smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features CCn1nccc1CNCc1ccc(N(C)C)c(F)c1 118979052 LAWOIZFKLYTJOT-UHFFFAOYSA-N 276.359 2.398 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccnc1 115281954 FKYJFXWVCKAMSU-UHFFFAOYSA-N 269.348 2.386 10 20 CECD CC[C@H](NCCC(=O)N(C)C)c1ccc(N(C)C)cc1 178294322 RJPIGPGUKYIEIR-HNNXBMFYSA-N 277.412 2.272 10 20 CECD CCCCOCC(=O)NCc1ccc(N(C)C)cc1 118195714 XLPUBAHHBJOBNF-UHFFFAOYSA-N 264.369 2.186 10 20 CECD CN(Cc1cnn(C)c1)Cc1cccc(Cl)c1O 179601845 GDXLKPKKXJSXGG-UHFFFAOYSA-N 265.744 2.411 10 20 CECD CC(C)[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)N(C)C 129675920 YKSYHIODDPQBHB-INIZCTEOSA-N 291.439 2.297 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Nc2ccnn2C)c1 125606234 JLDJARGKJLFPHH-VIFPVBQESA-N 290.323 2.017 10 20 CECD CSC[C@H](C)NC(=O)N(C)Cc1ccccc1O 77626638 PLAHRSCCZJLBEF-JTQLQIEISA-N 268.382 2.285 10 20 CECD CO[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)C(C)(C)C 180835913 UQEXMKMOXKPIBM-OWNNVSBGSA-N 293.363 2.288 10 20 CECD CC(C)[C@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186423839 BUZKUWDCIKUFEK-MNOVXSKESA-N 265.353 2.437 10 20 CECD C[C@H](NC[C@@H](C)CN1CCOCC1)c1ccccc1O 183522703 PFXKCNJYRUBJLJ-KGLIPLIRSA-N 278.396 2.011 10 20 CECD CCCN1CCCN(Cc2cccc(C)c2O)CC1=O 189200639 MLJKGACQVCUQFF-UHFFFAOYSA-N 276.380 2.145 10 20 CECD CC[C@@](C)(CO)NCc1cc(Cl)cc(OC)c1O 228677156 XOWTYMKPWOQTJC-ZDUSSCGKSA-N 273.760 2.305 10 20 CECD COc1cccc(CNc2ncnc3onc(C)c23)c1O 195512885 CTTZTBFBPOEARV-UHFFFAOYSA-N 286.291 2.253 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(N(C)C)cc1 90181696 COCMTYZNVRRTET-JSGCOSHPSA-N 287.407 2.167 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CCCN1C1CCCC1 269701730 PRKADBRGZSDUFO-OAHLLOKOSA-N 288.391 2.415 10 20 CECD CC[C@@H](N[C@H]1CCCCNC1=O)c1ccc(C)cc1O 279990246 FGUZHFRIMZETNF-KGLIPLIRSA-N 276.380 2.410 10 20 CECD Cc1cc(CN(C)CCn2cccn2)ccc1N(C)C 292974893 DTFMMWMRFPGCAL-UHFFFAOYSA-N 272.396 2.390 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H]2CC[C@@H](CO)O2)c(O)c1 294450958 VQBGGTMAUSDHGO-MCIONIFRSA-N 279.380 2.200 10 20 CECD CCn1nc(C)c(CN(C)Cc2ccc(N(C)C)cc2)n1 294509590 CQNOQTUISURAEM-UHFFFAOYSA-N 287.411 2.304 10 20 CECD C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)C(C)(F)F 815490558 VCNPXZBFRHVWAK-SSDOTTSWSA-N 288.246 2.115 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2ncnc3c2ncn3C)c1 728908784 CALMWEKRCBNNCD-SECBINFHSA-N 299.334 2.251 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CC(C(F)(F)F)C1 829144566 PNOSRVMCMLWMAX-RQOWECAXSA-N 287.237 2.132 10 20 CECD C[C@@H](NC(=O)c1cc(C2CC2)nn1C)c1ccccc1O 828539340 MTIQTGFSQVFHDQ-SNVBAGLBSA-N 285.347 2.494 10 20 CECD COc1cccc(CN(C)CC2=CCCOC2)c1O 827185382 ROWZCYYDUCYFEI-UHFFFAOYSA-N 263.337 2.179 10 20 CECD CCCSCC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832280534 PDNLHUBRWCODRO-AWEZNQCLSA-N 295.452 2.012 10 20 CECD CN(C)c1ccc(CN[C@@H](CC2CC2)C(=O)O)cc1F 901714194 ALQPVRPCWHMBKT-ZDUSSCGKSA-N 280.343 2.235 10 20 CECD COc1cc(O)c(CN[C@H]2CCS[C@H]2C)cc1OC 843435097 QFIRXEZOUVVNTI-ONGXEEELSA-N 283.393 2.393 10 20 CECD NCCc1ccc(CNCc2ccccc2O)cc1 841031971 FCWHGTZMDXEXCD-UHFFFAOYSA-N 256.349 2.183 10 20 CECD CC(C)[C@H](CNCc1cc(Cl)ccc1O)C(=O)O 848639708 JTXIGIZITLROPU-NSHDSACASA-N 271.744 2.492 10 20 CECD CCOCc1cc(CNC2(C(=O)O)CCC2)ccc1OC 841801288 PKHUPPRNXJDHNV-UHFFFAOYSA-N 293.363 2.329 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@]2(C)CCCN2)cc1 844173312 TZSLMYWYUCDGBG-QGZVFWFLSA-N 289.423 2.291 10 20 CECD COc1cccc([C@H](C)N[C@H](CO)CC(C)C)c1O 846144688 MYEKIHWVRUWVQJ-RYUDHWBXSA-N 267.369 2.458 10 20 CECD C[C@H](CCO)N(C)Cc1cc(Cl)c(F)cc1O 846113017 XWKLHYXCTISMDT-MRVPVSSYSA-N 261.724 2.387 10 20 CECD Nc1ccc(CCNC(=O)NCC[C@H]2CCCCO2)cc1 841871244 AGPJDKBXDWLQIV-OAHLLOKOSA-N 291.395 2.070 10 20 CECD C[C@H](NCCCSc1nccs1)c1cc(CO)on1 925101408 HDKIVTBIWYGHRJ-VIFPVBQESA-N 299.421 2.456 10 20 CECD COCc1cc(N[C@@H](C)Cc2ccc(O)c(O)c2)ncn1 762799776 AFRNXZHZJHDPMI-JTQLQIEISA-N 289.335 2.077 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CC23CCC3)c1O 760123172 SCLJMACFCGXQDD-NSHDSACASA-N 261.321 2.207 10 20 CECD Cc1ncccc1CNC(=O)NCCc1ccc(N)cc1 861640526 MOSCFZBHMZHCGJ-UHFFFAOYSA-N 284.363 2.014 10 20 CECD C[C@@](O)(Cc1ccccc1)C(=O)NCc1ccccc1O 769361807 AMIYSYFRHVBKTJ-QGZVFWFLSA-N 285.343 2.002 10 20 CECD CO[C@@H](CNCc1c(C)cccc1O)C(F)(F)F 877028011 UVRZKNXGSHIIKQ-NSHDSACASA-N 263.259 2.368 10 20 CECD N=C1Nc2nc3ccccc3n2[C@@H](c2cccc(F)c2O)N1 778519900 LWMJEAKKOOTDRB-ZDUSSCGKSA-N 297.293 2.378 10 20 CECD CC[C@H](C[C@H](C)CO)NC(=O)/C=C/c1ccc(O)c(O)c1 779534184 OIBREBGJYSGXBY-VAFIWLDWSA-N 293.363 2.024 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1CCC(F)(F)C1 1123889652 PMSJNZUIEMOLBM-QMMMGPOBSA-N 271.263 2.149 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@]23CCC[C@@H]2C3)c1O 897374952 HODBOZWSDGNRHY-QMTHXVAHSA-N 278.308 2.341 10 20 CECD OC[C@@]12C[C@H]1CN(Cc1ccc(N3CCCCC3)cc1)C2 783745890 WXPUTUNYBDOFDU-WMZOPIPTSA-N 286.419 2.491 10 20 CECD CN(C)c1ccc([C@@H](CNC(=O)C2(C)CC2)N(C)C)cc1 891251929 IERWIPFGLWHETO-OAHLLOKOSA-N 289.423 2.272 10 20 CECD COc1ccc(CNC(=O)COc2ccccc2)c(O)c1 794384246 XXNUABGCXCCWPK-UHFFFAOYSA-N 287.315 2.096 10 20 CECD COc1ccc(CNC(=O)CSC(F)(F)F)c(O)c1 794382495 XVRPAQGPIYTQRJ-UHFFFAOYSA-N 295.282 2.270 10 20 CECD CCN(CC(=O)NCc1ccc(N(C)C)cc1)C(C)(C)C 1327325980 DKFSNCUIOXJILM-UHFFFAOYSA-N 291.439 2.489 10 20 CECD CC(F)(F)C1(C(=O)NCc2ccccc2O)CC1 692814445 LWPKHEHIDPMOSU-UHFFFAOYSA-N 255.264 2.444 10 20 CECD CO[C@H](C)CC(=O)Nc1c(Cl)ccc2nonc12 1327168019 WVDYQHDJOLOJDO-ZCFIWIBFSA-N 269.688 2.240 10 20 CECD CCCN(Cc1cccc(OCC)c1O)[C@@H]1CCNC1 71314506 CNMHBGQROBBRCM-CQSZACIVSA-N 278.396 2.365 10 20 CECD CO[C@@H](CNCc1ccc2c(c1)CCO2)C(F)(F)F 733329958 MKVNHQGWKQGYDF-LBPRGKRZSA-N 275.270 2.288 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NC1(C)CC1 1339258608 LNXLCFUSRWUPDB-UHFFFAOYSA-N 261.369 2.413 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCC[C@@H]3C[C@@H]32)cc1 1262584091 QJGPXVAYZNLKMJ-KWCYVHTRSA-N 259.353 2.257 10 20 CECD C[C@@H](C(=O)O)C1(NCc2ccc3c(c2)CCCO3)CC1 1343428520 ZMFFIGVQSPCDFC-NSHDSACASA-N 275.348 2.355 10 20 CECD COc1ccc2c(c1)CCN2Cc1cc(C(=O)O)n(C)c1 1607295845 OFJUJUNEJUYZKO-UHFFFAOYSA-N 286.331 2.295 10 20 CECD Cc1c(CNC[C@@H]2CCC3(CNC3)O2)n(C)c2ccccc12 1579534663 OHYPBYKDYRVLTJ-AWEZNQCLSA-N 299.418 2.097 10 20 CECD CCN1CCc2cc(CNCC(C)(C)C(=O)O)ccc21 1776877427 GSBZTZDQJMTVKV-UHFFFAOYSA-N 276.380 2.269 10 20 CECD Cn1nncc1CN(Cc1ccco1)Cc1ccccc1O 154707330 IODDYZBOLNLDLX-UHFFFAOYSA-N 298.346 2.316 10 20 CECD COc1cccc(O)c1CN[C@@H]1C[C@H](OC)C12CCC2 839182214 LRSHEGQAFDJBQL-CABCVRRESA-N 277.364 2.448 10 20 CECD Oc1cccc(Cl)c1CNCCN1CC=CCC1 279615481 AGSAOJURBMYRKB-UHFFFAOYSA-N 266.772 2.397 10 20 CECD COc1ccc(O)c(CNCCc2cccc(C)n2)c1 280555491 KLCGMDUPTFUOFN-UHFFFAOYSA-N 272.348 2.437 10 20 CECD Oc1c(Cl)cccc1CNCC[C@H](O)C1CC1 898203107 RIXNKPCZJHXQBT-LBPRGKRZSA-N 255.745 2.296 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ncccc1F 857466819 IKQXNBVJMDHXPD-UHFFFAOYSA-N 260.268 2.199 10 20 CECD CN(C)[C@H](CCNCc1ccc(N)cc1)C(F)(F)F 1578406501 UOXHQFDMHJVYGS-GFCCVEGCSA-N 275.318 2.241 10 20 CECD [N-]=[N+]=NC1CN(C(=O)Cc2ccccc2Cl)C1 409422960 KAZQMCHLUZSDAH-UHFFFAOYSA-N 250.689 2.404 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCC[C@@H]2N)cc1 178711345 ZDXZIKHCELQDOE-CVEARBPZSA-N 289.423 2.276 10 20 CECD COc1ncccc1C(=O)NCc1ccc(N(C)C)cc1C 115280239 UNKVSTYAYNESKE-UHFFFAOYSA-N 299.374 2.395 10 20 CECD CC1([C@@H]2CCCN(Cc3ccccc3O)C2)OCCO1 183239995 CNZHFHDKOXGWLI-CQSZACIVSA-N 277.364 2.367 10 20 CECD COc1ccc(N(C)CC(=O)N[C@@H](C)C(C)C)cc1F 121810035 OILHQDQGZJVRMA-NSHDSACASA-N 282.359 2.431 10 20 CECD C[C@H]1CCN(Cc2cc3c(cc2O)OCO3)CCS1 191668710 AKBBZWBIRGXTII-JTQLQIEISA-N 281.377 2.448 10 20 CECD CCCOc1ccc(CN2CCN3CCC[C@H]3C2)c(O)c1 246072221 ZLPBHGBMTRLPAY-HNNXBMFYSA-N 290.407 2.461 10 20 CECD CC(C)N1C[C@@H](N[C@H](C)c2ccc(F)c(F)c2O)CC1=O 276898533 ISWRPQBSDVKHPX-ZJUUUORDSA-N 298.333 2.330 10 20 CECD Oc1ccc(F)cc1CN1C[C@H](O)Cc2ccccc21 279529867 ZGGUBSXDNCNGGC-CQSZACIVSA-N 273.307 2.455 10 20 CECD CCOc1ccc(O)c(CN2CCOC[C@H](C)C2)c1 370054484 WIMCPDAECSJCEE-GFCCVEGCSA-N 265.353 2.259 10 20 CECD CC(C)(C)c1nnc(C(=O)NCc2ccccc2O)s1 283256646 CXDYODNSUOJPIW-UHFFFAOYSA-N 291.376 2.471 10 20 CECD CC(=O)N1CCC[C@@H](CN[C@H](C)c2cc(F)ccc2O)C1 280939624 IRVILVLIDOQSGH-YPMHNXCESA-N 294.370 2.440 10 20 CECD CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@H](C)[S@]1=O 289953793 YSRZXTRWTPDJKC-BBEJJTJUSA-N 281.421 2.432 10 20 CECD COc1ccc(CNCc2cccc(C)c2O)c(OC)n1 290980294 TZKLFIZHENNMAF-UHFFFAOYSA-N 288.347 2.403 10 20 CECD CC[C@H](C)[C@H](CNCc1cc([N+](=O)[O-])ccc1O)OC 294919777 YOKKWHVIWIFQDD-HZMBPMFUSA-N 282.340 2.451 10 20 CECD COCCC[C@@H](C)NC[C@@H](N)c1ccc(N(C)C)cc1 817943503 URNJIFYSOSYXLT-CZUORRHYSA-N 279.428 2.157 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CC23CCNCC3)c1 817976409 LKGVQVYXFNZXPQ-ABAIWWIYSA-N 276.380 2.194 10 20 CECD Cc1ccc(C(=O)N2CC(CC(F)F)C2)c(O)c1O 819730510 CUCQYFSXMXYAMN-UHFFFAOYSA-N 271.263 2.133 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H](C)N1C 815179919 YPYBWEKUWQLAPX-OKILXGFUSA-N 261.413 2.277 10 20 CECD Cc1nccnc1[C@H](C)NCCc1ccc(N)cc1 817957167 JTCSSSMTVWCAQN-NSHDSACASA-N 256.353 2.261 10 20 CECD CN(Cc1ccc2ccccc2c1O)C[C@H]1COCCO1 827141433 SZTJYHOLZPJRGT-HNNXBMFYSA-N 287.359 2.393 10 20 CECD CC[C@H](NCc1cc(Cl)cc(F)c1O)[C@H](C)O 824920865 ADRZYUWHBNIKJF-CPCISQLKSA-N 261.724 2.434 10 20 CECD C[C@@H](CNC(=O)c1cc(O)cs1)CN1CCCCC1 731870624 LAOBVFBADVRWIR-NSHDSACASA-N 282.409 2.306 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@H](C)c1ccc(C)cc1O 834880470 DGOAWIJTCQFXQU-XJKCOSOUSA-N 279.380 2.403 10 20 CECD CCN(CCOC)C(=O)NCc1ccc(N(C)C)cc1C 734687229 OXVQTBQAHOHXBG-UHFFFAOYSA-N 293.411 2.239 10 20 CECD Nc1ccc(CC(=O)N2CC[C@@H](C3CCOCC3)C2)cc1 831452619 QPZHZWUYXYDIHT-OAHLLOKOSA-N 288.391 2.086 10 20 CECD COc1ccc(O)c([C@H](C)NCCCc2cncn2C)c1 846844929 RNYLJNHFIGKLOS-LBPRGKRZSA-N 289.379 2.418 10 20 CECD CC1(C)CN(C(=O)NCCc2ccc(N)cc2)CCCO1 841953873 FFZSZGHEEONVLX-UHFFFAOYSA-N 291.395 2.022 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CC[C@H](C(=O)O)C2)c1O 843040666 XEPSIHOCSJHIOU-GZMMTYOYSA-N 299.754 2.397 10 20 CECD CCn1ccc(CN[C@H](C)c2cc(OC)ccc2O)n1 840839977 CCVOSFCMYXXMHF-LLVKDONJSA-N 275.352 2.468 10 20 CECD COc1ccc(N(C)CCN(C)CCc2cn[nH]c2)cc1 844402688 TUEPQDUBEZGDQX-UHFFFAOYSA-N 288.395 2.029 10 20 CECD CC(C)C1(NC(=O)NCCc2ccc(N)cc2)CC1 841955825 OWCVGDQVQGACJZ-UHFFFAOYSA-N 261.369 2.299 10 20 CECD COc1ccc2c(c1)C[C@H](C(C)C)CN2CCOCCN 843390293 SNKUVRRWSKEVKG-HNNXBMFYSA-N 292.423 2.305 10 20 CECD COc1cccc(CN[C@@H]2CCNC3(CCC3)C2)c1O 841089267 KLTMLKYGXCUXSU-CYBMUJFWSA-N 276.380 2.165 10 20 CECD CCCC[C@H](CN)NC(=O)NCc1ccc(N(C)C)cc1 841654083 MQRVWRFDMWFMTQ-CQSZACIVSA-N 292.427 2.069 10 20 CECD COc1ccc(N2CC[C@H](CN[C@H]3COC[C@@H]3C)C2)cc1 926610783 FULUCYWROOQLSN-VBQJREDUSA-N 290.407 2.146 10 20 CECD CCCN(CC(=O)OCC)Cc1cc(C)cc(OC)c1O 756908711 INQDZOZNMIFQRK-UHFFFAOYSA-N 295.379 2.484 10 20 CECD CNC[C@@H](C)N[C@H](C)c1ccc(Br)cc1O 854232172 NVBVIRLDNDTUBK-RKDXNWHRSA-N 287.201 2.413 10 20 CECD CC1(C)CN(C(=O)Cc2ccc(N)cc2)[C@@H]1[C@H]1CCCO1 852873507 XCEZCMIMFOAGNY-GDBMZVCRSA-N 288.391 2.227 10 20 CECD CC(C)OCCCOC(=O)/C=C/c1ccc(O)c(O)c1 759587628 BKXCFNAKWYZVGA-FNORWQNLSA-N 280.320 2.469 10 20 CECD COc1ccc(N2CCN(C(=O)/C=C\SC)CC2)cc1 751567567 PJIJCXQZQPFHKR-GHXNOFRVSA-N 292.404 2.221 10 20 CECD CC[C@@H](NC(=O)NCc1ccc(OC)cc1O)C1CC1 852594353 MFPGCSYQYFUPHO-CYBMUJFWSA-N 278.352 2.389 10 20 CECD CC(C)N(Cc1cc2c(cc1O)OC[C@H]2O)CC(F)F 768462844 OEZXHDQJJMLNFG-GFCCVEGCSA-N 287.306 2.294 10 20 CECD Cc1ccc(CN2CCN(CCOC(C)C)CC2)c(O)c1 876757976 DFRBMOVHWNCZFR-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CO[C@@H]1CCC[C@@H]1CNC(=O)NCc1ccccc1O 774785317 FJHJDHYGUOJUNX-TZMCWYRMSA-N 278.352 2.007 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCn3ccnc3C2)cc1F 778190068 UYWIKLRXZJHDCO-CYBMUJFWSA-N 288.370 2.193 10 20 CECD CCOc1ccc(CNc2nnc3ccccn23)c(O)c1 771757245 OWXQFNZCFRFRIO-UHFFFAOYSA-N 284.319 2.446 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1C[C@H]1F 1123496619 YVZNTEYSSYCOAL-ZIAGYGMSSA-N 262.328 2.261 10 20 CECD C[C@@H](NC[C@H]1CCCN1CCCO)c1c(O)cccc1F 886615674 LGSPZKZVWSRAPQ-CHWSQXEVSA-N 296.386 2.029 10 20 CECD Cc1ccc(C(=O)NCc2ccc3c(c2)COC3)c(O)c1O 780985366 SLHJVXMNMKCUTJ-UHFFFAOYSA-N 299.326 2.366 10 20 CECD C[C@H](O)C[C@@H](C)NCc1ccc(N(C)C)c(F)c1 782981109 XXUBWTOMXYGDPR-MNOVXSKESA-N 254.349 2.141 10 20 CECD CO[C@@H]1[C@H](C)[C@@H](NC(=O)c2ccc(C)c(O)c2O)C1(C)C 781018189 TWZHDOSDPJFVRF-OWYVNGRQSA-N 293.363 2.196 10 20 CECD CCN(CCC(=O)NC)Cc1ccc(N(CC)CC)cc1 897710621 ZFFOOISKJUXOCU-UHFFFAOYSA-N 291.439 2.491 10 20 CECD CC[C@@]1(C)COCCN1Cc1ccc(OC)c(OC)c1O 893666834 XZPZAOLFSMKYSR-INIZCTEOSA-N 295.379 2.410 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2ccc(C)cc2O)C1 896126435 OOLANSMNNZJLAG-YPMHNXCESA-N 263.337 2.132 10 20 CECD CCO[C@H]1CCN(Cc2ccc(OC)c(OC)c2O)C1 897061333 IITXJSQIGXUSIR-LBPRGKRZSA-N 281.352 2.020 10 20 CECD COc1ccc(CNCc2cnn(C(C)C)c2)c(O)c1 793390405 QMJQBKYKRAUVEO-UHFFFAOYSA-N 275.352 2.468 10 20 CECD COc1cc(NCc2ccc(N(C)C)cc2)ncn1 269125426 GEAQWEJKSZJFOP-UHFFFAOYSA-N 258.325 2.163 10 20 CECD Nc1ccc(CNC(=O)N2C[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)cc1 1335737167 LDDLXPUHDYRMEH-DARAHFNDSA-N 285.391 2.456 10 20 CECD Cc1cc(CNCc2cc(F)ccc2O)oc1C(=O)O 1607648887 VLVBCBPIIJOSES-UHFFFAOYSA-N 279.267 2.421 10 20 CECD O=C(O)c1cnc(SCCOC(F)F)s1 1608979240 QZGGXJJPFUVXDN-UHFFFAOYSA-N 255.267 2.173 10 20 CECD CC(C)N1CCC(NCc2cc(F)ccc2O)CC1 226583613 PAQWYQYNXZLKKS-UHFFFAOYSA-N 266.360 2.494 10 20 CECD Nc1ccc(CNC(=O)Nc2cccc(F)n2)cc1 1580445562 KILFQVHAXSLLPA-UHFFFAOYSA-N 260.272 2.125 10 20 CECD C[C@H](N[C@H](C)c1cc(C(=O)O)ccc1O)c1cnn(C)c1 1593196796 IPGAZKVFDOPMDT-VHSXEESVSA-N 289.335 2.236 10 20 CECD C[C@H](NCC(C)(C)CN(C)C)c1cc(C(=O)O)ccc1O 1593241206 XLLYTHXVSXDJKE-NSHDSACASA-N 294.395 2.329 10 20 CECD CCN1CCc2cc(CNCC3(C(=O)O)CC3)ccc21 1776877308 LLWRKNFXQZDIJW-UHFFFAOYSA-N 274.364 2.023 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCO[C@H](C3CC3)C2)c(O)c1O 157083398 ZBDCVCQVWUDBSW-AAEUAGOBSA-N 291.347 2.094 10 20 CECD CC[C@H](C)NC(=O)CCNCc1cccc(Cl)c1O 124715042 VOXULECYIASFFO-JTQLQIEISA-N 284.787 2.440 10 20 CECD CC[C@@H](C)[C@H](O)CNCc1cc(F)cc(F)c1O 882993708 FPQZSWGYJXNWGR-PRHODGIISA-N 259.296 2.167 10 20 CECD O=C(O)[C@]1(NCc2ccc3c(c2)CCCO3)CCSC1 900033009 LAKXSUICAHFADN-HNNXBMFYSA-N 293.388 2.062 10 20 CECD COc1ccc(O)c(CNCCc2cccnc2)c1 37717968 DKGIFNYPOHIWCU-UHFFFAOYSA-N 258.321 2.128 10 20 CECD C[C@H](N[C@@H]1CCN(C2CC2)C1)c1ccc(F)cc1O 62748343 JNJXXXNIAKGKPL-CMPLNLGQSA-N 264.344 2.419 10 20 CECD CCOc1cccc(CN[C@H]2CO[C@H](C)C2)c1O 402351358 SHVCXWRNOTZAGT-ZYHUDNBSSA-N 251.326 2.058 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCC2CC2)c1 103507775 VUVTZYDTQVPFBL-VIFPVBQESA-N 264.325 2.171 10 20 CECD COc1ccc(N(C)CC(=O)NCC2CC2)cc1Cl 177071013 NSFPGKSABUMOLX-UHFFFAOYSA-N 282.771 2.311 10 20 CECD CS[C@H](C)C(=O)N1CCOc2cc(N(C)C)ccc21 173199262 HFBZHYWFCXVQEX-SNVBAGLBSA-N 280.393 2.230 10 20 CECD CC(C)(CO)CNCc1cc(Br)ccc1O 124967530 DQTCHVSISNIPTC-UHFFFAOYSA-N 288.185 2.263 10 20 CECD CC[C@H](NCCNC(=O)C1CC1)c1ccc(N(C)C)cc1 178213081 YNSDVWKGHSVVIJ-INIZCTEOSA-N 289.423 2.320 10 20 CECD c1cc(N2CCCCC2)ccc1CN1CCn2cnnc2C1 121822557 SKNXYRLPIOFAPE-UHFFFAOYSA-N 297.406 2.284 10 20 CECD C[C@@H](NCCN1CCOC(C)(C)C1)c1ccccc1O 183495789 LTVGSFOXOXQTGJ-CYBMUJFWSA-N 278.396 2.154 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)C1CC1 186429422 UZOOJEOXTKWWET-UWVGGRQHSA-N 263.337 2.191 10 20 CECD CCN(Cc1cccc(C)c1O)C[C@H](O)C(F)(F)F 189862868 APMQVKMEGKVJPN-NSHDSACASA-N 277.286 2.446 10 20 CECD C[C@@H](NCc1nnc2n1CCCC2)c1ccc(F)cc1O 183844162 OGOVIUKIPWDWAP-SNVBAGLBSA-N 290.342 2.310 10 20 CECD CCCSCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183466789 KBOFXCOLPDFAGL-JTQLQIEISA-N 283.393 2.288 10 20 CECD CC(C)C[C@@H](O)CNCc1ccc(N(C)C)cc1 224268461 NJNHJKGBDNDCCD-OAHLLOKOSA-N 250.386 2.249 10 20 CECD C[C@@H]1CN(C)CC[C@H]1N(C)Cc1cc(F)ccc1O 290599274 VUXCMXPXPHQSAF-BXUZGUMPSA-N 266.360 2.303 10 20 CECD COc1cc(CNCc2ccccc2O)cc(OC)c1O 134235392 LEDFEECPVXXLDS-UHFFFAOYSA-N 289.331 2.405 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)c1ncc[nH]1 138902192 IKSZCRSNYKDXJG-ZDUSSCGKSA-N 286.379 2.097 10 20 CECD CCN(CC)c1ccc(CN(C)CCCC(=O)NC)cc1 93734121 CVOAGQMTSDRIHI-UHFFFAOYSA-N 291.439 2.491 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCCS2)cc1F 266505081 GPOFKZPPXHIQOE-CYBMUJFWSA-N 282.384 2.404 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H]2CCCOC2)c1 273412867 QEVIAIVYXAHOBR-VXGBXAGGSA-N 293.363 2.256 10 20 CECD COc1cc(O)c(CNCc2ccn(C)c2)cc1OC 271815718 LVSYSPDTCVZPAR-UHFFFAOYSA-N 276.336 2.038 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(C)C1)c1cccc(Cl)c1O 287635075 KOIMUGFCAFXKSE-CABZTGNLSA-N 282.771 2.317 10 20 CECD CC1(C)CCC[C@@]1(O)CNCc1cc([N+](=O)[O-])ccc1O 292916392 HVMJNEJAXNJXMX-OAHLLOKOSA-N 294.351 2.331 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1CCCO1 807836900 UAXQWTBAJMGHGH-SNVBAGLBSA-N 290.146 2.494 10 20 CECD CC(C)[C@H]1NCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1 290158710 LTMAFXWMRVIMGF-HZPDHXFCSA-N 289.423 2.003 10 20 CECD C[C@H]1C[C@H](NC2CCNCC2)c2c(O)ccc(F)c21 817937116 TXHBCXRNJZGMOD-CABZTGNLSA-N 264.344 2.421 10 20 CECD CCN(C)c1ccc(CN(CC)[C@@H](C)CO)cc1 815182577 RPDOZHUMBAMMIE-ZDUSSCGKSA-N 250.386 2.345 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1cc(Cl)c(F)cc1O 816566939 LYHINPJQSBQVSD-HTQZYQBOSA-N 261.724 2.434 10 20 CECD O=C(/C=C/c1cncc(F)c1)N1C[C@@H](O)Cc2ccccc21 493248998 BQOAWRVSSNMICV-NFAHFFEMSA-N 298.317 2.184 10 20 CECD O=C(NCc1ccccc1O)NOCc1ccccc1 728748741 ZTXXSEMKHDZJPC-UHFFFAOYSA-N 272.304 2.323 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2cc(C)c(C)cc2O)C1 827812342 JVYNXHTZIRIHQB-AULYBMBSSA-N 263.337 2.050 10 20 CECD COc1ccc(N(C)CCc2cnn(C)c2)cc1OC 735919928 JUKAMDFUKJPOID-UHFFFAOYSA-N 275.352 2.116 10 20 CECD C[C@@H]1SCC[C@@H]1NC(=O)NCCc1ccc(N)cc1 831177733 AZMMQWJIKFGWSX-GWCFXTLKSA-N 279.409 2.005 10 20 CECD COc1cccc(CN2[C@H]3CC[C@H]2CC(=O)C3)c1O 839130713 AIYVWKLTWQOYKN-RYUDHWBXSA-N 261.321 2.097 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cnsn2)c1 839113378 UHWYPZINRWSLGE-SSDOTTSWSA-N 294.336 2.135 10 20 CECD Cc1noc(C2CN(Cc3cc(Cl)ccc3O)C2)n1 839130637 DPJMDVKHJXTIGQ-UHFFFAOYSA-N 279.727 2.336 10 20 CECD CON1CCC(N(C)Cc2ccc(N(C)C)c(F)c2)CC1 835076774 VKACGCBPNGGYHM-UHFFFAOYSA-N 295.402 2.349 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CO)CC(F)F 840941619 DSLCXLKYQHUYLZ-LBPRGKRZSA-N 272.339 2.167 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC[C@H]1CCCCO1 844925937 SBRAWVRSNGRBKH-GFCCVEGCSA-N 298.770 2.414 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1cc([N+](=O)[O-])ccc1O 842755010 VLUSKMZQXZXQMB-ZYHUDNBSSA-N 282.340 2.187 10 20 CECD CC[C@H](COC(=O)/C=C/c1ccc(O)c(O)c1)OC 842086390 CRERATNUHLYVEB-OKPNEXGHSA-N 266.293 2.079 10 20 CECD CCc1cccc(CN2CCN(C)C[C@H]2CC)c1O 848914834 TWZRIJRKVPIDAE-OAHLLOKOSA-N 262.397 2.481 10 20 CECD Cc1cnc(CNC(=O)NCCc2ccc(N)cc2)s1 841837903 NQMXRNQTGZXTDT-UHFFFAOYSA-N 290.392 2.076 10 20 CECD CCOCCCC(=O)NCc1cc(Cl)ccc1O 846471909 DGXMWGSQUFXDSB-UHFFFAOYSA-N 271.744 2.479 10 20 CECD COC(=O)[C@@H]1CN(Cc2cc(C)ccc2O)C[C@H]1C1CC1 846122398 IPHSKCYNRUDASB-LSDHHAIUSA-N 289.375 2.332 10 20 CECD C[C@H](N[C@@H]1CO[C@H](C)C1)c1ccc(N2CCOCC2)cc1 842674455 PIYADFCZDMCMRO-YCPHGPKFSA-N 290.407 2.351 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@@H]2CCOC[C@H]2O)c1O 858552539 UDZVIXJUNJLKSM-ZWKOPEQDSA-N 285.771 2.154 10 20 CECD Cc1cc(CN2CCc3nc[nH]c3C2)ccc1N(C)C 859306502 XPSASLPSILIVAI-UHFFFAOYSA-N 270.380 2.342 10 20 CECD CC(C)(C)N1C[C@@H](CNCc2ccccc2O)CC1=O 850397377 WXIBIGFIIKQNKO-GFCCVEGCSA-N 276.380 2.129 10 20 CECD C[C@H](NC/C=C/CO)c1cc(Br)ccc1O 850507857 IJRGBSFOLWUEFH-HPOULIHZSA-N 286.169 2.354 10 20 CECD CCCCC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210005 LPWKNXUMVGXZMZ-UHFFFAOYSA-N 290.407 2.454 10 20 CECD CC(C)(C)N1CC[C@H](NCc2cc([N+](=O)[O-])ccc2O)C1 850351664 QWAXYEQDPZLZIS-LBPRGKRZSA-N 293.367 2.263 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CC23CCOCC3)c1 858517622 SXLQRDCJTJMMNG-AWEZNQCLSA-N 290.363 2.069 10 20 CECD OC1CCN(c2ccc(CNc3ncccn3)cc2)CC1 853954607 LHVWXNMSMLOIND-UHFFFAOYSA-N 284.363 2.050 10 20 CECD C/C=C/C[C@H](CO)NCc1ccc(OCC)cc1O 769937167 NJBJYWJGKHXANV-MASHWEEQSA-N 265.353 2.208 10 20 CECD CCN(Cc1cc2c(cc1O)OC[C@H]2O)CC(C)C 768438536 BHCUMIAITFTXGE-CQSZACIVSA-N 265.353 2.296 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C)[C@@H]2CO)cc1 773887132 BJBAGRDBZWTGLL-CJNGLKHVSA-N 262.397 2.345 10 20 CECD Cc1cccc(O)c1CN1CCO[C@]2(CCO[C@@H]2C)C1 877485876 BMROHJBTOVITQN-CZUORRHYSA-N 277.364 2.080 10 20 CECD c1cc(N2CCCCC2)ccc1CN1C[C@@H]2CNC[C@@H]2C1 770394823 NKMCEEORHNQQLP-CALCHBBNSA-N 285.435 2.328 10 20 CECD Oc1ccc(CCNc2cc(C3CC3)ncn2)cc1O 882055426 AZCFJRXNDBUCSP-UHFFFAOYSA-N 271.320 2.420 10 20 CECD CC(=O)CCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773986952 GSDYIVGUEYNSEQ-GFCCVEGCSA-N 262.353 2.299 10 20 CECD Cc1ccc(CN(CCN(C)C)C[C@H]2CCCO2)c(O)c1 877524667 BHSVJSINLLAIGT-MRXNPFEDSA-N 292.423 2.243 10 20 CECD CCO[C@H](CC(=O)NCc1ccc(O)c(O)c1)C(C)C 778927286 OCKKVWDBKSOZSQ-CQSZACIVSA-N 281.352 2.165 10 20 CECD C[C@H](NCCOCC(F)F)c1c(O)cccc1F 886599073 QJBYOSQNTYKCQQ-QMMMGPOBSA-N 263.259 2.464 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)c(C)cc2O)[C@H]1C 787237368 FURWTULQBKIRED-GXTWGEPZSA-N 277.364 2.392 10 20 CECD CC[C@@](C)(CCO)NCc1cc(C)cc(OC)c1O 894334037 VWCDTCXGYVWKMM-HNNXBMFYSA-N 267.369 2.350 10 20 CECD COC[C@H](NCc1cc(C)c(C)cc1O)[C@@H]1CCCO1 788534685 IEMHULIANNNXDB-HOCLYGCPSA-N 279.380 2.293 10 20 CECD Cc1nc([C@@H]2CCN(Cc3cc(Cl)ccc3O)C2)n[nH]1 895007515 JTALZXLTVCZJIB-SNVBAGLBSA-N 292.770 2.462 10 20 CECD COc1ccc(CNC[C@H](OC)C(C)C)c(O)c1OC 893085928 JXTBZUBREWNIHS-ZDUSSCGKSA-N 283.368 2.170 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H]1CC[C@@H](O)C1 789585459 AAGDIFNNMWAVQK-GZMMTYOYSA-N 273.735 2.435 10 20 CECD CCn1cc(/C=C2/C(=O)N3CCCc4cccc2c43)nn1 899385202 ROMNNDGHJGZDIW-NTEUORMPSA-N 280.331 2.131 10 20 CECD CN(C)c1ccc(CNc2cc(N(C)C)ncn2)cc1 891579420 XYOWWUZFTLEACF-UHFFFAOYSA-N 271.368 2.221 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2CCS(=O)(=O)CC2)c1 186185217 ZCQBPVXGCKMVLA-GFCCVEGCSA-N 297.420 2.176 10 20 CECD COc1cc(CNCc2ccc(N(C)C)cc2)ccn1 57395089 UZOXONGSMUTKHD-UHFFFAOYSA-N 271.364 2.446 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 1334909497 UISAHHWIORBBTO-JFILPPLUSA-N 290.407 2.428 10 20 CECD C[C@H](NCc1c(O)cccc1Cl)C1(CO)CC1 696099870 QKJLWLPTUWJWFO-VIFPVBQESA-N 255.745 2.296 10 20 CECD Nc1ccc(CN[C@@]2(CO)CCc3ccccc32)cc1 1334754252 NBHKIFWFBSJYQO-QGZVFWFLSA-N 268.360 2.192 10 20 CECD O=C(O)[C@@H]1[C@H]2CCC[C@@H]2CN1Cc1ccc(F)c(F)c1O 1601756909 KHRSMNKTHOIWAQ-DVYJOKAKSA-N 297.301 2.356 10 20 CECD O=C(O)c1cnc(NCCCSc2nccs2)cn1 1602531956 KHCTUSJMCIKAQJ-UHFFFAOYSA-N 296.377 2.226 10 20 CECD O=C(O)Cc1ccccc1COC(=O)c1cc(O)cs1 1602147932 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CECD COC1CC(N[C@H](C)c2ccc(N3CCOCC3)cc2)C1 757678781 HUNVNIHHSPIECD-BZOOQXSSSA-N 290.407 2.351 10 20 CECD Cc1c[nH]ccc1=NCc1ccc(N2CCOCC2)cc1 757701602 IRMCYRAPNHXSHT-UHFFFAOYSA-N 283.375 2.261 10 20 CECD CCOc1ccc(CN[C@H](C)C2(CO)CC2)c(O)c1 850360624 IFLCCRNWCKKBOR-LLVKDONJSA-N 265.353 2.042 10 20 CECD CON1CCC(NCc2ccc3c(c2)CCCN3C)CC1 924869346 GUODIZCGDVWNJR-UHFFFAOYSA-N 289.423 2.184 10 20 CECD C[C@H](N[C@@H](C)[C@@H]1CN(C)CCO1)c1cc(Cl)ccc1O 756760218 POJOTZQAJKFVPR-PGUXBMHVSA-N 298.814 2.415 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CCCCNC2=O)c2c(O)ccc(F)c21 756395814 JJNSDZCZXRILHF-JLLWLGSASA-N 292.354 2.338 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cccnc2N(C)C)c1 862758713 IEOMIWHUKVFYPP-UHFFFAOYSA-N 285.347 2.092 10 20 CECD CN(CC(=O)N1CCc2ccccc2C1)c1ccc(N)cc1 863556597 VFFAEKDXDBNWLN-UHFFFAOYSA-N 295.386 2.290 10 20 CECD O=C(NCc1ccccc1O)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12 769087052 OVMDTDOLDMVLSC-DUBDDPSESA-N 272.348 2.236 10 20 CECD CN(C)c1cc(F)c(CN(C)C2(CO)CCC2)cc1F 862417970 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COc1ccc(O)c(CNC(=O)C2[C@H]3CCC[C@H]23)c1 177723384 HNOHVSGDBKVNJL-RYUDHWBXSA-N 261.321 2.063 10 20 CECD COc1ccc(O)c(CNCCc2nccs2)c1 63133602 BUEMSASPKUEOOF-UHFFFAOYSA-N 264.350 2.190 10 20 CECD CC[C@@H](NCCNC(=O)C1CC1)c1ccc(N(C)C)cc1 178213092 YNSDVWKGHSVVIJ-MRXNPFEDSA-N 289.423 2.320 10 20 CECD Cc1cccc(CN2CCCN(C(=O)C(C)C)CC2)c1O 179796491 OZLBEIYORLOVFX-UHFFFAOYSA-N 290.407 2.391 10 20 CECD CCn1cc(CN(C)c2ccc3c(c2)OCO3)cn1 180761471 VUOJPAHPPUZZHW-UHFFFAOYSA-N 259.309 2.268 10 20 CECD CCN(CC)c1ccc(CNC(=O)C(C)(C)O)cc1F 188454147 IJYRPMPCYUOJFP-UHFFFAOYSA-N 282.359 2.059 10 20 CECD N=C1Nc2nc3ccccc3n2[C@H](c2cc(F)ccc2O)N1 77472086 UGBHWQIHUWXUAQ-CYBMUJFWSA-N 297.293 2.378 10 20 CECD O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccccc1O 133935870 ONKGINGMCLRZKG-UHFFFAOYSA-N 286.287 2.159 10 20 CECD C[C@H]1COCCN1Cc1cc(Br)ccc1O 132608893 XBVMWXNGNZQVBF-VIFPVBQESA-N 286.169 2.375 10 20 CECD Oc1ccc(F)cc1CN1CC[C@@H](CN2CCCC2)C1 180188268 VELZQZICLDWULU-ZDUSSCGKSA-N 278.371 2.449 10 20 CECD COc1ccc(O)c(CN2C[C@@H](N3CCCC3)C[C@@H]2C)c1 289876197 VXVMYJCLFSCHNP-ZFWWWQNUSA-N 290.407 2.459 10 20 CECD COc1cccc(CNc2cccc(-c3nn[nH]n3)c2)c1O 393399164 WMWNVADCNZOONE-UHFFFAOYSA-N 297.318 2.193 10 20 CECD Cc1cccc(CN(C)C[C@H](O)C(F)(F)F)c1O 809751620 UKNYGRWWJTYNSS-JTQLQIEISA-N 263.259 2.056 10 20 CECD CC[C@@H]1C(=O)NCCN1Cc1cc(Cl)c(C)cc1O 824708466 FJVINDNOMOEURX-GFCCVEGCSA-N 282.771 2.064 10 20 CECD CC(C)[C@@H](N[C@H]1CCc2cccc(O)c21)c1nncn1C 903066484 VKOVODOKTCWHEX-SWLSCSKDSA-N 286.379 2.495 10 20 CECD CC[C@H](CNCc1c(O)cccc1Cl)C(=O)O 903706084 USZOLIUXKVZOMS-MRVPVSSYSA-N 257.717 2.246 10 20 CECD Cn1ncc(C(=O)NCc2ccccc2O)c1C(F)(F)F 748345444 LLCFFVJDUCECNK-UHFFFAOYSA-N 299.252 2.075 10 20 CECD CCOc1ccc(CNCC2(N)CCCC2)c(O)c1 849350196 UIMMAWBPWHZITA-UHFFFAOYSA-N 264.369 2.152 10 20 CECD C[C@@H](Cc1ccncc1)NCc1cc2c(cc1O)OCO2 749294323 GIZOZBAVDJLIFM-NSHDSACASA-N 286.331 2.237 10 20 CECD CC[C@@H](NCc1cccc(OC)c1O)[C@@H](O)C(C)C 840968133 VTOWULYUKAARKP-OCCSQVGLSA-N 267.369 2.286 10 20 CECD 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CECD CC[C@H](N[C@H]1CCN(CCOC)C1)c1ccccc1O 274931807 RAHCNESVELSBJS-ZFWWWQNUSA-N 278.396 2.154 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@](C)(C(N)=O)C2)cc1 793389449 HZZPGARCYCUQHD-QGZVFWFLSA-N 289.423 2.230 10 20 CECD CCSC1(CNCc2cc3c(cc2O)OCO3)CC1 691821194 YRNYHCBNSOZORC-UHFFFAOYSA-N 281.377 2.496 10 20 CECD COC(=O)CN(Cc1ccc(N)cc1)C1CCCC1 1336117908 QFVDDBHYSFYFOQ-UHFFFAOYSA-N 262.353 2.186 10 20 CECD CN1CCN(c2ccc(CNC/C=C\C3CC3)cc2)CC1 1261237851 HNWUGSFTOMDXEZ-IHWYPQMZSA-N 285.435 2.494 10 20 CECD CCC[C@H](CC)NC(=O)C(=O)N(C)Cc1ccccc1O 1345531307 CMOVCCSTJGSLRB-ZDUSSCGKSA-N 292.379 2.046 10 20 CECD O=C(O)[C@@H]1CC[C@@H](NCc2cccc(Cl)c2O)C1 1601796623 XWQFIHYJQSIETF-PSASIEDQSA-N 269.728 2.389 10 20 CECD Cc1ccc(O)c(CNC(C)(C)c2cc(C(=O)O)on2)c1 1607811825 XSOWHQZHIGPHJJ-UHFFFAOYSA-N 290.319 2.412 10 20 CECD C[C@H](NC[C@@H](O)C(F)(F)F)c1ccc(N(C)C)cc1 222613488 AKIYLWGJSRBNJG-JOYOIKCWSA-N 276.302 2.326 10 20 CECD CC(C)n1cc(CNCc2ccc(C(=O)O)cc2O)cn1 1776392585 GGQYBYLGAZQBGJ-UHFFFAOYSA-N 289.335 2.158 10 20 CECD CCN1CCc2cc(CN[C@@H]3CCC[C@H]3C(=O)O)ccc21 1776877664 YNYLFOIGBYIQSX-HUUCEWRRSA-N 288.391 2.412 10 20 CECD COc1ccc(CNCC(C)(C)C(=O)O)cc1C 258914124 TUROTSJMQUPYCC-UHFFFAOYSA-N 251.326 2.204 10 20 CECD COCCCCNCc1ccc(N2CCOCC2)cc1 44346281 UBCXTVKYNVKYQM-UHFFFAOYSA-N 278.396 2.039 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](CN(C)C)C2)c1O 184693380 NQVLTMOVFFOIBU-LLVKDONJSA-N 298.814 2.438 10 20 CECD O=C(CN[C@H]1CCc2cccc(O)c21)NCc1ccccc1 309720418 NNPJHBQZCZHSFL-HNNXBMFYSA-N 296.370 2.286 10 20 CECD CO[C@@H]1CC[C@@H](NCc2cc(F)cc(F)c2O)C1 708436480 MWZJMOIHKUSVCT-GHMZBOCLSA-N 257.280 2.328 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2CCCCS2(=O)=O)c(O)c1 694591106 RLFWRPMCWZGMAS-QWHCGFSZSA-N 297.420 2.319 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](C(C)C)N(C)C)c1 106917593 UBQCQLYNWOCAHQ-ABAIWWIYSA-N 294.395 2.164 10 20 CECD Cc1ccc(C(=O)N2CCS[C@@H](C)[C@H]2C)c(O)c1O 179507740 XSMIGBGJZGJTLL-ZJUUUORDSA-N 281.377 2.372 10 20 CECD COc1ccc(N2CCN(CCCCCCN)CC2)cc1 20072745 LHRPAWYVVASSTM-UHFFFAOYSA-N 291.439 2.336 10 20 CECD COc1ccc(O)c(CNC(=O)c2cncc(C)c2)c1 173580649 DBMUIIIQOKKNSX-UHFFFAOYSA-N 272.304 2.034 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCn1ccnc1 66096184 BXOLOWVJJLSFCP-UHFFFAOYSA-N 287.363 2.418 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)c1ccc(C)c(O)c1O 182509005 FSPOFLXZMHKUCW-SNVBAGLBSA-N 281.352 2.340 10 20 CECD CNCCc1ccccc1C(=O)N(C)Cc1ccccc1O 317474209 CTSRRQULWJIEBR-UHFFFAOYSA-N 298.386 2.426 10 20 CECD C[C@@H](NCCCOC[C@@H]1CCOC1)c1ccccc1O 183525336 YSWSEWDWNTZPGL-KGLIPLIRSA-N 279.380 2.486 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2CCCCO2)cc1F 87209991 OUFBATQYJJPUMO-CYBMUJFWSA-N 294.370 2.467 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccncn2)c1 194046538 LLOOZUFTLIZUGL-SECBINFHSA-N 288.307 2.074 10 20 CECD CN(C)c1ccc(CNC(=O)C(=O)c2ccccc2)cc1 194032352 BRTBPBFRUZJIBH-UHFFFAOYSA-N 282.343 2.252 10 20 CECD CCN(CC)CCN(CCOC)Cc1cc(C)ccc1O 93103910 XHFHOROGJVPTGH-UHFFFAOYSA-N 294.439 2.491 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2[C@@H](C)[C@H]2C2CC2)c1 528864863 TZHCVZTZQWBYJY-ULKVUYOBSA-N 275.348 2.309 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C1CCN(C)CC1 269189158 WHGDVTFADQSKJX-UHFFFAOYSA-N 290.407 2.473 10 20 CECD CCN(CC)c1ccc(CN[C@]2(CCO)CCOC2)cc1 278500625 NVAGTUBFNUOXCP-QGZVFWFLSA-N 292.423 2.164 10 20 CECD C[C@H](NCc1nnc2n1CCC2)c1ccc(F)c(F)c1O 277001781 ZHYXHIVFHXKJBE-QMMMGPOBSA-N 294.305 2.059 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@H](O)C2CCOCC2)c1 273484348 MXTAEFJRLUWPNH-LRDDRELGSA-N 279.380 2.139 10 20 CECD CCC[C@](C)(O)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273565235 JFLZTFVEAHPLOS-ZBEGNZNMSA-N 295.379 2.381 10 20 CECD CC[C@@H]1C[C@@H](C(=O)NCc2ccccc2O)CCO1 272570367 RVJZUKNOLUSJSC-WCQYABFASA-N 263.337 2.214 10 20 CECD COc1ccc(O)c(CN(CC2CCC2)[C@H](C)CO)c1 289537133 QFEMIWNYVAKSSL-GFCCVEGCSA-N 279.380 2.384 10 20 CECD CC[C@H](NCC(F)(F)CO)c1ccc(C)cc1O 280128254 OSPUVZKGLDUSOF-NSHDSACASA-N 259.296 2.369 10 20 CECD CC[C@@H](NCC[C@H](O)COC)c1ccc(C)cc1O 280151579 QGAKUUUVVMTLBK-GXTWGEPZSA-N 267.369 2.139 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](n3cccn3)C2)c1 291365105 YTNDXKRBFDHSMX-AWEZNQCLSA-N 257.337 2.344 10 20 CECD CCN(CC(=O)NCC(C)C)c1ccc(OC)cc1 299403502 WSXAGWQVYFFLTI-UHFFFAOYSA-N 264.369 2.294 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1CCOC1 807837777 CMOBMNWYJWEYJX-ZETCQYMHSA-N 290.146 2.352 10 20 CECD CN(Cc1ccccc1O)c1nnc(-c2cccnc2)n1C 809867200 GJWYLSQDLXCERA-UHFFFAOYSA-N 295.346 2.219 10 20 CECD C[C@H](N[C@H]1CC[C@H](CN)C1)c1cc(F)cc(F)c1O 817982707 VOVRPENVPIYNIG-QXEWZRGKSA-N 270.323 2.448 10 20 CECD C[C@H](N[C@H]1CC[C@@H](CN)C1)c1cc(F)cc(F)c1O 817982706 VOVRPENVPIYNIG-NGZCFLSTSA-N 270.323 2.448 10 20 CECD COc1cccc(O)c1CN1CC[C@@]2(CCCN(C)C2)C1 816643143 WJYXEJAUCMKYEC-QGZVFWFLSA-N 290.407 2.319 10 20 CECD C[C@@H]1CCC[C@H]1N1C(=O)CN(Cc2ccccc2O)C1=O 819167731 HPBIINHCHVUGPH-DGCLKSJQSA-N 288.347 2.345 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc3ccncc23)C[C@H]1C(=O)O 828457427 UODJTDWLUAUPRG-ZWNOBZJWSA-N 286.331 2.093 10 20 CECD CN(C[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc2c(c1)OCO2 828499404 YNJKXYHEEXARCG-CYZMBNFOSA-N 261.321 2.419 10 20 CECD C[C@@H](NC(=O)CSC1CC1)c1ccccc1O 827952248 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CCOc1ccc(CN2CC[C@H](COC)C2)c(O)c1 769398089 FXUYEJKWUDKFMX-LBPRGKRZSA-N 265.353 2.259 10 20 CECD C[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)[C@H]1CO 862336870 MXJLPVKBOOVBDL-BMIGLBTASA-N 284.350 2.234 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1Cc2ccccc21 762264479 ZUSVKFJQQYKLRL-CQSZACIVSA-N 283.327 2.096 10 20 CECD COc1cc(CN2CCC[C@@H]2c2ncon2)c(O)cc1C 768444590 MPAWSOKDFFMJHI-GFCCVEGCSA-N 289.335 2.429 10 20 CECD C[C@@H](NCC(=O)NCC(C)(C)C)c1ccccc1O 879650135 KNPRPHJNICEIRE-LLVKDONJSA-N 264.369 2.205 10 20 CECD C[C@H](NC(=O)C[C@H]1CCOC1)c1ccc(N(C)C)cc1 773010412 PJRVEWRIDFTWKR-QWHCGFSZSA-N 276.380 2.356 10 20 CECD COc1nc(C)ccc1C(=O)N(C)Cc1ccccc1O 777414024 GCRWELCGUBAYES-UHFFFAOYSA-N 286.331 2.376 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NCc2cccnc2)o1 1537962866 HEZJQEOHNFVFKN-UHFFFAOYSA-N 257.253 2.415 10 20 CECD Cc1ccc(CN2CCO[C@@]3(CCO[C@@H]3C)C2)c(O)c1 877487284 SDCYYXWEIKIOIB-CJNGLKHVSA-N 277.364 2.080 10 20 CECD COc1ccc(CNC(=O)N2CCCCCC2)c(O)c1 883106197 KZNVJLFUINDIMU-UHFFFAOYSA-N 278.352 2.486 10 20 CECD NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1Cc1c(O)cccc1Cl 787423982 OPKQROCPRMGDAK-BHDSKKPTSA-N 294.782 2.131 10 20 CECD COc1cccc(CN2CCCCC[C@H]2CO)c1O 895152389 UPAWWAQRYWELHB-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD CO[C@H](C)[C@@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898448422 RVOSLMKLBUMJJZ-CPUCHLNUSA-N 293.455 2.368 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1O 897685590 OPIFTRBYZGVTAF-RHSMWYFYSA-N 274.408 2.490 10 20 CECD COc1cc(Cl)cc(CN[C@H]2C[C@H](OC)C2)c1O 706533201 HHRYJQAMEKKCCI-XYPYZODXSA-N 271.744 2.321 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CO)CC(F)F)c1 717811253 LUIFUIKSSPRGJT-IUCAKERBSA-N 275.295 2.068 10 20 CECD CCCCN(C)C[C@H](C)NC(=O)NCc1ccc(N)cc1 1336894616 SRZQFKILJGYKCI-ZDUSSCGKSA-N 292.427 2.188 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2CCC[C@@H](F)C2)cc1 1332141849 JVOZMJTWTLZSMM-TZMCWYRMSA-N 279.359 2.391 10 20 CECD NCc1nccnc1NCc1ccc(N2CCCC2)cc1 1354071639 TVRLHEJKUHKXMJ-UHFFFAOYSA-N 283.379 2.148 10 20 CECD Cc1cc(O)c(CN2CCO[C@@H](CC(=O)O)C2)c(Cl)c1 1600285795 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251.263 2.008 10 20 CECD O=C(NCc1ccc(Cl)nc1)c1cc(O)cs1 732273722 ALDBQYCUGYUJNT-UHFFFAOYSA-N 268.725 2.432 10 20 CECD CCN(C(=O)/C=C\c1cnccn1)c1ccccc1C(=O)O 737051997 CVYONTUNCDFBAM-FPLPWBNLSA-N 297.314 2.241 10 20 CECD Cc1ccoc1CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 831924653 KPHXXXPXPXJSTB-LLVKDONJSA-N 289.331 2.289 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@H]2C2CCC2)c(O)c1 846061589 QRYVEVNNPDUSAQ-UONOGXRCSA-N 275.348 2.453 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H]2CCCNC2=O)cc1 840827273 GMTTUONEVDIXRV-HIFRSBDPSA-N 289.423 2.320 10 20 CECD C[C@H]1C[C@H](C(=O)NCc2cc(Cl)ccc2O)CCO1 846473240 KSIVDMOBSPNENI-VHSXEESVSA-N 283.755 2.477 10 20 CECD CO[C@@H](CNCc1cc([N+](=O)[O-])ccc1O)CC(C)C 841888030 CLKMRUGWGCSSCR-CYBMUJFWSA-N 282.340 2.451 10 20 CECD C[C@H](CNC(=O)NCCc1ccc(N)cc1)c1ccncc1 841853196 XTOKRUAXPJIACA-CYBMUJFWSA-N 298.390 2.309 10 20 CECD Nc1ccc(NC(=O)C(=O)NC2CCCCCCC2)cc1 841000374 UWEUCYWJYSMHKP-UHFFFAOYSA-N 289.379 2.436 10 20 CECD O=C(O)CN(Cc1cccc(Cl)c1O)CC1CC1 844936529 ORWVNYVWCPIFEN-UHFFFAOYSA-N 269.728 2.342 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCCNCC2)c1O 841059129 YCLVAFOXBVQZRE-LBPRGKRZSA-N 284.787 2.286 10 20 CECD C[C@H]1C[C@@H](NCc2c(O)ccc(Cl)c2F)CCN1 841062128 GIHQKSQVCCJPBI-IUCAKERBSA-N 272.751 2.415 10 20 CECD C[C@H]1CC[C@H](NC(=O)NCCc2ccc(N)cc2)C1 841886134 YMJYUHYZODFFJC-FZMZJTMJSA-N 261.369 2.299 10 20 CECD CC(C)[C@@H]1N(C(=O)C(=O)Nc2ccc(N)cc2)CC1(C)C 841133619 FQVOJHZHFMCAGH-ZDUSSCGKSA-N 289.379 2.100 10 20 CECD CN(C)c1ccc(CNCC2(C)CCNCC2)cc1 841053806 CIDTXOCKGKDRDB-UHFFFAOYSA-N 261.413 2.232 10 20 CECD CCn1cc(CN[C@H](C)c2c(C)cc(C)cc2O)nn1 850522750 YTGBVCXZOSHNDH-GFCCVEGCSA-N 274.368 2.471 10 20 CECD COc1ccc2c(c1)CCCN2Cc1cncn1C 751468047 BYYRDJZVXRDIFX-UHFFFAOYSA-N 257.337 2.382 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2COC[C@@H]2C)c1O 699846503 IQEGEMYVMBSZSY-GZMMTYOYSA-N 271.744 2.179 10 20 CECD C[C@@H]1COCCN(Cc2cc(F)c(N(C)C)cc2F)C1 862246627 LNNNMJJJJSTDBM-NSHDSACASA-N 284.350 2.499 10 20 CECD C[C@@H](NC(=O)N1CC(F)C1)c1ccc(N(C)C)cc1 776243598 FXFVGNKKSPVBDD-SNVBAGLBSA-N 265.332 2.177 10 20 CECD CC[C@H]1CO[C@H](C)CN1Cc1cc(OC)c(OC)cc1O 775642837 PCYLUEANKFRXMR-YPMHNXCESA-N 295.379 2.409 10 20 CECD C[C@@H](CC(=O)OCC(=O)c1ccc(O)c(O)c1)C1CC1 783198971 MJAGXTXATGGWMC-VIFPVBQESA-N 278.304 2.260 10 20 CECD O=C(COC(=O)[C@H]1Cc2ccccc21)c1ccc(O)c(O)c1 783882000 VQXCTVCGZMOAHM-ZDUSSCGKSA-N 298.294 2.164 10 20 CECD COCC1(C)CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 788575562 BAUZMEKEPRFOSB-UHFFFAOYSA-N 296.323 2.085 10 20 CECD C[C@@H]1NC(=O)[C@H](C)N(Cc2cc(Cl)ccc2O)[C@H]1C 895113761 KDCPPPUASINNGI-GUBZILKMSA-N 282.771 2.143 10 20 CECD C[C@@H](NC(=O)NCCC[C@H]1CCCN1)c1ccccc1O 892159222 ORQLTBKOIRZQCS-CHWSQXEVSA-N 291.395 2.285 10 20 CECD C[C@@H]1CCc2[nH]nc(C(=O)NCc3ccccc3O)c2C1 896015647 QQNTWKMTUBFRED-SNVBAGLBSA-N 285.347 2.170 10 20 CECD CC(C)OC(=O)C(C)(C)NCc1ccc2c(c1)CCO2 898508217 BDXCPWGWSMECJW-UHFFFAOYSA-N 277.364 2.441 10 20 CECD CCOC(=O)[C@H](C)[C@@H](C)NCc1cc(C)cc(OC)c1O 894453545 HLXUNLWBOCWVCU-VXGBXAGGSA-N 295.379 2.387 10 20 CECD COc1ccc(CNc2nc(C)cc(OC)n2)c(O)c1 795285977 XFFYHJDOEYSYLN-UHFFFAOYSA-N 275.308 2.120 10 20 CECD CN(C)c1ccc(CN(C)[C@H]2CC(C)(C)OC2=O)cc1 795686271 VWBYEDHDSDCGLC-AWEZNQCLSA-N 276.380 2.279 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](CF)C1 1339816834 AUQNKLADZYQAQG-FVOPLDGLSA-N 279.311 2.319 10 20 CECD O=C(O)[C@@H](C[C@H]1CCCO1)NCc1cc(Cl)ccc1O 1601641173 IDVZZLUWKRQTSC-VXGBXAGGSA-N 299.754 2.158 10 20 CECD CCOC(=O)/C=C/CSc1ncc(C(=O)O)s1 1596583496 NFTOTCANHVIWCM-ONEGZZNKSA-N 273.335 2.053 10 20 CECD CCc1ncsc1C(=O)NCc1cc(OC)ccc1O 162854345 WUKQCDIDUIRPDM-UHFFFAOYSA-N 292.360 2.350 10 20 CECD Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)CC2 160382493 RUUITOTZUWMONO-SWLSCSKDSA-N 299.422 2.318 10 20 CECD O=C(NCc1ccccc1O)c1ccc([N+](=O)[O-])s1 225107895 VEQYEOSLIPKPKP-UHFFFAOYSA-N 278.289 2.292 10 20 CECD CN1CCCc2cc(CNCc3c[nH]cn3)ccc21 112344672 JEKMPIWGGJTTGN-UHFFFAOYSA-N 256.353 2.082 10 20 CECD CN1CCC[C@H](CNCc2ccc(N(C)C)cc2)C1 44535799 SKVOFSQEJFTLLW-OAHLLOKOSA-N 261.413 2.184 10 20 CECD CN(C)CC(C)(C)NCc1cc(Cl)ccc1O 308610849 ZPGCUUNHDMEFPU-UHFFFAOYSA-N 256.777 2.475 10 20 CECD Cc1cnc(CN2CCCc3cc(CN)ccc32)o1 700927120 RIPDJXPLAZUFOZ-UHFFFAOYSA-N 257.337 2.395 10 20 CECD O=C(O)CC1(NCc2ccc3c(c2)CCCO3)CC1 1608688892 YIDGLPFVNSHAQJ-UHFFFAOYSA-N 261.321 2.109 10 20 CECD CC[C@H]1C(=O)NCCN1Cc1c(O)ccc2ccccc12 106855449 GACDJKGFAQPAQS-HNNXBMFYSA-N 284.359 2.256 10 20 CECD CCN(CCNC(=O)N(C)Cc1ccccc1O)C(C)C 102571622 WRSCFIVWLCZKAN-UHFFFAOYSA-N 293.411 2.264 10 20 CECD CN(CCOC[C@H]1CCCO1)c1ccc2c(c1)OCO2 121273604 OUZPTAFJLJPTTL-CYBMUJFWSA-N 279.336 2.047 10 20 CECD COc1ccc(NC(=O)c2cccc(O)c2O)cc1OC 126206451 RRWHEGFXCPABJV-UHFFFAOYSA-N 289.287 2.367 10 20 CECD COc1ccc(O)c(CN(C)Cc2cccnc2)c1 182031358 BJZWGGGPVXVLJJ-UHFFFAOYSA-N 258.321 2.428 10 20 CECD CSC[C@@H](C)NC(=O)N(C)Cc1ccccc1O 77626640 PLAHRSCCZJLBEF-SNVBAGLBSA-N 268.382 2.285 10 20 CECD C[C@H](CO)CN[C@@H](C)c1ccc(Br)cc1O 134914694 NCZHVIVGDKDCCY-IUCAKERBSA-N 288.185 2.434 10 20 CECD CC(C)CN(CC(=O)O)Cc1ccc(N(C)C)cc1 86777806 WQPRMPZPUPWZGN-UHFFFAOYSA-N 264.369 2.295 10 20 CECD Cc1oc(C(=O)O)cc1CNCc1ccccc1O 235828968 RFDCFIGVXOSNOB-UHFFFAOYSA-N 261.277 2.282 10 20 CECD C[C@H](CCO)CN[C@H](C)c1ccc(N(C)C)cc1 97436157 NZZXUXNTTYJURT-CHWSQXEVSA-N 250.386 2.422 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)Cc1cccnc1 266359139 REVUAVHMYXXFDL-UHFFFAOYSA-N 297.358 2.116 10 20 CECD COc1ccc(CNC(C)(C)CCS(C)(=O)=O)cc1C 266178195 UFDGFPNDIGILOA-UHFFFAOYSA-N 299.436 2.307 10 20 CECD C[C@H](NCCOCC(F)F)c1cc([N+](=O)[O-])ccc1O 276650228 MJECVUBKJNYMIE-QMMMGPOBSA-N 290.266 2.233 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)Nc1cncnc1 274381264 UZDSFHBVYOZGPS-UHFFFAOYSA-N 297.362 2.399 10 20 CECD CC[C@H](N[C@@H](C)c1ncn(C)n1)c1ccc(F)cc1O 287375823 HZGHJHJULFOYJD-CABZTGNLSA-N 278.331 2.462 10 20 CECD COc1ccc(N(Cc2cnnn2C)C(C)C)cc1F 289376816 OZFQGIDOUGQSDB-UHFFFAOYSA-N 278.331 2.378 10 20 CECD CC[C@H](NC[C@@](C)(O)CCOC)c1ccc(F)cc1O 285914485 DKORNRZLNYWCID-ZFWWWQNUSA-N 285.359 2.360 10 20 CECD O=C1OCc2ccc(NCc3cc4c(cc3O)OCO4)cc21 809788607 MCLOBEVAPUXEGC-UHFFFAOYSA-N 299.282 2.403 10 20 CECD Nc1ccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2)cc1 294764986 MCDUTFQNRRBCEI-GDLCADMTSA-N 259.353 2.128 10 20 CECD CCOC(=O)N1CC[C@@H](N[C@H]2CCc3cccc(O)c32)C1 296307942 DXIZCHZQJLHJFG-OLZOCXBDSA-N 290.363 2.200 10 20 CECD CCO[C@H](CC(=O)NCCc1ccc(N)cc1)C(C)C 818546115 RMCNJOUGIBBBRF-OAHLLOKOSA-N 278.396 2.379 10 20 CECD Cc1cccc(CN[C@H](CC(N)=O)c2ccccc2)c1O 816652994 BGBRXHYHEXUOBQ-OAHLLOKOSA-N 284.359 2.407 10 20 CECD CCCC[C@H](CN)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 817962746 NWQRCSVHZWTGHJ-WDEREUQCSA-N 281.356 2.469 10 20 CECD CC[C@@H](NC[C@H]1CNCCO1)c1cc(Cl)ccc1O 817982892 JHFSTQMAOKGLLS-DGCLKSJQSA-N 284.787 2.075 10 20 CECD CC[C@@H](NCCNC1CC1)c1ccc(F)cc1O 817951771 AKCOVVRMAMZVGL-CYBMUJFWSA-N 252.333 2.324 10 20 CECD COc1ccc(CNC(=O)c2cc(O)cs2)cc1OC 731861724 LJXPDOZNKOQQSX-UHFFFAOYSA-N 293.344 2.401 10 20 CECD Cc1cc(Br)cc(CNC2CC(N)C2)c1O 906509247 CCIMVGMTPWVSQE-UHFFFAOYSA-N 285.185 2.042 10 20 CECD COc1cccc([C@H](C)N[C@H]2COC[C@H]2C)c1O 903393587 PQQDTCRKZLSGNI-SCVCMEIPSA-N 251.326 2.086 10 20 CECD C[C@H]1C[C@H]1C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 833597120 JCNLDAYVTMWBJJ-GZMMTYOYSA-N 297.738 2.115 10 20 CECD Cc1cc(O)c(CN[C@@H]2C[C@@H]3CCCCN3C2=O)cc1C 835073102 KYJJEDBYRVMRGV-LSDHHAIUSA-N 288.391 2.252 10 20 CECD Cc1ccc([C@@H](C)C(=O)NCc2ccc(O)cc2O)o1 910950451 FJFFZRREIBJZET-SNVBAGLBSA-N 275.304 2.419 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)C[C@H]2C=CCC2)cc1 846663221 FLMUAXFLGOJJOF-XJKSGUPXSA-N 287.407 2.225 10 20 CECD C[C@@H]1CNCCN1Cc1ccc(N2CCCCC2)cc1 843048017 JDANHQBPPYGLPL-OAHLLOKOSA-N 273.424 2.471 10 20 CECD COCCOCCCN[C@H](C)c1cccc(OC)c1O 846137031 QLUJHNPLGQRRLK-GFCCVEGCSA-N 283.368 2.105 10 20 CECD Nc1ccc(CC(=O)N2CCO[C@@H](c3ccco3)C2)cc1 846686395 IKVGOXQUFNWLIT-OAHLLOKOSA-N 286.331 2.004 10 20 CECD C[C@H](N[C@H](CO)c1cnn(C)c1)c1ccc(Cl)cc1O 841752461 TVKMKQGUWOHRDW-TVQRCGJNSA-N 295.770 2.163 10 20 CECD CN(C)c1ccc(CNC(=S)NCC2CC2)cc1 849252836 KKCSYDNXFDAYQK-UHFFFAOYSA-N 263.410 2.127 10 20 CECD CCO/C=C/C(=O)N[C@H](C)c1ccc(N(C)C)cc1 841187034 PLHJYQFCWGUCTA-HCRIHEDKSA-N 262.353 2.480 10 20 CECD CNC[C@@H]1CCCN1Cc1cc(Cl)cc(F)c1O 843056357 ZCCJNFMNBGKFPL-NSHDSACASA-N 272.751 2.369 10 20 CECD Cc1ccc([C@H](C)NCCN2CCO[C@H](C)C2)c(O)c1 756542561 BIRMEUWWDYKFJB-KGLIPLIRSA-N 278.396 2.072 10 20 CECD CCCCN(Cc1ccccc1O)C[C@H]1CNC(=O)C1 852019099 UQCAPUNSJDOBLW-CYBMUJFWSA-N 276.380 2.130 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H]2CCC[C@]2(N)C1 857226264 JKNSISBCRXUEKZ-WBVHZDCISA-N 273.424 2.374 10 20 CECD COc1cccc(CNc2cnn(CCF)c2)c1O 858245455 IOHYHRHUZHFZIS-UHFFFAOYSA-N 265.288 2.179 10 20 CECD CCN(Cc1cnn(C)c1)Cc1c(O)cccc1OC 769045015 YFQVUEGNXCVEPQ-UHFFFAOYSA-N 275.352 2.156 10 20 CECD Cc1cccc(O)c1CN(C)CCCn1ccnc1 877528041 RVHCMMVCWPTCEU-UHFFFAOYSA-N 259.353 2.419 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1c(C)cccc1O 876764248 MGILTILKGMZRIH-GFCCVEGCSA-N 263.337 2.228 10 20 CECD CN(C)c1ccc(CN[C@H](CC2CC2)C(=O)O)cc1 871883986 FNWZQHLDZBVRIK-CQSZACIVSA-N 262.353 2.096 10 20 CECD COCCCN(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773630515 ULLDQXOQIHKUHU-CYBMUJFWSA-N 293.411 2.492 10 20 CECD CCO[C@H]1CCCN(Cc2cc(OC)c(OC)cc2O)C1 775634917 ZMWMXHABRIBLRT-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD CC(=O)N1CC[C@H](CN(C)Cc2c(O)cccc2Cl)C1 770384864 ZNOVOADSEZANCH-GFCCVEGCSA-N 296.798 2.346 10 20 CECD COc1cc(O)c(CNC[C@@H]2C=CCC2)cc1OC 895528649 YYJWIVNABBQKSM-LLVKDONJSA-N 263.337 2.465 10 20 CECD COc1cc(C)cc(CNC[C@@H](O)c2ccco2)c1O 894164263 BTZIHHGCVVKENV-GFCCVEGCSA-N 277.320 2.125 10 20 CECD C[C@H](O)CN(Cc1cc(F)cc(F)c1O)CC(F)F 894913731 CWYDYZJORCHWAN-ZETCQYMHSA-N 281.249 2.118 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccc2n[nH]cc2c1 793655510 HDVRTRNZKCHEIB-UHFFFAOYSA-N 295.342 2.470 10 20 CECD C[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)CS1 397819821 DLXAKJUHAPULHC-SCZZXKLOSA-N 267.350 2.105 10 20 CECD CC[C@H](NC[C@@]1(O)CCSC1)c1ccc(F)cc1O 796786444 CPZOCTUOJCKNRW-JSGCOSHPSA-N 285.384 2.440 10 20 CECD CN(Cc1ccccc1O)Cc1nnc2ccccn12 770511057 XPXNCYBPZSPAPQ-UHFFFAOYSA-N 268.320 2.067 10 20 CECD CCOc1ccc(N2CCN(CCCCCO)CC2)cc1 1236434623 VLQWFAAWEKFGNT-UHFFFAOYSA-N 292.423 2.370 10 20 CECD O=C(NC[C@@H]1CCOC2(CCC2)C1)c1cccc(O)c1O 1328067942 OWZYYYXXTLJJKF-LLVKDONJSA-N 291.347 2.177 10 20 CECD COC(=O)[C@H]1CCC[C@H]1NCc1ccc(N(C)C)c(C)c1 1324268479 WJCJHBUYWAEMTK-LSDHHAIUSA-N 290.407 2.492 10 20 CECD C[C@@H](NC(=O)N[C@H]1CCCC[C@H]1CN)c1ccccc1O 1332544896 VXBTXDRHSVYFHT-DYEKYZERSA-N 291.395 2.270 10 20 CECD C[C@@H]1C[C@@H]1C(=O)CSc1ncc(C(=O)O)s1 1604682083 PIKPJEPXSSVACL-RITPCOANSA-N 257.336 2.159 10 20 CECD O=C(O)[C@@H]1CCC[C@H](C(=O)N2Cc3cccc(O)c3C2)C1 1601800411 WFKOVDZQXQTBIP-WDEREUQCSA-N 289.331 2.125 10 20 CECD CN(C(=O)C1=CC[C@H](N)C1)c1cccc2ncccc12 1578368575 QILUOWBYGKJFCN-LBPRGKRZSA-N 267.332 2.245 10 20 CECD C[C@H](NCCc1ccn(C)n1)c1cc(F)ccc1O 230899370 UPPUAULYUSXUPI-JTQLQIEISA-N 263.316 2.158 10 20 CECD COc1cc(O)c(CN(C)C2CCC2)cc1OC 160298223 RHGDLDBHKKYLCV-UHFFFAOYSA-N 251.326 2.394 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCN(C)C)c1 19958832 FLSQYUPENBGYDE-LLVKDONJSA-N 252.358 2.003 10 20 CECD COc1ccc(O)c(CNC[C@@H](CC(C)C)N(C)C)c1 20201876 QNGZOFBMNMRIQQ-CQSZACIVSA-N 280.412 2.467 10 20 CECD CCO[C@@H]1CCCN(Cc2cccc(OC)c2O)C1 155437761 FZWNWWSUNKHWBA-CYBMUJFWSA-N 265.353 2.402 10 20 CECD COc1cccc(CN[C@@H]2CCN3CCCC[C@H]23)c1O 36996875 APYQPDQAFWCJKL-ZIAGYGMSSA-N 276.380 2.117 10 20 CECD CSCCCNCc1ccc(N2CCOCC2)cc1 70186544 ZVCKRKIKVASCHS-UHFFFAOYSA-N 280.437 2.366 10 20 CECD Nc1ccc(CNC(=O)C2CCSCC2)cc1 401700898 NUILHVPQGAPIOW-UHFFFAOYSA-N 250.367 2.028 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCCNCC2)c1O 50153785 YIVZMROQTNTYOI-UHFFFAOYSA-N 282.771 2.044 10 20 CECD CC(C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2O)C1 179565696 KWCZNHKCVNFCJA-AWEZNQCLSA-N 290.407 2.376 10 20 CECD CC[C@@H](C)[C@@](C)(O)CNCc1cccc(OC)c1O 304044771 JKLPAYVSQKIDCC-ABAIWWIYSA-N 267.369 2.288 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC(F)(F)F 183439098 TZXPBCOOJPAGPD-SSDOTTSWSA-N 277.242 2.097 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H](O)c2ccccc2)cc1 72844048 BBXQANPKIGTLQS-INIZCTEOSA-N 284.359 2.102 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](C)CO)cc1 129195328 HBBBYDSCDCBFDG-LLVKDONJSA-N 272.348 2.205 10 20 CECD COc1ccc(N2CCNCC2)cc1C(F)(F)F 59791872 LYOUNEJJEHOTDQ-UHFFFAOYSA-N 260.259 2.124 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2cccc(Cl)c2O)C1 193493916 CPULOKWYTGZIDT-GXSJLCMTSA-N 283.755 2.477 10 20 CECD CCN(C)c1ccc(/C=C2/SC(=S)N(C)C2=O)cn1 190394395 VRJRYNUNJUUIRC-JXMROGBWSA-N 293.417 2.369 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@](C)(O)CC2)c1O 230359021 VUDDFYGKJZSUKG-INIZCTEOSA-N 295.354 2.471 10 20 CECD CCOCCOCCSc1ncc(C(=O)OC)s1 917777368 GBTMBYABICWQEH-UHFFFAOYSA-N 291.394 2.075 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C(=O)C(C)(C)C 266624865 GYQAVLTVYNXBNJ-UHFFFAOYSA-N 290.363 2.093 10 20 CECD CCCOc1ccc(CN2CC[C@@H](C(=O)OC)C2)c(O)c1 271114082 VPGSQUXGOBAZJG-CYBMUJFWSA-N 293.363 2.176 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2CCCC[C@H]2N)cc1 296698301 IBELCDYCLAHTBA-GDBMZVCRSA-N 289.423 2.276 10 20 CECD CCC1(CN2C(=O)CN(Cc3ccccc3O)C2=O)CC1 819168465 RCIWLPHZWCTZHF-UHFFFAOYSA-N 288.347 2.347 10 20 CECD C[C@H]1C[C@H](NC[C@H](C)CN)c2c(O)ccc(F)c21 817963558 UXOKONIUMDJKLR-YWVKMMECSA-N 252.333 2.264 10 20 CECD O=C(NC[C@H]1COc2ccccc21)c1cccc(O)c1O 811562648 IRYPHRXGEFLSPZ-JTQLQIEISA-N 285.299 2.004 10 20 CECD C[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)c1cccnc1 817941826 LBOKTBOSLFEVOX-SUMWQHHRSA-N 284.407 2.498 10 20 CECD COc1cccc(CN2CC3(CCNCC3)C[C@H]2C)c1O 818431956 XQLTZVRCDYIFCF-CYBMUJFWSA-N 290.407 2.365 10 20 CECD COc1ccc(N(C)CC[S@@](C)=O)cc1Cl 828040510 IFSQMWGLHUXKJN-MRXNPFEDSA-N 261.774 2.163 10 20 CECD Oc1ccc(F)cc1CNCc1cccc(-c2nn[nH]n2)c1 826511314 KLXBOWWMYDROBD-UHFFFAOYSA-N 299.309 2.001 10 20 CECD CC[C@H]1C(=O)NCCN1Cc1cc(Cl)c(C)cc1O 824708468 FJVINDNOMOEURX-LBPRGKRZSA-N 282.771 2.064 10 20 CECD Oc1ccccc1CN(C[C@@H]1CCOC1)C[C@@H]1CCCO1 732203618 YYGINVANUUEGCA-HOCLYGCPSA-N 291.391 2.410 10 20 CECD CC[C@](C)(CNC(=O)N(C)Cc1ccccc1O)OC 838661178 KHCPWJKMQIDBHT-OAHLLOKOSA-N 280.368 2.349 10 20 CECD CNC(=O)C[C@H](C)N[C@H](C)c1ccc(C)c(C)c1O 834898634 AJZLRXRKYLBSGW-CMPLNLGQSA-N 264.369 2.184 10 20 CECD CO[C@@H](CNC(=O)c1cc(O)cs1)Cc1ccccc1 833599180 OMFZQIRVWXHWTG-CYBMUJFWSA-N 291.372 2.441 10 20 CECD CCCCOCCNC(=O)CN(C)c1ccc(OC)cc1 844353119 HGAVFSDKYAXYEE-UHFFFAOYSA-N 294.395 2.064 10 20 CECD CCCNCCNCc1c(O)ccc(Cl)c1F 841046766 MUFNZKPPTXKUPW-UHFFFAOYSA-N 260.740 2.274 10 20 CECD C[C@H]1C[C@H](NCc2cc(Br)ccc2O)CCN1 841062823 YBAQWEMDUFOMEY-JOYOIKCWSA-N 299.212 2.385 10 20 CECD CC[C@H](NCc1cc(OC)c(OC)cc1O)[C@@H](O)C(C)C 840967401 MNXRKSHVFJWBCE-LRDDRELGSA-N 297.395 2.295 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CC23CCOCC3)cc1 748527208 IUNSPYJXLVDLBS-OAHLLOKOSA-N 288.391 2.186 10 20 CECD Cc1cc(O)c(CN2CC[C@@H]3NCC[C@H]3C2)cc1C 843126040 FEZDFWKHXGCKMT-ZFWWWQNUSA-N 260.381 2.193 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@@]2(CCCN2)C1 841105463 PALZZXVJDFNHIU-AWEZNQCLSA-N 266.772 2.374 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C1CCNCC1 843046665 YNLFHCBGSVTFNF-UHFFFAOYSA-N 261.413 2.245 10 20 CECD O=C1C[C@@H](NCc2ccc(N3CCCC3)cc2)CCCN1 924647417 GIVGARXXEDJWQH-HNNXBMFYSA-N 287.407 2.045 10 20 CECD OC1CCN(c2ccc(CN[C@H]3CCSC3)cc2)CC1 850566516 ORNULGOEBUJDRR-AWEZNQCLSA-N 292.448 2.243 10 20 CECD Cc1ccnc(CN(C)c2ccc3c(c2)OCO3)n1 756646242 SPHBPAWANLAXCO-UHFFFAOYSA-N 257.293 2.150 10 20 CECD CCOc1ccc(CN2CCN(C(C)C)CC2)c(O)c1 768240826 HDEMTJVVOLQYLN-UHFFFAOYSA-N 278.396 2.317 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2ccc(N(C)C)cc2)CCC1=O 763263308 TTZPUZNFPYAQBC-TZMCWYRMSA-N 288.391 2.374 10 20 CECD NC[C@H]1CC[C@H](N[C@H]2CCc3cccc(O)c32)CC1 873239200 PKLGUJZPILAVNY-UBHSHLNASA-N 260.381 2.487 10 20 CECD Cc1cccc(O)c1CNC[C@](C)(O)c1ccco1 877071628 AXHJYDFWUINTSM-HNNXBMFYSA-N 261.321 2.291 10 20 CECD O=C(NCc1ccccc1O)Nc1cnn(C(F)F)c1 772481909 RXQZFABYWWSXPE-UHFFFAOYSA-N 282.250 2.306 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2c(O)cccc2Cl)C1 770384866 ZNOVOADSEZANCH-LBPRGKRZSA-N 296.798 2.346 10 20 CECD CCn1cccc(CNCc2cc(F)cc(F)c2O)c1=O 883106448 SQGFMHKKEZSROM-UHFFFAOYSA-N 294.301 2.142 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CO[C@H](C)C2)c1 784441404 FUXJKQBZSWNRJR-OUAUKWLOSA-N 279.336 2.003 10 20 CECD COCCSCCCOC(=O)c1cccc(O)c1O 784797821 JURBIWDDKZQOJM-UHFFFAOYSA-N 286.349 2.024 10 20 CECD COc1ccc(O)c(CNCc2scnc2C)c1 71212571 CHBJZURSLKTKLR-UHFFFAOYSA-N 264.350 2.456 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc2cncn2c1 786329877 INLNHALNTGOUTE-UHFFFAOYSA-N 281.315 2.312 10 20 CECD COc1ccc(CN2CCC3(CCO3)CC2)c(O)c1OC 894262406 KHNUMDZYNXVALD-UHFFFAOYSA-N 293.363 2.164 10 20 CECD CC[C@@H](NCC(C)(C)C(N)=O)c1ccc(C)cc1O 794815019 HBNMINGVLHAFNQ-GFCCVEGCSA-N 264.369 2.253 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCN2CCC[C@@H]2C1 725845538 CRPLCPVOTZMWTN-CHWSQXEVSA-N 276.380 2.117 10 20 CECD CCc1noc(C)c1CNC(=O)NCc1ccc(N)cc1 1346440174 HYMVNNAKGTZFMC-UHFFFAOYSA-N 288.351 2.127 10 20 CECD COc1ccc(O)c(CNCc2ccc(C(=O)O)s2)c1 1604821307 XMRVBGPYYYRTRG-UHFFFAOYSA-N 293.344 2.450 10 20 CECD C[C@@H](CC(=O)O)CC(=O)NCc1cccc(Cl)c1O 1604106746 PWSKEKJVXCNEOQ-MRVPVSSYSA-N 285.727 2.163 10 20 CECD O=C(O)[C@@]1(F)CCN(Cc2cccc(Cl)c2O)C1 1601716663 ACMGDIBNWDHGKC-GFCCVEGCSA-N 273.691 2.044 10 20 CECD C=Cn1cc(CN(C)c2ccc(OCC(=O)O)cc2)cn1 1588922271 ZUWIZVVMMBEDQW-UHFFFAOYSA-N 287.319 2.083 10 20 CECD Nc1ccc(NC(=O)NCc2ccc3oc(O)nc3c2)cc1 1580449847 WQDPCEQASOBSKN-UHFFFAOYSA-N 298.302 2.437 10 20 CECD Cc1ccc([C@H](C)NCCc2ccn(C)n2)c(O)c1 230897891 YHKSUOPWBUOHCP-LBPRGKRZSA-N 259.353 2.327 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](N3CCCC3)C2)c1 133943184 XEKIGIOASHTNML-OAHLLOKOSA-N 260.381 2.371 10 20 CECD CC[C@@H](CSC)NCc1cc2c(cc1O)OCO2 163873131 UMIGJSCYXXFRQN-JTQLQIEISA-N 269.366 2.352 10 20 CECD CC[C@@H](C)NCc1ccc(N2CCN(C)CC2)c(F)c1 1317946896 ZSXVKTOFMWHALO-CYBMUJFWSA-N 279.403 2.466 10 20 CECD CCc1cc(NCCc2ccc(O)c(O)c2)nc(C)n1 272939737 WTMKSADMLINEBM-UHFFFAOYSA-N 273.336 2.413 10 20 CECD Oc1c(Cl)cccc1CNCCC1(O)CCC1 285035892 KRFMLPQDDOEXRK-UHFFFAOYSA-N 255.745 2.440 10 20 CECD CC[C@H]1CN(C(=O)c2cccc(O)c2O)[C@@H](CC)CO1 403780309 ADPAIQHCSRKLNT-QWRGUYRKSA-N 279.336 2.127 10 20 CECD CCOCCCNC(=O)NCc1ccc(N(C)C)cc1C 115645168 HZNQMHPTDVNXQK-UHFFFAOYSA-N 293.411 2.287 10 20 CECD CN(Cc1ccccc1O)C(=O)/C=C/C1CCOCC1 118775248 QMCHWTHFNRSKMC-VOTSOKGWSA-N 275.348 2.333 10 20 CECD O=C(O)[C@H]1[C@H]2CC[C@@H](C2)[C@H]1NCc1ccc2c(c1)CCO2 115603574 DMFSQNUGQYVSEJ-DARAHFNDSA-N 287.359 2.210 10 20 CECD COc1cccc(CNC(=O)[C@@H]2COc3ccccc32)c1O 175928278 NZGPWCDULFFRJY-CYBMUJFWSA-N 299.326 2.193 10 20 CECD C[C@H](O)[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 305824294 BYSFBFVKAHWZIS-VHSXEESVSA-N 255.745 2.248 10 20 CECD COC1(CNCc2ccc(N(C)C)c(F)c2)CCOCC1 123203322 NWICOYMXENDQBP-UHFFFAOYSA-N 296.386 2.177 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1cccc(OC)c1O 182325503 FQLNXDLHVWKWRW-OAHLLOKOSA-N 278.352 2.021 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)C 183484475 INRHHOAEZHSQRE-SECBINFHSA-N 251.326 2.191 10 20 CECD C[C@@H](NC[C@H]1CC[C@H](O)C1)c1cc(F)ccc1O 189299967 QEFPFYJKQCYOSA-SCVCMEIPSA-N 253.317 2.343 10 20 CECD CN(CCNCc1cc2c(cc1O)OCO2)C1CCCC1 71377132 GPRONLICICVVMD-UHFFFAOYSA-N 292.379 2.085 10 20 CECD COc1cccc(CN2CC[C@@H]([C@H]3CCOC3)C2)c1O 371310499 LIQCONOOWRFZQO-OCCSQVGLSA-N 277.364 2.259 10 20 CECD Oc1cc2c(cc1CN[C@@H]1CCCSC1)OCO2 135702311 UUQZAMRGMOAHIM-SNVBAGLBSA-N 267.350 2.106 10 20 CECD COc1ccc2c(c1)CN(C(=O)c1cccc(O)c1O)CC2 192990297 IUZCHFFEGWUYCL-UHFFFAOYSA-N 299.326 2.305 10 20 CECD COc1cc(O)c(CN2CC[C@H](O)C(C)(C)C2)cc1OC 276093298 YEDYDTKFJRIWDW-HNNXBMFYSA-N 295.379 2.002 10 20 CECD CC(C)CCCNC(=O)c1c(F)ccc(O)c1O 276622370 RDFDNJCVNVRTDF-UHFFFAOYSA-N 255.289 2.403 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCC[C@@H](C)CO)c1 273458016 HMOCWVUVROLPPV-NEPJUHHUSA-N 295.379 2.238 10 20 CECD COc1cccc(CN2CC[C@H](c3nccn3C)C2)c1O 368134291 LOZWOGXCEDREFR-ZDUSSCGKSA-N 287.363 2.124 10 20 CECD COc1ccc(O)c(CN[C@@H](CO)c2ccc(F)cc2)c1 271798415 IIMDSONRZDQSOP-HNNXBMFYSA-N 291.322 2.363 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H]2C[C@H]21 804294470 LXBSSLIGQXWPGS-CZVUKNJHSA-N 259.305 2.122 10 20 CECD CN(CCN1CCCC1)Cc1ccc(N(C)C)c(F)c1 809738483 ZPJINLNDEOJCSO-UHFFFAOYSA-N 279.403 2.419 10 20 CECD Cc1ccc(CNCc2ccc3c(c2)CCCN3C)nn1 396594961 LDCFUSBSRZWWKJ-UHFFFAOYSA-N 282.391 2.457 10 20 CECD C[C@H]1CN(Cc2cc(Cl)c(F)cc2O)CC[C@@H]1O 816574989 YQQODRUZYAVXDW-UFBFGSQYSA-N 273.735 2.387 10 20 CECD C[C@H](NCC[C@@H]1CCNC1)c1ccc(F)cc1O 817955005 OFRHNLUFYNEXMY-QWRGUYRKSA-N 252.333 2.182 10 20 CECD CCC[C@](C)(N)C(=O)NCCCSc1nccs1 829527677 CAKPNCGPIZUEQP-LBPRGKRZSA-N 287.454 2.259 10 20 CECD Cc1coc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 907273074 KOEIGJKDRIROJG-JTQLQIEISA-N 275.304 2.360 10 20 CECD CCOc1ccc(O)c(CNCc2cnc(C)o2)c1 839170968 WIYYAYLJNRSTSU-UHFFFAOYSA-N 262.309 2.377 10 20 CECD CCOc1ccc(CNC[C@]2(C)CCOC2)c(O)c1 733327626 JGUQNCKMPCHYTL-HNNXBMFYSA-N 265.353 2.307 10 20 CECD CCN(C)C(=O)CSc1ncc(Cl)s1 849999665 WOJVXAXEEPBVCF-UHFFFAOYSA-N 250.776 2.367 10 20 CECD C[C@H](C(=O)O)N(C)C/C=C\c1ccc(N(C)C)cc1 840995700 LHJIIKVXUKVXFU-FOQNGQEVSA-N 262.353 2.171 10 20 CECD CSCCNC(=O)NCc1cc(Cl)ccc1O 844946459 UEZOMSNARDIIBV-UHFFFAOYSA-N 274.773 2.208 10 20 CECD C[C@@H](CC(=O)N(CC(=O)O)Cc1ccccc1O)C1CC1 911486479 NWKQUGFVKOPCBE-NSHDSACASA-N 291.347 2.242 10 20 CECD C[C@H]1CCC[C@@H](C)N(C(=O)C(=O)Nc2ccc(N)cc2)C1 841049487 SJUCQLAVXSQSBB-NWDGAFQWSA-N 289.379 2.244 10 20 CECD CC(C)(O)CCNC(=O)NCc1cc(Cl)ccc1O 845127378 KISOBQOGGCLFNA-UHFFFAOYSA-N 286.759 2.006 10 20 CECD NC[C@H]1CC[C@H](NCc2cccc(Cl)c2O)C1 841084967 RBBSGUJFYFPKSU-ONGXEEELSA-N 254.761 2.263 10 20 CECD CCC[C@H](C)NC(=O)NCc1cccc(OC)c1O 745260804 GJWRZCSWWSJORJ-JTQLQIEISA-N 266.341 2.389 10 20 CECD CCc1nc([C@@H](C)N[C@@H](C)c2cccc(OC)c2O)n[nH]1 846157388 MEMZANKEZUTMHL-VHSXEESVSA-N 290.367 2.493 10 20 CECD C[C@H]1[C@H](C)CCC[C@H]1NC(=O)C(=O)Nc1ccc(N)cc1 840999925 RBLVBELSIPVSLJ-UHIISALHSA-N 289.379 2.148 10 20 CECD C[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)CS1 840957378 AGDISSKUPMVEJO-WCBMZHEXSA-N 268.338 2.284 10 20 CECD Nc1ccc(NC(=O)N[C@@H](C2CC2)[C@H](CO)C2CC2)cc1 841299683 MOVSSNJLBIWCMU-CABCVRRESA-N 289.379 2.187 10 20 CECD CCc1cccc(CNCCCOC[C@H]2CCOC2)c1O 848896910 KQOGZEAUGJVMEQ-CQSZACIVSA-N 293.407 2.487 10 20 CECD COc1ccc(O)c([C@H](C)NCCC2CCNCC2)c1 844923672 HEGTYJOFPUDERC-LBPRGKRZSA-N 278.396 2.441 10 20 CECD CN(CCNCc1ccc(N(C)C)cc1)CC(F)F 858336137 WXFDOQIUUZXQBG-UHFFFAOYSA-N 271.355 2.039 10 20 CECD CC[C@@H](NCCO[C@H]1CCOC1)c1ccc(F)cc1O 927080134 HIAKOXDSDKFPRE-GXTWGEPZSA-N 283.343 2.378 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCOC2CCC2)c1 756839451 RSIBIOIYNUYIFI-NSHDSACASA-N 293.363 2.399 10 20 CECD C[C@@H](NCCN(C)CC(F)F)c1cc(F)ccc1O 858596119 BFGJXIWUSCDETP-SECBINFHSA-N 276.302 2.379 10 20 CECD Cc1cc(CN2C[C@@H]3CCN(C)C[C@@H]3C2)ccc1N(C)C 931439725 YKYMTVNBRONUDQ-DLBZAZTESA-N 287.451 2.445 10 20 CECD C[C@H](N[C@H](CCO)C1CCOCC1)c1ccc(F)cc1O 763557097 BFQOVOHGNTVIRT-XHDPSFHLSA-N 297.370 2.360 10 20 CECD CN(Cc1ccccc1O)C(=O)Nc1cnn(CCF)c1 861490549 WOIOEUNBZMNFJI-UHFFFAOYSA-N 292.314 2.222 10 20 CECD CSCC[C@@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 779519108 NUFKUGOEJHRYKD-DFVUYQKZSA-N 281.377 2.369 10 20 CECD C[C@H](NC(=O)c1ccnc(O)c1)c1ccc(N(C)C)cc1 773024621 MNQQQARJHBKFER-NSHDSACASA-N 285.347 2.344 10 20 CECD Cc1[nH]nc(NCc2ccc(N3CCN(C)CC3)cc2)c1C 886197614 FVETVCHZDZWTOW-UHFFFAOYSA-N 299.422 2.390 10 20 CECD COc1ccc(O)c([C@H](C)NC(=S)NC2(C)CC2)c1 789218268 ADDKTWVREANIRZ-VIFPVBQESA-N 280.393 2.478 10 20 CECD COc1ccc(CN[C@@H]2CCO[C@H]2C2CC2)c(O)c1OC 896409433 MQVPVKDDJLREJV-DOMZBBRYSA-N 293.363 2.067 10 20 CECD Cc1occc1C(=O)OCC(=O)c1ccc(O)c(O)c1 782520422 DIVWIPARQUXAHW-UHFFFAOYSA-N 276.244 2.039 10 20 CECD CCN1CCC[C@@H]1CNCc1cc(F)ccc1O 83393102 LZHICAKBMLDJSN-CYBMUJFWSA-N 252.333 2.105 10 20 CECD CCO[C@H]1CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 701708111 CQCOXPRWCFBGDR-ZDUSSCGKSA-N 281.327 2.345 10 20 CECD COc1cccc(CNC[C@H]2CCCC[C@@H]2O)c1O 77204633 VBCLNJXEGIFHHK-YPMHNXCESA-N 265.353 2.042 10 20 CECD CCc1cccc(CN(C)CCOCCOC)c1O 692086732 ORNWTJSXXLLETD-UHFFFAOYSA-N 267.369 2.049 10 20 CECD O=C(NC1(C2CC2)CCOCC1)c1cc(O)cs1 1350983595 UZNIYCVVTRREKM-UHFFFAOYSA-N 267.350 2.143 10 20 CECD C[C@@H](N)C1CCN(Cc2ccc(N(C)C)cc2)CC1 104134099 DWHIAUGYAWWIDS-CYBMUJFWSA-N 261.413 2.312 10 20 CECD COC(=O)CCCN(C)c1ccc(OC)cc1OC 132010701 AWJKZHAUQKVURT-UHFFFAOYSA-N 267.325 2.093 10 20 CECD COCCc1ncc(CNCc2ccc(N)cc2)s1 1579068781 VDTAWOOEYJUGGI-UHFFFAOYSA-N 277.393 2.204 10 20 CECD CN(C(=O)C1=CC[C@@H](N)C1)c1cccc2ncccc12 1578368574 QILUOWBYGKJFCN-GFCCVEGCSA-N 267.332 2.245 10 20 CECD Nc1ccc(CCNC(=O)[C@@]23CCCC[C@@H]2OCC3)cc1 1580443325 XYDJIZFKUHDHRG-DOTOQJQBSA-N 288.391 2.277 10 20 CECD Nc1ccc(CCNC(=O)[C@@]23CCCC[C@H]2OCC3)cc1 1580443326 XYDJIZFKUHDHRG-NVXWUHKLSA-N 288.391 2.277 10 20 CECD CC(C)C[C@@H](NCc1cccc(F)c1O)C(=O)O 158743327 KJUAQBFUFAZDSW-LLVKDONJSA-N 255.289 2.120 10 20 CECD Nc1ccc(NC(=O)[C@H]2Cc3ccccc3O2)cc1 19277312 JHACSRSULHCZKP-CQSZACIVSA-N 254.289 2.211 10 20 CECD Cc1ccc(S(=O)(=O)Oc2ccc(Cl)cc2-n2c(C)ccc2C)cc1 160217005 KPACOCHRUAVGPH-UHFFFAOYSA-N 375.877 4.824 10 20 CECD C[C@@H](CNC(=O)Cc1ccc(N)cc1)c1nccs1 235112435 FKGLOGUOXKXSME-JTQLQIEISA-N 275.377 2.188 10 20 CECD CN1CCC[C@@H]1CNCc1c(O)cccc1Br 706855614 IFLZOTOYDDSCBR-SNVBAGLBSA-N 299.212 2.339 10 20 CECD C[C@H]1CC[C@H](CNCc2cc(F)cc(F)c2O)O1 708481862 VEYYINNGQBPOJT-GZMMTYOYSA-N 257.280 2.328 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1CCCC[C@@H]1O 708502230 KENOEIVRZVZMMV-RNCFNFMXSA-N 271.307 2.311 10 20 CECD CCOc1cccc(CN[C@@H](C)C2(CO)CC2)c1O 696064988 YATJUCLBBWOLFD-NSHDSACASA-N 265.353 2.042 10 20 CECD COc1ccc(O)c(CN[C@@H](C)[C@@H]2CCCOC2)c1 389138095 XTIZKLJBCKMPHQ-NWDGAFQWSA-N 265.353 2.306 10 20 CECD Nc1ccc(CC(=O)Nc2ccccc2CC(=O)O)cc1 53200564 VJCMSMHWAPJPQY-UHFFFAOYSA-N 284.315 2.077 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H]2C=CCC2)c1 114543211 LDBLWYMJDNOWHD-LLVKDONJSA-N 261.321 2.373 10 20 CECD CC(C)NC(=O)NCCCSc1nccs1 175600294 YLOYIYDHSFLTAI-UHFFFAOYSA-N 259.400 2.333 10 20 CECD O=C(NCCSC(F)(F)F)c1cccc(O)c1O 189876894 LRYUBKAZOKKPLB-UHFFFAOYSA-N 281.255 2.081 10 20 CECD COc1ccc(O)c(CN(C)CCc2ccccn2)c1 120806720 DUCWDIDEBWKKFF-UHFFFAOYSA-N 272.348 2.470 10 20 CECD C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1cccc(O)c1O 186944685 YNHTVGKMSJAHIJ-RISCZKNCSA-N 293.363 2.423 10 20 CECD CN1C(=O)/C(=C/c2ccc3c(c2)CCO3)SC1=S 48642746 GALHQJNYQAVEBW-XFFZJAGNSA-N 277.370 2.453 10 20 CECD O=C(NCCCSc1nccs1)Nc1ccncn1 194113029 DDBHHFAIDVMFFR-UHFFFAOYSA-N 295.393 2.237 10 20 CECD COCCCC(=O)N(C)Cc1ccc(N(C)C)cc1 48241265 RMBNHOKCIDLJHX-UHFFFAOYSA-N 264.369 2.138 10 20 CECD CCOC[C@H]1CN(Cc2cccc(OCC)c2O)CCO1 529666390 KIRMPMDXJXOAIJ-CQSZACIVSA-N 295.379 2.028 10 20 CECD Cc1cc(O)c([C@H]2NC(=O)CN2CC(C)C)cc1C 266176304 AYANKORXRHDARS-HNNXBMFYSA-N 262.353 2.095 10 20 CECD CCNC(=O)[C@@H](C)N[C@H](CC)c1ccc(N(C)C)cc1 268709158 FUEDKQBBZUJGPD-IUODEOHRSA-N 277.412 2.318 10 20 CECD C[C@@H](O)CCCN[C@H](C)c1ccc(F)c(F)c1O 279124662 QKQHZJWIWWCIBM-RKDXNWHRSA-N 259.296 2.482 10 20 CECD CCNC(=O)C[C@H]1CCCCN1Cc1cc(F)ccc1O 284951968 HQVLUZOPBYYPDP-CQSZACIVSA-N 294.370 2.412 10 20 CECD CCN(C[C@@H]1CCNC(=O)CC1)c1ccc(OC)cc1 295635281 CQCUDAVSYWZCRN-ZDUSSCGKSA-N 276.380 2.438 10 20 CECD CN(C)c1ccc(CNc2ccc(CO)cn2)cc1F 291545615 LTBLNRHVNFETLD-UHFFFAOYSA-N 275.327 2.391 10 20 CECD COc1cccc(CNc2nnc(C(F)F)o2)c1O 292501696 NOVIJCSLYDXVHH-UHFFFAOYSA-N 271.223 2.334 10 20 CECD CC[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@H](CC)O1 817765541 CKNJIGQHGXGRIF-UWVGGRQHSA-N 297.326 2.267 10 20 CECD CCOc1ccc(CN2C[C@H](C)N(C)[C@H](C)C2)c(O)c1 816653415 QVZPMAWSNMMSJJ-BETUJISGSA-N 278.396 2.315 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(N(C)C)CC1 824241218 VOAKKPHNYCEQFA-UHFFFAOYSA-N 289.423 2.195 10 20 CECD CC(C)c1n[nH]c(CNCc2ccc(N(C)C)c(F)c2)n1 824603548 TXZSQRKSMQUVTJ-UHFFFAOYSA-N 291.374 2.423 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC[C@@H]1CCCN1 829764416 KOAUMKXPXGFJHV-HNNXBMFYSA-N 289.423 2.209 10 20 CECD Cc1cc(O)c(CN2CC[C@@](C)(C(N)=O)C2)cc1Cl 825752999 LDZHEBFAMJULDZ-CQSZACIVSA-N 282.771 2.051 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C\c2ccc[nH]2)c1 588549248 SBTIMPKBEWREAS-DAXSKMNVSA-N 272.304 2.059 10 20 CECD CO[C@@H]1COCC[C@@H]1CNCc1c(O)cccc1Cl 824710447 YWFQGPSIOVDLSU-QMTHXVAHSA-N 285.771 2.187 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1C=CCCC1 588404675 AYMYFSCYLVNGQS-ZVTBTPLYSA-N 259.305 2.336 10 20 CECD CC(C)OC(=O)[C@H](C)NCc1cccc(Cl)c1O 825117480 FKJOULBWWOJPFK-VIFPVBQESA-N 271.744 2.475 10 20 CECD CCN(CC(=O)NCC1CCC1)c1ccc(OC)cc1 731212026 OGSZDGAWXYFVKV-UHFFFAOYSA-N 276.380 2.438 10 20 CECD CC(C)c1nccn1CCNC(=O)c1cc(O)cs1 732278460 NUXDLFRAHFVLBO-UHFFFAOYSA-N 279.365 2.204 10 20 CECD CO[C@@](C)(C1CC1)[C@@H](C)NC(=O)c1cccc(O)c1O 839827728 AZNQBVNPZMVPTL-RFAUZJTJSA-N 279.336 2.031 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@@H](C)c1ccccc1O 834880660 ASQCXFWDNHIMPA-SLEUVZQESA-N 265.353 2.094 10 20 CECD CCc1cccc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)c1O 848899163 DFGQZXPASVDGRH-WBVHZDCISA-N 291.391 2.382 10 20 CECD COC[C@@H](CCO)N[C@H](C)c1ccc(Cl)cc1O 841756235 WGLNTGOCVXSTQT-MWLCHTKSSA-N 273.760 2.094 10 20 CECD COCCN(C)CCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756528727 OZNJGXDDDMKMQN-YPMHNXCESA-N 296.386 2.247 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)[C@@H]2CN(C)CCO2)c(O)c1 756762281 XEOOAAULNHJHKS-XEZPLFJOSA-N 278.396 2.070 10 20 CECD CCn1cc(CN[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)nn1 850522519 SUEQVYRHWVLSIX-BXKDBHETSA-N 290.342 2.481 10 20 CECD C[C@H]1C[C@@H](NCCCn2cncn2)c2c(O)ccc(F)c21 756830451 QIGFVYMNBYJWOM-CMPLNLGQSA-N 290.342 2.351 10 20 CECD CN(Cc1cn[nH]c1)Cc1c(O)cccc1Cl 769426131 SRIAIMZVTCIAHC-UHFFFAOYSA-N 251.717 2.401 10 20 CECD O=C1C[C@@H](Oc2ccccc2NCc2ccccc2O)N1 864040129 QPAVRJPWIKADNB-MRXNPFEDSA-N 284.315 2.229 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 768537692 WONWUTQQKWNXNR-OAHLLOKOSA-N 294.370 2.419 10 20 CECD C[C@@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccccc1O 877755951 URGYJYUCXKWVKR-UPJWGTAASA-N 297.420 2.399 10 20 CECD C[C@@H](NC(=S)NC[C@@H]1CCCCO1)c1ccccc1O 1118922618 GOQKZIABEAMQCJ-NEPJUHHUSA-N 294.420 2.486 10 20 CECD C[C@@H](NC(=O)NCC1(O)CCC1)c1ccc(N(C)C)cc1 776250905 YHMRMGKOHMENKI-GFCCVEGCSA-N 291.395 2.028 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCC23OCCO3)cc1F 883178737 CYRIWKHJAJQRCK-HNNXBMFYSA-N 294.370 2.277 10 20 CECD CC(C)Cn1ccc(C(=O)NCCc2ccc(N)cc2)n1 884028699 OVJWFTFFZWHUJS-UHFFFAOYSA-N 286.379 2.094 10 20 CECD C[C@@H](NS(=O)(=O)C1CCC1)c1ccc(N(C)C)cc1 882085588 YGAXWUZZRJVKKP-LLVKDONJSA-N 282.409 2.286 10 20 CECD C[C@H]1[C@@H](C)N(Cc2cc(F)cc(F)c2O)CCN1C 894488386 XBYUOHUIUPMNBG-VHSXEESVSA-N 270.323 2.195 10 20 CECD OCCCN(Cc1cc(F)cc(F)c1O)C1CC1 894019431 CLAWAKNKDINHCS-UHFFFAOYSA-N 257.280 2.017 10 20 CECD CC1=NO[C@@H](CNCc2ccc(N(C)C)c(F)c2)C1 895308592 NQCUBYBQWOTUCE-GFCCVEGCSA-N 265.332 2.146 10 20 CECD CCC(CC)[C@H](O)CNCc1ccc(OC)c(OC)c1O 892976222 BRVUTBUUYOYPQF-CYBMUJFWSA-N 297.395 2.296 10 20 CECD C[C@H](NCC1([S@@](C)=O)CC1)c1cc(F)cc(F)c1O 799727416 JNQALMCEKXEURQ-WPCRTTGESA-N 289.347 2.232 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cncc(F)c1 799012167 LWTAZPRWSUSZNR-DUXPYHPUSA-N 274.251 2.284 10 20 CECD C[C@H](NCc1nc(C(=O)O)cs1)c1ccccc1O 1599901309 ANDVDFFWFGSQQS-QMMMGPOBSA-N 278.333 2.398 10 20 CECD CC(C)(CCO)NCc1c(O)cccc1Br 706875166 OUFOAPLHJWZUJJ-UHFFFAOYSA-N 288.185 2.405 10 20 CECD CC[C@@]1(C)CN(Cc2cc3c(cc2O)OCO3)CCO1 190330307 AFUXYMHLDNGSSE-HNNXBMFYSA-N 279.336 2.122 10 20 CECD CC[C@@H](NCCN1CCOC[C@@H]1C)c1ccc(C)cc1O 794809081 QGEFLXLYNCWPQD-GOEBONIOSA-N 292.423 2.462 10 20 CECD COc1ccc(O)c(CN(C)C2CCC(N)CC2)c1 91844640 WEHFSMSQLCIVDQ-UHFFFAOYSA-N 264.369 2.103 10 20 CECD C[C@@H](CCC(=O)O)NCc1ccc2c(c1)CCCO2 1335615380 HXUKWKGXSXWOSG-NSHDSACASA-N 263.337 2.355 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@@H](F)CC)CC2)cc1 1337147260 KLMJINIOOBNYNG-HNNXBMFYSA-N 294.370 2.482 10 20 CECD OC[C@@H](NCc1cc(F)ccc1O)c1ccccc1 226608729 ILSBBFJTYODUHU-CQSZACIVSA-N 261.296 2.355 10 20 CECD Nc1ccc(Cl)c(C(=O)NCc2ccc(O)c(O)c2)c1 1580446672 DNVASGCXCMUZDU-UHFFFAOYSA-N 292.722 2.263 10 20 CECD CCN1CCCc2cc(CN[C@H]3C[C@@H](C(=O)O)C3)ccc21 1776876378 MFRNDIVFPVWBCV-GASCZTMLSA-N 288.391 2.412 10 20 CECD CC[C@@H](CCC(=O)O)NCc1ccc(N(C)C)cc1 1776710606 QVGKUVXDCUOUFL-ZDUSSCGKSA-N 264.369 2.486 10 20 CECD CCCCO[C@@H](C)C(=O)NCCc1ccc(N)cc1 152571557 QDMDJHBXVMSZEA-LBPRGKRZSA-N 264.369 2.133 10 20 CECD C[C@H]1CCNCC[C@H]1NCc1ccc2c(c1)CCO2 817902325 NSXZFWKSCKEYAM-SWLSCSKDSA-N 260.381 2.099 10 20 CECD CN(CCc1cccs1)C(=O)c1cccc(O)c1O 126477156 WJBPZQWCVWUVAZ-UHFFFAOYSA-N 277.345 2.474 10 20 CECD CN(C)c1nc(CNCc2cc(F)cc(F)c2O)cs1 883027969 WBKDUCVHYFZSEV-UHFFFAOYSA-N 299.346 2.483 10 20 CECD CN(C)c1ccc(CNC2CCN(C3CC3)CC2)cc1 35054305 XIUCHZYFFRPWPB-UHFFFAOYSA-N 273.424 2.469 10 20 CECD CCNC(=O)[C@@H](C)NCc1ccc(N(CC)CC)cc1 35134263 ZMBBXKXCEPERIW-CYBMUJFWSA-N 277.412 2.147 10 20 CECD Oc1ccc(F)cc1CN[C@H]1CCN2CCC[C@H]2C1 300416028 DNUTZQRRQBOVKY-KBPBESRZSA-N 264.344 2.248 10 20 CECD C[C@H]1CCCC[C@@H]1NC(=O)CN(C)c1ccc(N)cc1 702070221 XMIMHYMHEDGCNZ-WFASDCNBSA-N 275.396 2.400 10 20 CECD C[C@@H]1OCC[C@@]1(C)NCc1cc(F)cc(F)c1O 708438236 WITQWWDZZMHQGV-ISVAXAHUSA-N 257.280 2.328 10 20 CECD Cc1ccc(O)c(CN[C@@H](CCO)C(F)(F)F)c1 886371897 XUNBPZWPMABHJY-NSHDSACASA-N 263.259 2.104 10 20 CECD Cc1c(C(=O)NCc2ccc(N3CCCC3)cc2)cnn1C 28333155 QLWHHNSXCMZHAX-UHFFFAOYSA-N 298.390 2.259 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H](CO)C2)c1O 122844503 SIWSHKZVAIZWDO-JTQLQIEISA-N 283.755 2.062 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)c2nnnn2C2CC2)c1 189132805 DJNDFIKQGKLQBA-WDEREUQCSA-N 287.367 2.434 10 20 CECD CC(C)(O)CN(Cc1cc(F)ccc1O)C1CC1 189946724 NMDKNLKJXOYFFK-UHFFFAOYSA-N 253.317 2.267 10 20 CECD CCOC(=O)[C@H](C)[C@@H](C)NCc1ccccc1O 185220115 NDLZYQDUEIZHKD-GHMZBOCLSA-N 251.326 2.070 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](C)CN2CCOCC2)c(O)c1 185505313 CFFYKTKPCBHKPE-LSDHHAIUSA-N 292.423 2.320 10 20 CECD CO[C@H](CNC(=O)c1cccc(O)c1O)c1ccccc1 188252420 RXMDTVXAOQMAHD-CQSZACIVSA-N 287.315 2.215 10 20 CECD CN(Cc1c(O)cccc1Cl)Cc1nccn1C 134108659 UPILHZMQLOLNKI-UHFFFAOYSA-N 265.744 2.411 10 20 CECD CCCN(CC(=O)NC)Cc1ccc(N(CC)CC)cc1 92381964 RNDYLGBAXGAZFX-UHFFFAOYSA-N 291.439 2.491 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)[C@@H](C)CS(C)(=O)=O 93389918 XSLJTGPIHMMXAU-ZDUSSCGKSA-N 298.452 2.008 10 20 CECD CO[C@@H](C)[C@@H](C)NCc1ccc(N(C)C)c(F)c1 269057619 WYMMUZPULDSVRQ-MNOVXSKESA-N 254.349 2.405 10 20 CECD COCCC(C)(C)NCc1ccc(N2CCOCC2)cc1 397909137 YDMNIFLMRWEJSQ-UHFFFAOYSA-N 292.423 2.428 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCc1nnc(C)n1C 393200510 YELDAMOQZOLNEQ-CMPLNLGQSA-N 286.379 2.476 10 20 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2.311 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)[C@H](C)CN1 843119873 JGECMKXRZFMLDL-VHSXEESVSA-N 254.761 2.228 10 20 CECD CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@@H](C)CO1 846434964 UISMORBYEUHCNE-WDEREUQCSA-N 279.336 2.046 10 20 CECD C[C@@H](NCCC(=O)N(C)C)c1ccc(Cl)cc1O 841746216 DCWZUZRADBPWTF-SECBINFHSA-N 270.760 2.175 10 20 CECD COc1ccc(O)c(CN2CCC([C@@H](C)CO)CC2)c1 846059141 YVTYHKPPIGPDKL-LBPRGKRZSA-N 279.380 2.241 10 20 CECD CN(C)c1ccc(CNC[C@@]2(C)CCCNC2)cc1F 841058338 VUAKOTULPLKYLN-INIZCTEOSA-N 279.403 2.371 10 20 CECD CC(C)[C@@H]1C[C@H]1NC(=O)NCCc1ccc(N)cc1 841916424 ZXEGDEWYWBWXFP-UONOGXRCSA-N 261.369 2.155 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCNC1 843049598 SFWNEFNUFUENHV-QGZVFWFLSA-N 273.424 2.471 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@@H](C)c1ccc(C)cc1O 756773631 AMDAVXGQSUOMTN-IACUBPJLSA-N 276.380 2.266 10 20 CECD COc1ccc(N(C)C[C@H](O)COCC(C)C)cc1OC 920781658 UQJGROMTIPXIGZ-AWEZNQCLSA-N 297.395 2.174 10 20 CECD COC[C@@](C)(O)CN[C@H](C)c1cc(Cl)ccc1O 756576496 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CN(Cc1cc(F)cc(F)c1O)C[C@@H]1CCCN1C 708397303 BCUJMLIPDMHECE-LBPRGKRZSA-N 270.323 2.196 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3C)CC2)cc1 1322869972 SDSZRQLFGPWMJF-CJNGLKHVSA-N 288.391 2.390 10 20 CECD CN(C(=O)/C=C\c1cnn(C)c1)c1cccc2c1CCCN2 1337210350 MHFFUYOOTAJZSX-HJWRWDBZSA-N 296.374 2.454 10 20 CECD COc1cc(C)cc(CN2CCC[C@](C)(CO)C2)c1O 1338236462 YCMGZXPNUPXEGO-INIZCTEOSA-N 279.380 2.304 10 20 CECD Cc1noc(C)c1CCC(=O)Nc1ccc(N)cc1 212549114 JVBAJWLDIMYURE-UHFFFAOYSA-N 259.309 2.445 10 20 CECD CCN(C)c1ccc(CN[C@@H](CC(=O)O)C2CC2)cc1 1609990999 CEHAYBJEZCTVOT-HNNXBMFYSA-N 276.380 2.486 10 20 CECD NC[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)C1 1580334098 VKLUGTBYIHXIDD-ZKCHVHJHSA-N 258.724 2.012 10 20 CECD CN(C)c1ccc(CNCc2ncccc2C(=O)O)cc1 1777040085 OJXQCFXEXOAWSD-UHFFFAOYSA-N 285.347 2.136 10 20 CECD C[C@@H]1CC[C@@](NCc2ccc3c(c2)CCO3)(C(=O)O)C1 1776629587 OZVWTYBQISJRGN-BZNIZROVSA-N 275.348 2.355 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCCO2)c1 19963699 CMZGXSDLXSDVGU-CMPLNLGQSA-N 251.326 2.230 10 20 CECD Cc1[nH]ncc1CCCNCc1cc(F)ccc1O 226584353 ZTVRVFJLIRGKRP-UHFFFAOYSA-N 263.316 2.285 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)[C@@H]1OC 156979453 NMMGHTBSGUQCKX-XHSDSOJGSA-N 278.396 2.035 10 20 CECD C[C@H](NCC1([S@@](C)=O)CC1)c1ccc(N(C)C)cc1 282390101 RDBCQVOEJZYBHV-HXPMCKFVSA-N 280.437 2.314 10 20 CECD CCOc1cccc(CNCCN(CC)C2CC2)c1O 227550956 AFYDFVLCPFZNAT-UHFFFAOYSA-N 278.396 2.365 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C(/C)C2CC2)c1 114541382 FRYXOLTWXDHBOI-YFHOEESVSA-N 261.321 2.373 10 20 CECD CN(C)CCCNCc1cc(Br)ccc1O 76275395 YPLXOCVWCFKMGT-UHFFFAOYSA-N 287.201 2.196 10 20 CECD CC(C)(CO)CCCNC(=O)/C=C/c1ccc(O)c(O)c1 180869246 TWGPLOQVVIRUAE-FNORWQNLSA-N 293.363 2.026 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2cc(C)ccn2)c1 184104086 ARDXIAAOFAOXQR-UHFFFAOYSA-N 287.319 2.426 10 20 CECD Cc1nc(NC(=O)c2cccc(O)c2O)sc1C 126297336 BWUDIXKJFKXBJW-UHFFFAOYSA-N 264.306 2.423 10 20 CECD O=C(NCc1ccccc1O)c1ccc(Cl)cn1 134882368 DOVDSVUUZDXCNO-UHFFFAOYSA-N 262.696 2.371 10 20 CECD Cc1c(CN=c2cccn[nH]2)n(C)c2ccccc12 343088474 YOGFJALRHJQBTG-UHFFFAOYSA-N 252.321 2.311 10 20 CECD CCOc1cccc(CN2C[C@@H]3CCC[C@H](N)[C@H]3C2)c1O 252853765 JIJQCWKKEAFYER-QEJZJMRPSA-N 290.407 2.350 10 20 CECD CC[C@@H]1NC(=O)N(Cc2ccc(N(CC)CC)cc2)C1=O 272265067 MPJHFDONHKTTHN-AWEZNQCLSA-N 289.379 2.363 10 20 CECD CCC(CC)(CCO)NC(=O)c1ccc(C)c(O)c1O 283046557 IRCFEKDCYXYFAK-UHFFFAOYSA-N 281.352 2.077 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@H](SC)C2)c1O 294962956 FAKAKJBXKKZBBE-JTQLQIEISA-N 298.364 2.246 10 20 CECD COc1ccc(N(C)C[C@H](O)c2cccnc2)c(OC)c1 295042524 WWNGNPBJOUYULW-HNNXBMFYSA-N 288.347 2.269 10 20 CECD CCOc1cccc(CNCc2cnccc2OC)c1O 292774975 SZLGMQOQXUEWLF-UHFFFAOYSA-N 288.347 2.484 10 20 CECD COc1cccc(CN2CC[C@H](n3cc(C)cn3)C2)c1O 290978637 TWMFWNGOMQXXHS-AWEZNQCLSA-N 287.363 2.353 10 20 CECD Cc1nccnc1CCNCc1cccc(Cl)c1O 293619560 KOQNKKXRSMWXIZ-UHFFFAOYSA-N 277.755 2.476 10 20 CECD Cc1c(C(=O)NCc2ccc(N)cc2)cnn1CC(C)C 297125169 GVVYOXSKLGBPEQ-UHFFFAOYSA-N 286.379 2.360 10 20 CECD C[C@@H]1CC2(CCNCC2)CN1Cc1cc(F)ccc1O 818431372 KALVTDDDZMJWTD-GFCCVEGCSA-N 278.371 2.495 10 20 CECD COc1cc(O)c(CNCCCC2(O)CCC2)cc1OC 817414032 DQVHVPCPKJQQIZ-UHFFFAOYSA-N 295.379 2.194 10 20 CECD CCN(C)c1ccc(CN(C)[C@H](C)C(=O)OC)cc1 815108677 LIMSDZPUPCRWAQ-GFCCVEGCSA-N 264.369 2.136 10 20 CECD C[C@H](N[C@@H](C)[C@@H]1CCCNC1)c1cc([N+](=O)[O-])ccc1O 817948295 WUMKMQKYRGQTAD-SDDRHHMPSA-N 293.367 2.339 10 20 CECD CCN(C)c1ccc(CN2CCOC[C@@]23CCOC3)cc1 815108215 SIUKQJHUKFESQD-KRWDZBQOSA-N 290.407 2.134 10 20 CECD Cc1cc(O)c(CNCC[C@]2(O)CCCOC2)cc1Cl 826142441 CFJRTJUUWUZKTE-OAHLLOKOSA-N 299.798 2.375 10 20 CECD COC(=O)NC1CCN(Cc2cccc(Cl)c2O)CC1 827929580 NLKWQXCVXZKGKX-UHFFFAOYSA-N 298.770 2.366 10 20 CECD CNC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726700973 RWQPYNCLDXOFHC-UHFFFAOYSA-N 299.321 2.186 10 20 CECD COc1ccc(N2CCCN(C(=O)CCCF)CC2)cc1 822919914 PUAHNOHISWDSJK-UHFFFAOYSA-N 294.370 2.484 10 20 CECD COCC(C)(C)N1CCN(Cc2cccc(C)c2O)CC1 822498287 XKLUUAISMQXQGS-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CC[C@H](NC[C@H]1CCN1C)c1ccc(N(C)C)cc1 903321426 FCRDFGGLGADUSA-CVEARBPZSA-N 261.413 2.497 10 20 CECD COc1ccccc1CCNC(=O)c1cc(O)cs1 731862059 YOEHKWIAKYOKFP-UHFFFAOYSA-N 277.345 2.435 10 20 CECD CS[C@@H]1CC[C@H](NC(=O)c2cc(O)cs2)C1 743729395 ZNOMKMHAWVCANX-IONNQARKSA-N 257.380 2.468 10 20 CECD CCOC(=O)CN(Cc1cccc(CC)c1O)C1CC1 848882601 VMTKPUWIWGLHEK-UHFFFAOYSA-N 277.364 2.482 10 20 CECD CCOCc1cc(CN[C@H](C)CCN)ccc1OC 841051968 SRHJJLTULHQEQE-GFCCVEGCSA-N 266.385 2.059 10 20 CECD Cc1cc(/C=C2/SC(N3CCCCC3)=NC2=O)n(C)n1 841484635 BIVOHKIVAGBERX-FMIVXFBMSA-N 290.392 2.185 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H](CN)C[C@@H]1C 843057847 MMGDHFYZDQVZOU-UONOGXRCSA-N 261.413 2.230 10 20 CECD CN(C)[C@H]1CCC[C@@H](NC(=O)c2cc(O)cs2)C1 749544855 QBUGMXGGHXGXOT-ZJUUUORDSA-N 268.382 2.056 10 20 CECD CCN(CCC(=O)OC)Cc1ccc(N(C)C)cc1C 840911746 OPXNDFZTUKTBJP-UHFFFAOYSA-N 278.396 2.446 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@H](C)CCO 840894098 PBLFFNIXLSUARV-ZIAGYGMSSA-N 264.413 2.353 10 20 CECD Cc1ccc(O)c([C@H](C)NCCNc2cnccn2)c1 756645159 DUXHFEYFMCGRHS-LBPRGKRZSA-N 272.352 2.253 10 20 CECD C[C@@H](NC[C@@H]1CCC(=O)O1)c1ccc(N(C)C)cc1 851950333 NRAHCZRURIDFLW-RISCZKNCSA-N 262.353 2.109 10 20 CECD CN(C)c1cc(F)c(CN(CCO)CC2CC2)cc1F 862233717 QYMIJTXODWJLLY-UHFFFAOYSA-N 284.350 2.235 10 20 CECD CCOCc1cc(CNC2CC(C(=O)O)C2)ccc1OC 871884015 GHJSQBWZFZWHLT-UHFFFAOYSA-N 293.363 2.185 10 20 CECD CCCOc1ccc(CNCC(=O)NC2CC2)cc1C 873010515 ISGWXUOOFPZIKG-UHFFFAOYSA-N 276.380 2.152 10 20 CECD Cc1ccc(CNCC2(O)CCN(C(C)C)CC2)c(O)c1 877084836 JQEHCDHQQPORSC-UHFFFAOYSA-N 292.423 2.026 10 20 CECD Cc1cccc(O)c1CNCC(=O)NCCc1ccccc1 877010284 SHPZGEQVLQIQOV-UHFFFAOYSA-N 298.386 2.149 10 20 CECD Cc1ccc(CN2CCC(O[C@@H]3CCOC3)CC2)c(O)c1 876783543 GCPPASHXZKSKJM-MRXNPFEDSA-N 291.391 2.471 10 20 CECD Cc1ccc(CN2CC[C@H](C)[S@](=O)CC2)c(O)c1 877476768 MWHNYQITGBLTMJ-KPZWWZAWSA-N 267.394 2.044 10 20 CECD C[C@H](NC(=O)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 775432553 IJUHHFIIWVYBQE-NSHDSACASA-N 292.379 2.272 10 20 CECD COCCO[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 783714788 CXPCUQDNJAKQMS-AWEZNQCLSA-N 296.386 2.129 10 20 CECD C[C@H](N[C@H](CO)C[C@H]1CCCO1)c1c(O)cccc1F 886672932 XIEVMJPWMVLAND-SDDRHHMPSA-N 283.343 2.112 10 20 CECD CCn1cccc(CN[C@@H](C)c2ccccc2O)c1=O 788605825 QJVWSOFIQVJIAI-LBPRGKRZSA-N 272.348 2.425 10 20 CECD O=C1C[C@H](C(=O)NCc2ccccc2O)c2ccccc21 789816426 PAFKVXYXDIILNT-AWEZNQCLSA-N 281.311 2.379 10 20 CECD C[C@@H]1OCC[C@@]1(C)NC(=O)NCc1ccc(N(C)C)cc1 783928390 XZURTQRTMIGFSM-BLLLJJGKSA-N 291.395 2.119 10 20 CECD COc1cc(C)cc(CNC[C@@H](OC)C(C)C)c1O 894309449 YMVUREOZMXERJS-CQSZACIVSA-N 267.369 2.470 10 20 CECD COc1cccc(CN2CCN(C)C[C@@H]2C(C)C)c1O 184737438 NSDLIYCTELOAPL-CQSZACIVSA-N 278.396 2.173 10 20 CECD CCN(C)C(=O)CNCc1ccc(N(CC)CC)cc1 185188412 APPHSKXXXGCRDN-UHFFFAOYSA-N 277.412 2.101 10 20 CECD C[C@@H](NCc1cccc(Cl)c1O)c1ncnn1C 276443252 IYRYOOPIIBSDFQ-MRVPVSSYSA-N 266.732 2.025 10 20 CECD Oc1ccc(Cl)cc1CN1C[C@H]2COC[C@H]2C1 718240330 AGNFUPOJKDZABB-PHIMTYICSA-N 253.729 2.124 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](c2ccccn2)C1 799195623 YXMZSFFQVOUPLY-SNVBAGLBSA-N 274.345 2.478 10 20 CECD COc1cccc(O)c1CNCCc1ccc(O)cc1 725848632 ZUVNKQCZQIYRNT-UHFFFAOYSA-N 273.332 2.439 10 20 CECD Cc1nnc(O)c(CN[C@@H](C)c2ccc(F)cc2O)c1C 1254730352 SHFFKGSRPQRGRK-JTQLQIEISA-N 291.326 2.495 10 20 CECD Nc1ccc(CNC(=O)NCC2(CO)CCCCC2)cc1 1338792436 GHLZQMIPLAREFT-UHFFFAOYSA-N 291.395 2.011 10 20 CECD C[C@H]1CN(C(=O)NCc2ccc(N)cc2)C[C@H](C)S1 1262603565 MZFLWEWDBHRXKO-QWRGUYRKSA-N 279.409 2.304 10 20 CECD CC(C)(C)c1[nH]cnc1C(=O)NCc1ccc(N)cc1 1342022448 PLNDXARPBVGMJM-UHFFFAOYSA-N 272.352 2.219 10 20 CECD CCc1ncoc1C(=O)NCc1cc(C)ccc1O 1353752011 GVPRDWFBHWCWPP-UHFFFAOYSA-N 260.293 2.181 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCCC(C)(C)CO)c1 1352571054 LILSMCHNEOXNGT-UHFFFAOYSA-N 294.395 2.299 10 20 CECD NC[C@H]1Cc2ccccc2N(C(=O)/C=C/c2cccnc2)C1 1580273255 HOTAFAATFKIFRI-MVGZEHJDSA-N 293.370 2.259 10 20 CECD CCOCCOCCNCc1cc(Cl)ccc1O 922940123 AAMGSHOFUBNZCY-UHFFFAOYSA-N 273.760 2.188 10 20 CECD CCc1cccc(CN2C[C@@H](C)[C@H](C(=O)O)C2)c1O 1597587263 VBLBRGBJNUUAAU-ZWNOBZJWSA-N 263.337 2.107 10 20 CECD Oc1c(F)cccc1CNc1cccc(-c2nnn[nH]2)c1 164996906 QJYLPRDMBOWEKN-UHFFFAOYSA-N 285.282 2.324 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1cnc2cnccn12 156469890 FDJAJGWNFOOUTE-UHFFFAOYSA-N 295.390 2.427 10 20 CECD CCC[C@@](C)(O)C(=O)NCc1c(O)ccc2c1CCCC2 159757763 DTPDSUKFBLDWBD-QGZVFWFLSA-N 291.391 2.438 10 20 CECD COc1ccc(N(C)CCCc2cnn(C)c2)cc1 844353436 WWSLUILSWORSND-UHFFFAOYSA-N 259.353 2.498 10 20 CECD CC(C)N(CCNC(=O)Cc1ccc(N)cc1)C(C)C 19395438 RJDWWGLISQBVFM-UHFFFAOYSA-N 277.412 2.046 10 20 CECD C[C@H](NCC12CC(CO1)C2)c1cc(F)ccc1O 527984118 WNCNBIHQOATKBZ-IPWFMCSPSA-N 251.301 2.361 10 20 CECD Nc1ccc(NC(=O)c2cn3c(n2)CCCC3)cc1 696163062 UKWXZXYHHZSTJE-UHFFFAOYSA-N 256.309 2.054 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](CO)C[C@H]2CCCO2)c1 886670008 HVWFQMRGPXTXHC-BFHYXJOUSA-N 279.380 2.281 10 20 CECD Cc1cc(NC(=O)NCCc2ccc(O)c(O)c2)ccn1 119189476 FZUHILMQMDONKQ-UHFFFAOYSA-N 287.319 2.165 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2C[C@@H]2C2CC2)c1 176146905 FATSVMMXPUVWSN-OLZOCXBDSA-N 261.321 2.063 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCN1CCCC1=O 405365291 TVKRAWCTODFEQT-OLZOCXBDSA-N 288.391 2.461 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cc(C)nn2C)c1 284182516 FVYNLAFWPXXCOX-LLVKDONJSA-N 275.352 2.294 10 20 CECD CN(CC(N)=O)c1ccc(OCc2ccccc2)cc1 189645581 WKTWFWRLXYHIHA-UHFFFAOYSA-N 270.332 2.187 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 182343887 AUGLUFIVAZOBOG-SDDRHHMPSA-N 294.395 2.355 10 20 CECD CCCn1c(C)nnc1CN(C)c1ccc2c(c1)OCO2 121437153 ZTEPQWOSTJMNJW-UHFFFAOYSA-N 288.351 2.362 10 20 CECD CCn1nncc1CN[C@@H](C)c1ccc(C)cc1O 527920312 NVYZSBNIMSNNCN-NSHDSACASA-N 260.341 2.163 10 20 CECD CCC(CC)(CCO)CNC(=O)c1cccc(O)c1O 193135270 LSMHTBHJKNCQCA-UHFFFAOYSA-N 281.352 2.016 10 20 CECD Cc1c(CNC(=O)N2CCOCC2)n(C)c2ccccc12 335253886 HTTLTXVMBXHFMH-UHFFFAOYSA-N 287.363 2.029 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C(=O)OC)cc1F 193099912 QLFYQRPFXSYVMZ-LLVKDONJSA-N 282.359 2.323 10 20 CECD CO[C@H](C)CNCc1cc(Cl)cc([N+](=O)[O-])c1O 191147765 COGZUURQHZEPPV-SSDOTTSWSA-N 274.704 2.078 10 20 CECD COc1cccc(CN(C)[C@H](CO)C(C)(C)C)c1O 93837348 LWZOBIXVANCSPE-CYBMUJFWSA-N 267.369 2.240 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2ccc(N(C)C)cc2)C1 93813396 ZLLUQUQUHACEAD-MRXNPFEDSA-N 276.380 2.138 10 20 CECD Cc1cccc(CN[C@]2(CO)COc3ccccc3C2)c1O 529643059 IELASHPAZPAFAU-GOSISDBHSA-N 299.370 2.156 10 20 CECD CCOc1ccc(O)c(CN[C@H](CO)CC2CCC2)c1 279767312 JWPLWPHRRHWBKR-AWEZNQCLSA-N 279.380 2.432 10 20 CECD CCNC(=O)C1(CNCc2cc(C)c(C)cc2O)CCC1 277474061 RRWDETLHZPHFNG-UHFFFAOYSA-N 290.407 2.405 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)C(F)F 279503095 MTXSUHOOHVNRLJ-UHFFFAOYSA-N 254.280 2.168 10 20 CECD COC[C@@H](CO)NCc1cc(-c2ccccc2)ccc1O 279762528 JGVQDUJHCXARNW-MRXNPFEDSA-N 287.359 2.156 10 20 CECD CN(C)c1ccc(CN[C@H](CO)CC2CCC2)cc1 279675435 IIAVRRUCGCUZOK-HNNXBMFYSA-N 262.397 2.393 10 20 CECD CC(C)(C)n1ncnc1CNCc1cc(F)ccc1O 282785117 QRFASFSEGSFRHS-UHFFFAOYSA-N 278.331 2.168 10 20 CECD Cc1ncsc1CCNCc1cc([N+](=O)[O-])ccc1O 294738341 DSWNKSXAXTXOLS-UHFFFAOYSA-N 293.348 2.398 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H]2CC23CCNCC3)c1 817976697 RQBNJOAEQIJQCW-DOMZBBRYSA-N 260.381 2.493 10 20 CECD COc1cc(O)c(CN2CC[C@H](OC)[C@H](C)C2)cc1OC 824815318 LRHBUMJNLOWLKT-RISCZKNCSA-N 295.379 2.266 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1ccc2c(c1)CCO2 828665452 SHGSAKKUKGLGBG-HNNXBMFYSA-N 263.337 2.355 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)/C=C/[C@@H]1CCOC1 825981312 RRRWNPGMUIABND-BTKRWWFXSA-N 288.391 2.270 10 20 CECD Cc1cc(O)c(CNC[C@@H](CO)[C@H]2CCOC2)cc1Cl 825752394 ACFBIEJEBMZSRV-AAEUAGOBSA-N 299.798 2.089 10 20 CECD Cc1ncc(C(=O)NCc2c(O)ccc3c2CCCC3)n1C 901131838 PYKAGADSQILQTR-UHFFFAOYSA-N 299.374 2.243 10 20 CECD CN(C)c1ccc(CNCc2cc(C(=O)O)co2)cc1F 901953694 BWESHSWCTDVZAX-UHFFFAOYSA-N 292.310 2.473 10 20 CECD O=C(NCc1ccccc1O)C1CN(C2CCCCC2)C1 837480203 GQSCXYGAQVCNLN-UHFFFAOYSA-N 288.391 2.273 10 20 CECD C[C@@H](NCC1(C)OCCO1)c1ccc(Cl)cc1O 841751416 MRYLUJONJBOXGO-SECBINFHSA-N 271.744 2.459 10 20 CECD CC(C)(CCN[C@H]1CCc2cccc(O)c21)S(C)(=O)=O 840876858 PNAQLMWXQAYKAJ-LBPRGKRZSA-N 297.420 2.182 10 20 CECD C[C@H](CN)NCc1ccc(OCc2ccccc2)cc1O 841059776 CAOZAPYLTDMKPP-CYBMUJFWSA-N 286.375 2.408 10 20 CECD Oc1c(Cl)cccc1CN[C@@H]1CCN(CC(F)F)C1 841893237 BYPSNPSGLSHUMX-SNVBAGLBSA-N 290.741 2.475 10 20 CECD CC[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@H](C)O1 841955442 CCSFFPLXKIAQGO-SWLSCSKDSA-N 291.395 2.020 10 20 CECD COCCN(C)c1ccc(CNc2ccc(N)cc2)cn1 841040571 OTHOKFMTGXPTHA-UHFFFAOYSA-N 286.379 2.359 10 20 CECD COc1ccc(O)c(CNCCC[C@H]2CCCN2)c1 841071809 BVENNUFETBLSMQ-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD CO[C@@H](CNC(=O)c1cc(O)cs1)C1CCCC1 856154238 IZUMSNNDBDYDQW-NSHDSACASA-N 269.366 2.389 10 20 CECD CN1CCc2cc(/C=C\c3n[nH]cc3C=O)ccc21 751535550 OFBZJGGMUWXDKP-RQOWECAXSA-N 253.305 2.385 10 20 CECD CCC1(C(=O)NCc2ccc(N(C)C)cc2C)COC1 755324731 AJGQVLFWVHLXDC-UHFFFAOYSA-N 276.380 2.104 10 20 CECD C[C@H](NCCCn1cncn1)c1cc(F)cc(F)c1O 756831933 ZMSQMLKOYSXHLT-VIFPVBQESA-N 282.294 2.003 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](CC)NC 852799304 DAMPANLQZBYIGW-CYBMUJFWSA-N 264.369 2.129 10 20 CECD C[C@@H](NCCCN(C)C)c1cc(F)cc(F)c1O 756341687 JEUGQJCXTPNICW-SECBINFHSA-N 258.312 2.273 10 20 CECD C[C@H]1C[C@@H](NCC(C)(C)O)c2c(O)ccc(F)c21 756564910 TZSJZCFFMCNYGZ-WCBMZHEXSA-N 253.317 2.440 10 20 CECD C[C@@H]1C[C@H](NCCNC(=O)C2CC2)c2c(O)ccc(F)c21 756372211 PJHWJMILHSPFJP-SKDRFNHKSA-N 292.354 2.195 10 20 CECD Cc1ccc(O)c(CNC(=O)c2nc(C)oc2C)c1 862755827 LMCQNSIBKNGTRF-UHFFFAOYSA-N 260.293 2.235 10 20 CECD CCN(C)C[C@H]1CCN(Cc2c(C)cccc2O)C1 876783280 YOJXJJUDTJFKQM-CQSZACIVSA-N 262.397 2.474 10 20 CECD Cc1ccc(C(=O)N2C[C@H](C)S[C@H](C)C2)c(O)c1O 770498775 GCDBGUZADJSGIY-AOOOYVTPSA-N 281.377 2.372 10 20 CECD CCO[C@@H](CCN(C)C)CNCc1ccc(C)cc1O 877159074 RWLBZJGGUUSUCC-HNNXBMFYSA-N 280.412 2.147 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@@H](C(=O)N(C)c2ccc(N)cc2)C1 884441938 SQCVZKGYYKGAQR-HZMBPMFUSA-N 284.363 2.321 10 20 CECD COc1ccc(CNC(=O)[C@H](C)OCCC(C)C)c(O)c1 794377010 KGBMDLQNHCTNQO-LBPRGKRZSA-N 295.379 2.468 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CCC(F)(F)C1 797743522 GWPNVHLQTIAGDM-VIFPVBQESA-N 271.263 2.149 10 20 CECD CCC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)C[C@H]1C 987676472 ZTBSDMGQWWSTNG-HIFRSBDPSA-N 290.407 2.493 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCC[C@H](F)C2)c1O 1329252241 GMIBMBHXDAYHGQ-RYUDHWBXSA-N 296.342 2.481 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cc(C)n(C)n2)c1 775370429 NDMUZGDSVYZPFX-NSHDSACASA-N 275.352 2.294 10 20 CECD CC(C)CNC(=O)C1CCN(Cc2ccc(N)cc2)CC1 1336286164 NKPTXZSLZVBZFX-UHFFFAOYSA-N 289.423 2.253 10 20 CECD C[C@H](NC(=O)c1ccc2n1CCN[C@H]2C)c1ccccc1O 1354535108 BVIDKKBTMYEQDH-RYUDHWBXSA-N 299.374 2.349 10 20 CECD CC(C)(CCNCc1ccc(F)c(F)c1O)C(=O)O 1602943468 OREBWRBLNDERDV-UHFFFAOYSA-N 273.279 2.261 10 20 CECD Cc1nccc(CSc2ncc(C(=O)O)s2)n1 1600750036 BVOXHEBDVZNTGZ-UHFFFAOYSA-N 267.335 2.232 10 20 CECD O=C(O)c1cnc(SCC(=O)c2nccs2)s1 1602537584 WHTIRPVUGGKPBZ-UHFFFAOYSA-N 286.359 2.273 10 20 CECD CC[C@@H](NCC(C)(F)F)c1cccc(-c2nn[nH]n2)c1O 1590462613 DAZBLDQZPBIVFO-SNVBAGLBSA-N 297.309 2.268 10 20 CECD CN(C)c1ccc(/C=C\CN[C@@H]2CNCC23CC3)cc1 1578425601 HYOPIZWSUUVGDO-MJSXRHKHSA-N 271.408 2.107 10 20 CECD C[C@@H]1OC[C@]2(CC[C@H](CNCc3ccc(N)cc3)O2)[C@@H]1C 1576902582 BEYVPMIQEIMCOR-DLTLXFJOSA-N 290.407 2.331 10 20 CECD COc1cccc([C@@H](C)NC[C@H](C(=O)O)C(C)C)c1O 1594123168 CJUQUEBIACPTEP-PWSUYJOCSA-N 281.352 2.408 10 20 CECD C[C@H](NCC(C)(C)F)c1cc(C(=O)O)ccc1O 1593240211 KZJGPCBCMRAFHT-QMMMGPOBSA-N 255.289 2.489 10 20 CECD CN(C)c1ccc(CNC2(C(=O)O)CC(C)(C)C2)cc1 1777040000 UZAYMNANMIZKPS-UHFFFAOYSA-N 276.380 2.486 10 20 CECD CS[C@H](C)CNCc1ccc(N2CCOCC2)cc1 128062205 MGFFUZBHKKOWSL-CYBMUJFWSA-N 280.437 2.364 10 20 CECD CCNC(=O)[C@H](C)N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 36795248 PTYSOXLZSQRZSA-SDDRHHMPSA-N 276.380 2.363 10 20 CECD Oc1cccc2c1[C@H](NCCN1CC=CCC1)CC2 296616747 YXIAQQOMAGNHKO-CQSZACIVSA-N 258.365 2.231 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H]3NCC[C@@H]3C2)c1O 313194472 MSPBLWQLPPKCCZ-MFKMUULPSA-N 296.798 2.238 10 20 CECD C[C@@H](CCCCO)NCc1cc(F)cc(F)c1O 708481774 UMSQHWJDVCXHBJ-VIFPVBQESA-N 259.296 2.311 10 20 CECD Cc1ccc(C(=O)N2CCOC[C@H]2CC(C)C)c(O)c1O 179499142 ABKCVJZABQJMNO-GFCCVEGCSA-N 293.363 2.293 10 20 CECD COc1ccc(O)c([C@H](C)Nc2ncnc3c2cnn3C)c1 171607913 ZPESQTAJTFZLMY-VIFPVBQESA-N 299.334 2.251 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC1CCOCC1 66700740 UFCVSGQHFHJPGJ-UHFFFAOYSA-N 292.379 2.493 10 20 CECD CSC[C@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183450191 NOWHMGSYJWDEIH-UWVGGRQHSA-N 283.393 2.144 10 20 CECD CN(C(=O)/C=C/c1cnn(C)c1)c1ccc(F)cc1 48656452 BJGXKDLYZHOYIJ-FPYGCLRLSA-N 259.284 2.235 10 20 CECD C[C@@H](NCCCN1CCCC1=O)c1ccc(F)c(F)c1O 191186883 MDVBYWVZDVQVMS-SNVBAGLBSA-N 298.333 2.334 10 20 CECD CNC(=O)CN1CCCc2cc(OC(F)(F)F)ccc21 269669773 ZZTIPQCALPFIGD-UHFFFAOYSA-N 288.269 2.084 10 20 CECD CCOC[C@H](NC(=O)NCc1ccccc1O)C(C)C 276475702 HQPBYFIFIPXZEM-ZDUSSCGKSA-N 280.368 2.253 10 20 CECD CC[C@H](NCCCC(=O)NC)c1ccc(F)cc1O 286186109 RAEYZODNHJVUSR-LBPRGKRZSA-N 268.332 2.098 10 20 CECD COc1cccc(CNC(=O)NCCC2(C)CC2)c1O 280475933 UOQPMVZJKBXHRS-UHFFFAOYSA-N 278.352 2.390 10 20 CECD CCOCC(C)(C)CNC(=O)c1c(F)ccc(O)c1O 295201699 CDGBJUYYBVBYGP-UHFFFAOYSA-N 285.315 2.029 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2CCCSC2)c(O)c1O 292190420 FYDJNCLSAMLYGT-JTQLQIEISA-N 281.377 2.279 10 20 CECD Cc1cc(Cl)cc([C@H](C)NC[C@@]2(O)CCN(C)C2)c1O 808715817 XNQXPRRAQAQMLA-NHYWBVRUSA-N 298.814 2.071 10 20 CECD C[C@H](O)CN(Cc1cc(Cl)ccc1O)CC(F)F 825099049 SGJBVQNCHMOQEB-QMMMGPOBSA-N 279.714 2.494 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(C=O)n1C 825981142 PVDQZKYHIKEIJA-UHFFFAOYSA-N 299.374 2.142 10 20 CECD COc1ccc(O)c(CNC(=O)C2(C)CC(F)(F)C2)c1 821070490 DHZSTWYTUWMJRZ-UHFFFAOYSA-N 285.290 2.452 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CO[C@H](C)C1 828426675 BLLYCOOFWCKFHM-OCCSQVGLSA-N 292.379 2.491 10 20 CECD Cc1cc(O)c(CN[C@@H]2CC(=O)N(C3CC3)C2)cc1Cl 825429645 NTFRZCKLANHOHQ-LLVKDONJSA-N 294.782 2.207 10 20 CECD CCn1cnc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)c1 830541394 XINUHVSABBZHHC-JTQLQIEISA-N 289.335 2.108 10 20 CECD C[C@@H](NCC[C@H](O)C1CC1)c1cc(F)cc(F)c1O 903408905 VIARKRFMUPCZSE-OQPBUACISA-N 271.307 2.482 10 20 CECD CCOCc1cc(CN[C@@H](CO)C2CC2)ccc1OC 734165438 ZVKYTEBYMFBJPC-HNNXBMFYSA-N 279.380 2.092 10 20 CECD COC1(COC(=O)/C=C/c2ccc(O)c(O)c2)CCC1 837586945 HXNYEKVXAVHQKH-GQCTYLIASA-N 278.304 2.223 10 20 CECD CCc1noc([C@H](C)OC(=O)c2cc(O)cs2)n1 745002553 MEAPCBVXHSPHKR-LURJTMIESA-N 268.294 2.317 10 20 CECD C[C@@H](CCO)N(C)Cc1cc(Br)ccc1O 846113068 YTHJVCVGMQCICE-VIFPVBQESA-N 288.185 2.357 10 20 CECD CCN1C(=O)C(C)(C)N[C@H]1c1cccc(Cl)c1O 840833217 LYZCVSUOWHDJTJ-LLVKDONJSA-N 268.744 2.275 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1ccc(N)nc1 843057971 JFKNDNOBWMZMHP-UHFFFAOYSA-N 268.364 2.075 10 20 CECD C[C@]1(C(=O)NCc2cc(Cl)ccc2O)CCCOC1 846473142 JNGUXDNDCKIAPC-AWEZNQCLSA-N 283.755 2.479 10 20 CECD C[C@@H](NC1CCN([C@H]2CCOC2)CC1)c1ccccc1O 848919389 KHFYGQDKJAMMIR-HIFRSBDPSA-N 290.407 2.296 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2CC2(C)C)cc1F 840279974 DOOQDQIEMOHHSH-ZDUSSCGKSA-N 279.359 2.489 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@H]2CC[C@@H](C1)N2 843054297 JMYQKNDJRMGPSB-NEPJUHHUSA-N 266.772 2.372 10 20 CECD O=C(O)[C@@H]1CCCN(Cc2cc(Cl)c(F)cc2O)C1 840997465 NALDRKXAPMDCIT-MRVPVSSYSA-N 287.718 2.481 10 20 CECD CCC(N)(CC)CNC(=O)N(C)Cc1ccccc1O 841951148 FOTHFLVVTFKTBJ-UHFFFAOYSA-N 279.384 2.051 10 20 CECD CO[C@@]1(C)C[C@H]1NC(=O)NCc1ccc(N(C)C)cc1C 852688323 SMDLSJDPHFUPTB-ZBFHGGJFSA-N 291.395 2.038 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@]2(C)CCOC2)c1 755528595 FNROIIXXKCMOQB-ZUZCIYMTSA-N 279.336 2.005 10 20 CECD CC(C)=C(C)C(=O)NCc1ccc(N2CCOCC2)cc1 751193677 ZUZZAQOKRMIBMV-UHFFFAOYSA-N 288.391 2.496 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H]2CCN(C)C2)cc1 765767790 HMUVLMCPKXGCTG-DZGCQCFKSA-N 261.413 2.497 10 20 CECD COc1cc(O)c(CN2CCCOC[C@H]2C)cc1OC 768462937 OZXQJNNKIPHMGF-LLVKDONJSA-N 281.352 2.020 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1cc(F)c(N(C)C)cc1F 864389691 MAGVMWNVUZJMKW-ZDUSSCGKSA-N 297.349 2.260 10 20 CECD CN1CCC2(CCCN2Cc2ccc(N)cc2)CC1 1345160654 XGTNLIQBOMFBEA-UHFFFAOYSA-N 259.397 2.329 10 20 CECD Cc1cccc(O)c1CN(C)CCN1CCOC(C)(C)C1 877484413 ALBNQRVOJRRVCW-UHFFFAOYSA-N 292.423 2.243 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCN1C)c1ccc(N(C)C)cc1 773021713 BJOUXAQYAAFXPV-IUODEOHRSA-N 275.396 2.024 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC12CCC2 773745697 QSKPMZNZBIZJFM-ZYHUDNBSSA-N 275.348 2.335 10 20 CECD Cc1ccc(CNC2CCN([C@@H]3CCOC3)CC2)c(O)c1 877636279 RNZFSKORYDGXHV-MRXNPFEDSA-N 290.407 2.044 10 20 CECD C[C@@H](C[S@@](C)=O)N(C)Cc1cc(Cl)cc(F)c1O 776521224 MTEGTTYOVKBNKL-DCXZOGHSSA-N 293.791 2.384 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)[C@@H](O)c1cccc(F)c1 777534565 RNVMBKWLKMANID-ISVAXAHUSA-N 295.335 2.445 10 20 CECD COC(=O)c1csc(NC(=O)c2cccc(O)c2O)c1 776355941 RAKIHEHKDOFCSY-UHFFFAOYSA-N 293.300 2.198 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@H](C)C[C@@H](C)O 783229864 KMOXVRVYKGJJSE-CHWSQXEVSA-N 293.411 2.020 10 20 CECD COCC1CN(Cc2cc(F)c(N(C)C)cc2F)C1 895975185 QNRRVJWUYNOHJY-UHFFFAOYSA-N 270.323 2.109 10 20 CECD COCCN(CCOC)Cc1ccc(N2CCCC2)cc1 1204320180 NRCPIFACGFNYBT-UHFFFAOYSA-N 292.423 2.382 10 20 CECD COc1ccc(CN[C@H](CO)C2CCCC2)c(O)c1OC 894556817 LOCOERXSDSSKAQ-CYBMUJFWSA-N 295.379 2.050 10 20 CECD C[C@@H](NC[C@]1(O)CCSC1)c1cc(F)ccc1O 185639561 MEQISNCSZHHUNA-NOZJJQNGSA-N 271.357 2.050 10 20 CECD CCN(CC(=O)OC(C)C)c1ccc(OC)c(OC)c1 1319998622 ZXKUNOFXSUBPFJ-UHFFFAOYSA-N 281.352 2.482 10 20 CECD CN1CCN(c2ccc(CN3CC(C)(C)C3)cc2F)CC1 1333000222 JKXPBCVDEYYMNJ-UHFFFAOYSA-N 291.414 2.419 10 20 CECD O=C(OCCCOC(F)(F)F)c1cccc(O)c1O 1262063296 VLVKEJQGHWUFLB-UHFFFAOYSA-N 280.198 2.181 10 20 CECD COCCC1(CNC(=O)NCc2ccc(N)cc2)CCC1 1262578140 JFJPGTJCROIOIX-UHFFFAOYSA-N 291.395 2.275 10 20 CECD Nc1ccc(CN2CCC[C@H]([C@H]3CCNC3)C2)cc1 1352791071 TYLNBWOHFOCITE-GJZGRUSLSA-N 259.397 2.090 10 20 CECD CC[C@H](NC[C@H](C)C(=O)O)c1ccc(C)cc1O 1603585365 AOAOOFSKGGHCKP-JQWIXIFHSA-N 251.326 2.462 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1ccc(N(C)CC)cc1 1603500336 GGEWQGMMSBAEOQ-AWEZNQCLSA-N 264.369 2.438 10 20 CECD CC[C@@H](NCc1cc(C(C)C)ccc1O)C(=O)O 1593607495 BOVXWUSLOCZVMU-GFCCVEGCSA-N 251.326 2.468 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCc1ncn(C)n1 230670203 CVSWZZNBSTYRSF-GHMZBOCLSA-N 272.352 2.167 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2cc(C)cc(C)c2O)C1 165082246 VGHBIQIVIBCYDT-HNNXBMFYSA-N 290.407 2.309 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCCN3C)CO1 402373579 ZFRLDFMXJXRDLO-IUODEOHRSA-N 260.381 2.336 10 20 CECD COc1ccc(O)c(CN[C@H]2C[C@H](OC)C23CCC3)c1 713481308 SPWMOAGPEKDHKW-GJZGRUSLSA-N 277.364 2.448 10 20 CECD COc1cccc(CNCc2nn(C)cc2Cl)c1O 393325643 OPUVFONJMJZZEO-UHFFFAOYSA-N 281.743 2.078 10 20 CECD CCC1(CN[C@@H](C)c2cc(OC)ccc2O)COC1 393971423 NCGQDIAFDOCYGZ-NSHDSACASA-N 265.353 2.478 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCc1cnnn1C 394940348 BXHZQADGECTUBV-CMPLNLGQSA-N 272.352 2.167 10 20 CECD COc1ccc(O)c(CNCc2ccc(F)cn2)c1 776251741 XRMPBAZVHKNQOL-UHFFFAOYSA-N 262.284 2.225 10 20 CECD Cc1ccc(O)c(CN[C@H]2c3ccccc3C[C@@H]2O)c1 85334288 UJULNTDMABUCSX-IRXDYDNUSA-N 269.344 2.449 10 20 CECD CC(=O)c1cc(F)cc(CN(C)Cc2cnn(C)c2)c1O 50152990 JPBPUZRAFGSSAC-UHFFFAOYSA-N 291.326 2.099 10 20 CECD C[C@H]1CN=C(N2CCN(Cc3ccccc3O)CC2)S1 179580005 JHYRBPCEXMLIGX-LBPRGKRZSA-N 291.420 2.001 10 20 CECD Cc1nn(C)cc1C(=O)NCc1ccc(N2CCCC2)cc1 172013130 CAINVISWMPLPRX-UHFFFAOYSA-N 298.390 2.259 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C(F)(F)C(F)F)c1 179427534 LPPKHZOYEQURAN-LURJTMIESA-N 295.232 2.478 10 20 CECD COc1cccc(CNC(=O)CC(C)(C)C)c1O 68488587 KXGPLCWSVLQZIF-UHFFFAOYSA-N 251.326 2.453 10 20 CECD Cc1oncc1CN1CCOc2cc(N(C)C)ccc21 129567804 HMPWXBDDDMWAGC-UHFFFAOYSA-N 273.336 2.448 10 20 CECD CC(C)=CC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 71048988 LBYKUFAGHSNKQS-UHFFFAOYSA-N 288.391 2.448 10 20 CECD CC[C@@](C)(O)CN[C@H](C)c1ccc(F)c(F)c1O 187707437 BSOQFDXMXDRJKB-AMIZOPFISA-N 259.296 2.482 10 20 CECD O=C1N[C@@H](c2cc(F)ccc2O)Nc2ccccc21 193497455 OUERBGMSTHGWDG-ZDUSSCGKSA-N 258.252 2.385 10 20 CECD CN1CCCc2cc(CNC(=O)C(=O)C(C)(C)C)ccc21 265152581 XBMCMFHBQQBNSA-UHFFFAOYSA-N 288.391 2.300 10 20 CECD CCN(CC(=O)NCc1cccnc1)c1ccc(OC)cc1 264683708 DJPRTZVPPMCOKY-UHFFFAOYSA-N 299.374 2.233 10 20 CECD C[C@@H](NC(=O)N(C)Cc1ccccc1O)c1cnn(C)c1 266748056 FBUFPNHOKBUHBB-LLVKDONJSA-N 288.351 2.028 10 20 CECD COCC1(CNC(=O)NCc2ccccc2O)CCC1 283571756 QLTYWCRGZWWOCW-UHFFFAOYSA-N 278.352 2.008 10 20 CECD CC[C@@H](N[C@H](C)C(=O)N(C)CC)c1ccc(F)cc1O 287532187 OYOZGIUTTAKNAY-ZWNOBZJWSA-N 282.359 2.439 10 20 CECD COc1cc(O)c(CN2CCCc3n[nH]cc32)cc1OC 291697440 YRPJLUQKQWYIKT-UHFFFAOYSA-N 289.335 2.085 10 20 CECD CS[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 296752230 BPLZBKULTQAACT-JOAKQRRISA-N 279.361 2.075 10 20 CECD Cc1cc(CN2C[C@@H](O)C(C)(C)C2)ccc1N(C)C 294024857 HQRGOZRLCSMHDJ-OAHLLOKOSA-N 262.397 2.264 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C)cc(C)n2)c1 801173835 FICOMOKAVCFKMW-UHFFFAOYSA-N 286.331 2.343 10 20 CECD C[C@@H]1C[C@@H](NC[C@@H]2CCCN2)c2c(O)ccc(F)c21 817953227 XQFBLEHEQPXQHG-JFGNBEQYSA-N 264.344 2.421 10 20 CECD Cc1cc(O)c(CN(C)Cc2nc[nH]n2)cc1Cl 824829776 KVWXKJSXIMALKT-UHFFFAOYSA-N 266.732 2.104 10 20 CECD Cc1cc(Cl)cc(CN(C)CCC(=O)O)c1O 820976413 DYBJQRLXUJZDQZ-UHFFFAOYSA-N 257.717 2.261 10 20 CECD COc1cc(O)c(CN[C@H](C)[C@H](OC)C2CC2)cc1OC 825099084 UKZKLCOWMGNQOW-HWPZZCPQSA-N 295.379 2.313 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3cccc(C)c32)cn1 492733957 ICTILFWFPRRBBZ-SREVYHEPSA-N 295.342 2.396 10 20 CECD COC1CN(Cc2c(O)c(C(=O)O)cc3ccccc23)C1 737736536 XGRUGLXKQQWUIY-UHFFFAOYSA-N 287.315 2.074 10 20 CECD CCn1ccnc1[C@H](C)NC(=O)c1ccc(C)c(O)c1O 836948326 GRDCFSYZBNRGSE-JTQLQIEISA-N 289.335 2.114 10 20 CECD C[C@H]1c2cccn2CCN1C(=O)c1cc(O)cs1 731868147 NUBMXCQIDKKAKB-VIFPVBQESA-N 262.334 2.472 10 20 CECD CCOc1ccc(CN2CC(OCC(F)F)C2)c(O)c1 839137390 GEUWXGIOAYQSIJ-UHFFFAOYSA-N 287.306 2.257 10 20 CECD CC[C@H](OC)C(=O)NCc1cc(Cl)ccc1O 846473508 SKAVWBMYVODKBG-NSHDSACASA-N 257.717 2.087 10 20 CECD CCNC(=O)C1(CNCc2cccc(CC)c2O)CCC1 848905598 KBPCPVCHIZSVSQ-UHFFFAOYSA-N 290.407 2.351 10 20 CECD C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@@H]2c1cc(Cl)c(F)cc1O 840820225 QVWHIRDCUAEXPM-RESLBDFXSA-N 298.745 2.414 10 20 CECD C[C@@H](N)[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843052447 UEPDNEDXDGHJQW-OCCSQVGLSA-N 279.403 2.451 10 20 CECD CN1CCCc2cc(CNC(=N)NC3CCC3)ccc21 848998984 QOZVPYQAZNGIJV-UHFFFAOYSA-N 272.396 2.235 10 20 CECD COC(=O)CCCN(C)CCN(C)c1ccc(OC)cc1 844402172 VYAQIRDVMRSLCT-UHFFFAOYSA-N 294.395 2.016 10 20 CECD CCOCc1cc(CN[C@H]2COC[C@@H]2C)ccc1OC 922643502 QQXBAHNJZYLDGS-WFASDCNBSA-N 279.380 2.356 10 20 CECD C[C@@H]1CN(Cc2cccc(Br)c2O)CC[C@@H]1N 843052864 WUOQABRWUAPKJP-SKDRFNHKSA-N 299.212 2.324 10 20 CECD CCN(CC)c1ccc(CNCC(F)(F)CN)cc1F 841060167 RSSAXDALEQSCRG-UHFFFAOYSA-N 289.345 2.356 10 20 CECD COc1cc(Cl)cc(CN2C[C@H]3CCC[C@]3(N)C2)c1O 857226735 YGXJSOSILQBGOV-ABAIWWIYSA-N 296.798 2.367 10 20 CECD C[C@H]1COC[C@H]1NCc1ccc(N2CCSCC2)cc1 924709599 YNKPMBLOIQCVTI-XJKSGUPXSA-N 292.448 2.364 10 20 CECD CO[C@H](CNC(=O)c1c(F)ccc(O)c1O)C1CCCC1 857332564 XJUFJOXCRDKWTB-GFCCVEGCSA-N 297.326 2.172 10 20 CECD COc1cccc(CN[C@H](C)C[C@@H]2CCOC2)c1O 759836818 KNKHPZKQBHZLJQ-NEPJUHHUSA-N 265.353 2.306 10 20 CECD C[C@H](O)CCN(C)Cc1c(O)cccc1Br 862247534 ZKIATDMXKNCBKB-VIFPVBQESA-N 288.185 2.357 10 20 CECD Cc1cc(O)c(CN(C)[C@H]2CCC(=O)N(C)C2)cc1C 862428175 MNOITPLHNDEEGH-AWEZNQCLSA-N 276.380 2.062 10 20 CECD CN1CCN(Cc2ccc(N(C)C)c(F)c2)C(C)(C)C1 769448108 ZLYIPTZMUILKND-UHFFFAOYSA-N 279.403 2.418 10 20 CECD CN(C)c1ccc(CN2CCC(CCO)CC2)cc1F 768236897 LJHDEZSKNWUOQJ-UHFFFAOYSA-N 280.387 2.486 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1ccc(C)cc1O 876946727 PZWWWFPPKXLJPB-GFCCVEGCSA-N 264.369 2.095 10 20 CECD Oc1cccc2c1[C@@H](NC[C@@H]1C[C@@H]3CC[C@H](C1)N3)CC2 873261748 RFFOTKQNZQHJRF-ATGSNQNLSA-N 272.392 2.500 10 20 CECD Cc1nnc(O)c(CN[C@@H](C)c2cc(F)ccc2O)c1C 1116568901 VZIUCXZKDKZOQJ-JTQLQIEISA-N 291.326 2.495 10 20 CECD C[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@H](C)S1 1117793992 IDOYOXKSTVDJBK-YUMQZZPRSA-N 285.340 2.203 10 20 CECD CN(C(=O)c1cnn(C)c1C1CC1)c1ccc(N)cc1 877078536 TYRURQYEMGKJQX-UHFFFAOYSA-N 270.336 2.156 10 20 CECD CN(C)c1ccc(CN(C)C(=O)[C@H]2CC[C@@H](N)CC2)cc1 870856135 UCNQYVHFIMZBNZ-GASCZTMLSA-N 289.423 2.229 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1cc(Cl)cc(F)c1O 775656677 YPWSCXZCLGWVAU-QMMMGPOBSA-N 289.734 2.426 10 20 CECD CCOCc1cc(CN[C@@H](C)C[C@@H](C)O)ccc1OC 782978037 JQSVOWKGGTVFCL-QWHCGFSZSA-N 281.396 2.481 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCN(C3CC3)C2)c1O 894172296 HHWNKSTWTUPOGA-ZDUSSCGKSA-N 290.407 2.283 10 20 CECD CCc1cc(C(=O)N[C@H](C)c2ccccc2O)no1 899182385 ZBNFGQBRUYTQPO-SECBINFHSA-N 260.293 2.434 10 20 CECD COc1ccc(CN(C)C[C@@H]2CCC[C@@H]2O)c(O)c1OC 892217597 ZEHPWSPRJDTERJ-AAEUAGOBSA-N 295.379 2.002 10 20 CECD COc1ccc(N2CCC(NCCCCCO)CC2)cc1 790497136 KULFVJSYZIDZKL-UHFFFAOYSA-N 292.423 2.416 10 20 CECD CC[C@H](N[C@@H](CO)COC)c1cc(Cl)ccc1O 794839132 YVDCSWMHJJYMBG-JQWIXIFHSA-N 273.760 2.094 10 20 CECD c1cc(N2CCCC2)ccc1CNC[C@@H]1CCCN1 1327414972 GXSUYVINBOBACI-HNNXBMFYSA-N 259.397 2.128 10 20 CECD Oc1cccc(Br)c1CN[C@@H]1CCC[C@H]1O 706804252 GMUASOBRVCPEHY-ZYHUDNBSSA-N 286.169 2.158 10 20 CECD C[C@@H](C(=O)O)C1(NCc2cc(F)c(N(C)C)cc2F)CC1 1329681638 ISWNXSULAOSETK-VIFPVBQESA-N 298.333 2.374 10 20 CECD CCOC(=O)[C@@H](NCc1ccc(N(C)C)c(C)c1)C1CC1 1326388754 UGIRUOIBYJFIAE-INIZCTEOSA-N 290.407 2.492 10 20 CECD CC(C)(C)[C@@H](NCc1cc(F)ccc1O)C(=O)O 1603309663 FUXQCAOQWGEUTB-NSHDSACASA-N 255.289 2.120 10 20 CECD NC1CC(CC(=O)NCc2c(O)ccc3ccccc23)C1 1580160418 ROCRWAFIGVEIAV-UHFFFAOYSA-N 284.359 2.289 10 20 CECD CCN1CCc2cc(CN=c3cc[nH]c(C(=O)O)c3)ccc21 1776878056 YVUQVVBJCGFMJU-UHFFFAOYSA-N 297.358 2.196 10 20 CECD CN(C)c1ccc(CNCC2(C(=O)O)CC(F)(F)C2)cc1 1777040292 VDKKWFGKEYNVBS-UHFFFAOYSA-N 298.333 2.342 10 20 CECD C[C@H]1CCC[C@]1(NCc1cc(F)cc(F)c1O)C(=O)O 1776636278 DPXXFUCCQFGTKN-RMLUDKJBSA-N 285.290 2.403 10 20 CECD O=C(O)[C@H]1CCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 1777660321 GXJFLCVCCCHPLN-NWDGAFQWSA-N 294.307 2.033 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C/c2ccco2)c1 155927229 FKXYYUJIDUOGHJ-FNORWQNLSA-N 273.288 2.323 10 20 CECD Nc1ccc(CNC(=O)COC2CCCCC2)cc1 837303230 ADOXRIFUTAYSAB-UHFFFAOYSA-N 262.353 2.234 10 20 CECD C[C@@H]1CCCN(Cc2cc(F)ccc2O)[C@H]1C(=O)O 818631658 MHQDYYGGBCFASS-NOZJJQNGSA-N 267.300 2.216 10 20 CECD CC(C)(C)C[C@H](CO)NC(=O)Nc1ccc(N)cc1 841297843 IVRNJDIECFLGNN-GFCCVEGCSA-N 265.357 2.187 10 20 CECD CN1CCCc2cc(CNC3CCOCC3)ccc21 50286535 RLGVUKVQEJOONH-UHFFFAOYSA-N 260.381 2.338 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@](C)(O)C2CC2)c1 311694746 SVOXSPGLBPRYOL-BMIGLBTASA-N 265.353 2.212 10 20 CECD Cc1nc(C)c(CNC(=O)c2cccc(O)c2O)s1 312094667 QZQKUFCZDKZHKU-UHFFFAOYSA-N 278.333 2.101 10 20 CECD COc1cccc(CNC(=O)CCc2ccccn2)c1O 105650769 DNUVHHZVJAOUKH-UHFFFAOYSA-N 286.331 2.045 10 20 CECD CN(C)c1ccc(CNC(=O)CCc2nccs2)cc1 55132720 NQTKNCUCZYODOS-UHFFFAOYSA-N 289.404 2.458 10 20 CECD C[C@@H](N)CN(C)Cc1cc(Cl)cc(Cl)c1O 309406986 IDYHLDCCTXOICK-SSDOTTSWSA-N 263.168 2.478 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1cnn(C)c1 115750730 RLEWOVCNYCRMEN-UHFFFAOYSA-N 287.367 2.116 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CC(=O)N(C3CC3)C2)c(O)c1 186089050 UEPULYAPHJGNFC-RYUDHWBXSA-N 274.364 2.115 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCC[C@@H]2O)cc1F 74370957 YQHDQMFDIVAVBU-ZFWWWQNUSA-N 266.360 2.285 10 20 CECD CN(CC(=O)c1cccn1C)c1ccc2c(c1)OCO2 121431249 UGESTECVXJVOJO-UHFFFAOYSA-N 272.304 2.073 10 20 CECD CCCC(=O)NCc1ccc(N2CCC(CO)CC2)cc1 79606255 AEUCMIASIKBTMC-UHFFFAOYSA-N 290.407 2.312 10 20 CECD Cn1cnnc1CNCc1cc(Cl)cc(Cl)c1O 38007556 ULCLGWVRKRARCJ-UHFFFAOYSA-N 287.150 2.117 10 20 CECD Oc1c(Cl)cccc1CNC[C@@H]1CC[C@@H](O)C1 187985926 VLIWGFPBZJPGGH-MWLCHTKSSA-N 255.745 2.296 10 20 CECD CCN1CCN([C@@H](C)CN[C@@H](C)c2ccccc2O)CC1 183418338 AWOMZALDZQTHDF-GJZGRUSLSA-N 291.439 2.069 10 20 CECD CCCS(=O)(=O)CCSc1nccs1 133259210 REGVWQXWKRIRTC-UHFFFAOYSA-N 251.398 2.060 10 20 CECD C[C@@H](NCC(=O)N1CCCCC1)c1ccc(N(C)C)cc1 135108388 DKYYCXQCQRQQOY-CQSZACIVSA-N 289.423 2.416 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C(=O)O)cc1 41689430 KPKGIPGPJRQDDK-LLVKDONJSA-N 250.342 2.096 10 20 CECD CCC(CC)(CN)C(=O)N(C)Cc1ccccc1O 137762158 HWKMZAVGEKBELH-UHFFFAOYSA-N 264.369 2.116 10 20 CECD COc1cc(Cl)cc(CN(C)C[C@@H](C)C(=O)O)c1O 229119055 XEYWGQVOCSQEFA-MRVPVSSYSA-N 287.743 2.207 10 20 CECD CN(C)c1ccc(CN2CC[C@H](N3CCCC3)C2)cc1 92756121 HKWRQUBAWSLPHN-KRWDZBQOSA-N 273.424 2.423 10 20 CECD CO[C@H](C)[C@@H](C)NCc1ccc(N2CCOCC2)c(F)c1 268877898 QVFCRPANTAPWFV-CHWSQXEVSA-N 296.386 2.175 10 20 CECD COC(=O)C1=C(C)O[C@H](CN(C)Cc2ccccc2O)C1 272563472 PXOOLEUNJZMEFK-ZDUSSCGKSA-N 291.347 2.060 10 20 CECD C[C@H](NCC1(O)CCN(C)CC1)c1cc(Cl)ccc1O 273366806 BQNBIZULXPOOGV-NSHDSACASA-N 298.814 2.153 10 20 CECD CCOc1ccc(O)c(CNCC2([S@@](C)=O)CCC2)c1 280599187 JEFCUFNVABEGFT-HXUWFJFHSA-N 297.420 2.182 10 20 CECD CC(C)SCCNC(=O)NCc1ccccc1O 287152918 CODSNZYGMXNPPB-UHFFFAOYSA-N 268.382 2.333 10 20 CECD Cc1ccc(O)c(CN[C@H](c2nncn2C)C(C)C)c1 285580074 TXVKFWDFRXGXEE-AWEZNQCLSA-N 274.368 2.316 10 20 CECD C[C@@H](N)C[C@@H](C)NCc1ccc(N2CCSCC2)cc1 817887686 CDBBDTVYTMWYMY-ZIAGYGMSSA-N 293.480 2.455 10 20 CECD C[C@H](N[C@H]1CCCNCC1)c1cc([N+](=O)[O-])ccc1O 817967864 CVWAEUYSXKSFPB-QWRGUYRKSA-N 279.340 2.093 10 20 CECD CCCN1C[C@@H](CNCc2ccc(OC)c(C)c2)CC1=O 817410315 AIQZESXDZKZCLX-OAHLLOKOSA-N 290.407 2.352 10 20 CECD C/C=C/C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819578379 JPORQRFQOXSUOA-ITDFMYJTSA-N 274.364 2.214 10 20 CECD C[C@H](NC1CCNCC1)c1cc(F)cc(F)c1O 817937572 XUVORNXIDFCMJQ-QMMMGPOBSA-N 256.296 2.073 10 20 CECD COc1ccc(O)c([C@H](C)NC(=S)NC2CC2)c1 728791770 GHADGQTXMJKPGA-QMMMGPOBSA-N 266.366 2.088 10 20 CECD Cc1ncsc1CNC(=O)NCc1ccccc1O 729604906 BRNBVHPUVVDVDW-UHFFFAOYSA-N 277.349 2.157 10 20 CECD CC[C@@H](CNCc1cc(Cl)c(F)cc1O)C(=O)O 903708838 HDXNCNKLPUNNHT-ZETCQYMHSA-N 275.707 2.385 10 20 CECD Fc1cc(CN2CC[C@@H](F)C2)ccc1N1CCOCC1 824572547 ZNVCKFMTDVUIOY-CYBMUJFWSA-N 282.334 2.206 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H]1CO[C@@H](C)C1 828426671 BLLYCOOFWCKFHM-GXTWGEPZSA-N 292.379 2.491 10 20 CECD CNCCc1ccccc1C(=O)N(C)c1ccc(OC)nc1 662898279 SQLOASLOTLFAHQ-UHFFFAOYSA-N 299.374 2.129 10 20 CECD Cc1nc([C@@H]2CCN(Cc3ccc(N(C)C)c(C)c3)C2)n[nH]1 839661337 MUSZAKZTLPFNSA-OAHLLOKOSA-N 299.422 2.477 10 20 CECD CCOc1ccc(CNC[C@@]2(C)CCOC2)c(O)c1 733327627 JGUQNCKMPCHYTL-OAHLLOKOSA-N 265.353 2.307 10 20 CECD Cc1cc(CNC(C)(C)CN(C)C)ccc1N(C)C 839093695 FKMPVLBYMKYOKO-UHFFFAOYSA-N 263.429 2.491 10 20 CECD Cc1cccc(CNC[C@@H](N)c2ccccc2)c1O 841034246 BNOZVKAIWLVCGW-OAHLLOKOSA-N 256.349 2.490 10 20 CECD Cc1cccc(NC(=O)C(=O)NCc2ccccc2O)c1C 748486263 OGBUGKQDXRPMOI-UHFFFAOYSA-N 298.342 2.264 10 20 CECD CC[C@H](NC[C@@H]1CCCNC1=O)c1ccc(F)cc1O 840826129 QLSPIQXFCYHFOT-GWCFXTLKSA-N 280.343 2.098 10 20 CECD COCC1(CNCc2cc(C)c(C)cc2O)CCNCC1 841068222 LCYKNXAHQIXFSK-UHFFFAOYSA-N 292.423 2.115 10 20 CECD C[C@H]1CCCc2ncc(C(=O)NCc3ccc(N)cc3)n21 846297540 HSVHKZOFDTUYEG-NSHDSACASA-N 284.363 2.293 10 20 CECD C[C@H](c1ccccc1)[C@@H](O)CNC(=O)c1cc(O)cs1 856291872 GGPNRFJQWFNZJP-MFKMUULPSA-N 291.372 2.348 10 20 CECD C[C@H](NC1COC(C)(C)OC1)c1cc([N+](=O)[O-])ccc1O 757696838 FGXILNHLAMYAHN-VIFPVBQESA-N 296.323 2.103 10 20 CECD CCCNC(=O)CCN[C@@H](C)c1cc(F)cc(F)c1O 756459478 NQHRGLWBCHWEPV-VIFPVBQESA-N 286.322 2.237 10 20 CECD CC[C@H](NC)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 852776163 LHWJLCNBHJGZPK-INIZCTEOSA-N 291.439 2.489 10 20 CECD Cc1nc(C)c(C(=O)NCCCSc2nccs2)[nH]1 857124838 JZEXMNPDUHQZFC-UHFFFAOYSA-N 296.421 2.395 10 20 CECD O=C(NC[C@@]1(O)CCc2ccccc21)c1cc(O)cs1 752664103 OKXRZVARIWWMCP-HNNXBMFYSA-N 289.356 2.018 10 20 CECD C[C@H](N(C)Cc1cc2c(cc1O)OC[C@@H]2O)C1(C)CC1 768463644 KWTAFDQCZGECTJ-HZMBPMFUSA-N 277.364 2.438 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)/C=C\SC)c1 761973166 NCNKWZACOBNXJD-ATJFRQLMSA-N 267.350 2.455 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 773021984 AGWQRLIAAAIVKG-KBPBESRZSA-N 280.412 2.455 10 20 CECD C[C@@H](NC[C@@H](O)COCc1ccco1)c1ccccc1O 879648732 BFIJXCSMBFESOU-CHWSQXEVSA-N 291.347 2.214 10 20 CECD C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)[C@@H](C)O1 875988842 NJXCBGALKNWOCR-WZRBSPASSA-N 278.352 2.100 10 20 CECD CCOc1ccc(N(C)Cc2cc(C(=O)OC)no2)cc1 877179439 AMQXYAQMLRHLEY-UHFFFAOYSA-N 290.319 2.496 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC12CCC2 773745696 QSKPMZNZBIZJFM-PWSUYJOCSA-N 275.348 2.335 10 20 CECD Cc1ccc(CNCCCOC[C@@H]2CCOC2)c(O)c1 877060479 YOBXUJCCBQCTRZ-AWEZNQCLSA-N 279.380 2.233 10 20 CECD CCCOc1ccc(CNCC[S@@](C)=O)cc1C 873053102 FDCNSJRXJKBRIX-GOSISDBHSA-N 269.410 2.252 10 20 CECD CNC(=O)C1(NCc2cccc(Cl)c2O)CCCC1 779177230 YGBGAQCFYNMIFA-UHFFFAOYSA-N 282.771 2.194 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NN2CCCC2=O)cc1 770546399 KKWHWJIVRJJYOS-UHFFFAOYSA-N 297.358 2.361 10 20 CECD O=S(=O)(NCCCSc1nccs1)C1CCC1 881886893 IAOUWIIBMGXAJE-UHFFFAOYSA-N 292.451 2.097 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@@H]1C 787421826 XFPYCGRKSXQSCV-YPMHNXCESA-N 294.370 2.275 10 20 CECD Oc1c(F)cc(F)cc1CNCCO[C@@H]1CCCCO1 894792335 ARRMKWVNTHUQOF-CYBMUJFWSA-N 287.306 2.303 10 20 CECD COc1ccc(CN2CC(C(F)(F)F)C2)c(O)c1OC 894710128 AOZNPPPOPVWQJW-UHFFFAOYSA-N 291.269 2.404 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)NCc1cccc(OC)c1O 793689084 JCXBTSKXBZCKDY-IINYFYTJSA-N 281.352 2.078 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC[C@@H]3C[C@H]32)cc1 796590930 QOVWCEGDNSPGPC-UKRRQHHQSA-N 273.380 2.447 10 20 CECD OCC[C@H]1CCC[C@H]1NCc1cc(F)ccc1O 190307040 BNGGIUZDXZNYFA-ZWNOBZJWSA-N 253.317 2.172 10 20 CECD CC(C)c1ncc(C(=O)N(C)c2ccc(N)cc2)[nH]1 1262009325 SARDZJQQEVVIDG-UHFFFAOYSA-N 258.325 2.392 10 20 CECD CC[C@H]1C[C@@H](C(=O)NCc2ccc(N)cc2)CCO1 1356228215 POOIDAJHVYLEGX-JSGCOSHPSA-N 262.353 2.090 10 20 CECD Cc1cc(O)c(CN2CC[C@](F)(C(=O)O)C2)c(Cl)c1 1600286840 XIAYLKAUPHIIIU-CYBMUJFWSA-N 287.718 2.353 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](C(=O)O)C2CCCC2)c1 1605296862 QPYQUUSAWWOXKR-AWEZNQCLSA-N 291.347 2.208 10 20 CECD C[C@@H]1NC[C@H](C)N(Cc2ccc(F)c(F)c2O)[C@H]1C 1576881855 NQONKBYINPGMSS-GUBZILKMSA-N 270.323 2.241 10 20 CECD Cc1ccc(O)c(CNC[C@@](C)(O)C(F)(F)F)c1 270478165 IZAIDTUWBOXUBI-LLVKDONJSA-N 263.259 2.104 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2c[nH]nc2C)c1 38011147 KOWAWBLDQHRUTP-SNVBAGLBSA-N 261.325 2.283 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCN(C3CC3)C2)cc1 44683824 PDZQDSAWODTZPU-CQSZACIVSA-N 259.397 2.079 10 20 CECD CN1CCC(CN(C)Cc2cc(F)ccc2O)CC1 180075511 RUOMXCHZTXIXQE-UHFFFAOYSA-N 266.360 2.305 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)(F)F)c1ccc(F)cc1O 717773070 GAQSLKIVNCPPCF-VXNVDRBHSA-N 281.249 2.495 10 20 CECD Cc1nnc(CN[C@@H](C)c2ccc(N(C)C)cc2)n1C 393140334 BUYINBNWJXKOJH-NSHDSACASA-N 273.384 2.040 10 20 CECD COc1ccc(O)c([C@H](C)NCc2csnn2)c1 398279823 KUKLCQSTYALXMA-QMMMGPOBSA-N 265.338 2.103 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@H](C)CCO)cc1 172555799 HDSJPYYQEPOKQQ-CYBMUJFWSA-N 293.411 2.103 10 20 CECD CCCNC(=O)NC1CCN(c2ccc(OC)cc2)CC1 102440126 IWRKSLXSSGOSAR-UHFFFAOYSA-N 291.395 2.373 10 20 CECD CCN(C[C@@H]1CCCO1)C(=O)c1ccc(C)c(O)c1O 177675693 QRTKVUNYAKWMKV-NSHDSACASA-N 279.336 2.047 10 20 CECD O=C1NCCN(Cc2ccccc2O)[C@H]1c1ccccc1 179565358 MRWGIRNOXRCLPU-INIZCTEOSA-N 282.343 2.065 10 20 CECD COc1cccc(CNC[C@@H]2CSCCS2)c1O 125227395 MDFNAFPLUJAHDN-LLVKDONJSA-N 285.434 2.339 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCO[C@H](C)C2)c1O 37322687 IZKQGZWMHPPLGW-SECBINFHSA-N 283.755 2.469 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H]2CC(=O)N(C3CC3)C2)c1 186088385 DJRSHICQWRIMAP-RYUDHWBXSA-N 274.364 2.115 10 20 CECD CC[C@H](O)CNCc1ccc(N(CC)CC)cc1 124387278 HVEJLXGNMPRSQI-HNNXBMFYSA-N 250.386 2.393 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2)cc(O)n1 132655402 HJJBHXMOJOVITJ-UHFFFAOYSA-N 285.347 2.092 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@H]2CCCS(=O)(=O)C2)c1 287166531 UHBWVHZTIOZGKJ-QWHCGFSZSA-N 297.420 2.176 10 20 CECD Oc1ccc(F)cc1CNC[C@@H]1CCCC[C@H]1O 226610895 INRNHCALACEULP-GXFFZTMASA-N 253.317 2.172 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C(=O)N(C)C)cc1F 191738881 RGQBREZOEZNSDB-LBPRGKRZSA-N 295.402 2.238 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H]2CCCCO2)cc1 87004627 PYFMDCWVBPOCPV-HNNXBMFYSA-N 276.380 2.328 10 20 CECD Cc1cc(O)c(CN[C@@H]2C[C@H]3CC[C@H]2NC3)cc1C 530246622 QNKOMZMZNCGTHS-BPLDGKMQSA-N 260.381 2.239 10 20 CECD COC[C@@H](CCO)N[C@H](C)c1cc2c(cc1O)CCCC2 273591843 PHWHMQNXXGPYBX-IUODEOHRSA-N 293.407 2.319 10 20 CECD C[C@@H]1C[C@@H](NC[C@H]2CCCN2)c2c(O)ccc(F)c21 817953225 XQFBLEHEQPXQHG-CKYFFXLPSA-N 264.344 2.421 10 20 CECD C[C@H]1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 819168517 QBNSPSUVHZLOSX-AAEUAGOBSA-N 288.347 2.345 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)OC2CCOCC2)c1 810050916 SUHHDVUBSWZRPJ-SNVBAGLBSA-N 295.335 2.367 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H]2C2OCCO2)c1O 902623621 ZZFJCNVRXTWJLG-CYBMUJFWSA-N 293.363 2.047 10 20 CECD CO[C@@H](C1CC1)[C@@H](C)NC(=O)N(C)Cc1ccccc1O 838700609 BJMMECNABPDMPN-IAQYHMDHSA-N 292.379 2.347 10 20 CECD CN(C)c1ccc(CNc2nc3n(n2)CCCC3)cc1 834482345 DVGIHVYIWIRQFV-UHFFFAOYSA-N 271.368 2.293 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@H]1C 734687912 XJXZKXKPMFXNJS-GFCCVEGCSA-N 261.369 2.365 10 20 CECD COc1ccc(N(Cc2cn(C)nn2)CC2CC2)cc1 831587784 LWHOBEQDGDANBV-UHFFFAOYSA-N 272.352 2.240 10 20 CECD CC[C@H](O)CCCNC(=O)NCc1ccc(N(C)C)cc1 743810988 JFWZSQWTOOBTCO-HNNXBMFYSA-N 293.411 2.103 10 20 CECD CC(C)=CCCNC(=O)NCCc1ccc(N)cc1 841886530 PKNFHULELKNBOH-UHFFFAOYSA-N 261.369 2.467 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1nonc1C 840949274 SXEUQXSXWWFFAM-UHFFFAOYSA-N 260.341 2.042 10 20 CECD CCOc1ccc(CNCCOC2CCC2)c(O)c1 742387950 YKIVDHAXRGWUJX-UHFFFAOYSA-N 265.353 2.450 10 20 CECD CC[C@H](CO)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840554344 GGRMJLVLWDKRJG-UONOGXRCSA-N 292.423 2.127 10 20 CECD CCC[C@H]1CNCCN1Cc1cc(F)ccc1O 843057326 CDKOYKRAQFIVOM-ZDUSSCGKSA-N 252.333 2.105 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)CC[C@@H]1N 843052215 PLMIXPLVQROOPZ-PELKAZGASA-N 272.751 2.354 10 20 CECD O=C(NCc1ccccc1O)c1ccc2nc(O)oc2c1 748347071 UHEWEMVKZQJMNF-UHFFFAOYSA-N 284.271 2.169 10 20 CECD COc1cccc([C@H](C)NCC2CCN(C)CC2)c1O 846148340 ZRPHAEXEQMKJGH-LBPRGKRZSA-N 278.396 2.393 10 20 CECD NC[C@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 843047170 HXIPKMZCMLKAFR-SECBINFHSA-N 272.751 2.355 10 20 CECD Cc1cc(CN2CCN(c3ncc[nH]3)CC2)ccc1N(C)C 846875071 CPZQVCRDJCDYCA-UHFFFAOYSA-N 299.422 2.106 10 20 CECD CCn1cc(CN[C@@H](C)c2c(C)cc(C)cc2O)nn1 850522751 YTGBVCXZOSHNDH-LBPRGKRZSA-N 274.368 2.471 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)OCCF)C2)cc1 859196199 NORHYYKSGSDUNY-LBPRGKRZSA-N 296.342 2.217 10 20 CECD COc1cc(CN2CCC[C@H]2C[C@@H](C)O)c(O)cc1C 768461489 DFKIPLPUGCKTSH-OCCSQVGLSA-N 279.380 2.445 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](N(C)C)CC1 763617968 YGXSCDJBBBUDAB-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD C[C@@H](CCO)N(C)Cc1c(O)cccc1Br 862402516 OOPURCZRBXVFNR-VIFPVBQESA-N 288.185 2.357 10 20 CECD Oc1cc2c(cc1CN(CC1CC1)CC1CC1)[C@@H](O)CO2 768448768 WKZNIDRAQKINMG-INIZCTEOSA-N 289.375 2.440 10 20 CECD Cc1ccc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(O)c1 877567216 VLLJEXCALIVTJP-WMHQRMGPSA-N 257.333 2.086 10 20 CECD CCN(Cc1ccc(C)cc1O)[C@H](C)CS(=O)(=O)CC 876734876 AZQJHSKGZVZMMD-CYBMUJFWSA-N 299.436 2.346 10 20 CECD CCn1nccc1NC(=O)N[C@H](C)c1ccccc1O 879110201 PIHUVJHYTMNUAR-SNVBAGLBSA-N 274.324 2.491 10 20 CECD Cc1cccc(O)c1CN(CCN(C)C)C[C@H]1CCCO1 877525238 WESBRJDYBFODNN-OAHLLOKOSA-N 292.423 2.243 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCNc1ccccc1 779519504 OVZGMTVDSDXDTE-CLFYSBASSA-N 298.342 2.339 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C)C[C@H]2C(N)=O)cc1 773844577 GRGPQXPEFBYXQR-BBRMVZONSA-N 289.423 2.229 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)N(C)C[C@H]2C)c1O 894487278 HTUSTQLWBBVADF-QWHCGFSZSA-N 278.396 2.234 10 20 CECD COc1cc(C)cc(CN[C@@H](C)[C@H](C)OC)c1O 894534390 ZSVRAGJLHUOGCA-QWRGUYRKSA-N 253.342 2.222 10 20 CECD COc1ccc(CNC(=O)NC(C2CC2)C2CC2)c(O)c1 792791703 KHDOJYOWNOICQS-UHFFFAOYSA-N 290.363 2.389 10 20 CECD CC[C@H](NCCN1CCO[C@@H](C)C1)c1ccc(F)cc1O 796747616 TUHYWMSQFZITAS-WFASDCNBSA-N 296.386 2.293 10 20 CECD CC[C@H](C(=O)NCc1ccc(N2CCCC2)cc1)[C@H](C)O 791207420 AKRNABVGPRZSGJ-BBRMVZONSA-N 290.407 2.310 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CC[C@H](C)C2)c(O)c1 794390973 RZQKCHYGTIAGGX-WDEREUQCSA-N 263.337 2.453 10 20 CECD Cc1nnsc1CNCc1cc(F)cc(F)c1O 708502423 LMKWBTOSELNGBB-UHFFFAOYSA-N 271.292 2.120 10 20 CECD COc1cccc(O)c1CNC[C@H](OC)C(C)C 744448895 NYTCPWJIMSSWER-AWEZNQCLSA-N 253.342 2.161 10 20 CECD C[C@H]1CCN(CCNCc2cc(Cl)ccc2O)C1 744449704 CBAYBZWDXCCAKZ-NSHDSACASA-N 268.788 2.477 10 20 CECD CN(C)C(=O)OCCOc1ccc(N2CCCC2)cc1 1255642155 ZKBFXZSLXBGKRW-UHFFFAOYSA-N 278.352 2.364 10 20 CECD CCN(CC)CC[C@H](C)NC(=O)c1cc(O)cs1 1348863802 DCHOUGRETCSIEC-JTQLQIEISA-N 270.398 2.304 10 20 CECD CCC[C@@H](C)S(=O)(=O)NCc1cc(C)ccc1O 1348157159 PLOGJWFUAARTFQ-LLVKDONJSA-N 271.382 2.309 10 20 CECD Cc1nc(CC(=O)NCc2cccc(O)c2O)c(C)s1 1349077825 DOUKZAFUHIGHBJ-UHFFFAOYSA-N 292.360 2.030 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CC[C@H](C2CC2)C1 1350471647 ZNPJBWNEWJLJOQ-JTQLQIEISA-N 290.392 2.486 10 20 CECD COc1cc(O)c(CN2CCC[C@H]2C(C)(C)O)cc1OC 154419596 IUDRXFYHFCUNIM-HNNXBMFYSA-N 295.379 2.145 10 20 CECD CCOC[C@@H](O)CN(c1ccc(OC)c(F)c1)C(C)C 156767711 WRORJQDIDACQAS-ZDUSSCGKSA-N 285.359 2.447 10 20 CECD CS[C@H]1CC[C@@H](NC(=O)c2cccc(O)c2O)C1 229412875 MXWKXWUKBGCNCJ-BDAKNGLRSA-N 267.350 2.112 10 20 CECD C[C@H](NCC1CC2(C1)OCCO2)c1ccccc1O 927003987 PTOVSWFMZJFEMJ-NSHDSACASA-N 263.337 2.196 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccccn1 53251052 REYJDGMOEPIVKL-UHFFFAOYSA-N 298.390 2.489 10 20 CECD Cc1nn(C)cc1CCC(=O)N(C)Cc1ccccc1O 115710045 SAOCXNRUOUKZMR-UHFFFAOYSA-N 287.363 2.025 10 20 CECD CCN1CCCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 104136582 WPELUGFCSZMHTF-MRXNPFEDSA-N 289.423 2.243 10 20 CECD CC[C@H](C)NC(=O)CN(C)c1ccc(OC)c(OC)c1 63616809 PCKTUMUXHQKBCS-NSHDSACASA-N 280.368 2.055 10 20 CECD CC(C)C[C@@H]1COCCN1Cc1cc2c(cc1O)OCO2 113924298 FIKMXSUPCWRFES-CYBMUJFWSA-N 293.363 2.368 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCO1 20208541 IEBBKHYDBSJTRF-WMLDXEAASA-N 290.407 2.180 10 20 CECD Cc1cc(C(=O)NCC(F)F)c(C)n1-c1ccccn1 174539425 JMQYKZKRDJUBGK-UHFFFAOYSA-N 279.290 2.484 10 20 CECD CN(Cc1ccccc1O)C(=O)CC1(O)CCCC1 304268353 WACXOCNZLABVOL-UHFFFAOYSA-N 263.337 2.046 10 20 CECD Oc1ccccc1CN1CCOCC2(CCOCC2)C1 183268476 PLSJOIXVLIDQSR-UHFFFAOYSA-N 277.364 2.021 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2=COCCO2)cc1 193749083 QYHKFPNWHDKLKW-UHFFFAOYSA-N 290.363 2.037 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)N(C)Cc1ccccc1O 171937411 YDLASLMHDCAUCL-NEPJUHHUSA-N 264.369 2.127 10 20 CECD CC[C@@H]1C[C@H](CC(=O)NCc2ccc(O)c(O)c2)CCO1 272882222 VOVZODLKLRJACO-DGCLKSJQSA-N 293.363 2.309 10 20 CECD Nc1ccc(NC(=O)[C@H]2CCCN2Cc2ccccn2)cc1 361734464 QVVKNNPXHOADCM-MRXNPFEDSA-N 296.374 2.267 10 20 CECD C[C@@H](NC[C@@H](O)C1CCOCC1)c1cc(Cl)ccc1O 273480127 LWPRGSSUKXYJCD-MEBBXXQBSA-N 299.798 2.484 10 20 CECD CC[C@@H](N[C@@H](C)c1ncn(C)n1)c1ccc(F)cc1O 287375835 HZGHJHJULFOYJD-JOYOIKCWSA-N 278.331 2.462 10 20 CECD CC[C@H](NCC1(O)CCN(C)CC1)c1ccc(C)cc1O 280251887 WRZAARAPKMJSPD-HNNXBMFYSA-N 292.423 2.198 10 20 CECD CN(C)c1ccc(CN[C@H]2COc3ccccc3[C@@H]2O)cc1 288644694 UQTXRLBTSWFMGR-WMZOPIPTSA-N 298.386 2.337 10 20 CECD COCCc1ccnc(NC(=O)c2cc(O)cs2)c1 807688436 KCTGUBNPRCUKQQ-UHFFFAOYSA-N 278.333 2.290 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](CO)C(C)C)c1 806168901 DWQAJQSXXOUADN-AAEUAGOBSA-N 295.379 2.094 10 20 CECD COc1cccc(O)c1CN1CC(O)(c2ccccc2)C1 811508723 FOSYHEUPXAZWRM-UHFFFAOYSA-N 285.343 2.104 10 20 CECD COc1ccc(N(C)C[C@@H]2CCNC(=O)CC2)cc1OC 827492739 YOMXYERFMIBCSU-LBPRGKRZSA-N 292.379 2.056 10 20 CECD C[C@@H]1C[C@H](O)CN(Cc2cc(Cl)cc(F)c2O)C1 825316040 JHAADFNKKPCWMR-KCJUWKMLSA-N 273.735 2.387 10 20 CECD Cc1cc(O)c(CN2CC(=O)N(C)C[C@@H]2C)cc1Cl 825628586 AYZXHOZZUQQLIL-JTQLQIEISA-N 282.771 2.017 10 20 CECD COc1cccc(CNC(=O)[C@@H](C)OCC(C)C)c1O 729859678 VRFNHAOHUKSDGB-LLVKDONJSA-N 281.352 2.078 10 20 CECD CCc1cccc(CN(CCOCCO)C2CCC2)c1O 827203971 IZLIKDZGTUXFJC-UHFFFAOYSA-N 293.407 2.318 10 20 CECD Cc1ccc(N(C)C(=O)/C=C\c2cccnc2)nc1 493234675 ZWFHKVNQEKTCAI-VURMDHGXSA-N 253.305 2.461 10 20 CECD CCOc1ccc(CN[C@H]2C[C@@H](OCC)C2)c(O)c1 839147564 NDJJLWKELZCBBN-XBXGTLAGSA-N 265.353 2.448 10 20 CECD O=C(O)C[C@H](NC(=O)c1cc(O)cs1)c1cccs1 739627100 HGLPAYLAOSWIJX-QMMMGPOBSA-N 297.357 2.461 10 20 CECD COc1cccc(CNC(=O)[C@H](C)C2CCC2)c1O 837485781 QVTQZLYYUIHASY-SNVBAGLBSA-N 263.337 2.453 10 20 CECD CCOc1ccc(CNCCC[C@@H]2CCCN2)c(O)c1 841073792 YNDSEMREAACRRW-CQSZACIVSA-N 278.396 2.413 10 20 CECD Cc1nc(CN(C)c2ccc(OCC(=O)O)cc2)oc1C 846279785 KYCOZDFXPQPOGP-UHFFFAOYSA-N 290.319 2.391 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)C(=O)O)cc1 842519706 QARLELYZNPCGFU-GFCCVEGCSA-N 292.379 2.212 10 20 CECD C[C@]1(CN)CCN(Cc2c(O)ccc(Cl)c2F)C1 843116544 ZGQKYXRXSSMKFP-CYBMUJFWSA-N 272.751 2.355 10 20 CECD CCOc1ccc(CN[C@@H](C)c2csnn2)c(O)c1 840969627 FVPZJMWAMRTRPR-VIFPVBQESA-N 279.365 2.493 10 20 CECD C[C@@H]1CN(C(=O)/C=C\c2cn(C)cn2)c2ccccc2O1 932549029 IECWVDVEIBOAPR-QDZRJHCZSA-N 283.331 2.247 10 20 CECD CO[C@@]1(CN[C@H](C)c2ccc(C)c(C)c2O)CCOC1 763573560 SVTGFMIJMXBODD-CZUORRHYSA-N 279.380 2.465 10 20 CECD CCCn1cc(CN(C)c2ccc(OC)c(F)c2)nn1 877181168 IVFXHRZNRFUJJZ-UHFFFAOYSA-N 278.331 2.472 10 20 CECD O=C(NCCCSc1nccs1)N1CC=CC1 875374395 JUQJXAKTYBHRDF-UHFFFAOYSA-N 269.395 2.207 10 20 CECD C[C@H](NCc1cc(=O)n2ccccc2n1)c1ccccc1O 775130650 NPBPFTHKUUMYJL-LBPRGKRZSA-N 295.342 2.251 10 20 CECD C[C@@H]1[C@@H](C)[S@](=O)CCN1Cc1cccc(Cl)c1O 775712683 BEMMAHJYFQOSHR-CLFVBBPSSA-N 287.812 2.387 10 20 CECD CSCC[C@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 779519110 NUFKUGOEJHRYKD-RWCYGVJQSA-N 281.377 2.369 10 20 CECD CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@@H](C)[S@@]1=O 877519688 ZLLGIPMCTITWMW-VPZZIHKRSA-N 281.421 2.432 10 20 CECD CC[C@H](Nc1cnn(CCO)c1)c1ccccc1O 775541194 SGLYEGDDNRKEPM-ZDUSSCGKSA-N 261.325 2.144 10 20 CECD C[C@@H](Nc1ccc(C(=O)O)nn1)c1ccccc1O 1599842112 FTHAWTZNNQHGKO-MRVPVSSYSA-N 259.265 2.054 10 20 CECD CCOc1cccc(CNC[C@H]2CC[C@@H](C)O2)c1O 398072107 AHCCKYQYRVNMKM-DGCLKSJQSA-N 265.353 2.448 10 20 CECD O=S(=O)(NCc1ccccc1O)c1c(F)cccc1F 751150471 GFMKKTKFRVOUPZ-UHFFFAOYSA-N 299.298 2.149 10 20 CECD COc1ccc(CNC[C@H]2CC[C@@H](NC(C)=O)C2)cc1C 994567184 CBYRURCADOOZJI-JKSUJKDBSA-N 290.407 2.398 10 20 CECD CC[C@H](NCc1ccc(N2CCCC2)cc1)C(=O)O 1329425789 AUIDFAXCEMRTOV-AWEZNQCLSA-N 262.353 2.240 10 20 CECD CCCOc1ccccc1NC[C@H](O)COCC 819399998 ZQDNKMTTXAGVQN-LBPRGKRZSA-N 253.342 2.285 10 20 CECD Cc1ccc(CN2CCSC[C@@H]2CC(=O)O)c(O)c1 1600414287 KNZXLQXJXGIAMZ-LBPRGKRZSA-N 281.377 2.093 10 20 CECD Cc1cccc(CN[C@@H](C(=O)O)c2cccc(O)c2)c1O 1610522089 QEHNWVNQEXSAPK-CQSZACIVSA-N 287.315 2.322 10 20 CECD Cc1noc(C)c1CNCc1cc(F)ccc1O 226586403 UDIVMQVNYXLROJ-UHFFFAOYSA-N 250.273 2.426 10 20 CECD COc1ccc(CN[C@@H]2[C@@H](C)CCN[C@@H]2C)cc1C 1579216535 ZBBYDNURADNJRI-NORZTCDRSA-N 262.397 2.480 10 20 CECD COc1cc(Cl)cc(CN(C)CC(C)(C)CN)c1O 229104385 MDAJUURFWBPAJF-UHFFFAOYSA-N 286.803 2.471 10 20 CECD CCOCc1cc(CNC[C@H](C)CC(=O)O)ccc1OC 1776909041 AOIYDOOKXCOYCW-GFCCVEGCSA-N 295.379 2.432 10 20 CECD CCCOc1ccc(CNC[C@](C)(O)CC(=O)O)cc1C 1776820773 QVLYYGROBKVUBY-MRXNPFEDSA-N 295.379 2.099 10 20 CECD Cn1ccc(CCNCc2ccc3c(c2)CCCO3)n1 921997744 LHVOXMTUUJEQHB-UHFFFAOYSA-N 271.364 2.077 10 20 CECD CC[C@H](N[C@@H]1CCCCNC1=O)c1ccccc1O 36976945 RSUDVEGYJVJYAW-QWHCGFSZSA-N 262.353 2.102 10 20 CECD Cc1cccc(CN2CC[S@](=O)C(C)(C)CC2)c1O 322110873 LHBRRDCJNXVMMV-IBGZPJMESA-N 281.421 2.434 10 20 CECD Oc1cccc(Br)c1CNCCN1CCCC1 706851951 AYOIHGUUCJETTH-UHFFFAOYSA-N 299.212 2.340 10 20 CECD CN(Cc1ccccc1O)c1ncc(C(=O)O)s1 1777076923 SQZUBBGHMFXRQX-UHFFFAOYSA-N 264.306 2.183 10 20 CECD COc1ccc(O)c(CNC(=O)c2cnc(C)s2)c1 172042643 VNKKXSHCIOEMOH-UHFFFAOYSA-N 278.333 2.096 10 20 CECD COC(=O)C[C@H]1CSCCN1Cc1cccc(C)c1O 180401397 XSIYZSLYRQTKSZ-ZDUSSCGKSA-N 295.404 2.181 10 20 CECD CCOc1ccc(O)c(CNC[C@](C)(O)C(C)C)c1 304081449 YQFQZTDLSYEBTD-HNNXBMFYSA-N 267.369 2.288 10 20 CECD CC[C@@H](O)CCN[C@@H](C)c1ccc(F)c(F)c1O 187762176 BDOQAQKOLXGGRJ-DTWKUNHWSA-N 259.296 2.482 10 20 CECD C[C@@H]1C[C@H](CN)CN1Cc1cc(Cl)ccc1O 216020678 MLSJHRBHVAZBOQ-NXEZZACHSA-N 254.761 2.215 10 20 CECD CN(CCC1CC1)CC(=O)NCc1ccc(N(C)C)cc1 135303254 AZRBZNRWFUBLCO-UHFFFAOYSA-N 289.423 2.101 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccccn1 180885823 WVKMUTOEOSYBAC-IOCXFXADSA-N 284.315 2.383 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)COC(C)(C)C)c1 182345247 AYHRWUDUVDUGEL-SNVBAGLBSA-N 281.352 2.393 10 20 CECD CN(C)c1ccc(CNc2cccnc2-n2cncn2)cc1 194375804 OMSLAHLHRNSHJI-UHFFFAOYSA-N 294.362 2.340 10 20 CECD CC(C)Oc1ccc(N(C)CC(=O)NC2CC2)cc1 191579855 IPXZOOQAANUOIQ-UHFFFAOYSA-N 262.353 2.189 10 20 CECD CC(C)[C@@H](CO)N[C@@H](C)c1ccc(N(C)C)cc1 92392236 FYXLKMDFVPOYII-SWLSCSKDSA-N 250.386 2.420 10 20 CECD Cc1nnc(CC(=O)NCc2c(C)c3ccccc3n2C)o1 348702552 TZECZKDQTBLUFB-UHFFFAOYSA-N 298.346 2.037 10 20 CECD Cc1nnccc1C(=O)N(C)Cc1ccc(N(C)C)cc1 269858838 IUNHHNVOVFCHHF-UHFFFAOYSA-N 284.363 2.123 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 266189858 YDSFSJJJVOPHJC-YPMHNXCESA-N 266.360 2.406 10 20 CECD CN(Cc1ccccc1O)C(=O)CCc1ccc(O)nc1 279828055 KLONUXINOPGLHT-UHFFFAOYSA-N 286.331 2.084 10 20 CECD O=C1CN(C2CC2)C(=O)N1Cc1ccc(N2CCCC2)cc1 272253758 LLUVHFRXGXZHAA-UHFFFAOYSA-N 299.374 2.213 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCCOC(F)F 802438321 FVFNZBJSWJQHGN-UHFFFAOYSA-N 288.294 2.163 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](C)CCCCO)c1 296337238 HQMVZVWORSXQMH-NEPJUHHUSA-N 295.379 2.381 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CC(CC(F)F)C1 819731536 SCYBZPNMOBPBGF-DUXPYHPUSA-N 283.274 2.225 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccoc1 588408076 IYKPDRFVCSZVQW-RQOWECAXSA-N 259.261 2.020 10 20 CECD c1cc2c(cc1CN[C@H]1CC13CCNCC3)CCCO2 904354857 JWUPMGCEUFBMEO-INIZCTEOSA-N 272.392 2.243 10 20 CECD COc1ccnc(COC(=O)c2ccc(C)c(O)c2O)c1 730303329 ONLKDZHYTSYESQ-UHFFFAOYSA-N 289.287 2.167 10 20 CECD COc1ncc(/C=C/C(=O)N2CCc3ccccc32)cn1 492651903 SOQVPSGZWJQMRO-VOTSOKGWSA-N 281.315 2.088 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1 839468221 SUSROVHLTPGSDR-UHFFFAOYSA-N 284.363 2.123 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CC2(CC2)C1 831923991 BDLOQANYVJGWFD-JTQLQIEISA-N 275.348 2.335 10 20 CECD CC[C@H](NC(=O)c1cc(O)cs1)C1CCOCC1 746409851 PGRAXECRVYRFCS-NSHDSACASA-N 269.366 2.389 10 20 CECD CCC[C@H]1CNCCN1Cc1cc(OCC)ccc1O 843058656 ZOSYJVMRTSRCBG-AWEZNQCLSA-N 278.396 2.365 10 20 CECD C[C@H]1C[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CO1 842773553 APGMVHADYVVJAF-OIBJUYFYSA-N 286.715 2.221 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CS[C@H](C)C2)c1 840297140 FYURVIHUBMHNKV-MWLCHTKSSA-N 296.392 2.094 10 20 CECD CC1(C)NCC[C@H]1NCc1cccc(Cl)c1O 841086533 OLJXHZKOUAQBCQ-LLVKDONJSA-N 254.761 2.276 10 20 CECD CC[C@H](C(=O)NCCCSc1nccs1)[C@H](C)O 842232964 XNIMVAYBALZFBX-UWVGGRQHSA-N 288.438 2.149 10 20 CECD Cc1cc(CN2CCC[C@H]2C(=O)O)ccc1N(C)C 846229615 VZXNYXDZEHDWFH-AWEZNQCLSA-N 262.353 2.110 10 20 CECD Cc1cc(Br)c(O)c(CNC[C@H](C)CN)c1 841049519 SYKUUOLVXUEVRJ-SECBINFHSA-N 287.201 2.148 10 20 CECD CN(C)c1ccc(CN2CC[C@H]3NCC[C@@H]3C2)cc1F 843128905 YYBLETVZXCMMJT-UKRRQHHQSA-N 277.387 2.076 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)C[C@H]2C=CCC2)cc1 846663218 FLMUAXFLGOJJOF-BBRMVZONSA-N 287.407 2.225 10 20 CECD CCn1ccc(CN[C@@H](C)c2cccc(OC)c2O)n1 846169179 PTZIYOZYMGULKC-NSHDSACASA-N 275.352 2.468 10 20 CECD CCc1cccc(CN2CC[C@H](C)[S@@](=O)CC2)c1O 848905682 LFHNILJNSCQYHG-BUXKBTBVSA-N 281.421 2.298 10 20 CECD COc1ccc(N(C)CCN(C)CCC[C@@H](C)O)cc1 844402981 YPYKBVSWOSJFMQ-CQSZACIVSA-N 280.412 2.224 10 20 CECD CCOC(=O)c1cnc(SCCCOC(C)=O)s1 853554892 PDTWADFTFRMVAR-UHFFFAOYSA-N 289.378 2.365 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC2(O)CCCC2)c1 756574565 NCTRKHRHKCRCPQ-LLVKDONJSA-N 293.363 2.135 10 20 CECD CN(Cc1ccccc1O)C(=O)c1nnc(C(C)(C)C)o1 865903414 BMQOZZWOUNJFRB-UHFFFAOYSA-N 289.335 2.345 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnn(CC3CC3)c2)c1 869410291 JTSRGHPWUCZFAO-UHFFFAOYSA-N 285.347 2.237 10 20 CECD Cc1ccc(O)c(CNC[C@@H](CO)Cc2ccco2)c1 769420679 STUQFBYYNJMGHS-ZDUSSCGKSA-N 275.348 2.234 10 20 CECD Cc1ccc(C(=O)N[C@H](C)CC(F)(F)F)c(O)c1O 768575060 FNVVLMQZSZDRKH-SSDOTTSWSA-N 277.242 2.477 10 20 CECD COc1ccc(N(Cc2cn(C)nn2)C(C)C)cc1F 761677539 ZXDAUEOMYCBXPB-UHFFFAOYSA-N 278.331 2.378 10 20 CECD COc1ccc(O)c(CN[C@H]2Cc3cccc(O)c3C2)c1 763481072 QMSPZPJNNFBWQD-ZDUSSCGKSA-N 285.343 2.363 10 20 CECD CCCOc1ccc(CN[C@@](C)(CO)COC)cc1C 873069246 ABKNVWAIUUQSKF-INIZCTEOSA-N 281.396 2.271 10 20 CECD CC(C)CC[C@@H](N)C(=O)NCc1ccc(N(C)C)c(F)c1 876739060 BWHHLHONAYGLCM-CQSZACIVSA-N 295.402 2.271 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc3cc[nH]c3n2)c1 779382177 ZWLLHLPDPXTLPQ-UHFFFAOYSA-N 297.314 2.207 10 20 CECD Cc1ccc(CN2CCCc3c(cnn3C)C2)c(O)c1 877587452 LTFRLKVCBFUYCR-UHFFFAOYSA-N 271.364 2.383 10 20 CECD C[C@H](NCC(C)(C)N1CCOCC1)c1c(O)cccc1F 886489714 PBVNGRYZKWPWAV-LBPRGKRZSA-N 296.386 2.293 10 20 CECD CCN(C)C(=O)CCN[C@H](C)c1ccc(N(C)C)cc1 775836171 KDLNASXLACMGQS-CYBMUJFWSA-N 277.412 2.272 10 20 CECD C[C@H]1CN(C2CC2)C[C@H]1NCc1cc(F)cc(F)c1O 883039256 IVIGNEBABPVJEX-LKFCYVNXSA-N 282.334 2.243 10 20 CECD Oc1ccccc1CNc1ccc2nnc(C(F)F)n2n1 771179582 LRMNXUUAQDCKFP-UHFFFAOYSA-N 291.261 2.380 10 20 CECD Cc1cncnc1N[C@@H](C)Cc1ccc(O)c(O)c1 882170927 ICJRDCDBKUJMRM-JTQLQIEISA-N 259.309 2.239 10 20 CECD CCC/C=C\C(=O)OCC(=O)c1ccc(O)c(O)c1 782990231 CQGKPAFKWNBSDS-PLNGDYQASA-N 264.277 2.180 10 20 CECD COC(=O)[C@H](CC(F)F)NCc1cc(C)c(C)cc1O 789579159 FCOZGWWLDBJJKE-NSHDSACASA-N 287.306 2.295 10 20 CECD COC(=O)[C@H](C)CN(Cc1cc(F)cc(F)c1O)C1CC1 894422280 IZMOCDANWWKCDC-SECBINFHSA-N 299.317 2.444 10 20 CECD COc1ccc(CNc2cc(C)nc(C)n2)c(O)c1 795284258 JPLUZFMICQWDKY-UHFFFAOYSA-N 259.309 2.420 10 20 CECD CC(C)C[C@@H](CO)NCc1cc(F)cc(F)c1O 708455240 VSFJWSZXHXBDPS-NSHDSACASA-N 259.296 2.167 10 20 CECD C[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccccc1O 777725555 URGYJYUCXKWVKR-AVGNSLFASA-N 297.420 2.399 10 20 CECD Cc1ccc(O)c(CN2CCC(OCCCN)CC2)c1 94069978 BTUDVMQOZQNKPB-UHFFFAOYSA-N 278.396 2.030 10 20 CECD COc1ccc(CN2CC[C@@H](CF)C2)c(O)c1OC 1335551974 ODRDNGDIOFBCMA-JTQLQIEISA-N 269.316 2.201 10 20 CECD O=C(O)c1cccc(CC(=O)N2Cc3cccc(O)c3C2)c1 1602435273 JAZNTVWTCIGKGE-UHFFFAOYSA-N 297.310 2.175 10 20 CECD COCCCCN[C@H](C)c1cc(C(=O)O)ccc1O 1606870617 WJTKRIONDKAHCS-SNVBAGLBSA-N 267.325 2.168 10 20 CECD CC(C)OC(=O)CC[C@@H](C)NC(=O)Cc1ccc(N)cc1 1575940987 GGZVOIQEFGHXIA-GFCCVEGCSA-N 292.379 2.048 10 20 CECD Nc1ccc(NC(=O)c2cccc(Cn3cncn3)c2)cc1 1580449843 WNELZQWPLXQLIN-UHFFFAOYSA-N 293.330 2.161 10 20 CECD CCc1nc(NC(=O)c2cc(O)cs2)sc1C(=O)O 1597682062 PCPHILBKCZKWCO-UHFFFAOYSA-N 298.345 2.423 10 20 CECD CCCOc1ccc(CNC[C@@H](CC(=O)O)OC)cc1C 1776820673 BLIIPCCGHKMZMJ-CQSZACIVSA-N 295.379 2.363 10 20 CECD Cc1cccc(O)c1CNCc1n[nH]cc1Br 877057559 IIDIIVDLFXDPOR-UHFFFAOYSA-N 296.168 2.476 10 20 CECD Cc1cccc(CNC[C@@](C)(O)C(F)(F)F)c1O 271766375 AJCZJWDQZMLJKM-LLVKDONJSA-N 263.259 2.104 10 20 CECD C[C@@H](NCC1([S@](C)=O)CC1)c1ccc(F)cc1O 282315541 NIKIGVWDMILYGB-LZVRBXCZSA-N 271.357 2.093 10 20 CECD C[C@@H](NCCCC(=O)N(C)C)c1ccc(F)cc1O 185194042 UHBGSYKUPQMPJP-SNVBAGLBSA-N 268.332 2.050 10 20 CECD O[C@H]1CCC[C@@H]1NCc1ccc(N2CCCC2)cc1 323813214 ILHVWINAHKZYLB-HOTGVXAUSA-N 260.381 2.290 10 20 CECD COC1(C(=O)NCc2ccccc2O)CCCCC1 692051023 MTRXZHJBLFMYHA-UHFFFAOYSA-N 263.337 2.358 10 20 CECD CC(C)(C)N1CC[C@@H](NCc2cc(F)ccc2O)C1 693857572 VAJGGZVPDLPCLX-CYBMUJFWSA-N 266.360 2.494 10 20 CECD COc1cccc(CN[C@H](C)[C@@H](OC)C2CC2)c1O 388240160 QJRJWVJHONMUFP-MEBBXXQBSA-N 265.353 2.304 10 20 CECD CC(C)[C@@H](CO)CNCc1c(O)cccc1Cl 394088356 OYGMVJXORIUZCB-SNVBAGLBSA-N 257.761 2.400 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ncccc2C)c1 172019628 HLAMYMJUPGBGSH-UHFFFAOYSA-N 287.319 2.426 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccccn2)c1 114512501 XVEROCLDWAEFFH-UHFFFAOYSA-N 273.292 2.118 10 20 CECD CC(C)N(CCS(C)(=O)=O)Cc1ccc(N(C)C)cc1 121626345 FVHMKKRLAUCFJK-UHFFFAOYSA-N 298.452 2.008 10 20 CECD CCCNC(=O)CN[C@H](C)c1cc2c(cc1O)CCCC2 184881886 KGLFZWVBQMHLSE-GFCCVEGCSA-N 290.407 2.448 10 20 CECD CN1C(=O)/C(=C/c2ccc(F)nc2)SC1=S 189420439 QCUXOHYLJASQAG-DAXSKMNVSA-N 254.311 2.052 10 20 CECD C[C@H](N[C@@H]1C=C[C@H](CO)C1)c1ccc(F)c(F)c1O 187764167 YMDIALMQJHKFSC-LPEHRKFASA-N 269.291 2.258 10 20 CECD O=C(NCCC[C@H]1CCCCO1)c1cccc(O)c1O 193163686 ZWQQGNXRUCRVGP-LLVKDONJSA-N 279.336 2.177 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1c(F)cccc1F 97075349 IHUGJYIESFSERA-UHFFFAOYSA-N 293.269 2.349 10 20 CECD Nc1ccc(CCNC(=O)c2noc3c2CCCC3)cc1 237965573 CCWNGPFOVDXGDW-UHFFFAOYSA-N 285.347 2.108 10 20 CECD COCc1ccc(/C=C2\SC(=S)NC2=O)cc1 255774875 PJTQZTMIJZTXHT-POHAHGRESA-N 265.359 2.322 10 20 CECD Cc1ncoc1C(=O)N1CCOc2cc(N(C)C)ccc21 354754471 WQUHKIBWZGQTST-UHFFFAOYSA-N 287.319 2.088 10 20 CECD CC[C@@H](N[C@H](CCO)COC)c1ccc(N(C)C)cc1 269048538 WYAHFYQIAKKAJD-GDBMZVCRSA-N 280.412 2.191 10 20 CECD CC(F)(F)CCNCc1cc([N+](=O)[O-])ccc1O 296198556 ZAROEWPXEWCAGI-UHFFFAOYSA-N 260.240 2.435 10 20 CECD O=C(O)/C=C/c1ccc(N2CC[C@@H]3C[C@H]32)c([N+](=O)[O-])c1 706901875 PJKSOAVLKPFWMM-DHAXOIOKSA-N 274.276 2.291 10 20 CECD CC(C)(C)n1ncnc1CNCc1ccc2c(c1)CCO2 800293752 JUMZFTWVSPDHMB-UHFFFAOYSA-N 286.379 2.258 10 20 CECD CCOc1ccc(O)c(CNC[C@@]2(O)CCC[C@@H]2C)c1 293001622 NBNXEQPXOYDBPE-LRDDRELGSA-N 279.380 2.432 10 20 CECD COCC1(COC(=O)/C=C/c2ccc(O)c(O)c2)CCC1 812589499 LWCHBJBKWGPCIT-GQCTYLIASA-N 292.331 2.471 10 20 CECD CCOc1ccc(CNCCc2nccnc2C)c(O)c1 815153882 GFTFRKWEGLHEDB-UHFFFAOYSA-N 287.363 2.222 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(C=O)n1C 822265345 NQMFTUYJYAQWQZ-UHFFFAOYSA-N 299.374 2.176 10 20 CECD CC[C@H](C)[C@H](NC(C)=O)C(=O)N[C@H](C)c1ccccc1O 827946521 KUUPHSKBNMSEGE-RWSFTLGLSA-N 292.379 2.120 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C1(CO)CC1 827903480 IHQKMOBXOMFZCO-UHFFFAOYSA-N 259.708 2.141 10 20 CECD C[C@@H](NC[C@@H]1CCN1C)c1cc(F)cc(F)c1O 903319429 ZFEUBZNZJCAFFE-SCZZXKLOSA-N 256.296 2.025 10 20 CECD Cc1ccc(C(=O)NC(C)(C)CN2CCCC2)c(O)c1O 837173406 ZVFUBMRZEYXORR-UHFFFAOYSA-N 292.379 2.010 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H](c2cc[nH]n2)C1 732278110 XVEJMHJHAWFSNU-VIFPVBQESA-N 277.349 2.197 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C)c2ccn(C)n2)c1O 839195741 GOBPVSOEHDXBPD-VIFPVBQESA-N 291.326 2.318 10 20 CECD COCC1(CNCc2ccc(OC)c(C)c2)CCNCC1 841067509 BFZDIICFKKLVKJ-UHFFFAOYSA-N 292.423 2.109 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1n[nH]c2c1CCC2 846473254 SHDCCEHDCJFRAE-UHFFFAOYSA-N 291.738 2.187 10 20 CECD Nc1ccc(CCNC(=O)NCCc2cccs2)cc1 841506350 UHMGLHWYLQBZMB-UHFFFAOYSA-N 289.404 2.415 10 20 CECD Cc1cc(O)c([C@@H]2NC3(CCCC3)C(=O)N2C)cc1C 742439530 MMFZXMWRVQXLOQ-CQSZACIVSA-N 274.364 2.382 10 20 CECD NC[C@H]1CCCC[C@H]1NCc1cc(F)ccc1O 841031325 ROTYXBNHUPSCTB-ZWNOBZJWSA-N 252.333 2.138 10 20 CECD CCc1cccc(CN2CCO[C@@H]([C@H]3CCCO3)C2)c1O 848891224 XMBITURHDSYJQO-HZPDHXFCSA-N 291.391 2.334 10 20 CECD CN1C(=O)C2(CCCC2)N[C@@H]1c1cc(Cl)ccc1O 742441771 HPFRDSOPMUBSPF-LBPRGKRZSA-N 280.755 2.419 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](C)NC[C@H]1C 843119901 LZHMNELCAFSCSQ-UONOGXRCSA-N 261.413 2.243 10 20 CECD CCN(CC(=O)NC(C)C)c1ccc(OC)c(OC)c1 921061152 QGOQQLXMABSCSP-UHFFFAOYSA-N 280.368 2.055 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1cc(C)ccc1O 756731956 DTKNRUWXINVLMI-QWHCGFSZSA-N 267.369 2.403 10 20 CECD COc1ccc(CNCC[C@H](C)N(C)C)cc1C 697874465 YXQPQRGGFXZYFR-ZDUSSCGKSA-N 250.386 2.433 10 20 CECD C[C@H]1C[C@H](N[C@@H]2CCNC2)c2c(O)ccc(F)c21 863545939 BSKMDTSUETVQDL-NGZCFLSTSA-N 250.317 2.031 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C1Cc2ccccc2C1 762097233 CEGINQUMHPWDPH-UHFFFAOYSA-N 283.327 2.129 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](C)C(=O)OC(C)(C)C)c1 862754755 JAMGZQGAFCWALN-NSHDSACASA-N 293.363 2.295 10 20 CECD CNC(=O)CC1CCN(Cc2c(C)cccc2O)CC1 876759563 NFNHSFIFXKNWKR-UHFFFAOYSA-N 276.380 2.049 10 20 CECD CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@H](C)[S@]1=O 877517406 NQGZCDWXDMSTPB-BBEJJTJUSA-N 281.421 2.432 10 20 CECD C[C@@H](NC(=O)C1(N(C)C)CCC1)c1ccc(N(C)C)cc1 775412595 ZPYCVNFLFBGJSI-CYBMUJFWSA-N 289.423 2.414 10 20 CECD CCc1nnc(CNCc2ccc(C)cc2O)s1 877541408 OIBYIJUWGMNXEY-UHFFFAOYSA-N 263.366 2.404 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(C)cc2O)[C@H]1C 877466971 UTBPCVCZWGPUJW-WCQYABFASA-N 263.337 2.084 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccnn1CC1CC1 779535702 YFEDNERTPAHTLG-GQCTYLIASA-N 299.330 2.356 10 20 CECD O=C1OCC[C@@]12CCCN2Cc1cc(Cl)cc(F)c1O 779198904 PHXKZNJEUZEVCW-AWEZNQCLSA-N 299.729 2.466 10 20 CECD CC(C)(C)c1n[nH]c(CNCc2cc(F)cc(F)c2O)n1 883143991 BFKKGWRVJJVQOP-UHFFFAOYSA-N 296.321 2.376 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)CO1 784441303 DSBLHVWCISLOGP-WCQYABFASA-N 289.375 2.312 10 20 CECD C[C@H](Cc1cccnc1)NC(=O)NCc1ccccc1O 892527600 SIFLXBRQGBJZOE-GFCCVEGCSA-N 285.347 2.218 10 20 CECD CC(C)(O)CCC(=O)NCc1c(O)ccc2c1CCCC2 787451664 XTQRNYWYDVMXAO-UHFFFAOYSA-N 291.391 2.438 10 20 CECD CCOc1cccc(CN2C[C@@H](C)S(=O)[C@H](C)C2)c1O 792191866 CZDIVCHJFPWOAH-VXGBXAGGSA-N 297.420 2.132 10 20 CECD COc1cc(C)cc(CNCc2c(C)nn(C)c2C)c1O 894221789 WZHCFRYDRZTOJW-UHFFFAOYSA-N 289.379 2.349 10 20 CECD Cc1nccc(N2CC=C(CCNC(=O)C(C)C)CC2)n1 1089807016 DPAICASECZVXSA-UHFFFAOYSA-N 288.395 2.084 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H]2CCCO2)c(O)c1 40906048 KVIHTKYZBCPCHP-HZMBPMFUSA-N 251.326 2.058 10 20 CECD CC(C)CNCC(=O)NCc1c(O)ccc2c1CCCC2 1326340309 ZHMGDKBAHSIKPB-UHFFFAOYSA-N 290.407 2.133 10 20 CECD CN(Cc1cnc(Cl)cn1)Cc1ccccc1O 788493995 LSAKJSVCAGVFJL-UHFFFAOYSA-N 263.728 2.468 10 20 CECD Cc1cnc(CSc2ncc(C(=O)O)s2)nc1 1600622806 VFVCVFGGKXEVFD-UHFFFAOYSA-N 267.335 2.232 10 20 CECD C[C@H](N[C@H](C)c1csnn1)c1cc(C(=O)O)ccc1O 1593199701 YPUNRSBLCNQCLQ-JGVFFNPUSA-N 293.348 2.354 10 20 CECD CN(C)c1cc(F)c(CNCC2CC(C(=O)O)C2)cc1F 1777038182 UDNXBKNHTBSTMU-UHFFFAOYSA-N 298.333 2.231 10 20 CECD CCC[C@](C)(O)C(=O)NCc1c(O)ccc2c1CCCC2 159757620 DTPDSUKFBLDWBD-KRWDZBQOSA-N 291.391 2.438 10 20 CECD CCS(=O)(=O)CCN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 230660573 VRDYBWGYNGEUEW-VXGBXAGGSA-N 297.420 2.273 10 20 CECD COc1ccc(NCc2cc3c(cc2O)OCO3)cn1 42879009 YMMCOIMQNILFSA-UHFFFAOYSA-N 274.276 2.137 10 20 CECD CN1CCC[C@@H](CN(C)Cc2cc(F)ccc2O)C1 179938736 QBDLKILEQXGTSS-GFCCVEGCSA-N 266.360 2.305 10 20 CECD Oc1cccc(Br)c1CNCCn1cccn1 706809040 JGCWMECBDQRLJY-UHFFFAOYSA-N 296.168 2.141 10 20 CECD C[C@@H]1CC(NC(=O)Nc2ccc(N)cc2)C[C@@H](C)O1 694775849 WPJKZZYGNIKBCZ-NXEZZACHSA-N 263.341 2.346 10 20 CECD C[C@@H](N[C@H](CO)CC(F)(F)F)c1ccccc1O 717816829 BKWWDRVYHNGXAW-BDAKNGLRSA-N 263.259 2.356 10 20 CECD COc1ccc(O)c(CNC(=O)NCc2ccccc2)c1 114512536 UIOBMXMTNQDHGR-UHFFFAOYSA-N 286.331 2.400 10 20 CECD CN(CC(=O)N(C)Cc1ccco1)Cc1ccccc1O 114721360 XGNJMUZSNKSWTM-UHFFFAOYSA-N 288.347 2.076 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](N)C(C)C)cc1 178712319 WJZGMCDUYQKUNI-HNNXBMFYSA-N 277.412 2.132 10 20 CECD COc1cccc(CNC(=O)CCC(C)C)c1O 68489281 QKMMADFTBPLVFL-UHFFFAOYSA-N 251.326 2.453 10 20 CECD Cc1cncc(N(C)Cc2ccc(N3CCOCC3)cc2)n1 302233732 TVMBTIOKCSEASE-UHFFFAOYSA-N 298.390 2.258 10 20 CECD Oc1ccc(F)cc1CN1CCOC[C@@H]1C1CC1 180196730 QDRIIKIVABFROW-CYBMUJFWSA-N 251.301 2.142 10 20 CECD CSCCCCC(=O)NCc1ccc(O)c(O)c1 182540775 USGVJTYTOMGXEK-UHFFFAOYSA-N 269.366 2.247 10 20 CECD Cc1noc2ncnc(N(C)Cc3ccccc3O)c12 192514498 OBPJBRNMNYIQDY-UHFFFAOYSA-N 270.292 2.268 10 20 CECD CCCOc1ccc(CNc2nc3ncccn3n2)c(O)c1 195037314 LTFRUQGTRFLKSU-UHFFFAOYSA-N 299.334 2.231 10 20 CECD C[C@@H](N[C@H]1CCCC[C@@H]1O)c1cc(F)ccc1O 94618082 ONYUDSCKYKSCNW-LQJRIPTKSA-N 253.317 2.485 10 20 CECD C[C@H](N[C@H]1CCCC[C@@H]1O)c1cc(F)ccc1O 94618081 ONYUDSCKYKSCNW-WFBYXXMGSA-N 253.317 2.485 10 20 CECD CN(c1ccc(CNC(=O)CN)cc1)C1CCCCC1 237053933 RCFNDIHTNAOEIE-UHFFFAOYSA-N 275.396 2.030 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccn(C)c2)c1 273612094 WFOLUGQYRBELQM-NSHDSACASA-N 288.347 2.368 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2c2ncon2)cc1 371375014 SXVSFESBVIHCET-AWEZNQCLSA-N 272.352 2.473 10 20 CECD Nc1ccc(NC(=O)[C@H]2CCC[C@@H](C(=O)O)C2)cc1 388880104 HENODYRPCRXEFD-VHSXEESVSA-N 262.309 2.098 10 20 CECD CC[C@@H]1C[C@H]1NC(=O)NCc1ccc(N(C)C)c(F)c1 280859111 BKINLPCSHNLEEW-DGCLKSJQSA-N 279.359 2.489 10 20 CECD Cc1cnn([C@@H]2CCN(Cc3cc(F)ccc3O)C2)c1 290822780 GYWJSNGDVHIWPC-CQSZACIVSA-N 275.327 2.483 10 20 CECD COCC1(CN[C@@H](C)c2cc(F)ccc2O)CCNCC1 817975292 STNNAKCYPJFJDR-LBPRGKRZSA-N 296.386 2.198 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CC[C@H](C2CC2)C1 827562026 HLIXYJLVAOHIRF-VIFPVBQESA-N 265.284 2.109 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1C[C@H]1C1CCC1 823878869 BRBIYOFFPBEOJY-QWHCGFSZSA-N 260.337 2.380 10 20 CECD Oc1cc(Br)ccc1CN1CCC(O)CC1 824522781 RVOGIEKPRGKIBH-UHFFFAOYSA-N 286.169 2.111 10 20 CECD C[C@H]1SCC[C@H]1NC(=O)N(C)Cc1ccccc1O 828532187 SKVUJJRKNAPDAA-ZYHUDNBSSA-N 280.393 2.428 10 20 CECD Cc1cc(O)c(CN[C@@H](C)c2ncn(C)n2)cc1Cl 825621140 JOVKVGKOSNRUIY-VIFPVBQESA-N 280.759 2.333 10 20 CECD CCN(Cc1cc(=O)n2nccc2[nH]1)c1ccc(OC)cc1 731211897 HFFHHIQEAVHHHR-UHFFFAOYSA-N 298.346 2.058 10 20 CECD Cc1cc(C)c([C@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c(O)c1 834906845 HUBFCSXDGVRVTF-RWMBFGLXSA-N 276.380 2.314 10 20 CECD C[C@H](NCC[C@@H](O)C1CC1)c1cc([N+](=O)[O-])ccc1O 903409461 XCSOYEFCWORQQM-TVQRCGJNSA-N 280.324 2.112 10 20 CECD COCCC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 839917433 CWJAVMXQRFCIKH-ZDUSSCGKSA-N 278.396 2.145 10 20 CECD CC(C)CCC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832293209 RHWHRASZXRQMIE-HNNXBMFYSA-N 277.412 2.305 10 20 CECD COc1ccccc1CNC(=O)NCc1ccccc1O 748325110 LFJFVRWVWXWIFQ-UHFFFAOYSA-N 286.331 2.400 10 20 CECD COCCn1cc(CN(C)c2ccc(OC)cc2)cn1 845999714 XZHQPNWJEMIMAD-UHFFFAOYSA-N 275.352 2.175 10 20 CECD O=C(NCc1ccccc1O)C1SCCCS1 841403347 GBNALTRURUPPCY-UHFFFAOYSA-N 269.391 2.205 10 20 CECD O=C(C[C@@H]1CCCOC1)NCc1cc(Cl)ccc1O 846474252 SQKNSALOAKRJDD-JTQLQIEISA-N 283.755 2.479 10 20 CECD CO[C@@H](CNCc1cc2c(cc1O)OCO2)C1CCCC1 850400983 RNNXWZGODNQCHW-INIZCTEOSA-N 293.363 2.416 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H](OC)[C@@H]1CCOC1 851722601 OLILAZLAZUMQLO-PBHICJAKSA-N 291.391 2.499 10 20 CECD C[C@H](NCCOC[C@@H]1CCOC1)c1cc(F)ccc1O 756565202 WUVQCBNLKACSKZ-NWDGAFQWSA-N 283.343 2.235 10 20 CECD CN(C)c1ccc(CNC(=O)Cn2ccnc2C2CC2)cc1 863385429 FDBQQDJJLKFERL-UHFFFAOYSA-N 298.390 2.143 10 20 CECD CC(C)CO[C@H](C)C(=O)N(C)c1ccc(N)cc1 877080446 IYWVXMJBOMBSQI-LLVKDONJSA-N 250.342 2.293 10 20 CECD COc1ccnc(NC(=O)c2cc(O)cs2)c1 761008012 LWPOSADQPDKXBI-UHFFFAOYSA-N 250.279 2.110 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 769381418 OFVKSWACXIMHOA-CYBMUJFWSA-N 279.403 2.418 10 20 CECD CC(=O)c1cc(F)cc(CN2CCN(C)[C@@H](C)[C@H]2C)c1O 771467644 UPKGXCBAHSKFIT-WDEREUQCSA-N 294.370 2.258 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCN(CC(F)F)C1 877593514 BUSOXQSESUZVJW-LLVKDONJSA-N 270.323 2.130 10 20 CECD Cc1ccc(CNC[C@H]2CC[C@H](C(N)=O)CC2)c(O)c1 877595166 UDUYZRYHXPZKJX-JOCQHMNTSA-N 276.380 2.082 10 20 CECD CCC[C@H]1NC(=O)N(CCCSc2nccs2)C1=O 777649480 HJCKZWBDFWKGMD-SECBINFHSA-N 299.421 2.346 10 20 CECD C[C@H](N[C@H](C)[C@H]1CN(C)CCO1)c1ccc(N(C)C)cc1 773072000 MRNNJCUXHWELQO-JJRVBVJISA-N 291.439 2.122 10 20 CECD C[C@H](NC(=O)N1C[C@@H]2C[C@H]2C1)c1ccc(N(C)C)cc1 888830584 WKOWLBOOLAOWQQ-UBHSHLNASA-N 273.380 2.475 10 20 CECD COc1cccc(CN2CCO[C@H]3CCC[C@@H]32)c1O 132770020 YHKJPXVBHSRNLB-STQMWFEESA-N 263.337 2.154 10 20 CECD CCOc1ccc(CN[C@H](CCO)C(F)(F)F)c(O)c1 886371522 NYUHBPFUKXHEOF-GFCCVEGCSA-N 293.285 2.194 10 20 CECD CCOc1ccc(CNCC2(N(C)C)CCC2)c(O)c1 782536149 PDNFDAAMEXGAKM-UHFFFAOYSA-N 278.396 2.365 10 20 CECD COc1ccc(CNC(=O)NC[C@H]2CCCS2)c(O)c1 792991086 BXVBUCVOVQLBHO-GFCCVEGCSA-N 296.392 2.096 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CCN(C(C)C)C2=O)c1 186047790 UQZWSFFMYJVVNK-GXTWGEPZSA-N 276.380 2.361 10 20 CECD C[C@H](CCCNCc1ccc(N(C)C)cc1)C(=O)O 1321907529 RRIIOIXFPYWHPB-GFCCVEGCSA-N 264.369 2.343 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@H]2C[C@@H](O)C2)c1O 703857632 KOHHJGSKWVCMID-GSJFWJNXSA-N 297.782 2.451 10 20 CECD CCCN(CC(=O)NCC(C)C)Cc1ccccc1O 750875181 OMHHJTDIZBZNGY-UHFFFAOYSA-N 278.396 2.376 10 20 CECD O=C(NCc1ccccc1O)NC1(C(F)(F)F)CC1 1333396066 IWMWLCZGPLFAAW-UHFFFAOYSA-N 274.242 2.286 10 20 CECD C[C@H](CCCNCc1cc(F)cc(F)c1O)C(=O)O 1334842289 VISXYUJVTNBTHO-MRVPVSSYSA-N 273.279 2.261 10 20 CECD C[C@@H]1CCSCCN1C(=O)NCc1ccc(N)cc1 1357791310 KETKKGUXJXGARA-LLVKDONJSA-N 279.409 2.306 10 20 CECD CCCN(CC)CCN[C@@H](C)c1cc(C(=O)O)ccc1O 1605312529 KMJSZPGYXMWWMD-LBPRGKRZSA-N 294.395 2.473 10 20 CECD CC1(C(=O)NCc2cccc(O)c2O)C[C@H]2C[C@@H]2C1 1548791493 FGHGMCJUHNEJRW-GHMZBOCLSA-N 261.321 2.150 10 20 CECD CC(C)C[C@@](C)(CN)C(=O)N1Cc2cccc(O)c2C1 1575534764 JWTBJVFDBSTZME-INIZCTEOSA-N 276.380 2.246 10 20 CECD C[C@H](C(=O)O)N(Cc1ccc(F)c(F)c1O)C1CCC1 1589486663 JMRKLKCFXDIFFZ-MRVPVSSYSA-N 285.290 2.498 10 20 CECD CCN(CCN[C@H](C)c1cc(C(=O)O)ccc1O)C(C)C 1596334684 AHJDKHCHPRPDAO-GFCCVEGCSA-N 294.395 2.471 10 20 CECD CC1(C)CNCC[C@H]1NCc1ccc2c(c1)CCCO2 904355221 LRWRFXNWRVZAQQ-MRXNPFEDSA-N 274.408 2.489 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCC[C@H]3OCC[C@H]23)cc1 841298146 MSSQDURMUIOOTQ-MGPQQGTHSA-N 275.352 2.348 10 20 CECD COCC[C@H](C)CNCc1cc(OC)ccc1O 840954202 AOZZDGVWDJFUSM-NSHDSACASA-N 253.342 2.163 10 20 CECD CCOCCOCCN[C@@H](C)c1ccc(F)cc1O 927087291 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CC[C@@H](C)CONC(=O)NCc1cc(OC)ccc1O 813642381 ITRIYQOGDHDAGO-SNVBAGLBSA-N 282.340 2.178 10 20 CECD CCc1cccc(CN2C[C@@H](C)[C@](C)(CO)C2)c1O 827692274 HDBRHZKIJXUARZ-WBMJQRKESA-N 263.381 2.405 10 20 CECD CN(Cc1ccc(S(C)(=O)=O)o1)Cc1ccccc1O 839516940 NTFGKXVXPVWWMK-UHFFFAOYSA-N 295.360 2.021 10 20 CECD CCC(C)(C)OCC(=O)NCc1cccc(OC)c1O 837484956 JRQFNFZJFAKWNH-UHFFFAOYSA-N 281.352 2.222 10 20 CECD CO[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C12CCC2 834555496 YKJLSXXWQVJXNT-KGLIPLIRSA-N 292.335 2.348 10 20 CECD C[C@@H]1C[C@@H](N[C@H](C)c2ccc(N3CCOCC3)cc2)CO1 842674453 PIYADFCZDMCMRO-IIAWOOMASA-N 290.407 2.351 10 20 CECD CC1=C(C(=O)N(C)Cc2ccccc2O)C(=O)OC1(C)C 748564649 SEJKWDBDHNNMDY-UHFFFAOYSA-N 289.331 2.003 10 20 CECD COC1([C@H](C)NC(=O)NCc2ccccc2O)CCC1 840277745 WAVFGCPPIARKMG-NSHDSACASA-N 278.352 2.149 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CCCN2C)c1O 846142205 DFQJEPNWQLGGAU-NWDGAFQWSA-N 264.369 2.146 10 20 CECD Cc1nc(CNC(=O)NCCc2ccc(N)cc2)cs1 841672185 UWBKVEDPILZZRB-UHFFFAOYSA-N 290.392 2.076 10 20 CECD CC1(NC(=S)NCCc2ccc(O)c(O)c2)CCC1 840705302 ZEERROVRGHDPNF-UHFFFAOYSA-N 280.393 2.047 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCc2c[nH]nc2C1 840917846 OHCFTKUJPQQPRR-UHFFFAOYSA-N 270.380 2.342 10 20 CECD COc1cccc(CN[C@@H](C)C[C@@H]2CCOC2)c1O 759836820 KNKHPZKQBHZLJQ-RYUDHWBXSA-N 265.353 2.306 10 20 CECD COc1cc(CN(C)c2ccc(OC)c(OC)c2)on1 851734635 IZXLKFBNXOHPAP-UHFFFAOYSA-N 278.308 2.337 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CCO[C@@H](C)C2)c1 858340803 OGBUEFGGQIQKHV-AAEUAGOBSA-N 278.352 2.067 10 20 CECD COC(=O)[C@H](NCc1cc(F)c(N(C)C)cc1F)C1CC1 862339190 KJPXZDBVYBIZES-CQSZACIVSA-N 298.333 2.072 10 20 CECD CCN(CCN)Cc1cc(Br)cc(C)c1O 863644340 SENULSKGWPIATF-UHFFFAOYSA-N 287.201 2.244 10 20 CECD CN(CC(=O)NCCC(C)(C)C)c1ccc(N)cc1 863557384 NRWHCHHUXFQSBV-UHFFFAOYSA-N 263.385 2.257 10 20 CECD COc1cccc(O)c1CN(C)Cc1nccs1 769468830 PZBXBGHYKWHEFT-UHFFFAOYSA-N 264.350 2.489 10 20 CECD C[C@H](CC(=O)O)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 872859759 SCBBPUVYCZAPOK-RYUDHWBXSA-N 292.379 2.431 10 20 CECD COc1ncc(/C=C/C(=O)N(C)c2ccc(C)cc2)cn1 775828442 YGYMIPOPVHMDOT-RMKNXTFCSA-N 283.331 2.470 10 20 CECD CCc1nn(C)cc1NC(=O)c1cc(O)cs1 774419082 LXDQXXOHLAISIX-UHFFFAOYSA-N 251.311 2.002 10 20 CECD CC[C@H](O)c1cn(Cc2ccc(N(C)CC)cc2)nn1 881314987 KEODWCLBSLUMRF-HNNXBMFYSA-N 274.368 2.226 10 20 CECD CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)C[C@@H](C)O1 891806055 VSTXHFZACINORZ-DGCLKSJQSA-N 295.379 2.409 10 20 CECD CN(C)c1ccc([C@@H](CNCc2ccon2)N(C)C)cc1 898449572 HSSLZTOLWOLXBJ-MRXNPFEDSA-N 288.395 2.133 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)C[C@@H]2CCCO2)cc1Cl 895750191 XXDXXFZQFZSNLU-OLZOCXBDSA-N 299.798 2.374 10 20 CECD COc1ccc(CNC[C@H]2CCOC[C@@H]2C)c(O)c1OC 894419501 GIIFFYMBTLCSCB-NWDGAFQWSA-N 295.379 2.172 10 20 CECD COc1cc(C)cc(CN[C@@]2(C)CCO[C@@H]2C)c1O 894443976 JQQKQKXVXYETFV-ABAIWWIYSA-N 265.353 2.366 10 20 CECD COc1cc(C)cc(CN[C@]2(C)CCO[C@H]2C)c1O 894443979 JQQKQKXVXYETFV-XHDPSFHLSA-N 265.353 2.366 10 20 CECD COc1cccc(CN2CC(C(F)(F)F)C2)c1O 894892333 QSICTIVCONTBBV-UHFFFAOYSA-N 261.243 2.395 10 20 CECD CC[C@]1(CO)CCCN1Cc1cc(C)cc(OC)c1O 894532947 LKVJZWPQBJNAGJ-MRXNPFEDSA-N 279.380 2.446 10 20 CECD CSc1ccccc1C(=O)N1C[C@@H](C)S(=O)[C@H](C)C1 791172239 HSIQSQWVVYCOJX-GHMZBOCLSA-N 297.445 2.390 10 20 CECD Oc1ccccc1CNCc1cccc2c1OCCO2 134235479 HQIYADVXPBZJLV-UHFFFAOYSA-N 271.316 2.453 10 20 CECD Nc1ccc(CN2CC[C@@H](CN3CCCC3)C2)cc1 1352788306 OHBBDSOJIAVFPO-HNNXBMFYSA-N 259.397 2.187 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@H](C)c1cc(C)ccc1O 186029832 ZMOCEMRNESHUQO-NWDGAFQWSA-N 285.409 2.174 10 20 CECD C[C@@H](c1ccncc1)N(C)C(=O)c1cccc(O)c1O 187031072 SPMFNTUOYREVCR-JTQLQIEISA-N 272.304 2.326 10 20 CECD COc1ccc(CN[C@@H](CO)CC(F)F)cc1C 717756310 UCBSZAQZADREBA-LLVKDONJSA-N 259.296 2.109 10 20 CECD C[C@@H](N[C@H](C(N)=O)c1ccccc1)c1ccccc1O 775135859 GZUKVHLEEZHBKT-ABAIWWIYSA-N 270.332 2.269 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOC[C@@H]1C1CC1 1334350393 SSZVRWCVJADWKC-CYBMUJFWSA-N 269.291 2.281 10 20 CECD Cc1cc(O)c(CNC2CC(C(=O)O)C2)cc1Cl 1607700020 QMHHKIHZGZETBJ-UHFFFAOYSA-N 269.728 2.307 10 20 CECD COc1ccc(CN[C@@H](C)[C@H](C)NC(=O)C2CC2)cc1C 1755223526 KNWAGFQORGLXKJ-STQMWFEESA-N 290.407 2.396 10 20 CECD CNC(=O)c1cccc(NCc2ccccc2O)c1 20124606 NYUHOLQOQUOVKA-UHFFFAOYSA-N 256.305 2.364 10 20 CECD CCOCCOCCNCc1ccc(OC)c(C)c1 922942499 YWNBTCDIXRGZNZ-UHFFFAOYSA-N 267.369 2.146 10 20 CECD OCC1(CNCc2cc(Cl)ccc2O)CCC1 184369664 DIGGHTYQVZHOCR-UHFFFAOYSA-N 255.745 2.298 10 20 CECD NCC[C@H]1CCN(Cc2cc(Br)ccc2O)C1 723674922 KPXSAFVHPVPJRI-JTQLQIEISA-N 299.212 2.325 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CC1(O)CCCC1 304211526 AFYXJINIJSJDHY-UHFFFAOYSA-N 290.407 2.406 10 20 CECD CCCCCCOCC(=O)NCc1ccc(N)cc1 1342698204 BHAQJSQMOABZAE-UHFFFAOYSA-N 264.369 2.482 10 20 CECD Cc1ccc(C(=O)N[C@H]2COc3ccccc3C2)c(O)c1O 181986723 QJAIGSGSEAAPSG-GFCCVEGCSA-N 299.326 2.140 10 20 CECD NC(=O)C[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 180560796 AYJSFKNXHOEVAR-JTQLQIEISA-N 282.771 2.133 10 20 CECD CC[C@H](NCCOCCOC)c1ccccc1O 44693697 JPRCUQASKYBTOB-ZDUSSCGKSA-N 253.342 2.096 10 20 CECD CCN(CCC(=O)OC)Cc1ccc(N(C)C)c(F)c1 130492941 DPMJDAOPNOXDBT-UHFFFAOYSA-N 282.359 2.277 10 20 CECD O=C(CCc1c[nH]cn1)NCc1c(O)ccc2c1CCCC2 193597052 XHDMETWKGVAWRA-UHFFFAOYSA-N 299.374 2.243 10 20 CECD COC[C@H](O)CCNCc1cc(Cl)cc(Cl)c1O 231606223 LWPUJPKPQOONPI-SNVBAGLBSA-N 294.178 2.186 10 20 CECD CCCOc1ccc(CN2CCC[C@H](CO)C2)c(O)c1 269351185 KKQWSBWPXSEIHE-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD Nc1ccc(NC(=O)[C@@H]2CCCN2Cc2ccccn2)cc1 361734463 QVVKNNPXHOADCM-INIZCTEOSA-N 296.374 2.267 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)cc(OC)c2O)C[C@H]1O 273779469 SLDCAQHWZKBAOH-JOYOIKCWSA-N 285.771 2.257 10 20 CECD CN(C)c1ccc(CN2CCC[C@@](C)(O)CC2)cc1 280129906 QKOYIIJOPFMQLZ-MRXNPFEDSA-N 262.397 2.490 10 20 CECD C[C@@H]1C[C@@H](N2CCCC2)CN1Cc1ccccc1O 289740638 QCYHBWOHOAYDMP-UKRRQHHQSA-N 260.381 2.451 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1cnn(C)n1 289318800 FZGLGPMBXDVIMK-UHFFFAOYSA-N 272.352 2.167 10 20 CECD CC[C@H](N[C@@H]1CCC[C@H]1O)c1ccc(F)cc1O 286318392 XTSZBCSOYSNFIK-YNEHKIRRSA-N 253.317 2.485 10 20 CECD CCCc1cc(C(=O)NCc2cccc(OC)c2O)no1 294780295 CPDJPWAOCKTUPZ-UHFFFAOYSA-N 290.319 2.271 10 20 CECD C[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)c1ccncc1 817939169 AAPDPVRLNKBLQB-SUMWQHHRSA-N 284.407 2.498 10 20 CECD CC[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cc(Cl)ccc1O 817977156 CRKANRWQITYMRB-KZVDOYCCSA-N 266.772 2.304 10 20 CECD CC[C@H](CNC(=O)N[C@H](C)c1cc(OC)ccc1O)OC 811969137 RYVNCAOHDPENEM-GHMZBOCLSA-N 296.367 2.186 10 20 CECD COc1ncc(/C=C\C(=O)N(C)c2ccc(F)cc2)cn1 492653917 VMPPURGGBUZGQO-BAQGIRSFSA-N 287.294 2.301 10 20 CECD COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]23)c1O 825703485 VMJZHNPFPXIUAM-GVXVVHGQSA-N 275.348 2.453 10 20 CECD C[C@H](N[C@@H]1C[C@H]2CCCCN2C1=O)c1ccccc1O 834914456 MYJZJDUSCFAFFX-OUCADQQQSA-N 274.364 2.196 10 20 CECD C[C@@H]1CCC[C@@H](C)N1NC(=O)c1cc(O)cs1 907986566 DYLJGZUZACJENC-RKDXNWHRSA-N 254.355 2.361 10 20 CECD O=C(NCCC[C@@H]1CCOC1)c1cc(O)cs1 839788255 DBMVLEDSWAOHCV-SECBINFHSA-N 255.339 2.000 10 20 CECD CCOCCC(=O)N(C)CCN(C)c1ccc(OC)cc1 844853397 HDYCBSJKAHNSSW-UHFFFAOYSA-N 294.395 2.016 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@H]1CCCNCC1 841057881 LSRCMYOUNPDCSI-VIFPVBQESA-N 272.751 2.416 10 20 CECD C[C@H]1CC[C@@H](C)N1CC(=O)NCc1ccc(N(C)C)cc1 741139157 DBBUXIZVWUKJQU-OKILXGFUSA-N 289.423 2.242 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@@H](C)CCN1 844186647 MGOXMMIYTQOJIP-BLLLJJGKSA-N 289.423 2.065 10 20 CECD CC(C)CC1(CNC(=O)C(=O)Nc2ccc(N)cc2)CC1 841067147 VIYFVLQDHRXIOL-UHFFFAOYSA-N 289.379 2.150 10 20 CECD CCn1ccc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)n1 840840008 DIPFSDJHSUXERY-JTQLQIEISA-N 290.323 2.368 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCN(C)[C@@H](C)C2)c1 742375638 SYJDIBKYHXZXSP-JSGCOSHPSA-N 278.396 2.363 10 20 CECD O=C(CC[C@@H]1CCOC1)NCc1cc(Cl)ccc1O 846477606 VDZQVNMEJILHOW-SNVBAGLBSA-N 283.755 2.479 10 20 CECD CCN(CC)C[C@H](C)NC(=O)Nc1ccc(N)cc1 41681711 WWONZGFXQJCUMB-NSHDSACASA-N 264.373 2.121 10 20 CECD COc1cccc(O)c1CNc1ccc(OCCN)cc1 841053359 UEHFOLJPVYNIJR-UHFFFAOYSA-N 288.347 2.350 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H]1CC[C@H](O)C1 840942203 VMQDFZVGCXSLPN-CJNGLKHVSA-N 262.397 2.312 10 20 CECD COC(=O)N1CCC[C@@H](N[C@@H](C)c2cc(F)ccc2O)C1 756526099 FMDMJGYQXFWVBZ-CMPLNLGQSA-N 296.342 2.413 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](F)C(C)C 935948883 RZMMZTZUCIXDOR-GFCCVEGCSA-N 274.332 2.488 10 20 CECD CO[C@H]1C[C@H](NC(=O)NCc2ccccc2O)C1(C)C 753343511 NIELIRQVTVVAQF-STQMWFEESA-N 278.352 2.005 10 20 CECD CCC[C@H](O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 935461321 ABITXMUDNPMHFF-RISCZKNCSA-N 264.369 2.091 10 20 CECD CC(C)(C)OC(=O)N1CCO[C@H](CN=[N+]=[N-])CC1 1898242717 FJECMHXKGJIDPR-VIFPVBQESA-N 256.306 2.323 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCCc3nn(C)cc32)c1 862756131 QVVRTBOFIAAPAC-CYBMUJFWSA-N 299.374 2.170 10 20 CECD CCOc1ccc(CN(C)C[C@@H]2CCOC2)c(O)c1 769531626 DPTDYVPYRIUDQC-LBPRGKRZSA-N 265.353 2.259 10 20 CECD Cc1ccc(CN2CC[C@@H](Cc3cnn(C)c3)C2)c(O)c1 876796662 HPORZRNHJOESFF-AWEZNQCLSA-N 285.391 2.499 10 20 CECD Cc1ccc(CNC[C@](C)(O)c2ccco2)c(O)c1 877072033 GKUNWBPIAGHVEA-HNNXBMFYSA-N 261.321 2.291 10 20 CECD CC[C@H]1C(=O)N(CC)CCN1Cc1ccc(C)cc1O 877440516 AWSUORYMUPQXCL-AWEZNQCLSA-N 276.380 2.143 10 20 CECD Cc1cccc(O)c1CN1CCN(c2nccnc2C)CC1 877501017 LBQVKKSSFPUEEH-UHFFFAOYSA-N 298.390 2.121 10 20 CECD COCCN(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773624242 KIMVHNQSEQNIQP-LBPRGKRZSA-N 279.384 2.101 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1[C@H]2CCCO[C@H]21 780322822 XBJFTXBJBOPATI-BZUAXINKSA-N 288.391 2.136 10 20 CECD CC1=NO[C@@H](CNCc2cc(Cl)c(F)cc2O)C1 895304354 IGUIUFYSZKUPKD-SECBINFHSA-N 272.707 2.439 10 20 CECD CCC[C@@](C)(O)CNCc1cc(C)cc(OC)c1O 894253470 CHGLTRJFMNKKDX-OAHLLOKOSA-N 267.369 2.350 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)c(O)c1 794377668 TZSONGCRFQCXDW-COPLHBTASA-N 275.348 2.453 10 20 CECD C[C@@H](NCC(=O)NCC(F)F)c1cc(Cl)ccc1O 795844415 JZMGBQHYYYVHHY-SSDOTTSWSA-N 292.713 2.078 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@@H]1O 1335001426 PGVPQXWLDRVDJW-CJNGLKHVSA-N 260.381 2.099 10 20 CECD COc1ccc(CN[C@H]2CCCSC2)c(O)c1OC 1335050184 FJTUKMMMLFPPPM-NSHDSACASA-N 283.393 2.395 10 20 CECD CC1=NO[C@](C)(C(=O)NCCCSc2nccs2)C1 1357913989 PUFQEFOSLADXRU-LBPRGKRZSA-N 299.421 2.296 10 20 CECD C[C@H](NCC1(O)CCCC1)c1cc(C(=O)O)ccc1O 1604338113 QGEHRFZEEMEKIJ-JTQLQIEISA-N 279.336 2.046 10 20 CECD CCC(=O)NC[C@H](C)CNCc1ccc(OC)c(C)c1 1753604191 CSGCWLNHXIKEIT-GFCCVEGCSA-N 278.396 2.256 10 20 CECD O=C(O)[C@@H]1CCC[C@@H]1NCc1ccc(F)c(F)c1O 1595171901 UMZUKDQJWRVEPE-SCZZXKLOSA-N 271.263 2.013 10 20 CECD C[C@@H](NCc1cccc(Cl)c1O)c1nnc2n1CCC2 165016936 OEUZULHJYBTMDV-SECBINFHSA-N 292.770 2.434 10 20 CECD CC[C@H](NCCc1n[nH]c(C)n1)c1ccccc1O 274764015 KSIRREFDLZFFON-LBPRGKRZSA-N 260.341 2.102 10 20 CECD C[C@H](NCC1([S@@](C)=O)CC1)c1ccc(F)cc1O 282315544 NIKIGVWDMILYGB-NIVTXAMTSA-N 271.357 2.093 10 20 CECD Cc1ncsc1CNCc1cc2c(cc1O)OCO2 71213059 BUHNESQKYWADDF-UHFFFAOYSA-N 278.333 2.176 10 20 CECD OC[C@@H](C[C@@H]1CCCO1)NCc1c(O)cccc1Cl 886226833 SCLWMXXUDORGGU-MNOVXSKESA-N 285.771 2.065 10 20 CECD COc1cccc(CNC(=O)c2ccsc2)c1O 105652518 PBBADZBPAYKPLW-UHFFFAOYSA-N 263.318 2.392 10 20 CECD CN(Cc1ccccc1O)[C@@H](C(N)=O)c1ccccc1 109770590 VNQUJVKGSGUZQP-OAHLLOKOSA-N 270.332 2.051 10 20 CECD CCOc1cccc(CN2CCOC(C)(C)C2)c1O 132311375 OBYAUGUOKDTVMK-UHFFFAOYSA-N 265.353 2.402 10 20 CECD COC(=O)[C@@H](NCc1ccc2c(c1)CCO2)C(C)(C)C 119284222 RYIAQLDJPRQPTR-CQSZACIVSA-N 277.364 2.299 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1cc(F)ccc1O 180766548 AMCZCBNSWMSEPV-GFCCVEGCSA-N 267.300 2.059 10 20 CECD C[C@@H](NCCCNC(=O)C1CCC1)c1cc(F)ccc1O 186092165 SHOXPDOYLSMGAL-LLVKDONJSA-N 294.370 2.488 10 20 CECD CCOc1cccc(CN[C@]2(C)CCOC2)c1O 120180249 OWFTZGWKDGQWPP-CQSZACIVSA-N 251.326 2.060 10 20 CECD CCCN1CCCN(Cc2cc(C)c(C)cc2O)CC1=O 189214083 OZDMOZYFYPDTNP-UHFFFAOYSA-N 290.407 2.453 10 20 CECD C[C@H](NCCCOC[C@H]1CCOC1)c1ccccc1O 183525356 YSWSEWDWNTZPGL-UONOGXRCSA-N 279.380 2.486 10 20 CECD COc1cccc(CNC(=O)NCC2CCC2)c1O 73747197 OCYGKMCBCQJCRY-UHFFFAOYSA-N 264.325 2.000 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCCO1 46686231 PDMVQZLCYZRMDM-HNNXBMFYSA-N 274.364 2.082 10 20 CECD COc1cccc(CNC[C@@]2(O)CCCC2(C)C)c1O 292908970 HFWUCIPNLNMQLK-INIZCTEOSA-N 279.380 2.432 10 20 CECD COCCOC[C@H]1CCN(Cc2cc(F)ccc2O)C1 180215686 XSYTYCWGCYJQKC-LBPRGKRZSA-N 283.343 2.016 10 20 CECD COCCOC[C@@H]1CCN(Cc2cccc(C)c2O)C1 180525664 DMMZVWQUJSGLSF-CQSZACIVSA-N 279.380 2.186 10 20 CECD CC(=O)c1cc(F)cc(CN(C)Cc2ccon2)c1O 267463631 UCSXIYWAJUPSKS-UHFFFAOYSA-N 278.283 2.354 10 20 CECD CCC[C@@H](O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 268893815 OOGGHFAPMSDMHX-WMLDXEAASA-N 292.423 2.335 10 20 CECD CCOc1cccc(CN2CCN(C3CCC3)CC2)c1O 271197085 RVRTXYGEFMYQHS-UHFFFAOYSA-N 290.407 2.461 10 20 CECD CN(C)c1ccc(CN2CC[C@H](O)C2)c(C(F)(F)F)c1 279546518 DDOZRRLGTUOAJP-LBPRGKRZSA-N 288.313 2.338 10 20 CECD CC(C)CN1CC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 272124823 QULNMIBHFWTAJO-UHFFFAOYSA-N 289.379 2.173 10 20 CECD COc1cc(N(C)C[C@H]2CCOC2)c([N+](=O)[O-])cc1OC 270873780 AGCBKTHVWKVQNB-SNVBAGLBSA-N 296.323 2.085 10 20 CECD CO[C@H](C)c1noc(COc2ccc(N(C)C)cc2)n1 289369526 JWFIHHZJKZGVHH-SNVBAGLBSA-N 277.324 2.422 10 20 CECD CC[C@H](NCCOCCOC)c1ccc(F)cc1O 286098126 NCSXFGONEIZUNM-ZDUSSCGKSA-N 271.332 2.235 10 20 CECD C[C@H]1C[C@@H](CO)CCN1Cc1cc(F)ccc1O 290131477 JRGHPTUVKGRGTP-QWRGUYRKSA-N 253.317 2.124 10 20 CECD COc1ccc(CN[C@H](C)COC(C)C)c(O)c1 800524118 APFKSVHVWVNSBC-LLVKDONJSA-N 253.342 2.304 10 20 CECD C[C@@H]1CCC[C@H]1NC(=O)c1c(F)ccc(O)c1O 295392739 YOMYJCJHFVXGIC-VXNVDRBHSA-N 253.273 2.155 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1ccncc1 803400669 GUJDUGYQDWHQNO-DUXPYHPUSA-N 271.272 2.249 10 20 CECD CC[C@@H](N)CN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 817980728 WQAGZPJWMHTIJS-TZMCWYRMSA-N 295.402 2.050 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)N1C 816653609 ANKODIPPHOXTGO-BETUJISGSA-N 279.403 2.416 10 20 CECD CC(=O)N[C@H]1CCN(Cc2ccc3ccccc3c2O)C1 817415708 XBYWZJIOELJOEF-HNNXBMFYSA-N 284.359 2.256 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCS[C@@H]2C)c1O 828543319 VAFKLJJEFHPXMN-MWLCHTKSSA-N 296.392 2.094 10 20 CECD C[C@@H](NC(=O)c1cc2c(nc1O)CCC2)c1ccccc1O 827930338 HDQFBQJWFOJSLQ-SNVBAGLBSA-N 298.342 2.473 10 20 CECD O=C(O)/C=C\c1ccc(N2CC[C@H](CF)C2)c([N+](=O)[O-])c1 906148929 NROUKFYFBLEHLZ-CJHWANRJSA-N 294.282 2.488 10 20 CECD O=C(/C=C\c1cccnc1)N1CCc2ccncc21 492435162 FHTOUDXAQDQQCY-ARJAWSKDSA-N 251.289 2.079 10 20 CECD CC(C)[C@](C)(O)CNCc1ccc(N(C)C)c(F)c1 733326756 YAGJWWVLJDEFJL-OAHLLOKOSA-N 268.376 2.388 10 20 CECD CC(C)[C@H](N[C@H]1CCc2cccc(O)c21)c1nncn1C 903066485 VKOVODOKTCWHEX-WFASDCNBSA-N 286.379 2.495 10 20 CECD CO[C@@H]1CCC[C@H]([C@@H](NCc2ccccc2O)C(=O)O)C1 901762761 QKENKDVIPPODKQ-NJZAAPMLSA-N 293.363 2.140 10 20 CECD Cc1cc(O)c(CN(C)[C@H]2CCN(C)C2=O)cc1C(C)C 738264537 DNVWJPXVTCYYTA-HNNXBMFYSA-N 290.407 2.487 10 20 CECD Cc1ccc(C(=O)N2CCSC[C@H]2C2CC2)c(O)c1O 836857630 CHLBRWBVDVRWSN-LBPRGKRZSA-N 293.388 2.374 10 20 CECD COc1cc2c(c(OC)c1)N(C[C@H]1CCOC1)CCC2 839653862 IGNYWGMOSWEJPC-GFCCVEGCSA-N 277.364 2.493 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@H]2CC=CCC2)cc1 846663985 UDCRSXGWVBCRFF-ZBFHGGJFSA-N 287.407 2.225 10 20 CECD Nc1ccc(Cc2noc([C@@H]3CCc4n[nH]cc4C3)n2)cc1 843160071 VHHQBGJMVCNMQL-LLVKDONJSA-N 295.346 2.238 10 20 CECD CCc1cccc(CN2CCOC[C@@H]2[C@@H]2CCCO2)c1O 848910158 HLEDPOZKDFLBJP-CVEARBPZSA-N 291.391 2.334 10 20 CECD CCN(C)c1ccc(CN2CCC[C@H]2C(=O)N(C)C)cc1 741752600 BTRWHDUBASHZSI-INIZCTEOSA-N 289.423 2.195 10 20 CECD Cc1ncoc1CNC(=O)N[C@H](C)c1ccccc1O 923792585 QMNHUFQNTQPGRS-SECBINFHSA-N 275.308 2.249 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1CC1(F)F 846477695 VJIVGNXTELEGND-MRVPVSSYSA-N 261.655 2.317 10 20 CECD COc1ccc(O)c(CN2CCC([C@@H]3CCNC3)CC2)c1 843126328 JJXAACFEGTWNDH-CQSZACIVSA-N 290.407 2.222 10 20 CECD Cc1nc(C)c(C(=O)NCc2ccc(N(C)C)cc2)[nH]1 856740830 SQXGHTPLCVFASX-UHFFFAOYSA-N 272.352 2.023 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCC[C@H]([S@](C)=O)C1 850356360 OVIJNTMYTSYRMF-JGRMJRGVSA-N 297.420 2.180 10 20 CECD C[C@H](N[C@H](C)c1cc(F)cc(F)c1O)C1(CO)CC1 850513636 AHKCJEYYLXZVQG-BDAKNGLRSA-N 271.307 2.482 10 20 CECD Fc1cc(CN2C[C@H]3C[C@@H]3C2)ccc1N1CCOCC1 862442239 YQHANTXNWFSECW-ZIAGYGMSSA-N 276.355 2.114 10 20 CECD CO[C@@](C)(C(=O)NCc1cc(C)ccc1O)C1CC1 862755196 DVVVWWUQIINKGJ-OAHLLOKOSA-N 263.337 2.132 10 20 CECD CC[C@H](NCc1ncn(C)n1)c1cc(Cl)ccc1O 775526580 SFVUMUDOPATPNR-NSHDSACASA-N 280.759 2.415 10 20 CECD Cc1ccccc1[C@H](CO)NC(=O)c1cc(O)cs1 778514634 JXGHCYJNBHYIIA-LBPRGKRZSA-N 277.345 2.226 10 20 CECD Cc1cnn(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 773013154 JCCBVSAYAKAGFA-ZDUSSCGKSA-N 286.379 2.135 10 20 CECD CCOc1cccc(CN2CCN(C)[C@H](C)[C@H]2C)c1O 775986462 QUNIRCOOQNRXNB-CHWSQXEVSA-N 278.396 2.315 10 20 CECD CC[C@@H](O)CCCNCc1cc(C)cc(OC)c1O 894288365 STYNDANSSIPAPC-CYBMUJFWSA-N 267.369 2.350 10 20 CECD COC(=O)C[C@@H](NCc1cc(OC)ccc1O)C(C)(C)C 897889628 WCHBZPQDHCTBDZ-CQSZACIVSA-N 295.379 2.468 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H]2CCCOC2)c(O)c1OC 893471020 BMCMWAKXCITAHS-WCQYABFASA-N 295.379 2.314 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@]2(C)CO)c1 789558600 ZTYBSLUEPUHDGU-OAHLLOKOSA-N 265.353 2.138 10 20 CECD CN(C)c1ccc(CNc2cncc(C(=O)O)c2)cc1 82717072 OKEROAQDDNAXTJ-UHFFFAOYSA-N 271.320 2.458 10 20 CECD CCOCc1cc(CNC[C@@H](C)CNC)ccc1OC 1328677769 URZMWSBHRZSZLA-ZDUSSCGKSA-N 280.412 2.177 10 20 CECD CN(Cc1ccc(C(N)=O)cc1)Cc1ccccc1O 109773050 GOFXMPBTMFGEBR-UHFFFAOYSA-N 270.332 2.123 10 20 CECD CN(C)c1ccc(CNCc2nc(C(=O)O)cs2)cc1 277291582 MLHOIHGQUYPLCW-UHFFFAOYSA-N 291.376 2.197 10 20 CECD Cc1cc(Br)cc(CNCCCCO)c1O 194531246 VXNKPXYDUZZPKY-UHFFFAOYSA-N 288.185 2.325 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CO)CC(F)(F)F)c1 717809904 FYAHQGDXHDCUGK-IUCAKERBSA-N 293.285 2.365 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)C2(CO)CC2)c1O 696078177 DVAWCAGGGILQAL-VIFPVBQESA-N 285.771 2.305 10 20 CECD C[C@H]1CC/C(=C\C(=O)NCc2cccc(O)c2O)C1 1352658887 ZTLHJFQUYVZOHN-NGPGYTDTSA-N 261.321 2.460 10 20 CECD COc1cc(C)cc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)c1O 1350328840 YMSIEUHRHNAJAF-UPJWGTAASA-N 263.337 2.119 10 20 CECD Cc1cc(O)c(CN2CCOC[C@H]2CC(=O)O)c(Cl)c1 1607700152 UWAGVEIYPLBPDI-SNVBAGLBSA-N 299.754 2.030 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCCCSc2nccs2)C1 1601794639 MJHXNDYCRHMOJR-ZJUUUORDSA-N 286.422 2.468 10 20 CECD C[C@H]1CN(Cc2ccc(N)cc2)c2ccccc2C(=O)N1 1576808747 IBEADHVSRZJRDP-LBPRGKRZSA-N 281.359 2.407 10 20 CECD CC(C)Cn1ccc(C(=O)Oc2ccc(N)cc2)n1 1575673006 HLOKUEXSOUCYQK-UHFFFAOYSA-N 259.309 2.341 10 20 CECD CNCCCC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1578678721 AUAIOXVDXZNIPN-UHFFFAOYSA-N 289.423 2.245 10 20 CECD CCCCCOCC(=O)NCCc1ccc(N)cc1 152485721 FDGSBTGXIUDQOP-UHFFFAOYSA-N 264.369 2.134 10 20 CECD CS[C@H]1CC[C@H](NC(=O)c2cccc(O)c2O)C1 229412892 MXWKXWUKBGCNCJ-IUCAKERBSA-N 267.350 2.112 10 20 CECD C[C@H](NC[C@H]1CCCN1C)c1ccc(N(C)C)cc1 154543654 YIEXUBCFTFDDTM-XJKSGUPXSA-N 261.413 2.497 10 20 CECD CN(Cc1ccccc1O)CC(C)(C)CN1CCOCC1 179582343 HJSXYRTUECFMNR-UHFFFAOYSA-N 292.423 2.182 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H](O)C2)c1O 184672341 IECNEQCDMDGQGS-LLVKDONJSA-N 271.744 2.011 10 20 CECD NC[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 128318987 MMEXEYRPWQUEHA-JTQLQIEISA-N 254.761 2.216 10 20 CECD COCCO[C@H]1CCN(Cc2cc(C)c(C)cc2O)C1 188920735 XCSXBNTUQCTMCJ-HNNXBMFYSA-N 279.380 2.246 10 20 CECD COCCO[C@@H]1CCN(Cc2cc(C)cc(C)c2O)C1 188921336 JDISFHPRYREHET-OAHLLOKOSA-N 279.380 2.246 10 20 CECD CCC[C@@](C)(NCc1cc(OC)ccc1O)C(=O)OC 180036261 NTDHHWWOJNZYBD-OAHLLOKOSA-N 281.352 2.222 10 20 CECD O=C(O)CCCNCc1cccc(Br)c1O 42412335 WVGFPDRXWKWLOM-UHFFFAOYSA-N 288.141 2.109 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)NCCO)c1C 98067188 ZWUKEVUEWQIWJK-UHFFFAOYSA-N 272.348 2.125 10 20 CECD CCOCCNC(=O)NCc1c(C)c2ccccc2n1C 349375784 DAZZLDOJBMFMIO-UHFFFAOYSA-N 289.379 2.322 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1 252445848 HDWRBWKRONVASR-YUELXQCFSA-N 288.391 2.271 10 20 CECD COc1ccnc(NCc2ccc(N3CC=CC3)cc2)n1 265830910 KSLSSAYQINJPKX-UHFFFAOYSA-N 282.347 2.474 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCCCO1 272639780 LLDYRDKHMDVZGH-VUPNYRSLSA-N 291.347 2.185 10 20 CECD CCn1ccnc1C(=O)NCc1ccc2c(c1)CCCN2C 279283295 XCPRDQKCWKJCFG-UHFFFAOYSA-N 298.390 2.215 10 20 CECD CC1(C)CC[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 287247786 RIBZHSXOVNQPQH-DIECRNLCSA-N 261.321 2.416 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CO)CCOC)cc1F 282104366 DJCCZXDBTSSRTA-CQSZACIVSA-N 298.402 2.159 10 20 CECD O=C(c1cccc(O)c1O)N1CCCc2occc2C1 290646237 NCOABQNCFXUFNR-UHFFFAOYSA-N 273.288 2.279 10 20 CECD CCSCCCNC(=O)c1c(F)ccc(O)c1O 296061704 GECLYZIBRUFTAK-UHFFFAOYSA-N 273.329 2.110 10 20 CECD COC(=O)[C@H]1CC[C@H](C(=O)Nc2ccc(N)cc2)CC1 818556471 TXVGPLFCHWLVSY-XYPYZODXSA-N 276.336 2.187 10 20 CECD C[C@@H](NCC[C@@H]1CCNC1)c1cc(F)cc(F)c1O 817955559 YUBWLQLWILUYQT-ZJUUUORDSA-N 270.323 2.321 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2(CN)CCCC2)c1 828666499 FERDMEGRDYXAMZ-LLVKDONJSA-N 292.379 2.097 10 20 CECD CC[C@](C)(CN(C)c1ccc(OCC(=O)O)cc1)OC 902014979 GNPQJYJIGBMUJO-OAHLLOKOSA-N 281.352 2.401 10 20 CECD CCC1(NC(=O)c2cc(O)cs2)CCOCC1 831414940 ZLNZSHKWQXICJY-UHFFFAOYSA-N 255.339 2.143 10 20 CECD CC(C)c1nnc(COC(=O)c2cc(O)cs2)o1 732353778 VFEBMCRGQXRPGW-UHFFFAOYSA-N 268.294 2.317 10 20 CECD Cc1cccc(CNCC(C)(C)C2(O)CCOCC2)c1O 841890362 OIAYQNBWMYJKAL-UHFFFAOYSA-N 293.407 2.358 10 20 CECD CCc1ncc(NC(=O)NCc2ccccc2O)cn1 747377437 XUNAGZFHVQGVTK-UHFFFAOYSA-N 272.308 2.066 10 20 CECD NC1CCN(Cc2c(O)ccc(Cl)c2F)CC1 843047263 IUMITNYVSBRUKN-UHFFFAOYSA-N 258.724 2.108 10 20 CECD CC1(C)NCC[C@@H]1NCc1cc(Cl)ccc1O 841085657 JHRAAZWPUDGIGW-LBPRGKRZSA-N 254.761 2.276 10 20 CECD C[C@H]1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)CCO1 845086048 FCBKLVOEACOHDU-JOYOIKCWSA-N 298.770 2.412 10 20 CECD C[C@@H]1CCC[C@@H](CNC(=O)C(=O)Nc2ccc(N)cc2)C1 841022412 SVWQRZIRICGOJV-VXGBXAGGSA-N 289.379 2.150 10 20 CECD Nc1ccc(CCNC(=O)NCC2CCCC2)cc1 841709537 HUAXBSMRHMIWSK-UHFFFAOYSA-N 261.369 2.301 10 20 CECD c1cc2c(cc1CN[C@@H]1CCc3c[nH]nc3C1)CCCO2 921839499 PZFFZWBLYWFYTI-OAHLLOKOSA-N 283.375 2.382 10 20 CECD COc1cc(N2CC[C@@H]3C[C@H]3C2)c([N+](=O)[O-])cc1OC 853901757 JPINZUUHLKRSDL-ZJUUUORDSA-N 278.308 2.458 10 20 CECD CCOc1ccc(N(CC)Cc2cn(C)nn2)cc1 761673709 AVAZNFUKDIOKTI-UHFFFAOYSA-N 260.341 2.240 10 20 CECD C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@@H](C2CC2)C1=O 761576315 BQQDMVJJWPEPML-YGRLFVJLSA-N 287.363 2.144 10 20 CECD CC(C)CC[C@H](CO)NC(=O)/C=C\c1ccc(O)c(O)c1 862778064 DKQVNMJHHOFYDR-DMTLFAOVSA-N 293.363 2.024 10 20 CECD Cc1cccc(O)c1CN1CCN(CC(F)(F)F)CC1 876557108 UOPIZMHIOIGUDV-UHFFFAOYSA-N 288.313 2.381 10 20 CECD Cc1ccc(C(=O)O[C@H](C)C(=O)OC(C)(C)C)c(O)c1O 762806221 JQKNDBGYLVOTSW-SECBINFHSA-N 296.319 2.293 10 20 CECD CO[C@H]1CCC[C@H]1CNC(=O)NCc1ccccc1O 774785315 FJHJDHYGUOJUNX-JSGCOSHPSA-N 278.352 2.007 10 20 CECD Cc1cccc(CN2CCC[C@H](N3CCCC3=O)C2)c1O 775687102 VQWBWXMQTXBBCN-HNNXBMFYSA-N 288.391 2.287 10 20 CECD C[C@H](NCCc1ccnn1C)c1c(O)cccc1F 886589919 JJTCSOOITSHVNF-JTQLQIEISA-N 263.316 2.158 10 20 CECD C[C@@H](NCCC1(O)CCC1)c1c(O)cccc1F 886607293 ONZXEMJUDVYSSN-SNVBAGLBSA-N 253.317 2.487 10 20 CECD CC[C@@H]1CN(C)CCN1Cc1cc(F)cc(F)c1O 894865507 XOUFALZSVYYDOI-GFCCVEGCSA-N 270.323 2.196 10 20 CECD CC[C@@H](NCc1ccc(C(N)=O)nc1)c1ccc(C)cc1O 794808342 ABCLMZIZJQSCCJ-CQSZACIVSA-N 299.374 2.435 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1O[C@H](C)C[C@@H]1C 799938024 NNXPWRIDYNYKKA-WOSRLPQWSA-N 290.407 2.491 10 20 CECD CN(C)[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccccc1O 1318428041 VQLAWYPXINLAKW-UONOGXRCSA-N 291.395 2.064 10 20 CECD C[C@@H](C[S@@](C)=O)NCc1ccc(N2CCCC2)cc1 168149796 DJMOGJSPFKJJJI-DJJJIMSYSA-N 280.437 2.143 10 20 CECD C[C@H]1CC[C@@H](NCc2ccc(Br)cc2O)CN1 1246341645 BLZIIHOGVRATCZ-JOYOIKCWSA-N 299.212 2.385 10 20 CECD CCN(Cc1cccc(OC)c1O)C[C@H]1CCOC1 768522101 YPRMLNZOHCJMIM-GFCCVEGCSA-N 265.353 2.259 10 20 CECD O=C(CCNc1ccccc1)NCc1ccc(O)c(O)c1 1254314529 VASLUAQBQYDBAP-UHFFFAOYSA-N 286.331 2.216 10 20 CECD C[C@H](N[C@@H]1CCn2ccnc2C1)c1ccc(F)cc1O 779063683 CAHNFQXJBWPBHJ-CMPLNLGQSA-N 275.327 2.393 10 20 CECD CC(=O)OC[C@H](C)NCc1ccc(N(C)C)cc1C 1355255233 WGCSONOXKMIZIP-LBPRGKRZSA-N 264.369 2.102 10 20 CECD CC(C)N1CCC(C(=O)NCc2ccc(N)cc2)CC1 1524008658 IUKMOAHFZQOUGB-UHFFFAOYSA-N 275.396 2.005 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C)C[C@H]2C(=O)O)c1 1610042951 MAJWTTFRVPFGSE-FZMZJTMJSA-N 293.363 2.476 10 20 CECD Cc1ccc(F)cc1S(=O)(=O)NCc1ccccc1O 158579130 LXLRGUPCFBDFBN-UHFFFAOYSA-N 295.335 2.318 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCN(C)C2)c1 44534961 RIDCNRAHBOMUQX-OLZOCXBDSA-N 278.396 2.393 10 20 CECD C[C@@H](NC[C@H](O)C1CCC1)c1cc(F)ccc1O 315953918 IZGOWLHRVLUAML-OTYXRUKQSA-N 253.317 2.343 10 20 CECD O=C(NCCCSc1nccs1)NCC1CC1 177746346 WNGOKERYUUVPHQ-UHFFFAOYSA-N 271.411 2.335 10 20 CECD CCn1cc([C@H](C)NCc2cc(OC)ccc2O)cn1 180896754 KMUWZUGOUBXIOM-NSHDSACASA-N 275.352 2.468 10 20 CECD C[C@@H](NCCN1CCOCC1(C)C)c1ccccc1O 183488414 VOKORRBRZUIMLC-CYBMUJFWSA-N 278.396 2.154 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)CN2CCCC2=O)c1 37782158 VZEANOFGAXEAJX-NWDGAFQWSA-N 292.379 2.062 10 20 CECD CCOc1cccc(CN2CCC(OC)CC2)c1O 132148167 KKGGNTMJFDWQEF-UHFFFAOYSA-N 265.353 2.402 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@H](C)O)cc1F 130710915 HXXMAWMANFQUKX-LBPRGKRZSA-N 268.376 2.485 10 20 CECD CCCN(CCC(=O)N(C)C)Cc1ccccc1O 263925425 YHKGGICTIYWZSX-UHFFFAOYSA-N 264.369 2.083 10 20 CECD COc1cccc(CN(C)[C@H](C)C(=O)OC(C)C)c1O 93773210 ZSLLAHXSDQNXOE-LLVKDONJSA-N 281.352 2.173 10 20 CECD CCOC(=O)[C@@H]1CCCN(Cc2cc(C)ccc2O)C1 92456329 TZBSKXVFCHPAQG-CYBMUJFWSA-N 277.364 2.476 10 20 CECD C[C@@H](CNCc1c(O)cccc1Cl)CN(C)C 291683442 IAXIETKFOAIWNJ-JTQLQIEISA-N 256.777 2.333 10 20 CECD CCNC(=O)C1(CN[C@H](C)c2ccc(F)cc2O)CCC1 276833340 BPOVWPJCJYEDLT-LLVKDONJSA-N 294.370 2.488 10 20 CECD COC(=O)[C@H]1CC12CCN(Cc1cc(F)ccc1O)CC2 272253530 IRWFJPVPEHNUMP-CYBMUJFWSA-N 293.338 2.306 10 20 CECD C[C@H](NCc1nncn1C)c1cc2c(cc1O)CCCC2 273368737 FOHIBUOOFPWELT-NSHDSACASA-N 286.379 2.250 10 20 CECD CC[C@H](NCc1nnc2n1CCC2)c1ccccc1O 271710370 OGRSJQWURRJHPC-LBPRGKRZSA-N 272.352 2.171 10 20 CECD Cc1cccc(CN(CCCO)Cc2ccccn2)c1O 289548756 XMBUQHFXFZHWFA-UHFFFAOYSA-N 286.375 2.480 10 20 CECD CC1(CCNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 280176443 VILYRVAAEDBCNJ-HWKANZROSA-N 261.321 2.417 10 20 CECD Cc1ccc([C@H](C)NC[C@H](CO)[C@@H]2CCOC2)c(O)c1C 280975238 VUFYSOYOOUCCGM-RRFJBIMHSA-N 293.407 2.305 10 20 CECD CC(C)Oc1ccc(N(C)C[C@@H](O)CN(C)C2CC2)cc1 809989045 WQEBKPIRURTMCM-INIZCTEOSA-N 292.423 2.365 10 20 CECD Cn1ncc(CN(Cc2ccccc2O)C2CCCC2)n1 809945915 HFNZCTWZKUUDRR-UHFFFAOYSA-N 286.379 2.466 10 20 CECD COC(=O)c1cnc(S[C@@H](C)c2noc(C)n2)s1 295164506 HJGMUBRETPDOQM-YFKPBYRVSA-N 285.350 2.474 10 20 CECD C[C@@H](NC(=O)C(=O)c1cccn1C)c1ccc(N(C)C)cc1 807273987 FBRDCVWLCHGUGH-GFCCVEGCSA-N 299.374 2.151 10 20 CECD CC[C@@H](N[C@@H](C)CC(N)=O)c1cccc(Cl)c1O 806143751 OSPOTDMEKGAECI-GZMMTYOYSA-N 270.760 2.350 10 20 CECD Cc1nnc(CN(C)Cc2cccc(C)c2O)s1 827806353 RTFUGLUOIDEVCB-UHFFFAOYSA-N 263.366 2.493 10 20 CECD CSCCNC(=O)NCc1ccc2c(c1)CCCN2C 726249410 FGDNXHRJDSXFLI-UHFFFAOYSA-N 293.436 2.231 10 20 CECD COCC(C)(C)N1CCN(Cc2cc(C)ccc2O)CC1 822498011 SJCRLGYWHYFZGC-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CCCCN(CC[S@](C)=O)Cc1ccccc1O 829515752 GEMKMTYGBQITDC-SFHVURJKSA-N 269.410 2.373 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H](C(=O)O)C2)cc1 737841403 LGYYFYZQFFXBQQ-CQSZACIVSA-N 276.380 2.439 10 20 CECD CCc1cc(NC(=O)c2cc(O)cs2)n(C)n1 734873107 TVPXHFRDIRRROB-UHFFFAOYSA-N 251.311 2.002 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](CO)[C@@H]2C)c1O 839668895 JZVFRRIFDSJDPF-JQWIXIFHSA-N 295.354 2.327 10 20 CECD Cc1cc(CN2[C@H]3CC[C@H]2COC3)ccc1N(C)C 839190197 DVJBKHVZKUEKQV-GJZGRUSLSA-N 260.381 2.424 10 20 CECD CC(C)COC[C@@H](O)CN[C@H]1CCc2cccc(O)c21 834531205 SDLRSQUFPAHPMZ-KBPBESRZSA-N 279.380 2.003 10 20 CECD CCO[C@H](C)c1noc(COC(=O)c2cc(O)cs2)n1 736825726 PHWAOBDQCVQYRY-SSDOTTSWSA-N 298.320 2.291 10 20 CECD O=C(COC(=O)C1CC2(CCC2)C1)c1ccc(O)c(O)c1 830636579 DJEPDYQAKZXGMY-UHFFFAOYSA-N 290.315 2.404 10 20 CECD CN(Cc1ccccc1O)C(=O)Cn1cc(C2CC2)cn1 830141412 SPVMHZLZZUQALQ-UHFFFAOYSA-N 285.347 2.125 10 20 CECD CC[C@@H](O)[C@@H]1CCCCN1C(=O)c1cc(O)cs1 912118734 GFUFSMVXWICPRA-WDEREUQCSA-N 269.366 2.219 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)Cc2cnccn2)c1O 846142485 ULZPHEDQZBIGAW-RYUDHWBXSA-N 287.363 2.473 10 20 CECD CC(C)[C@@H](N)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 841882101 WFYUYNYUMASYFS-WFASDCNBSA-N 292.427 2.096 10 20 CECD COc1cccc([C@@H](C)NCCC[C@H](C)CO)c1O 846158349 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CN(C)c1ccc(OCC[C@@H]2CCCO2)cc1C(=O)O 1606058836 QCERUOKHWDMWKQ-NSHDSACASA-N 279.336 2.399 10 20 CECD CC[C@@H](C)C[C@H](NCc1cccc(OC)c1O)C(=O)O 1594953671 RQAZRFCMKAXCOU-PWSUYJOCSA-N 281.352 2.380 10 20 CECD COc1cc(CN2CC[C@H](C(=O)O)[C@H](C)C2)c(O)cc1C 1594056727 WDYRYNSONZDAFD-YPMHNXCESA-N 293.363 2.252 10 20 CECD COc1cc(Cl)cc(CNC[C@H]2CC[C@@H](O)C2)c1O 187985429 KNGNNEMKBUALRY-JOYOIKCWSA-N 285.771 2.305 10 20 CECD CCn1cc(CNCc2ccc3c(c2)CCO3)cn1 688517943 UJFJJBRCRIAJDZ-UHFFFAOYSA-N 257.337 2.128 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCO1 52851328 SXZPJNBYRIYERI-OAHLLOKOSA-N 276.380 2.280 10 20 CECD COCCCC(=O)N[C@H](C)c1cc(OC)ccc1O 103529621 CUHCNECGEWLUTD-SNVBAGLBSA-N 267.325 2.005 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCOC1 179169867 PYTNNGFRCQQIPE-ZDUSSCGKSA-N 278.352 2.103 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2nccs2)c1 172019440 CVEXHNWYAPYOKI-UHFFFAOYSA-N 279.321 2.179 10 20 CECD Cc1cc(N(C)Cc2ccc(N(C)C)cc2)ncn1 301222869 BPYLUZRYPQDYMU-UHFFFAOYSA-N 256.353 2.487 10 20 CECD C[C@H](NCCC(=O)N1CCCC1)c1ccc(N(C)C)cc1 37228779 MEWVJXURVNLGTO-AWEZNQCLSA-N 289.423 2.416 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2CC(=O)C2)cc1F 137007261 LIAQAHHXFABYNX-UHFFFAOYSA-N 292.354 2.267 10 20 CECD CCOC(=O)[C@H](C)N(Cc1ccccc1O)C1CC1 191713317 WJOGJUVAGHCJOZ-NSHDSACASA-N 263.337 2.308 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N1CCOCC1 194467343 ZSKFOWSVVFLFFE-UHFFFAOYSA-N 291.395 2.027 10 20 CECD CCCN(c1ccc(CN)cc1)C1CCN(C(C)=O)CC1 194978248 NAQUJLTVYVTTPA-UHFFFAOYSA-N 289.423 2.373 10 20 CECD CCOCCCCNC(=O)N(C)Cc1ccccc1O 194564933 BQOKORAOJBNTEN-UHFFFAOYSA-N 280.368 2.350 10 20 CECD Cc1cc(O)c(CN(C)[C@@H](C)[C@H](C)S(C)(=O)=O)cc1C 245721821 HYXXTXKRLIBERI-STQMWFEESA-N 299.436 2.262 10 20 CECD COCCCNC(=O)c1ccc(CN=[N+]=[N-])s1 1537962913 JOHOTWZNEAQZRN-UHFFFAOYSA-N 254.315 2.325 10 20 CECD C[C@H](NCc1cnnn1C)c1cc(Cl)ccc1O 287264985 IRRZEAATYVYKHG-QMMMGPOBSA-N 266.732 2.025 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCN2C)c1ccc(=O)[nH]n1 286250984 UJPWIQDUCREOCB-GFCCVEGCSA-N 298.390 2.003 10 20 CECD CCCOc1ccc(CN2CC3(CCOC3)C2)c(O)c1 293884872 DGNHAVFBVCTOEQ-UHFFFAOYSA-N 277.364 2.403 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](C(=O)N3CCCC3)C2)c1 290527302 QJKHOFIXOVQCOG-AWEZNQCLSA-N 288.391 2.145 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccon1 299425549 JVSKBXTTXZWMPK-UHFFFAOYSA-N 273.336 2.403 10 20 CECD COc1ccc(C(=O)OCC(=O)C(C)=O)c2ccccc12 808491968 OUQONULEDSXXJL-UHFFFAOYSA-N 286.283 2.163 10 20 CECD O=C(OCCCC(=O)N1CCCCC1)c1cc(O)cs1 805450006 NTKUJYLQYSJHRX-UHFFFAOYSA-N 297.376 2.403 10 20 CECD CC(C)c1nnc(CNCc2ccc3c(c2)CCO3)[nH]1 294790443 LYFMMFSESFMGAI-UHFFFAOYSA-N 272.352 2.153 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](CO)OC(C)(C)C1 817413491 YEYDYRIECPRQMA-MRXNPFEDSA-N 292.423 2.033 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@](C)(OC)C2CC2)c1 812497673 ANRHCCHUPLKBEW-MGPLVRAMSA-N 293.363 2.393 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2cc(Cl)ccc2O)C1 827501161 SNVCFMRSVIBVFS-DKTWLAJQSA-N 269.728 2.087 10 20 CECD O=C(NCc1ccccc1O)c1cnc(NC2CC2)s1 901123690 KBHRCNIPLZZUCK-UHFFFAOYSA-N 289.360 2.353 10 20 CECD CCN(CCC(=O)O)Cc1ccc(N(C)C)cc1C 901601925 NQRVBDXSMHBJRN-UHFFFAOYSA-N 264.369 2.358 10 20 CECD CC[C@@H]1CN(CC)CCN1C(=O)c1cc(O)cs1 839785347 FPPQCWIIODMIKQ-SNVBAGLBSA-N 268.382 2.010 10 20 CECD Cc1ccc(C(=O)NCCOCC2CCCC2)c(O)c1O 837215553 GDJDHUAILYYZRB-UHFFFAOYSA-N 293.363 2.343 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(OC)cc2O)[C@@H]1SC 839067028 MCBVBZSOTKXPNL-YUELXQCFSA-N 297.420 2.399 10 20 CECD CC(=O)[C@@H](C)CCOC(=O)/C=C\c1ccc(O)c(O)c1 849745288 OIAWSKFYXZIEOQ-OAQKJQOQSA-N 278.304 2.269 10 20 CECD C[C@@H]1CCCc2ncc(C(=O)NCc3ccccc3O)n21 845833623 NHIKCDSDUXMDJG-LLVKDONJSA-N 285.347 2.416 10 20 CECD CC(C)OCCCN(C)C(=O)NCCc1ccc(N)cc1 841955836 PHTSMUBUNKGRGY-UHFFFAOYSA-N 293.411 2.268 10 20 CECD CCN[C@H](C)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 841881774 UTFQUKZYUCBPRX-CHWSQXEVSA-N 292.427 2.111 10 20 CECD COc1cccc([C@@H](C)NCCCc2cnn(C)c2)c1O 846148326 ZNZOJVLDKCOOFY-GFCCVEGCSA-N 289.379 2.418 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1CCCCO1 759595953 SIRHXMHOXYZAPR-PZBABLGHSA-N 278.304 2.223 10 20 CECD Cc1nnc(COC(=O)/C=C\c2ccc(O)c(O)c2)s1 759594551 GWRTXFNGZAWUEO-HYXAFXHYSA-N 292.316 2.014 10 20 CECD C[C@H]1CSCCN(C(=O)c2cc(O)cs2)C1 754493882 IBFBPQJKHDXUEY-MRVPVSSYSA-N 257.380 2.279 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2cnccc2C)c1 858516523 GPOGRNFZRSBFDR-UHFFFAOYSA-N 285.347 2.403 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)C1(C)C 753558369 REFGGVJRJVNEGC-ZIAGYGMSSA-N 292.379 2.347 10 20 CECD CN1C[C@H]2CN(Cc3cc(F)c(N(C)C)cc3F)C[C@H]2C1 862351854 TYIUIYYPYPLPDX-BETUJISGSA-N 295.377 2.024 10 20 CECD COC(C)(C)CNC(=O)N[C@H](C)c1ccccc1O 868318508 DTNYTQCVPAODLW-SNVBAGLBSA-N 266.341 2.177 10 20 CECD Cc1ccc(CN2C[C@@H](C)S(=O)[C@H](C)C2)c(O)c1 877473623 NWHFMBHXZOGYPS-VXGBXAGGSA-N 267.394 2.042 10 20 CECD C[C@@H](C[C@@H]1CCCC(=O)N1)NCc1ccc2c(c1)CCO2 876996619 XBIWTTIPYFBICO-WFASDCNBSA-N 288.391 2.158 10 20 CECD COC(C)(C)CCNC(=O)N(C)Cc1ccccc1O 876080774 NVUQRMVJDLIILT-UHFFFAOYSA-N 280.368 2.349 10 20 CECD CN(C[C@H]1CCCC[C@@H]1O)C(=O)c1cc(O)cs1 778515208 PCRFWTUFTISFDY-KOLCDFICSA-N 269.366 2.077 10 20 CECD COc1ccc(O)c(CNC(=O)NOC2CCCCC2)c1 779575254 NBDUTTYPVJSAEA-UHFFFAOYSA-N 294.351 2.464 10 20 CECD C[C@H](NC(=O)C[C@@H]1CCOC1)c1ccc(N(C)C)cc1 773010414 PJRVEWRIDFTWKR-STQMWFEESA-N 276.380 2.356 10 20 CECD COc1ccc(N(Cc2nc(O)n[nH]2)CC(C)C)cc1 774664420 VHMBDDBBIFAZLC-UHFFFAOYSA-N 276.340 2.182 10 20 CECD COC[C@H](N[C@@H](C)c1c(O)cccc1F)[C@H]1CCCO1 886602971 DNRBXESNBKAYJT-VHRBIJSZSA-N 283.343 2.376 10 20 CECD Cc1noc(C)c1CN(C)C(=O)c1c(F)ccc(O)c1O 789953836 WJWMSOAKGAXASS-UHFFFAOYSA-N 294.282 2.114 10 20 CECD COc1ccc(CN(C)[C@@H]2CCSC2)c(O)c1OC 891602589 QZECVYNUDZBZRZ-LLVKDONJSA-N 283.393 2.347 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)C(C)C)c(O)c1 794377002 KFRFJLKVACMQPG-JTQLQIEISA-N 251.326 2.309 10 20 CECD C[C@@](O)(CNCc1ccc(N2CCCC2)cc1)C(F)F 704947154 OWQNDJXHQOZNCJ-OAHLLOKOSA-N 284.350 2.393 10 20 CECD CC[C@@H](NCCN1CCOC[C@H]1C)c1ccc(F)cc1O 796751597 AGLMHVBVFUJKMA-IUODEOHRSA-N 296.386 2.293 10 20 CECD CCCC(=O)NCCC1=CCN(c2cnc(F)cn2)CC1 1089804909 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CC(=O)c1cc(F)cc(CN2C[C@H](C)O[C@H](C)C2)c1O 37322598 BGPVGPVXGAOJNE-AOOOYVTPSA-N 281.327 2.343 10 20 CECD CC[C@H]1CN(C(=O)Cc2ccc(N)cc2)[C@H](CC)CO1 404048767 JPGHRDGQDZWELX-CABCVRRESA-N 276.380 2.227 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)[C@H]1CCCCN1 817902849 ZKQSRGFBQONGEZ-SWLSCSKDSA-N 260.381 2.242 10 20 CECD COc1cccc(CNC(=O)c2sc(C)nc2C)c1O 105652829 MSHFXYKJDBQFLO-UHFFFAOYSA-N 292.360 2.404 10 20 CECD CC(C)[C@@](C)(O)CNCc1ccc(N2CCOCC2)cc1 304002662 ADKLDAUKQAMTMH-KRWDZBQOSA-N 292.423 2.020 10 20 CECD COc1cccc(CNC(=O)OCC(F)(F)F)c1O 170791917 ITHCUWWLMYNEQA-UHFFFAOYSA-N 279.214 2.189 10 20 CECD CN(Cc1cscn1)C(=O)/C=C/c1ccc(O)c(O)c1 180978308 BJJRBKTYEWIPDL-HWKANZROSA-N 290.344 2.226 10 20 CECD Oc1cccc(Cl)c1CNCCn1ccnc1 83551407 TYRPCCMQWJOBDP-UHFFFAOYSA-N 251.717 2.032 10 20 CECD COc1cc(/C=C2/SC(=S)NC2=O)ccc1C 193405895 CLDRNTHLFSJYNI-UXBLZVDNSA-N 265.359 2.492 10 20 CECD Oc1ccc2ccccc2c1CN1CCn2cnnc2C1 96477789 ZBMOEDXLDVXOIQ-UHFFFAOYSA-N 280.331 2.153 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)C(C)(C)C 265057258 PVOLPAXKRZZFNS-UHFFFAOYSA-N 276.380 2.326 10 20 CECD OC[C@@H]1[C@H]2CN(Cc3cc(Cl)cc(Cl)c3O)C[C@H]21 368352509 SKZQKLKTUSWCEG-URLYPYJESA-N 288.174 2.369 10 20 CECD CN(C)c1ccc(CN[C@H]2C[C@@H](O)C2(C)C)cc1F 272322537 IRCLUYIBASXTLJ-UONOGXRCSA-N 266.360 2.141 10 20 CECD Cc1ccc(C(=O)N2CCCO[C@H](C(C)C)C2)c(O)c1O 294494695 QWHUDHHHWVOPES-ZDUSSCGKSA-N 293.363 2.293 10 20 CECD O=C(O)[C@@]12C[C@@H](NCc3c(O)cccc3Cl)C[C@@H]1C2 712947015 YLOPQGRNXQACBR-ITMYJUKJSA-N 281.739 2.389 10 20 CECD C[C@@H](NC[C@@H]1[C@H](C(=O)O)C1(F)F)c1ccccc1O 715282425 ZAYBGJGBDGAQJP-BCMRRPTOSA-N 271.263 2.009 10 20 CECD CCN(CC)C(=O)CNCc1cc(Cl)c(F)cc1O 816542216 HHARLJNTNWUINL-UHFFFAOYSA-N 288.750 2.143 10 20 CECD C[C@@H](NCC1CNC1)c1cccc(C(F)(F)F)c1O 817965349 PFIFDOLSEGHTRU-MRVPVSSYSA-N 274.286 2.281 10 20 CECD C[C@@H](NCCCNC1CC1)c1cc(F)ccc1O 817984613 VUQAIVHXSFIGJC-SNVBAGLBSA-N 252.333 2.324 10 20 CECD CN(CCCNC(=O)c1cc(O)cs1)CC(F)(F)F 731870169 RRSIIABGYLXNHU-UHFFFAOYSA-N 296.314 2.068 10 20 CECD C[C@H](C(=O)O)[C@@H](C)NCc1ccc(N(C)C)c(F)c1 901447878 JWLAIBZGHPSNFA-VHSXEESVSA-N 268.332 2.091 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@H](C)C(=O)O 901448808 NBVGDNVAKGIYTB-RYUDHWBXSA-N 264.369 2.260 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NOC(C)C 838480093 WIBTUAFNUGOIET-UHFFFAOYSA-N 265.357 2.200 10 20 CECD CCCN(Cc1cccc(F)c1O)[C@H]1CCNC1 843051625 AHIIHKCSQYMGTG-LBPRGKRZSA-N 252.333 2.105 10 20 CECD CCOc1ccc(CN[C@@H]2CCCC[C@@H]2CN)c(O)c1 841028715 CPBBMTKNDOJMBH-IUODEOHRSA-N 278.396 2.398 10 20 CECD CO[C@@H](C)CCc1nc(Cc2ccc(N)cc2)no1 843160369 XMNSBSNDTMCMEF-JTQLQIEISA-N 261.325 2.210 10 20 CECD C[C@@H]1C[C@H](NCc2cc(Cl)cc(F)c2O)CCN1 841062838 YHLORBPXJAURFS-LDYMZIIASA-N 272.751 2.415 10 20 CECD C[C@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1(C)C 841088004 WWNGAUXSJZIJTP-NSHDSACASA-N 289.379 2.102 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CCCN1 841936282 GSWWZAAZEMTFRV-AWEZNQCLSA-N 291.395 2.066 10 20 CECD Cc1cc(N(C)C)ccc1CNCCNC(=O)C(C)(C)C 840934927 ZSYZZGCUNWKOLK-UHFFFAOYSA-N 291.439 2.313 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](CN(C)C)C1 840915581 RETFAQDWXMBZCV-OAHLLOKOSA-N 275.440 2.445 10 20 CECD CCOc1cccc(CN[C@H]2CCC[C@H](N)C2)c1O 841055216 MALFFMGZSUQANF-STQMWFEESA-N 264.369 2.150 10 20 CECD NCC[C@@H](NCc1cccc(Cl)c1O)C(F)(F)F 841091276 WQYCAMQCWIPOLV-SECBINFHSA-N 282.693 2.415 10 20 CECD CC[C@@H](NCc1cc2c(cc1O)OCO2)[C@H](O)C(C)C 840966531 HLDDNUGZFCLPPX-IAQYHMDHSA-N 281.352 2.006 10 20 CECD C[C@H](C[S@](C)=O)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 757659327 YGBHBSZZFXGGMU-XQZNDVAUSA-N 285.384 2.436 10 20 CECD CS[C@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 42998860 TXJXGHLMZHJHKJ-LLVKDONJSA-N 266.410 2.463 10 20 CECD C[C@@H](NCCO[C@H]1CCOC1)c1cc(F)cc(F)c1O 927081880 YAWXVNYTFRGSPO-KOLCDFICSA-N 287.306 2.127 10 20 CECD Oc1ccccc1CN(C[C@@H]1CCCO1)c1cnccn1 853462040 HULSLSIVVRZIRV-AWEZNQCLSA-N 285.347 2.368 10 20 CECD C[C@H](NC(=O)/C=C\c1cn(C)cn1)c1ccc(N(C)C)cc1 935465362 QJRRJRGOVPKAEJ-SZNGSJQDSA-N 298.390 2.377 10 20 CECD CCCC[C@@H](C(=O)O)N(C)Cc1ccccc1O 829276406 KJOXQOMYEALHMG-LBPRGKRZSA-N 251.326 2.467 10 20 CECD CN(Cc1ccoc1)Cc1cc2c(cc1O)OCO2 769003279 DMLLTJVISPOMQS-UHFFFAOYSA-N 261.277 2.346 10 20 CECD CN(C)c1cc(F)c(CN2CCO[C@@H](CF)C2)cc1F 862391443 CISHBZDZDMWRFE-NSHDSACASA-N 288.313 2.201 10 20 CECD COc1cc(CN2CCCO[C@H](C)C2)c(O)cc1C 768446402 NRJRKKRNLCNMIJ-GFCCVEGCSA-N 265.353 2.320 10 20 CECD C[C@@H](NCc1ccno1)c1ccc(N2CCOCC2)cc1 775258111 QNDZQHWLDHMLJY-CYBMUJFWSA-N 287.363 2.362 10 20 CECD CC[C@@H](C[C@@H](C)CO)NCc1cc(F)ccc1O 779088638 SPIJDKVWCPCRTD-MFKMUULPSA-N 255.333 2.418 10 20 CECD C[C@H](NCCN1CCOC(C)(C)C1)c1c(O)cccc1F 886524267 HIEUSVAMKKZDRZ-LBPRGKRZSA-N 296.386 2.293 10 20 CECD CCCCCCN(C)CC(=O)NCc1ccc(O)c(O)c1 778919597 GNGZUNZJNPFLJU-UHFFFAOYSA-N 294.395 2.226 10 20 CECD OC[C@H](CC1CCC1)NCc1cc(F)cc(F)c1O 883107898 OPIODXNMLOBZSY-LBPRGKRZSA-N 271.307 2.311 10 20 CECD COc1ccc(CN(C)[C@H](CO)C(C)(C)C)c(O)c1OC 892178618 GQEJBEKDYHCAGO-CYBMUJFWSA-N 297.395 2.248 10 20 CECD COc1cc(O)c(CNC[C@H]2C=CCC2)cc1OC 895528651 YYJWIVNABBQKSM-NSHDSACASA-N 263.337 2.465 10 20 CECD COCCC1(NCc2ccc(OC)c(OC)c2O)CCC1 894169456 JJSYYSBTRXKEEV-UHFFFAOYSA-N 295.379 2.458 10 20 CECD COc1cc(C)cnc1C(=O)NCc1ccc(N(C)C)cc1 792577758 RPELGDKOXSNEGD-UHFFFAOYSA-N 299.374 2.395 10 20 CECD CCOc1cccc(CNC[C@H]2CC[C@H](C)O2)c1O 398072108 AHCCKYQYRVNMKM-WCQYABFASA-N 265.353 2.448 10 20 CECD C[C@H](N[C@@H](C)c1nncn1C)c1cc(F)ccc1O 94617329 SZGGYRKQBHWMMF-IUCAKERBSA-N 264.304 2.072 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCC[C@@H](F)C2)c1O 1329252242 GMIBMBHXDAYHGQ-VXGBXAGGSA-N 296.342 2.481 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC1(CC(N)=O)CC1 1331556579 JFBLQRPLLMIQSV-NEPJUHHUSA-N 288.391 2.494 10 20 CECD O=C(O)[C@@H](C[C@@H]1CCCO1)NCc1cccc(Cl)c1O 1601641570 MEVMBCIDZMRROM-CMPLNLGQSA-N 299.754 2.158 10 20 CECD C[C@@H](CC(F)F)C(=O)NCc1cccc(O)c1O 1548791548 PBRPJIXPKSOBHA-ZETCQYMHSA-N 259.252 2.005 10 20 CECD CC(C)n1nccc1NC(=O)Cc1ccc(N)cc1 19398241 MTPQQZLVHXEXFJ-UHFFFAOYSA-N 258.325 2.227 10 20 CECD C[C@H](NCCCCCCO)c1cc(C(=O)O)ccc1O 1593264150 GAGKKPLHHVFBRV-NSHDSACASA-N 281.352 2.294 10 20 CECD O=C(CCc1ccsc1)NCc1ccc(O)c(O)c1 159013281 NVLFDEMUZPNLCT-UHFFFAOYSA-N 277.345 2.408 10 20 CECD COC(=O)C(C)(C)NCc1ccc2c(c1)CCCO2 258875024 VBHZWZASDGAUCI-UHFFFAOYSA-N 263.337 2.053 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccccc2C1 126226846 CYAMUHKQNQVPIN-UHFFFAOYSA-N 269.300 2.296 10 20 CECD Cc1cccc(O)c1CN1CC[C@H]2CC[C@@H](C1)N2C 876765651 WFYKYSFIECKQLT-KGLIPLIRSA-N 260.381 2.369 10 20 CECD C[C@H]1CN(C)CC[C@@H]1N(C)Cc1cc(F)cc(F)c1O 894783208 QTWZINOWQXANEW-HZMBPMFUSA-N 284.350 2.442 10 20 CECD COc1ccc(O)c(CNC2CCN(C3CC3)CC2)c1 37140802 SORWBPUFHHEPHB-UHFFFAOYSA-N 276.380 2.117 10 20 CECD COc1cccc(CN2CCO[C@H](C(F)(F)F)C2)c1O 698971887 RBHWMILCGFWONX-NSHDSACASA-N 291.269 2.164 10 20 CECD COCCC(C)(C)NCc1cc2c(cc1O)OCO2 398062090 KLGGIYUVOUFBEP-UHFFFAOYSA-N 267.325 2.026 10 20 CECD Oc1cccc(Cl)c1CNCC1CC2(C1)OCCO2 922800134 MJKIGUTWQRRWCT-UHFFFAOYSA-N 283.755 2.288 10 20 CECD COc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3C)CC2)cc1F 177278506 DBBVAVARPVBFGA-WCQYABFASA-N 292.354 2.139 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C3CC3)on2)c1 178284223 WVIANRPLGLOUDO-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(NC=O)cc1 177077248 RADPZAVHBYOLPL-UHFFFAOYSA-N 284.315 2.233 10 20 CECD Cc1cccc2c1C(=O)N[C@H](c1cc3c(cc1O)OCO3)N2 63495966 KELHXSZFUKIBLS-OAHLLOKOSA-N 298.298 2.283 10 20 CECD CCC[C@H]1CN(Cc2ccccc2O)CCN1CCOC 179585253 YPSBLIMUXPSBOX-INIZCTEOSA-N 292.423 2.325 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1cc(OC)c(C)cc1O 179447780 CPQZMNQAVGRELS-ZDUSSCGKSA-N 293.363 2.237 10 20 CECD Cc1ccc(C(=O)N[C@@H]2COc3ccccc3C2)c(O)c1O 181986744 QJAIGSGSEAAPSG-LBPRGKRZSA-N 299.326 2.140 10 20 CECD C[C@@H](CN[C@@H](C)c1ccc(F)cc1O)CN1CCOCC1 185504797 OFELBBKJPNZENZ-STQMWFEESA-N 296.386 2.150 10 20 CECD COC(=O)C1(CNCc2cc(C)c(C)cc2O)CC1 188678761 HGNUGBORLFNABI-UHFFFAOYSA-N 263.337 2.052 10 20 CECD CCOCc1cc(CN[C@@H](CC)CO)ccc1OC 186517584 QXQQOVDKZAURFB-AWEZNQCLSA-N 267.369 2.092 10 20 CECD Cc1cc(O)ccc1NC(=O)c1cccc(O)c1O 126575028 DKBWCSRAHJDNAM-UHFFFAOYSA-N 259.261 2.364 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccccc2O)C[C@H]1C 188108980 IIUSLODHVDZUEL-YPMHNXCESA-N 263.337 2.023 10 20 CECD CN(CCc1ccccn1)Cc1cc2c(cc1O)OCO2 193229132 UVBCBPMNCGHBCL-UHFFFAOYSA-N 286.331 2.190 10 20 CECD COCCSCC(=O)N(C)Cc1ccc(N(C)C)cc1 46321260 CUPJYGUAUVNZPY-UHFFFAOYSA-N 296.436 2.091 10 20 CECD CC[C@@H](C)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 133831259 XCUWQWUKWFFGGX-GFCCVEGCSA-N 292.379 2.037 10 20 CECD CC[C@@]1(CO)CCCN1Cc1cc(OC)c(OC)cc1O 191956900 YFRUSJQNHSCXHP-INIZCTEOSA-N 295.379 2.146 10 20 CECD CO[C@@]1(C)C[C@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 237159512 ISRRGZGMBMCEAU-YOEHRIQHSA-N 290.407 2.473 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H]2CC(=O)N(C)C2)cc1 268899183 ZPUMCZSUWPLJEP-OCCSQVGLSA-N 275.396 2.024 10 20 CECD CN(c1ccc(CNC(=N)N)cc1)C1CCCCC1 263980265 QTAKAUODNRECBR-UHFFFAOYSA-N 260.385 2.439 10 20 CECD Cc1ccc([C@H](C)NCC2(C)OCCO2)c(O)c1C 273536986 XOXOSNYEHHOLCD-LBPRGKRZSA-N 265.353 2.423 10 20 CECD COC(=O)COc1ccc(N(C)CCOC2CCC2)cc1 287922027 WEMVPNQHDYJKCH-UHFFFAOYSA-N 293.363 2.244 10 20 CECD C[C@@H](NCCF)c1ccc(N2CCOCC2)c(F)c1 281204304 YHNHWIXWWBWURC-LLVKDONJSA-N 270.323 2.282 10 20 CECD Cc1ncc2n1CC[C@@H](C(=O)N(C)Cc1ccccc1O)C2 289946878 UQXJSDKDSURSLD-CYBMUJFWSA-N 299.374 2.118 10 20 CECD Cc1ccc(O)c(CNCCc2nccnc2C)c1 292902815 DUGQGQJHQODXDZ-UHFFFAOYSA-N 257.337 2.131 10 20 CECD Cc1cc(C)c(O)c(CN2CCOCC(F)(F)C2)c1 808235692 ZQLIWCQASHSPRO-UHFFFAOYSA-N 271.307 2.477 10 20 CECD COCCO[C@@H]1CCCN(Cc2cc(OC)ccc2O)C1 802652120 LZFPZMPOMFYFEP-OAHLLOKOSA-N 295.379 2.028 10 20 CECD O=Cc1c[nH]c(C(=O)NCCCSc2nccs2)c1 815590873 MAODZJDCPOTUTB-UHFFFAOYSA-N 295.389 2.196 10 20 CECD CN(Cc1ccc(Br)cc1O)C1(CO)CC1 827897914 BNQWCRCXSPFAPF-UHFFFAOYSA-N 286.169 2.111 10 20 CECD CN(C[C@H]1CCC=CO1)c1ccc(OCC(=O)O)cc1 902017603 XJFXENCYHNFWNQ-CQSZACIVSA-N 277.320 2.279 10 20 CECD O=C(NCc1ccccc1O)[C@]1(c2ccccc2)C[C@H](O)C1 901122042 CUPNWEQZPVKMNH-RHNCMZPLSA-N 297.354 2.101 10 20 CECD CO[C@H](C1CC1)[C@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 837012477 ISZNDQXNTMFCPX-GXMNCLBSSA-N 291.347 2.041 10 20 CECD O=C(NCCCOCC(F)(F)F)c1cc(O)cs1 732269858 ZHBPQNQVQKVPBB-UHFFFAOYSA-N 283.271 2.153 10 20 CECD CCCN(C)CC(=O)NCc1ccc2c(c1)CCCN2C 730098923 SGZWVQHJNDIIGA-UHFFFAOYSA-N 289.423 2.027 10 20 CECD CC1CCN([C@@H](C)CNC(=O)c2cc(O)cs2)CC1 731871421 KBBUMTBZVLPFSN-NSHDSACASA-N 282.409 2.304 10 20 CECD CC(C)(C)c1n[nH]cc1C(=O)NCc1ccc(O)cc1O 910943826 IGOKERQPBIBHCB-UHFFFAOYSA-N 289.335 2.048 10 20 CECD CC(C)[C@@H](N)CNCc1cc(Cl)cc([N+](=O)[O-])c1O 841028867 JMGWMVAHNGLHDZ-JTQLQIEISA-N 287.747 2.027 10 20 CECD COc1cccc([C@H](C)N[C@H]2CCc3c[nH]nc3C2)c1O 846144273 BXJMPEDPLYTPEZ-JQWIXIFHSA-N 287.363 2.332 10 20 CECD C[C@@H](N[C@H]1CCCN(C)C1=O)c1ccc(Cl)cc1O 841755106 NLZMGRSKSJWNDZ-SKDRFNHKSA-N 282.771 2.317 10 20 CECD Cc1cc(N(C)C)ccc1CNc1nc(C(=O)O)co1 844210466 YLPJHIYPVHWPKX-UHFFFAOYSA-N 275.308 2.359 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843058314 RNUKOFMVILZBED-IUCAKERBSA-N 299.758 2.123 10 20 CECD C[C@H](C(=O)NCc1ccc(N2CCOCC2)cc1)C1CC1 747907913 MLMBAXXCFZGXAB-ZDUSSCGKSA-N 288.391 2.186 10 20 CECD Nc1ccc(CCNC(=O)N2CCCC(F)(F)C2)cc1 846172408 LZRVPCZSZPOJNJ-UHFFFAOYSA-N 283.322 2.252 10 20 CECD CN(C)c1ccc(CNC(=O)C2CC(F)(F)C2)cc1 753570981 DMSYDXVVGBOAPU-UHFFFAOYSA-N 268.307 2.414 10 20 CECD COc1cc(O)c(CN[C@@]2(C)CCO[C@H]2C)cc1OC 753575203 GRSVXSHKGBNXKK-BONVTDFDSA-N 281.352 2.067 10 20 CECD Cc1ccc(O)c(CNC(=O)NC2C[C@H](C)O[C@@H](C)C2)c1 858337533 JPMHIRUAPNSXJR-RYUDHWBXSA-N 292.379 2.456 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C(=O)O)C(C)C)c1 43430581 MGFRQEVHTCSJQG-ZWNOBZJWSA-N 251.326 2.460 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)C2CC3(CC3)C2)cc1 852791736 LGVLXYGJJPFTLZ-OAHLLOKOSA-N 287.407 2.059 10 20 CECD COc1cc(N(C)CC2(C)COC2)c([N+](=O)[O-])cc1OC 858705835 IGHLPDJKBOUQFQ-UHFFFAOYSA-N 296.323 2.085 10 20 CECD CC[C@](C)(O)C(=O)NCc1cc(Cl)cc(Cl)c1O 935994510 YQSFZCXARHMPMX-LBPRGKRZSA-N 292.162 2.476 10 20 CECD COc1ccc(N(C)Cc2ccc(CO)o2)cc1OC 761221359 KZUYAUOBJCMUQK-UHFFFAOYSA-N 277.320 2.426 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@@H]1C 768466023 VNYTTXSUWUSDTR-JRPNMDOOSA-N 277.364 2.296 10 20 CECD CN1CCCc2cc(CNC(=O)c3coc(C=O)c3)ccc21 931152161 IVZNCGFKVIPICV-UHFFFAOYSA-N 298.342 2.405 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CC[C@@H](N)CC1 870888198 KTHZZCKKXCYXCK-OTVXOJSOSA-N 289.423 2.195 10 20 CECD CN(C)c1ccc(CN[C@@H](CC2CC2)C(=O)O)cc1 871883985 FNWZQHLDZBVRIK-AWEZNQCLSA-N 262.353 2.096 10 20 CECD C[C@H](C(=O)NCc1ccc(O)c(O)c1)c1ccco1 778918143 MMEJTKMQFQRJJU-VIFPVBQESA-N 261.277 2.111 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3COC[C@H]3C2)cc1 872319228 BJIOCBNFNWIJDP-GASCZTMLSA-N 260.381 2.221 10 20 CECD Cc1cc(CN[C@H](C)c2c(O)cccc2F)n(C)n1 886606815 GVXIGWNNYWVWBK-SNVBAGLBSA-N 263.316 2.424 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3c(C)cccc32)cn1 773805566 OJFXNJUARKRZSL-SREVYHEPSA-N 295.342 2.396 10 20 CECD CN(Cc1cn[nH]c1)Cc1cc(F)cc(F)c1O 894028971 WDPZMJWHJXPZNP-UHFFFAOYSA-N 253.252 2.026 10 20 CECD C[C@@H](NC(=O)N[C@H]1CCC[C@H](N)C1)c1ccccc1O 892090624 WZAODFGDGQJJJL-WOPDTQHZSA-N 277.368 2.022 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@@]1(C)CO 895345507 VDRRZYLFNUUWDA-OTYXRUKQSA-N 271.307 2.121 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H]([C@H](C)O)C2)c1O 894423539 TWGDOJXZDNZBFF-QWHCGFSZSA-N 279.380 2.302 10 20 CECD CCC[C@@H](NCc1ccc(OCC)cc1O)C(=O)OC 897835372 ARPSMCNJHBQVKZ-CYBMUJFWSA-N 281.352 2.222 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H]1C(=O)O 86774305 BUESLUCQKLJYOI-KWQFWETISA-N 269.728 2.198 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)c2ncnn2C)c1O 276470759 MSNSRGKJZSZAQM-QMMMGPOBSA-N 296.758 2.034 10 20 CECD C[C@H](NC(=O)CC(C)(C)O)c1ccc(N(C)C)cc1 792332166 GHGHISCEHWBVAP-NSHDSACASA-N 264.369 2.091 10 20 CECD CC[C@@H]1C[C@@H](C(=O)NCc2ccc(OC)cc2O)CCO1 794387463 JDAQMJFYGAKTQS-WCQYABFASA-N 293.363 2.222 10 20 CECD C[C@@H](N[C@H](CO)CC1CC1)c1cc(F)ccc1O 756769070 JBOSNDSUWBPXRZ-SKDRFNHKSA-N 253.317 2.343 10 20 CECD C[C@@H]1CN(C/C=C/c2ccc(N(C)C)cc2)C[C@H]1C(=O)O 1599866929 LDDPAGMUMRHKRZ-LVQRLBQTSA-N 288.391 2.418 10 20 CECD CCN(C)c1ccc(CN2[C@H](C(=O)O)[C@H]3C=C[C@H]2C3)cc1 1776855501 FUHNFJTWIOOULA-BPUTZDHNSA-N 286.375 2.356 10 20 CECD C[C@@H](N)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 166470670 RERFLIOPZIZFEJ-CYBMUJFWSA-N 289.423 2.419 10 20 CECD COc1ccc(O)c(CN[C@@H](C)[C@@H]2CCCO2)c1 20208955 ASOCTUIMADJRAU-HZMBPMFUSA-N 251.326 2.058 10 20 CECD CCOc1cccc(CNCCC(=O)NC(C)(C)C)c1O 134592206 FLSXRFDSAFQKOB-UHFFFAOYSA-N 294.395 2.185 10 20 CECD COc1cccc(O)c1CNCC[C@@H]1C[C@H]2CC[C@H]1O2 839162629 BJPGUPCAWZOIGN-LALPHHSUSA-N 277.364 2.448 10 20 CECD Nc1ccc(CC(=O)NC[C@@H]2C[C@H]3CC[C@H]2C3)cc1 250243676 JIWDUGXWRPLLEL-IHRRRGAJSA-N 258.365 2.364 10 20 CECD Cc1cccc(CNCCCOC[C@@H]2CCCO2)c1O 158080385 QDTJUSRBODRFCU-HNNXBMFYSA-N 279.380 2.376 10 20 CECD Nc1ccc(CC(=O)NCCc2cccc(F)c2)cc1 36778501 HAMRNWQEVFZJCL-UHFFFAOYSA-N 272.323 2.309 10 20 CECD COC1(C)CCN(Cc2cc3c(cc2O)OCO3)CC1 271586993 DSLDLJLMZCSHHM-UHFFFAOYSA-N 279.336 2.122 10 20 CECD CC(C)OCCC(=O)N(C)Cc1ccccc1O 298816199 YGRORLCBADUKRF-UHFFFAOYSA-N 251.326 2.166 10 20 CECD C[C@@H](CNC(=O)c1cccc(O)c1O)CC(F)(F)F 397047226 PZSDBAJIBBAYLB-SSDOTTSWSA-N 277.242 2.416 10 20 CECD NCC1CCN(Cc2ccc(Cl)cc2O)CC1 1205040824 JIHDZJMXGQVBRQ-UHFFFAOYSA-N 254.761 2.216 10 20 CECD CCN(CCC(=O)OC)Cc1cc(F)cc(C(C)=O)c1O 175612465 LGZFVRYORBBAPN-UHFFFAOYSA-N 297.326 2.119 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCNC2)cc1 178711236 RLRYBHOENBKURP-OAHLLOKOSA-N 289.423 2.149 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCOC(C)C 115279922 CIAFLSUWGJORQP-UHFFFAOYSA-N 278.396 2.492 10 20 CECD COc1ccc(O)c(CNC(=O)CSC(F)(F)F)c1 114543645 DEFUJLFCWNPCJE-UHFFFAOYSA-N 295.282 2.270 10 20 CECD CCN(Cc1cc(C)ccc1O)C[C@@H](O)C(F)(F)F 189880888 NFBDIZHDAOYGSU-GFCCVEGCSA-N 277.286 2.446 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)[C@H]1CCOC1=O 127210646 ACBVJIXORQTBLR-INIZCTEOSA-N 288.391 2.424 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Cc2ccncc2)c1 121734846 LMTCWQHPOFVPEQ-NSHDSACASA-N 286.331 2.216 10 20 CECD CCCN(CCN(CC)CC)C(=O)c1cccc(O)c1O 193164246 GYFGZEKWDRLCBB-UHFFFAOYSA-N 294.395 2.292 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1cnsn1 47832724 NAVHEECRSOUMRH-UHFFFAOYSA-N 288.376 2.068 10 20 CECD Cc1cc(C(=O)NC[C@H](C)O)c(C)n1-c1ccc(F)cc1 97178959 LZZFOYJFWKNSDX-NSHDSACASA-N 290.338 2.344 10 20 CECD COc1cccc(CN2CCC[C@@H]2C[C@H](C)O)c1O 93482923 NTZMHZATWDNPCR-WCQYABFASA-N 265.353 2.136 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)CC[C@H]1N 252501444 CGBVNTLKENAFBZ-BXKDBHETSA-N 254.761 2.215 10 20 CECD C[C@@H](NCc1nccn1C)c1ccc(F)c(F)c1O 276992280 XTUGKTCEKFANLA-MRVPVSSYSA-N 267.279 2.255 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCO[C@H](C(C)C)C2)c(O)c1O 272909362 CVNDAMNVSGZSPF-YPMHNXCESA-N 293.363 2.340 10 20 CECD C[C@@H]1C[C@@H](C)CN(C(=O)c2c(F)ccc(O)c2O)C1 276659983 MMYFZLOJHJEHSO-RKDXNWHRSA-N 267.300 2.355 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@H]2CCC[C@@H]2C1 276546036 GSZDOEZSVBLIBR-RKDXNWHRSA-N 265.284 2.109 10 20 CECD C[C@@H](N[C@@H]1CCSC1)c1cc([N+](=O)[O-])ccc1O 273488182 NRSLSBMMOUYCMF-RKDXNWHRSA-N 268.338 2.457 10 20 CECD C[C@@H](CO)CCCNCc1ccc(N(C)C)c(F)c1 270311544 VBQMWUXWHOQILL-GFCCVEGCSA-N 268.376 2.390 10 20 CECD Cc1cccc(CN2CCOC[C@H]2[C@@H]2CCCC2=O)c1O 375472593 WZIBSEGEINBOLY-GJZGRUSLSA-N 289.375 2.271 10 20 CECD CC[C@H](NCC(C)(C)OCCO)c1ccc(F)cc1O 287331377 MLRHFBXDTFKGIF-ZDUSSCGKSA-N 285.359 2.360 10 20 CECD CNC(=O)[C@]1(C)CCN(Cc2ccc(N(C)C)c(C)c2)C1 294245681 UHKHUMIKKOROBB-QGZVFWFLSA-N 289.423 2.019 10 20 CECD CCC1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 292954859 VOSZMAGOCDNYPV-FNORWQNLSA-N 261.321 2.370 10 20 CECD CN(C)c1ccc(CNC(=O)CSC(F)F)cc1 294362211 JUHMCXSJYGRUTF-UHFFFAOYSA-N 274.336 2.325 10 20 CECD CC[C@@H](N[C@@H]1CCNC1)c1cccc(Cl)c1O 817945337 ZTPKLTVXYOYTIB-BXKDBHETSA-N 254.761 2.448 10 20 CECD CC(C)N1CCC[C@H]1C(=O)N[C@H](C)c1ccccc1O 828539545 PYHMEOAXEODIPM-OCCSQVGLSA-N 276.380 2.442 10 20 CECD COc1cc(N2CC[C@H](F)C2)c([N+](=O)[O-])cc1OC 828448813 JPQKFGHAWORUOK-QMMMGPOBSA-N 270.260 2.160 10 20 CECD CC(C)N(CCO)Cc1ccc(Br)cc1O 824523461 ZGXAGOVPVHDFQF-UHFFFAOYSA-N 288.185 2.357 10 20 CECD CCOc1cccc(CN(C)C2(CO)CCC2)c1O 827903812 PTJLRXMGBCYGBH-UHFFFAOYSA-N 265.353 2.138 10 20 CECD COc1cccc(CN[C@@H](C2CC2)[C@H](CO)C2CC2)c1O 824846242 QIQIZGJKTNUVOE-ZBFHGGJFSA-N 291.391 2.288 10 20 CECD COc1cccc(NC(=O)c2cccc(O)c2O)c1F 690020770 OZIXYDDQAKLRRU-UHFFFAOYSA-N 277.251 2.498 10 20 CECD COc1ccc(N(CC(=O)N2CCC2)CC(C)C)cc1 746170070 MFQQRSMIVMUASJ-UHFFFAOYSA-N 276.380 2.390 10 20 CECD C[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)CC1 841114884 JAXQYUYMQHICEA-WCQYABFASA-N 289.379 2.292 10 20 CECD CCOCCOC1CN(Cc2ccc(N(C)C)cc2C)C1 840937661 VSKLMEPGSSTYQD-UHFFFAOYSA-N 292.423 2.298 10 20 CECD COc1cccc(CN2CCC([C@H]3CCNC3)CC2)c1O 843127083 OJCAFKFURUUSNK-AWEZNQCLSA-N 290.407 2.222 10 20 CECD O=C(C[C@H]1C=CCCC1)NCc1ccc(O)cc1O 910947458 FJFKNFDAXSCLPF-NSHDSACASA-N 261.321 2.460 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 843057673 QNWRQSALDOKRMO-IUCAKERBSA-N 272.751 2.354 10 20 CECD CC[C@@H](O)CCCNC(=O)NCc1ccc(N(C)C)cc1 743810989 JFWZSQWTOOBTCO-OAHLLOKOSA-N 293.411 2.103 10 20 CECD O=C(CSc1ncc(Cl)s1)NC1CCOCC1 849998752 JFRKKOJOJACTFP-UHFFFAOYSA-N 292.813 2.184 10 20 CECD Cc1nc(COC(=O)/C=C\c2ccc(O)c(O)c2)oc1C 759788678 JEAKTGITQBWTIG-XQRVVYSFSA-N 289.287 2.459 10 20 CECD COc1ccc(N(C)CCOC2CC2)cc1OC 929348574 RFGOAVBDJIGBLH-UHFFFAOYSA-N 251.326 2.319 10 20 CECD Cc1nccnc1C(=O)N(C)Cc1ccc(N(C)C)cc1 854324983 UPWBJHLLOYUOTB-UHFFFAOYSA-N 284.363 2.123 10 20 CECD CCn1cnnc1CN[C@H](C)c1cc(F)cc(F)c1O 756420354 JIQPVSGRXIOTMY-MRVPVSSYSA-N 282.294 2.133 10 20 CECD CC(C)[C@](C)(O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756576309 MEPXOEBBVHGYKD-QMTHXVAHSA-N 282.340 2.358 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccnn1CC 935947991 IYCJCIOXWFIYHR-UHFFFAOYSA-N 294.351 2.024 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C(C)C)n(C)n2)c1 862757735 CYYWCZCKYLDTTD-UHFFFAOYSA-N 287.363 2.488 10 20 CECD CCOc1ccc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)c(O)c1 863740562 XREQEGMGYBCZHH-SMDDNHRTSA-N 293.363 2.334 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](C)OCC(C)C)c1 862759279 ZZCJOVZELICSFQ-LBPRGKRZSA-N 265.353 2.378 10 20 CECD C[C@@H](NCCC1CC(O)C1)c1cc([N+](=O)[O-])ccc1O 762650740 RLGRAYDMXUACFB-GRZMOONWSA-N 280.324 2.112 10 20 CECD CSCCCCC(=O)NCc1ccc(N)cc1 1341923780 OYKHABRJHFYAHD-UHFFFAOYSA-N 252.383 2.418 10 20 CECD Cn1cc(/C=C\C(=O)N2CCc3cccc(F)c32)cn1 768585770 GVEIHFLEUWJTAN-WAYWQWQTSA-N 271.295 2.162 10 20 CECD CC[C@H]1CN(Cc2c(C)cccc2O)C[C@H](C)S1(=O)=O 877522091 MMCWFQRIZFFTRU-STQMWFEESA-N 297.420 2.098 10 20 CECD Cc1ccc(CNCc2nc(C(C)C)n[nH]2)c(O)c1 877560657 XLIVWMRUNDLKOL-UHFFFAOYSA-N 260.341 2.232 10 20 CECD Cc1ccc(CNC(C)(C)C(=O)N2CCCC2)c(O)c1 877494577 YMKYMQUNJOOJHF-UHFFFAOYSA-N 276.380 2.191 10 20 CECD Cc1cc(N(C)C)ccc1CNc1nnc(C)c(C)n1 775476494 BNUHNSAGOHLBGK-UHFFFAOYSA-N 271.368 2.475 10 20 CECD C[C@H](NCc1cc(F)ccc1O)C1CCNCC1 873222112 AALMKXRYRBNIOX-JTQLQIEISA-N 252.333 2.009 10 20 CECD CCOC(=O)CN(CC)Cc1ccc(C)cc1O 876633304 SMACQCZDUBQHNW-UHFFFAOYSA-N 251.326 2.086 10 20 CECD C[C@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H](C)S1 779487501 HCHNSFCMYMEZRK-FOYPTKHBSA-N 293.388 2.463 10 20 CECD CCN(C)c1ccc(Cn2cc(-c3cnn(C)c3)nn2)cc1 881315211 NXHAKNXFKVNRBT-UHFFFAOYSA-N 296.378 2.183 10 20 CECD CCOC(=O)[C@H](NCc1ccc(OCC)cc1O)C1CC1 1326218399 FZVFFLUGRPBZNK-OAHLLOKOSA-N 293.363 2.222 10 20 CECD CN(C)[C@H]1CCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 1327676392 WYXSPCRBLKUMRD-KGLIPLIRSA-N 293.367 2.263 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)NCc1ccc(N)cc1 1335464841 JAIKQVKHUGPWFS-NSHDSACASA-N 279.384 2.272 10 20 CECD CN(c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-])C1CC1 208249536 OEGGMMUONISMSA-CLTKARDFSA-N 262.265 2.291 10 20 CECD COC[C@H](NC(=O)NCc1ccc(N)cc1)c1ccco1 1357669317 ZBWBUSBGRVVMSF-ZDUSSCGKSA-N 289.335 2.049 10 20 CECD Cc1cc(Cn2cc(C(=O)O)nc2C)ccc1N(C)C 1600221732 HTOLDEOFLBWJBV-UHFFFAOYSA-N 273.336 2.312 10 20 CECD CN(C)c1ccc(OCCC2(O)CCC2)cc1C(=O)O 1606058571 DPKJDJXHCSRJNR-UHFFFAOYSA-N 279.336 2.135 10 20 CECD CC(C)OC1(C(=O)NCCc2ccc(N)cc2)CCC1 1575741259 NLAXWNXZIOWHCW-UHFFFAOYSA-N 276.380 2.275 10 20 CECD C[C@H](N[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589955877 NBAIXZSJOAFGKK-MMWGEVLESA-N 285.351 2.021 10 20 CECD CC(F)(F)C[C@H](NCc1cc(F)cc(F)c1O)C(=O)O 1776443201 YMOJBHCPSMPLIH-VIFPVBQESA-N 295.232 2.259 10 20 CECD COC(=O)CC(C)(C)NCc1ccc2c(c1)CCCO2 921770200 HQZBCUASYXYHHE-UHFFFAOYSA-N 277.364 2.443 10 20 CECD c1cc2c(cc1CN[C@@H]1CCN3CCC[C@H]3C1)CCO2 252674529 RUIHHLKIMKYEFW-CVEARBPZSA-N 272.392 2.338 10 20 CECD COC(=O)[C@@H](CC(C)C)NCc1ccc2c(c1)CCO2 37363255 DYIXGQCOHBMSTC-CQSZACIVSA-N 277.364 2.299 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cc(C)[nH]n2)c1 716493206 KHPLCCNYFNQGHC-JTQLQIEISA-N 261.325 2.283 10 20 CECD COc1cc(-c2nc3ccc(C)nc3[nH]2)cc(O)c1O 178979785 VIQPCHCQCDJCCE-UHFFFAOYSA-N 271.276 2.353 10 20 CECD CCN(CC(=O)N(C)C)Cc1ccc(N2CCCC2)cc1 1341523684 ZOWIYBVGCBLXNF-UHFFFAOYSA-N 289.423 2.197 10 20 CECD COCCC(C)(C)C(=O)NCc1cccc(OC)c1O 183976088 JVUODUSHVBBQSY-UHFFFAOYSA-N 281.352 2.080 10 20 CECD CN(C)c1ccc(CNC(=O)/C=C/c2ccc[nH]2)cc1 189609846 VXNPUBGADIGCIW-JXMROGBWSA-N 269.348 2.410 10 20 CECD CCOCCN1CCN(Cc2c(O)cccc2Cl)CC1 127459852 YBEHDODFKWFSTC-UHFFFAOYSA-N 298.814 2.200 10 20 CECD C[C@@H](NC[C@H]1CC[C@H](O)C1)c1ccc(F)c(F)c1O 189335268 NZLIZKLRHUNWMI-UTLUCORTSA-N 271.307 2.482 10 20 CECD C[C@@H]1COCC[C@H]1NCc1ccc(N(C)C)c(F)c1 191757997 CQFOHCNFTBNOBH-BXUZGUMPSA-N 266.360 2.406 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)[C@H](C)N 192026917 DFRKFSOZBAYXEJ-RYUDHWBXSA-N 264.369 2.114 10 20 CECD CC[C@@H](C(=O)N(C)Cc1ccccc1O)N(CC)CC 267349068 GBQSZNHMVQCHMC-AWEZNQCLSA-N 278.396 2.471 10 20 CECD Cc1cc(C(=O)NCc2ccccc2O)c(C)n1C 269169964 YLWVZYNKFGSSDH-UHFFFAOYSA-N 258.321 2.278 10 20 CECD O=C(CSC[C@H]1CCCCO1)NCc1ccccc1O 263872188 NIBTUNNNBBIJIA-CYBMUJFWSA-N 295.404 2.311 10 20 CECD C[C@H](NCCC[C@@H](C)CO)c1cc([N+](=O)[O-])ccc1O 273359606 DLHUSNJLNZHSQD-MNOVXSKESA-N 282.340 2.360 10 20 CECD CC[C@@H](NCCc1n[nH]c(C)n1)c1ccc(N(C)C)cc1 272553963 MPGKBXVWVDIQCK-OAHLLOKOSA-N 287.411 2.463 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(C(N)=O)CCCC2)c1 273562961 IQKKBMWVZMSRST-NSHDSACASA-N 292.379 2.097 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCOC[C@H]2C)cc1OC 289236821 DJZGRXNPDOVMEI-NEPJUHHUSA-N 295.379 2.172 10 20 CECD Cc1cc(C(=O)N2CCCOC2)c(C)n1-c1ccccn1 288499539 UFCOSIILBIWFRX-UHFFFAOYSA-N 285.347 2.309 10 20 CECD c1cnc(CCNCc2ccc(N3CCCC3)cc2)cn1 389944747 MHCPJUDHQBVYSR-UHFFFAOYSA-N 282.391 2.409 10 20 CECD Cc1nc(C(=O)NCc2ccc(N(C)C)c(F)c2)c(C)o1 293053251 PJZBIKMUNVJOFQ-UHFFFAOYSA-N 291.326 2.427 10 20 CECD CC(=O)C(=O)COC(=O)COc1ccccc1C(C)(C)C 808491758 RCXDHYWKRLKHPE-UHFFFAOYSA-N 292.331 2.064 10 20 CECD CC(C)(C)C(=O)CCCC(=O)NCc1ccc(O)c(O)c1 296218404 CZGMPMDONVXNIQ-UHFFFAOYSA-N 293.363 2.500 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H]2COC[C@@H]2OC)cc1 290311680 ZVTWRWXYVSXHGR-KCXAZCMYSA-N 278.396 2.207 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H]2CNCCCO2)c(O)c1 817981907 OIUGOSWZPSSULL-UONOGXRCSA-N 278.396 2.038 10 20 CECD C[C@@](CO)(NCc1cc(Cl)c(F)cc1O)C1CC1 816564199 XQGFIESQLRZWQE-ZDUSSCGKSA-N 273.735 2.435 10 20 CECD Cc1c(C)n(C)c2ccc(OC(=O)c3cn(C)nn3)cc12 817760569 AGKXGVWBPKUKJO-UHFFFAOYSA-N 284.319 2.143 10 20 CECD O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1ccc(O)c(O)c1 827316994 LOLSLHMTQNUQLY-WOPDTQHZSA-N 261.321 2.150 10 20 CECD C[C@@H](CC(=O)N[C@H](C)c1ccccc1O)c1cnn(C)c1 827952508 VWZMZFQCXGUORO-NWDGAFQWSA-N 287.363 2.497 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1(C(=O)O)CC1 901505545 WAZQQPIMLXNDCB-UHFFFAOYSA-N 262.353 2.015 10 20 CECD Cc1nccc(C(=O)NCCCSc2nccs2)n1 733974813 MEXITKQZDFTGFT-UHFFFAOYSA-N 294.405 2.154 10 20 CECD CC[C@H](C)CC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832278533 DSEJKEIAMDQAGW-WFASDCNBSA-N 277.412 2.305 10 20 CECD CCc1cccc(CNC[C@]2(N(C)C)CCSC2)c1O 848897434 ITAWVKPECSRQRW-MRXNPFEDSA-N 294.464 2.482 10 20 CECD N[C@H]1CCC[C@@H](NCc2cc(Cl)ccc2O)C1 841055257 MQRKPOJNAATIOP-NWDGAFQWSA-N 254.761 2.405 10 20 CECD NC1(CNCc2cc(Cl)cc([N+](=O)[O-])c2O)CCCC1 849350284 WTSPVNALTRXPPV-UHFFFAOYSA-N 299.758 2.315 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2CCN)c1O 843384953 LQJFMLCVWIXFAD-CQSZACIVSA-N 294.370 2.437 10 20 CECD COc1cccc([C@H](C)NCc2cc(C)ncn2)c1O 846157958 QBANTBPXAGZACO-NSHDSACASA-N 273.336 2.350 10 20 CECD CCC[C@@H]1C[C@H]1NC(=O)NCCc1ccc(N)cc1 841894161 SNCWXICLKBLXJS-TZMCWYRMSA-N 261.369 2.299 10 20 CECD COc1cc(C)nc(NNC(=S)Nc2ccccc2)n1 747654197 LUSSWLLTWAXEJT-UHFFFAOYSA-N 289.364 2.107 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)[C@@H](C)OC)c1O 846168454 CWNGTJZJWXWUBK-GMTAPVOTSA-N 253.342 2.475 10 20 CECD Oc1ccc(F)cc1CN(C1CCNCC1)C1CC1 843043797 HSLZHTMOWGVUMI-UHFFFAOYSA-N 264.344 2.248 10 20 CECD COc1nc(C)ccc1C(=O)NCc1cc(C)ccc1O 862757117 IASMCASERFVUNX-UHFFFAOYSA-N 286.331 2.343 10 20 CECD CCN(C(=O)/C=C\c1cn(C)cn1)c1ccc(OC)cc1 930065873 BMVGVIYCDZUINS-YHYXMXQVSA-N 285.347 2.495 10 20 CECD COC(=O)[C@@H]1CC12CCN(Cc1c(C)cccc1O)CC2 876739246 BTGBLZWRGKMILO-AWEZNQCLSA-N 289.375 2.476 10 20 CECD CC[C@@H](N[C@@H]1CCOC[C@H]1O)c1cc(Cl)ccc1O 872141115 MPBZTLMDGSDELD-YRGRVCCFSA-N 285.771 2.236 10 20 CECD OC[C@@H](NCc1cc(Cl)cc(F)c1O)C1CC1 776177525 RHYFPNASTPVXFG-LLVKDONJSA-N 259.708 2.045 10 20 CECD Cc1nccnc1CCNCc1cc(F)cc(F)c1O 883131371 ZBKSHIKOVKVQAD-UHFFFAOYSA-N 279.290 2.101 10 20 CECD CCCN(CC)CCNCc1ccc(OC)c(OC)c1O 1120030595 DMKXRFJEOXXZAM-UHFFFAOYSA-N 296.411 2.231 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@H]1F 1121112388 XYMWXVQIXMEYBN-QWHCGFSZSA-N 250.317 2.035 10 20 CECD CCc1cccc(CN2[C@H](C)C(=O)N[C@H](C)[C@H]2C)c1O 895123753 ZCHTXGGXVAKGFY-IJLUTSLNSA-N 276.380 2.052 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCC(=O)[C@H](C)C2)c(O)c1 794386776 AEOBCKZSPVEEEV-MNOVXSKESA-N 291.347 2.022 10 20 CECD C[C@H](O)C[C@@H](C)NCc1c(O)cccc1Br 706871591 LOTYYSWAMJNLBA-BDAKNGLRSA-N 288.185 2.404 10 20 CECD CON(C(=O)c1cccc(O)c1O)C1CCCC1 790933270 ZNCIMDCRMHCLHD-UHFFFAOYSA-N 251.282 2.044 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ncc(Cl)s1 1321189853 LTKKQAIVMVXWMT-UHFFFAOYSA-N 298.751 2.180 10 20 CECD CC1(C)C[C@@H](C(=O)NCc2ccccc2O)CCO1 1182026277 JNWVUUFODSGSOP-NSHDSACASA-N 263.337 2.214 10 20 CECD CCN(CC1CC1)c1nnc(-c2sccc2O)n1C 1337957228 NKPNQIHVOGJVOV-UHFFFAOYSA-N 278.381 2.486 10 20 CECD CCn1ccc(Nc2nnc(-c3sccc3O)n2C)n1 1341281887 ZCOXTLNMILYOKC-UHFFFAOYSA-N 290.352 2.209 10 20 CECD CC(C)(C)c1[nH]cnc1C(=O)NCc1cccc(O)c1O 1352669891 LYQLTOMYFQTMQC-UHFFFAOYSA-N 289.335 2.048 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CCO)COC)cc1 219132015 KNVPDXBVQAWVBC-HNNXBMFYSA-N 280.412 2.020 10 20 CECD Cc1oc(C(=O)O)cc1COc1ccc(N)c([N+](=O)[O-])c1 1600831636 GIWDMYCLCHJKEC-UHFFFAOYSA-N 292.247 2.356 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1cc(F)cc(F)c1O 1604904011 ZSOBQECVNUWRKE-ZDUSSCGKSA-N 273.279 2.403 10 20 CECD COc1ccc(C)c2c1N(C(=O)C1=CC[C@H](N)C1)CCC2 1579198447 UPGPWMKPUIWPRW-ZDUSSCGKSA-N 286.375 2.330 10 20 CECD C[C@@H]1CCCN(Cc2ccc(F)c(F)c2O)[C@@H]1C(=O)O 1589333885 FBYMVLWUQUCQTH-PELKAZGASA-N 285.290 2.356 10 20 CECD CCN1CCc2cc(CN[C@H](C(=O)O)[C@H]3C[C@H]3C)ccc21 1776884725 NCBHKPJNJZOTLV-WPGHFRTFSA-N 288.391 2.268 10 20 CECD Cc1ccc(O)c([C@H](C)NCCO[C@H]2CCOC2)c1 927079949 IJDXWGZXZLXUCJ-STQMWFEESA-N 265.353 2.157 10 20 CECD CC[C@@H](N[C@H]1CCN(C(C)C)C1=O)c1ccccc1O 183338889 IXMMHCNEGPJQQW-KGLIPLIRSA-N 276.380 2.442 10 20 CECD O[C@@H](CNCc1ccc2c(c1)CCO2)c1ccco1 78820806 VUBPAJHMHKHQAS-ZDUSSCGKSA-N 259.305 2.038 10 20 CECD Cn1cc(Cl)c(CNCc2cc(F)ccc2O)n1 393499295 KNJKFZLOAIGXGG-UHFFFAOYSA-N 269.707 2.208 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccccn1 115780462 XWVSUQASPGMQRZ-UHFFFAOYSA-N 298.390 2.455 10 20 CECD Cc1cccnc1CNC(=O)N(C)Cc1ccccc1O 105288373 HUUDUYLJHFUDJD-UHFFFAOYSA-N 285.347 2.437 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)OC 55501370 XMUDRJLFNOVKJX-GFCCVEGCSA-N 264.369 2.136 10 20 CECD COCCN(CCOC)Cc1cccc(Cl)c1O 124509089 XHASGXPXURYSBM-UHFFFAOYSA-N 273.760 2.140 10 20 CECD C[C@@H]1CSCCN1C(=O)NCc1ccc(N(C)C)cc1 172334135 XAWLPVPFDWEJRP-GFCCVEGCSA-N 293.436 2.400 10 20 CECD O=C(Cc1cncs1)NCCCSc1nccs1 187916494 OYAFRPFXDZOSTF-UHFFFAOYSA-N 299.446 2.441 10 20 CECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(C)C 121234779 IPXUHVZWMBMUJB-UHFFFAOYSA-N 271.744 2.429 10 20 CECD C[C@H]1CC[C@@H](CCC(=O)NCCc2ccc(O)c(O)c2)O1 122190448 JWIIVBXOXQORSD-AAEUAGOBSA-N 293.363 2.104 10 20 CECD COc1ccc(O)c(CNC(=O)NCC=C(C)C)c1 188958939 ICIRJVNLUAFRGX-UHFFFAOYSA-N 264.325 2.166 10 20 CECD CO[C@@H](CNC(=O)NCc1ccc(N(C)C)cc1)C(C)C 72930522 SMKDTAMQPZVWMO-HNNXBMFYSA-N 293.411 2.223 10 20 CECD Oc1c(Cl)cccc1CN1CCO[C@@H]([C@H]2CCCO2)C1 246009598 YDXCLLBCPRPKIB-ZIAGYGMSSA-N 297.782 2.425 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@]1(O)CCO[C@@H]1C 228064157 GCXKZVFSGFFWTJ-FJZAXULXSA-N 291.391 2.378 10 20 CECD COCC(C)(C)C(=O)NCCCSc1nccs1 134070119 WJUMRVMPKMJTJG-UHFFFAOYSA-N 288.438 2.414 10 20 CECD CCO[C@H](CCNC(=O)c1cccc(O)c1O)C(C)C 193117933 AZKVCDPOHSTZIG-CYBMUJFWSA-N 281.352 2.279 10 20 CECD COCCOC1CCN(Cc2cccc(OC)c2O)CC1 93339604 JAVNUUZGWAVUDY-UHFFFAOYSA-N 295.379 2.028 10 20 CECD Oc1c(Cl)cccc1CN1CCO[C@H]([C@@H]2CCCO2)C1 180707531 YDXCLLBCPRPKIB-KBPBESRZSA-N 297.782 2.425 10 20 CECD CC[C@H](NCc1cc(Br)ccc1O)[C@@H](C)O 386816556 SRQAISCJMMLULQ-KCJUWKMLSA-N 288.185 2.404 10 20 CECD CCC(CC)(CC(=O)OC)NC(=O)Cc1ccc(N)cc1 262657520 ZSMYENZOXFVSPT-UHFFFAOYSA-N 292.379 2.049 10 20 CECD COCCN(CCCCCO)c1ccc(OC)c(OC)c1 266863651 LOLYGMMZPUBRRY-UHFFFAOYSA-N 297.395 2.319 10 20 CECD COc1ccc(O)c(CNC[C@](C)(O)c2ccsc2)c1 271857660 VDTIYXSMSBJTCP-HNNXBMFYSA-N 293.388 2.460 10 20 CECD C[C@H](N[C@H]1CCO[C@@H]1C)c1ccc(F)c(F)c1O 276894759 IGBWSPNDGRUOPH-RNSXUZJQSA-N 257.280 2.498 10 20 CECD CCN1C[C@H](N[C@@H]2C[C@@H](C)c3c(C)ccc(O)c32)CC1=O 391498810 IEKORWIUEKREMU-JHJVBQTASA-N 288.391 2.459 10 20 CECD CN1CCCc2cc(CNC(=O)c3cc(C=O)c[nH]3)ccc21 292857000 AKHLKYGREONQJU-UHFFFAOYSA-N 297.358 2.140 10 20 CECD C[C@H](C(=O)O)N(C)Cc1cccc(Br)c1O 819895162 ABFRGVYWSWPFBW-SSDOTTSWSA-N 288.141 2.060 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C)CCCCN)c1 817976419 LUGJVKKJJCVAOU-RYUDHWBXSA-N 294.395 2.347 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C)SC)c1 728977794 DEWJEQUYBPGVLI-DTWKUNHWSA-N 269.366 2.330 10 20 CECD COc1cc(N2CC3(CC3)C2)c([N+](=O)[O-])cc1OC 828365271 UDTZQCJNNKYFLG-UHFFFAOYSA-N 264.281 2.212 10 20 CECD CC[C@H](CN1CCOCC1)N[C@H](C)c1c(O)cccc1F 903338048 BDPZICQONKUCSN-CHWSQXEVSA-N 296.386 2.293 10 20 CECD Oc1cccc2c1[C@@H](NCCCOC[C@H]1CCOC1)CC2 834598992 URDUCYUQKGKFAV-HIFRSBDPSA-N 291.391 2.412 10 20 CECD COc1cc(O)c(CN2CCC[C@@H](F)C2)cc1OC 846119726 HDLZSBYPKJUUSN-LLVKDONJSA-N 269.316 2.343 10 20 CECD C[C@]1(CNC(=O)NCc2cc(Cl)ccc2O)CCCO1 845028922 ARKXAARMKPBKGY-CQSZACIVSA-N 298.770 2.414 10 20 CECD CNCCN(C)Cc1cc(Br)cc(C)c1O 843057769 UPRIRQPRAFJNQA-UHFFFAOYSA-N 287.201 2.114 10 20 CECD CCOc1ccc(CNCCN(C)CC(F)F)c(O)c1 858336436 ICEDBVKJBRSDLP-UHFFFAOYSA-N 288.338 2.077 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H]2CCC(=O)[C@@H]2C)c1 862756130 QVUNYRZUYWMNFN-VXGBXAGGSA-N 275.348 2.322 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)[C@H](O)C(F)(F)F)c1 865712134 XEBUDRZUSRFIDP-UFBFGSQYSA-N 293.285 2.192 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1c(O)cccc1Cl 765796560 OJPDYWQJHXJIJM-SKDRFNHKSA-N 282.771 2.050 10 20 CECD COC[C@H](C)[C@@H](C)C(=O)NCc1cc(C)ccc1O 862755907 NBGZUAUKYGTAOG-NWDGAFQWSA-N 265.353 2.235 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)C(=O)NCC(F)(F)F 879649284 PFPFIZLKWUJDDJ-BDAKNGLRSA-N 290.285 2.110 10 20 CECD CCOc1ccc(CN[C@@H](CO)C(C)(C)C)c(O)c1 775198756 FOTDUFSNJLOHFO-AWEZNQCLSA-N 267.369 2.288 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@H](c1cccc(O)c1O)N2 877862534 YENHCRUXPODVIW-CQSZACIVSA-N 270.288 2.260 10 20 CECD CCN(CCC(=O)OC)Cc1ccc(C)cc1O 876631151 QDTLZHXTQQDUBX-UHFFFAOYSA-N 251.326 2.086 10 20 CECD CCN[C@H](C)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 876713245 HRCPOTTWEXJGMH-CQSZACIVSA-N 291.439 2.489 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CC12CCC2 773745695 QSKPMZNZBIZJFM-JQWIXIFHSA-N 275.348 2.335 10 20 CECD COCC1(C(=O)NCc2ccc(N(C)C)cc2C)CC1 778759112 ZLDALGBDGRUMEK-UHFFFAOYSA-N 276.380 2.104 10 20 CECD CC[C@@H](CO)C(=O)NCc1ccc(N(CC)CC)cc1 779744772 SFCWPJNPEZIUMY-AWEZNQCLSA-N 278.396 2.168 10 20 CECD Cc1cncnc1N[C@H](C)Cc1ccc(O)c(O)c1 882170928 ICJRDCDBKUJMRM-SNVBAGLBSA-N 259.309 2.239 10 20 CECD N[C@H](CC1CC1)C(=O)NCc1ccc(N2CCCC2)cc1 884193392 FEMHDBBKMRLGOW-MRXNPFEDSA-N 287.407 2.030 10 20 CECD COCC1CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 880593663 ACFJSMNEIIXRPL-UHFFFAOYSA-N 299.374 2.208 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(C)c(C)cc2O)[C@H]1C 787237369 FURWTULQBKIRED-JSGCOSHPSA-N 277.364 2.392 10 20 CECD C/C=C/C=C/C(=O)NCc1ccc(N2CCN(C)CC2)cc1 893608504 VNTCUXMLZVWTGL-VNKDHWASSA-N 299.418 2.187 10 20 CECD COc1cc(C)cc(CN(C)C[C@H]2CCC[C@H]2O)c1O 894089338 RRHRAZKVPZNUHY-TZMCWYRMSA-N 279.380 2.302 10 20 CECD C[C@H](O)[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894423428 RUECWYGABOLLFU-VHSXEESVSA-N 271.307 2.263 10 20 CECD COc1ccc(CN[C@@H](CO)CC2CCC2)c(O)c1OC 894168098 SDBQSHBGPCXOJJ-CYBMUJFWSA-N 295.379 2.050 10 20 CECD CC[C@@H](C)CC[C@@H](O)CC(=O)NCc1ccc(O)c(O)c1 793689057 IWZZZSHSIWIUEL-DGCLKSJQSA-N 295.379 2.291 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)c2ncnn2C)c1 276744872 ZODMBLMAHMAOOH-QWRGUYRKSA-N 260.341 2.241 10 20 CECD COc1cccc(CN2CCOC(C)(C)[C@@H]2C)c1O 687954554 RJUMHWMEOFTEGZ-NSHDSACASA-N 265.353 2.400 10 20 CECD COCCCNCc1ccc(Br)cc1O 691418330 ZTBFVRGWGNLVCR-UHFFFAOYSA-N 274.158 2.281 10 20 CECD Cc1nnc(CNCc2ccc3ccccc3c2O)n1C 1327869459 VVFUJOVUGJWVOM-UHFFFAOYSA-N 282.347 2.272 10 20 CECD CSC[C@@H](CCO)N[C@@H](C)c1cc(F)cc(F)c1O 1342407765 SDLBZPHKPRRJSJ-WCBMZHEXSA-N 291.363 2.435 10 20 CECD CC[C@@H](C)[C@H](NCc1ccc2c(c1)CCO2)C(=O)O 1604944736 IJGPKAWOGAXTIL-YGRLFVJLSA-N 263.337 2.210 10 20 CECD O=C(O)[C@H]1CC[C@@H](NCCCSc2nccs2)C1 1601794638 MJHXNDYCRHMOJR-VHSXEESVSA-N 286.422 2.468 10 20 CECD CC(C)(NCc1ccccc1O)c1nocc1C(=O)O 1609680857 SUTZKXSCKOKQJN-UHFFFAOYSA-N 276.292 2.103 10 20 CECD CC(C)[C@H](CO)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1604332943 MVJWDKPCBLOXPB-JQWIXIFHSA-N 281.352 2.006 10 20 CECD Cc1ccc(CN[C@H](CCN)C(F)(F)F)c(O)c1 1579696962 PONNYGXQJDKLKZ-LLVKDONJSA-N 262.275 2.070 10 20 CECD CN(C)c1cc(F)c(CN(C)C(C)(C)C(=O)O)cc1F 1598305293 CWJPHMILIFZNBM-UHFFFAOYSA-N 286.322 2.326 10 20 CECD CC[C@@H](N[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1590466772 OIVLIRJGJLPGCH-FBKDDSFISA-N 299.378 2.412 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)CCO1 159715529 AQRGUKNROCHYEW-GFCCVEGCSA-N 281.352 2.020 10 20 CECD COC(=O)c1ccc(N(C)Cc2ccccc2O)nc1 813599020 AGDNSZRDWNQIDG-UHFFFAOYSA-N 272.304 2.210 10 20 CECD C[C@@H](NCc1cccc(C(N)=O)c1)c1ccccc1O 36902834 PBRQMYKBZZQFFL-LLVKDONJSA-N 270.332 2.342 10 20 CECD CCOc1cccc(CN2CCCC[C@@H]2[C@@H](C)N)c1O 63191252 SUUMTMRUSUTGDK-TZMCWYRMSA-N 278.396 2.493 10 20 CECD C[C@@H](NCc1cc2c(cc1O)OCO2)[C@H]1CCCOC1 389002322 QWIASQQLNINFFD-MNOVXSKESA-N 279.336 2.026 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1cccc(Cl)c1O 179774033 LEHBJWQPPCENGG-VIFPVBQESA-N 271.744 2.287 10 20 CECD CC(C)N1CC[C@@H](N[C@@H](C)c2ccc(F)c(F)c2O)C1=O 187784413 VREDKPUJCTVFGL-JOYOIKCWSA-N 298.333 2.330 10 20 CECD CCO[C@H]1C[C@@H](NC(=O)c2cccc(O)c2O)C12CCC2 187129845 KNTVIICLYNTGCU-OLZOCXBDSA-N 291.347 2.175 10 20 CECD COc1ccc(N(CC2OCCO2)C(C)C)cc1F 182640035 FYINPJXSAPFMNZ-UHFFFAOYSA-N 269.316 2.422 10 20 CECD CN(CCN1CCCC1)Cc1cc(F)ccc1O 234295544 KQCJVEVLJPQLIT-UHFFFAOYSA-N 252.333 2.059 10 20 CECD CN(C)c1ccc(CN2CC[C@]3(CCCN3)C2)cc1 257721793 VRDRNBNXKXDOGN-MRXNPFEDSA-N 259.397 2.081 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](C)C[C@H](C)O)c1 273556266 GXADQPZMGDCAAN-WOPDTQHZSA-N 295.379 2.236 10 20 CECD CNC(=O)[C@H](CCSC)N[C@H](C)c1ccc(C)cc1O 806663108 MPUFQTLKXDVQIP-YPMHNXCESA-N 296.436 2.219 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](n3cccn3)C2)c1 291270811 NUSKCUWDUHSTLV-AWEZNQCLSA-N 287.363 2.434 10 20 CECD CO[C@@H]1[C@H](C)[C@H](NC(=O)c2c(F)ccc(O)c2O)C1(C)C 295097309 SWGWEQCUBNZCRH-HYJLZEBJSA-N 297.326 2.026 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H](O)C13CCCC3)OCO2 293983909 RNUBQNIZACHVMZ-OAHLLOKOSA-N 291.347 2.000 10 20 CECD CC[C@@H](CO)N(C)Cc1cc(Cl)cc(OC)c1O 295137028 PHDKBPUSRPAZCP-NSHDSACASA-N 273.760 2.257 10 20 CECD CCOC1CN(Cc2cc(Cl)cc(OC)c2O)C1 297422646 MLODFNFKWATEEE-UHFFFAOYSA-N 271.744 2.275 10 20 CECD O=C(NC[C@H]1CCCSC1)c1c(F)ccc(O)c1O 295410760 HSUBUNGFQVXYAK-MRVPVSSYSA-N 285.340 2.110 10 20 CECD C[C@H](NC1CC1)C(=O)NCc1ccc(N2CCCC2)cc1 296330707 HTPFBNOJBGKKSK-ZDUSSCGKSA-N 287.407 2.044 10 20 CECD C[C@H](N)CN[C@@H](C)c1cc(Br)ccc1O 817971530 DWEVCBNIONMMBF-YUMQZZPRSA-N 273.174 2.153 10 20 CECD COCC1(CNC(=O)c2cccc(O)c2O)CCCCC1 812370331 GMESXVWUORZWAI-UHFFFAOYSA-N 293.363 2.425 10 20 CECD COCC[C@@]1(NCc2ccc(N(C)C)c(C)c2)CCOC1 815103650 XVSRFJIFOHQERH-QGZVFWFLSA-N 292.423 2.346 10 20 CECD CC(C)N(CC[S@@](C)=O)Cc1ccc(N(C)C)cc1 827441764 CDKDZELBITUNSK-LJQANCHMSA-N 282.453 2.342 10 20 CECD C[C@@H](NC(=O)[C@H]1CCc2cncn2C1)c1ccccc1O 827946206 AKKQJODCOYJFJW-NEPJUHHUSA-N 285.347 2.029 10 20 CECD CC(C)c1nccn1CC(=O)N(C)Cc1ccccc1O 820877542 AXJQUQMNMLUGMA-UHFFFAOYSA-N 287.363 2.371 10 20 CECD CCC[C@H](CN(C)c1ccc(OCC(=O)O)cc1)OC 902016589 MGQATRWAKCCCOJ-CQSZACIVSA-N 281.352 2.401 10 20 CECD COCC1(C(=O)N[C@H](C)c2ccccc2O)CCOCC1 827946295 CSKKQRKESANEII-GFCCVEGCSA-N 293.363 2.013 10 20 CECD COc1cccc(COC(=O)c2ccc(C)c(O)c2O)n1 733010299 DTGYXPNVPDRHOY-UHFFFAOYSA-N 289.287 2.167 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCCON)c1O 902416140 SQUACBRQZYXLDS-VIFPVBQESA-N 258.749 2.285 10 20 CECD Cc1noc(C)c1[C@H](C)CNC(=O)Cc1ccc(N)cc1 831437173 PDVTWCDDBPIEHA-SNVBAGLBSA-N 287.363 2.336 10 20 CECD CCOc1ccc(CNc2nnc(CC)o2)c(O)c1 834478280 BBTZASDKIPHWGK-UHFFFAOYSA-N 263.297 2.348 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CC1CC1)C(=O)O 901716382 NBKJJHHTHSEQPG-OAHLLOKOSA-N 276.380 2.404 10 20 CECD CCOc1ncccc1CNC(=O)c1cc(O)cs1 732267217 DBABIYYGEIDAMF-UHFFFAOYSA-N 278.333 2.177 10 20 CECD CCN(CC)c1ccc(CN[C@H](C(=O)O)C2CC2)cc1 901475264 OCMMYFFBAYMYSP-HNNXBMFYSA-N 276.380 2.486 10 20 CECD Cc1occc1C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832293430 WROAPSKFVPXXLE-OAHLLOKOSA-N 287.363 2.084 10 20 CECD C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccccn1 588406119 WVKMUTOEOSYBAC-JYKYSHPRSA-N 284.315 2.383 10 20 CECD COc1cccc([C@@H](C)NCCN2CCSCC2)c1O 846142790 CJZAIJMPPJYUKW-GFCCVEGCSA-N 296.436 2.100 10 20 CECD CCOCCCc1nc(Cc2ccc(N)cc2)no1 843158664 FZGMEUORSTVKQM-UHFFFAOYSA-N 261.325 2.212 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H](C)N(C)C 840557580 RLCYDGWMOKCEPN-KGLIPLIRSA-N 291.439 2.058 10 20 CECD Oc1cc2c(cc1CN1CC[C@H](N3CC=CC3)C1)CCC2 742161933 APTZBBWBFDIZIV-KRWDZBQOSA-N 284.403 2.327 10 20 CECD CO[C@@](C)(C1CC1)[C@H](C)NC(=O)c1ccc(C)c(O)c1O 840510726 QBRHEOCWILUZMS-MGPLVRAMSA-N 293.363 2.340 10 20 CECD CCc1cccc(CNC[C@H](CO)Cc2ccco2)c1O 848898440 CMTCCTPLHGEQHG-CYBMUJFWSA-N 289.375 2.488 10 20 CECD CN(C[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(OCC(=O)O)cc1 846279832 MXPYUXNIQLQCAK-NILFDRSVSA-N 291.347 2.154 10 20 CECD COc1ccc(N2CCC(NCCOCCF)CC2)cc1 853091449 ISAVEZJDCHTLSP-UHFFFAOYSA-N 296.386 2.240 10 20 CECD CN(C)c1ccc(CN(CCOCCO)C2CCC2)cc1 852291675 ZSLRLQNTOACWLL-UHFFFAOYSA-N 292.423 2.116 10 20 CECD Cc1cccc(COC(=O)c2cccc(O)c2O)n1 758559122 QASKKPKDKOBUNY-UHFFFAOYSA-N 259.261 2.158 10 20 CECD Cc1ccc(C(=O)N2C[C@@H]3CCCC[C@@H]32)c(O)c1O 855059835 BVQVAEIHIRHFBD-JQWIXIFHSA-N 261.321 2.421 10 20 CECD C[C@@]1(C(=O)NCc2ccc(N3CCCC3)cc2)CCOC1 755046076 KHZPKTSYEMIUAG-QGZVFWFLSA-N 288.391 2.330 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](N3CC=CC3)C2)c1O 754741946 PJFGWKKOBCNYDO-OAHLLOKOSA-N 288.391 2.155 10 20 CECD Cc1nccc(CNC(=O)N[C@H](C)c2ccccc2O)n1 868078556 MZKLALZFECIACW-SNVBAGLBSA-N 286.335 2.051 10 20 CECD CN(C)c1cc(F)c(CN2C[C@H]3C[C@H]3C2)cc1F 862442190 BEJLXCVUPJNENU-AOOOYVTPSA-N 252.308 2.483 10 20 CECD Oc1cc2c(cc1CN1Cc3ccccc3C1)[C@@H](O)CO2 768449247 FPGYCIPPSIZBCN-INIZCTEOSA-N 283.327 2.334 10 20 CECD C[C@@H](NC(=O)NCCCCCCO)c1ccccc1O 868549208 RQHALCUAZADVLL-GFCCVEGCSA-N 280.368 2.305 10 20 CECD CC[C@]1(C(=O)N[C@H](C)c2ccccc2O)CCCN1 877255264 BGSKGXGYVQSBDI-IAQYHMDHSA-N 262.353 2.102 10 20 CECD CC[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(C)=O 873371557 XNRGBUQBFYOEEE-IYNGYCSASA-N 264.277 2.022 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C[C@]1(OC)CCOC1 876522511 SWFPLRFZIKUGIE-QGZVFWFLSA-N 292.423 2.380 10 20 CECD COC(=O)c1ccc(CNCc2c(C)cccc2O)o1 877526129 GLEXXBRKMXEURT-UHFFFAOYSA-N 275.304 2.370 10 20 CECD CC(C)CS(=O)(=O)N[C@H](C)c1ccc(N(C)C)cc1 773084331 PIFRQMDHLKOXJM-GFCCVEGCSA-N 284.425 2.389 10 20 CECD CC[C@H](NCCN1CCOC[C@H]1C)c1ccccc1O 775499176 PJOPINMQSJBBRM-HIFRSBDPSA-N 278.396 2.154 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@H](C(=O)N(C)C)C2)c(O)c1 877045113 QDMODHQCBQBQPY-DZGCQCFKSA-N 290.407 2.437 10 20 CECD Cc1cccc(O)c1CN(C)CC(=O)NCc1ccccc1 876754302 FLKKRGIDUCHNBI-UHFFFAOYSA-N 298.386 2.449 10 20 CECD CCCOc1ccc(CN[C@H](C)C(=O)OC)cc1C 877491737 BXOTUAUKUVTUEW-GFCCVEGCSA-N 265.353 2.435 10 20 CECD O=C(CCc1ccccc1F)NCc1ccc(O)c(O)c1 778925068 HKEAMEIRLLNRPU-UHFFFAOYSA-N 289.306 2.486 10 20 CECD C[C@@H]1C[C@@H]1CNCc1ccc(N2CCN(C)CC2)cc1 775991131 KPYXNGZKLTVJSE-GDBMZVCRSA-N 273.424 2.184 10 20 CECD O=C(Nc1ccc(CCO)cc1)c1c(F)ccc(O)c1O 789990435 OUTLLTSLTXBJFJ-UHFFFAOYSA-N 291.278 2.024 10 20 CECD COc1ccc(N2CCC(NCc3cnc[nH]3)CC2)cc1 894216192 JRYFRNDJMYSFDP-UHFFFAOYSA-N 286.379 2.177 10 20 CECD COc1ccc(CNC(=O)c2ccc(C)cc2O)c(O)c1 794374930 ZPRILJUKAXFGBD-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CN(Cc1ccccc1O)C[C@@H](O)Cc1ccccc1 111235474 ATHODBQZUJFLRK-INIZCTEOSA-N 271.360 2.428 10 20 CECD Cc1cc(N[C@H](C)c2ccccc2O)nc(CO)n1 1329297724 HIJZVOKFSGLVIQ-SNVBAGLBSA-N 259.309 2.156 10 20 CECD CC(C)(O)C1CN(Cc2ccc(N3CCCC3)cc2)C1 1328222246 XGMNHEUTHYHCSA-UHFFFAOYSA-N 274.408 2.490 10 20 CECD COc1cc(Cl)cc(CNCc2cc(C)ncn2)c1O 761216418 RARYOOHTLAIBII-UHFFFAOYSA-N 293.754 2.442 10 20 CECD Oc1ccc(CCN=c2cc[nH]cc2Cl)cc1O 784598965 KCQRAJQAOCFSGE-UHFFFAOYSA-N 264.712 2.223 10 20 CECD CCOc1cccc(CNCC2(O)CCCC2)c1O 96479108 KNTZWBFILGEQQI-UHFFFAOYSA-N 265.353 2.186 10 20 CECD CC[C@H](C)C[C@H](N)C(=O)NCc1ccc(N(C)C)c(F)c1 1340839041 NGOMQEVLYOMALO-FZMZJTMJSA-N 295.402 2.271 10 20 CECD O=C(O)Cc1ccc(CNCc2cc(F)ccc2O)cc1 1602121827 ILPHJDRMICQPBJ-UHFFFAOYSA-N 289.306 2.448 10 20 CECD CC[C@H](C)[C@H](O)CN[C@H](C)c1cc(C(=O)O)ccc1O 1594920808 LSFMVZGLOHUIPY-IMSIIYSGSA-N 281.352 2.148 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@@H](CCC(N)=O)C2)c1 164272359 RBOLAHWWCPFDQI-AWEZNQCLSA-N 290.407 2.487 10 20 CECD COc1ccc(CNCc2ccncc2C)c(O)c1 228661322 WAAJKGMXDQURCB-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CCOC(=O)[C@H](C)NCc1cc(Cl)cc(OC)c1O 229051348 MNINEDBREHNPMY-QMMMGPOBSA-N 287.743 2.095 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1N 251844403 RCVWGVLGYSHSSQ-GOEBONIOSA-N 261.413 2.312 10 20 CECD O=C(NCc1ccc(F)cc1)c1cccc(O)c1O 28966877 LCKHAWSKODCNGK-UHFFFAOYSA-N 261.252 2.167 10 20 CECD COc1cccc(CNCC(C)(C)C(C)(C)O)c1O 393624357 UYHQQULXDGUIAI-UHFFFAOYSA-N 267.369 2.288 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2nccnc2C)c1 699907634 CGDYZUYJOSZEGH-SNVBAGLBSA-N 273.336 2.350 10 20 CECD CN(C)C1(CNCc2cccc(Cl)c2O)CC1 397799888 BNTFJLZCCANHKF-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CN(C)C1(CNCc2cccc(Br)c2O)CC1 397947569 UQWBIUKXYJPEBK-UHFFFAOYSA-N 299.212 2.339 10 20 CECD CC[C@H](CO)NC1CCN(c2ccc(OC)cc2)CC1 305070880 LMBJJWHILDMXQQ-CYBMUJFWSA-N 278.396 2.025 10 20 CECD CN(Cc1nc(C2CC2)no1)c1ccc2c(c1)OCO2 121278485 VEKGVPFIDAEAHV-UHFFFAOYSA-N 273.292 2.312 10 20 CECD COc1cc(O)c(CNCc2ccoc2)cc1OC 180519565 CRFNSQUTODGOIB-UHFFFAOYSA-N 263.293 2.292 10 20 CECD Cc1nccn1CCCN(C)Cc1ccccc1O 127433342 RHULNFSQXCXSMK-UHFFFAOYSA-N 259.353 2.419 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCSCC1 274897887 FOIHTUAKXDVTAV-SNVBAGLBSA-N 295.404 2.288 10 20 CECD CCC[C@@H](OC)C(=O)N(C)Cc1ccccc1O 294941067 VGKOSKPZOBSQMN-CYBMUJFWSA-N 251.326 2.166 10 20 CECD C[C@@H]1C[C@@H](CO)CN(Cc2ccc(N(C)C)cc2)C1 817280913 FEWJYFDGQFSARK-UKRRQHHQSA-N 262.397 2.203 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C(F)F)n(C)n2)c1 827167664 RSUYCGIRXZTYMH-UHFFFAOYSA-N 295.289 2.302 10 20 CECD C[C@H](OCC1CC1)C(=O)N[C@H](C)c1ccccc1O 827930771 QJUWLCAHXVQDAY-MNOVXSKESA-N 263.337 2.385 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)n1cccn1 734402555 LRLRDGDLRQKPJR-ZDUSSCGKSA-N 286.379 2.135 10 20 CECD COc1ccc(N2CCC(NCCC(C)(C)N)CC2)cc1 903939433 HGEVDAKRBSXQLC-UHFFFAOYSA-N 291.439 2.381 10 20 CECD CC(C)[C@@](C)(O)C(=O)NCc1cc(Cl)ccc1O 846472985 HJJBTZWTEZNFIP-CYBMUJFWSA-N 271.744 2.069 10 20 CECD COc1cccc([C@H](C)NC[C@H](C2CC2)N(C)C)c1O 846142282 ZUFFCEQQIGNDMV-SMDDNHRTSA-N 278.396 2.392 10 20 CECD CCOCCCNC(=O)NCc1cc(Cl)ccc1O 844848882 RJJUZFXVULGJFX-UHFFFAOYSA-N 286.759 2.271 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1ccc2c(c1)CCO2 840959532 YFBRXDADIIJSJR-AWEZNQCLSA-N 275.348 2.053 10 20 CECD CC[C@](C)(CNCc1ccc2c(c1)CCO2)C(=O)O 1326504958 HMSBVWGICSQBSI-OAHLLOKOSA-N 263.337 2.212 10 20 CECD COc1cccc(O)c1CNCc1ccc(CCN)cc1 841032827 ZMVBFZJUBUWOEA-UHFFFAOYSA-N 286.375 2.192 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H](CN)C1CC1 841945228 BHDDDBJDPBBIJX-CQSZACIVSA-N 291.395 2.051 10 20 CECD Oc1cc2c(cc1CN[C@H]1CCC[C@H](F)C1)OCO2 1328512105 PXENJKILKDBLOJ-QWRGUYRKSA-N 267.300 2.491 10 20 CECD CN(C)c1cc(F)c(CN[C@H](CCO)C2CC2)cc1F 858145191 YUTVFHZXNBXVQC-CQSZACIVSA-N 284.350 2.281 10 20 CECD CCN(C[C@@H]1CCC(=O)O1)c1ccc(OC)c(OC)c1 851828080 MSSRDAFGAILFIA-LBPRGKRZSA-N 279.336 2.236 10 20 CECD CC(C)[S@@](C)(=O)=NC(=O)/C=C\c1ccc(O)c(O)c1 926053708 FTDTZRNVVNWZDZ-SUOMESGTSA-N 283.349 2.144 10 20 CECD CCOC(=O)CCN(C(=O)c1cc(O)cs1)C(C)C 855056905 SIGHYKOAEDFRQU-UHFFFAOYSA-N 285.365 2.258 10 20 CECD C[C@H]1COC[C@@H]1NCc1ccc2c(c1)CCCN2C 699460949 CMTQYQZNNBSGCB-WFASDCNBSA-N 260.381 2.194 10 20 CECD CCCn1cc(CNCc2ccc3c(c2)CCCN3C)nn1 865437266 FJHPOICZWCQNBU-UHFFFAOYSA-N 299.422 2.360 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(OC)CCC1 935948450 MJEDNMUKXOPCSG-UHFFFAOYSA-N 284.352 2.063 10 20 CECD CN(C)c1cc(F)c(CN2CC([C@@H]3CCOC3)C2)cc1F 862351142 KPCFLRYOQHIPNU-LLVKDONJSA-N 296.361 2.499 10 20 CECD CN(Cc1cc(F)c(N(C)C)cc1F)CC1(C)COC1 862479366 LMINWQNMODCHLI-UHFFFAOYSA-N 284.350 2.499 10 20 CECD C[C@@H](CCCC(=O)O)NCc1cc(F)cc(F)c1O 1119610645 BPEANIBXMRSBRN-QMMMGPOBSA-N 273.279 2.403 10 20 CECD Cc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1O 1116510248 OXUKVKDEXXYKIL-UHFFFAOYSA-N 273.288 2.042 10 20 CECD CC[C@](C)(O)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776237231 FSXMQXJECMZAHB-LRDDRELGSA-N 293.411 2.274 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2CCO)cc1F 779202273 MFZHQSFRKOQQES-ZDUSSCGKSA-N 266.360 2.239 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@H]1O 775744006 IUZGPEAUTYMTSY-QPUJVOFHSA-N 273.735 2.387 10 20 CECD O=C(C[C@H](O)c1cccc(F)c1)NCc1ccccc1O 772805293 WWCIUQJMOUZNBA-HNNXBMFYSA-N 289.306 2.271 10 20 CECD CCN(CCCO)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 776240009 ULKOFWIANKOODW-CYBMUJFWSA-N 293.411 2.228 10 20 CECD C[C@@H](NCc1cc(F)cc(F)c1O)c1nnc2n1CCC2 882886531 YTSWFEYOKCHQNW-MRVPVSSYSA-N 294.305 2.059 10 20 CECD COC(=O)C1CCC(NCc2cc(F)cc(F)c2O)CC1 882988270 IBNQPAQYQWGVJQ-UHFFFAOYSA-N 299.317 2.492 10 20 CECD Cc1cc(Cn2cc(-c3cnn(C)c3)nn2)ccc1N(C)C 881378673 RXQNRXVTDJNWKY-UHFFFAOYSA-N 296.378 2.101 10 20 CECD COC(=O)[C@@H](NCc1cc(F)cc(F)c1O)C(C)(C)C 894423784 VCPJTXULZBUILA-GFCCVEGCSA-N 287.306 2.348 10 20 CECD COc1ccc(CN[C@]2(C)CCCOC2)c(O)c1OC 893392446 HSAWPINVKKHWAJ-OAHLLOKOSA-N 281.352 2.068 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CC[C@@H](C)C2)c(O)c1 794390970 RZQKCHYGTIAGGX-GHMZBOCLSA-N 263.337 2.453 10 20 CECD CCCCCNC(=O)NCc1ccc(OC)cc1O 792764973 ZXYJNOYLIIYUHX-UHFFFAOYSA-N 266.341 2.390 10 20 CECD c1cc(N2CCCC2)ccc1CN1C[C@H]2COC[C@H]2C1 1204326731 BCBFSAPJALYTSI-IYBDPMFKSA-N 272.392 2.365 10 20 CECD CC[C@@H](NCCN(C)CCOC)c1ccccc1O 61375158 BFWMAMWBURYEPS-CQSZACIVSA-N 266.385 2.011 10 20 CECD CCC[C@@H]1CN(Cc2cccc(OC)c2O)CCO1 93508815 RCOZKFFUMHOKCV-CYBMUJFWSA-N 265.353 2.402 10 20 CECD C[C@@H]1CSCCN1c1nnc(-c2sccc2O)n1C 1262854711 UJVZMNHLPFOTMG-MRVPVSSYSA-N 296.421 2.191 10 20 CECD Cc1cc(O)c(CN[C@]2(CC(=O)O)CCCOC2)cc1C 1600285452 BXYVRKMWRKRMQW-INIZCTEOSA-N 293.363 2.123 10 20 CECD O=C(O)c1cccc(NC(=O)c2cc(O)cs2)c1 1602445687 QVGDYDAJXFEEDN-UHFFFAOYSA-N 263.274 2.404 10 20 CECD C[C@H]1C[C@@H](C(=O)O)CN(Cc2cc(F)c(F)cc2O)C1 1603367625 FQIOJPWEEROAKT-WCBMZHEXSA-N 285.290 2.213 10 20 CECD C[C@H]1CCN(CCN[C@@H](C)c2cc(C(=O)O)ccc2O)C1 1609859479 VGFFLBIVMPOURS-RYUDHWBXSA-N 292.379 2.083 10 20 CECD CCOC(=O)c1cnc(SC[C@H](C)C(=O)OC)s1 853342277 BRTSXFSFZKTLQL-ZETCQYMHSA-N 289.378 2.221 10 20 CECD CN(C)c1ccc(CN[C@@H]2[C@@H]3C[C@@H]2CN3)c(C(F)(F)F)c1 1578425392 BCCFGSXAXGWABV-SWHYSGLUSA-N 299.340 2.221 10 20 CECD CCc1[nH]c(C(=O)Nc2ccc(N)cc2)c(C)c1C(=O)O 1597373674 WPYRAUPDBKGRFA-UHFFFAOYSA-N 287.319 2.418 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CCOc2ccccc21 159063908 JWVYVPWMQRIXJW-ZDUSSCGKSA-N 299.326 2.280 10 20 CECD COCCO[C@@H]1CCCN(Cc2cccc(C)c2O)C1 802652228 ASJVPESJPQYLCM-OAHLLOKOSA-N 279.380 2.328 10 20 CECD COC(=O)N1CCC(NCc2ccc(C)cc2O)CC1 876972265 YRLVUFMRTDHTFQ-UHFFFAOYSA-N 278.352 2.021 10 20 CECD CCc1noc(CN2CCCc3cc(CN)ccc32)n1 700926208 OCKVAVDGQXSCPL-UHFFFAOYSA-N 272.352 2.044 10 20 CECD Cn1cncc1CNCc1ccc(N2CCCC2)cc1 384262106 ORKMAAUCQDQMNJ-UHFFFAOYSA-N 270.380 2.310 10 20 CECD CN(C)c1ccc(CN[C@H]2CCNCC2(C)C)cc1 388927912 RYEVEZOHZBGLSR-HNNXBMFYSA-N 261.413 2.230 10 20 CECD CCCCS(=O)(=O)NCc1ccc2c(c1)CCCN2C 58511044 FJFSEGMIGMFVNV-UHFFFAOYSA-N 296.436 2.289 10 20 CECD Cn1cncc1CNCCCSc1nccs1 176797384 DWVDOZKLKCEGDN-UHFFFAOYSA-N 268.411 2.149 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1cc(C)cc(OC)c1O 178902650 MBRICZRXPQOETN-CYBMUJFWSA-N 293.363 2.237 10 20 CECD Nc1ccc(NC(=O)N2CC[C@H](N3CCCCC3)C2)cc1 110380182 KXRKWMYPNKBQJO-HNNXBMFYSA-N 288.395 2.361 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCCCN2)cc1 178711269 QPUFAUMGHFUXOT-MRXNPFEDSA-N 289.423 2.291 10 20 CECD CCN(C)C(=O)[C@@H](C)NCc1ccc(N(CC)CC)cc1 188468705 XYASKUSVXUBQMF-CQSZACIVSA-N 291.439 2.489 10 20 CECD C[C@H](NC[C@H]1CCCN1C)c1cc(F)ccc1O 185142713 HOVKWAVECDYEBU-CMPLNLGQSA-N 252.333 2.276 10 20 CECD CCS(=O)(=O)CCCCCN(C)Cc1ccccc1O 190860857 YKMYOCAWBAQEEC-UHFFFAOYSA-N 299.436 2.429 10 20 CECD CCOC(=O)[C@@H](C)NCc1cc(Cl)ccc1O 49368179 CAUBDNUZMVHARB-MRVPVSSYSA-N 257.717 2.087 10 20 CECD Cc1conc1NCc1ccc(N2CCOCC2)cc1 191568675 BNBSDJCMRAZGIL-UHFFFAOYSA-N 273.336 2.432 10 20 CECD C[C@H]1CCN(Cc2c(O)cccc2Cl)C[C@H]1CN 253183520 GQFSAHIEOFEREF-WDEREUQCSA-N 268.788 2.462 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2[C@@H](C)O)c1O 267473890 ZTKPVPCNOKJBIP-IAQYHMDHSA-N 295.354 2.469 10 20 CECD COC(=O)[C@@H](NCc1cccc(Cl)c1O)C1CC1 276454811 KKIHBJQDYCIWLQ-NSHDSACASA-N 269.728 2.087 10 20 CECD NC(=O)C[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 271189916 PHXCAFRXPKTTSQ-JTQLQIEISA-N 282.771 2.133 10 20 CECD COc1cccc(CN[C@H](CO)CC2CCC2)c1O 279851477 RUDLQMRDEUGFOC-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD CCOc1cccc(CN2CC[C@H](CO)C[C@@H]2C)c1O 289222351 AAPFSUOCZCGCTC-STQMWFEESA-N 279.380 2.384 10 20 CECD CC(=O)N1CCC[C@H](CN[C@@H]2CCc3cccc(O)c32)C1 296401113 KIDZLIZYCMALMO-UKRRQHHQSA-N 288.391 2.228 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H](C3CC3)C1)[C@@H](O)CO2 808230836 RBAQYQOZOGFQKZ-LRDDRELGSA-N 289.375 2.440 10 20 CECD COc1cccc(O)c1CN(C)CCCn1ccnc1C 809753309 QJKYVKXYFOJVSN-UHFFFAOYSA-N 289.379 2.428 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2C[C@H](F)CN2)c(O)c1C 817976342 KEHHSEADPURNJG-AVGNSLFASA-N 266.360 2.360 10 20 CECD C[C@@H](CC(=O)N(C)Cc1ccccc1O)n1cccn1 819383617 XOOWNDTWKSPEBX-LBPRGKRZSA-N 273.336 2.198 10 20 CECD COC1(CO)CCN(Cc2ccc(N(C)C)c(C)c2)CC1 815102261 GRGGIWBWJBMUAK-UHFFFAOYSA-N 292.423 2.034 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCC[C@H](OC)C2)c1 815835609 ZBNDYSZBMKRQDU-YPMHNXCESA-N 293.363 2.222 10 20 CECD CCCN1C[C@@H](CN[C@H](C)c2ccc(F)cc2O)CC1=O 817589841 QDWPVPMONBCJJX-VXGBXAGGSA-N 294.370 2.440 10 20 CECD CC[C@H](NC[C@@H]1C[C@H](F)CN1)c1ccccc1O 817975811 CHJQIYDWUOIKKX-GVXVVHGQSA-N 252.333 2.133 10 20 CECD CCN(CC(N)=O)Cc1ccc(N2CCCCC2)c(C)c1 829158587 BOEBMBVJFQXQMO-UHFFFAOYSA-N 289.423 2.293 10 20 CECD CSCCNC(=O)NCc1ccc(N2CCCC2)cc1 726234727 XTADMZVUSPXVLI-UHFFFAOYSA-N 293.436 2.449 10 20 CECD Cc1cncc(CNC(=O)/C=C\c2ccc(O)c(O)c2)c1 588407621 OBLAIIXPOHLPRG-HYXAFXHYSA-N 284.315 2.131 10 20 CECD CCC(C)(C)NC(=O)[C@H](C)OC(=O)c1cc(O)cs1 732353510 RYEJRXNMZQJJNQ-QMMMGPOBSA-N 285.365 2.304 10 20 CECD C[C@@]1(CCCO)CCCN1C(=O)c1cc(O)cs1 831544523 YQRRQBIYJSQARK-ZDUSSCGKSA-N 269.366 2.221 10 20 CECD CN(CC1CC1)S(=O)(=O)Nc1ccc(O)cc1Cl 849308807 VFRWCOPQHICLIP-UHFFFAOYSA-N 290.772 2.044 10 20 CECD CN(Cc1cccc(Br)c1O)CC(C)(C)N 849350576 QVSZYOWRGXMVRS-UHFFFAOYSA-N 287.201 2.324 10 20 CECD C[C@H](CNC(=O)C(=O)Nc1ccc(N)cc1)C(C)(C)C 841038838 RILHMFNVTQVFMB-SNVBAGLBSA-N 277.368 2.006 10 20 CECD COc1cccc(O)c1CN[C@H](C)CCCCN 841080526 SBCRUHQBQDBLON-LLVKDONJSA-N 252.358 2.008 10 20 CECD CC(C)CN1CC(=O)N[C@H]1c1cc(Cl)ccc1O 917506168 QQVOBNAZSHDRHN-CYBMUJFWSA-N 268.744 2.132 10 20 CECD CC[C@@H](C)[C@H](C(=O)OC)N(C)Cc1ccccc1O 929975639 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Cc1ccc(O)c(CN2CC[C@@H](C)C[C@H]2C(=O)O)c1 1607811160 LYVOZWUDRHDVRS-YPMHNXCESA-N 263.337 2.386 10 20 CECD CC[C@H](C)[C@H](N)C(=O)NCc1cc(Cl)ccc1O 1578229430 CTHLTEAXGQSMBV-UFBFGSQYSA-N 270.760 2.035 10 20 CECD C[C@]1(C(=O)O)CCCN1Cc1cc(F)c(F)cc1O 1589186758 CBORHBKDKNBNAD-CYBMUJFWSA-N 271.263 2.110 10 20 CECD C[C@H](NC[C@@H](C)C(=O)O)c1ccc(N(C)C)cc1 1589067280 GXCRBNCGCYKYPS-MNOVXSKESA-N 250.342 2.124 10 20 CECD CCN1CCc2cc(CNC[C@@]3(C(=O)O)C[C@H]3C)ccc21 1776877793 ZRYPPWOXBZHRGB-PXAZEXFGSA-N 288.391 2.269 10 20 CECD C[C@@H](NCc1cc2c(cc1O)OCO2)C1CCOCC1 134496388 WJOLQRCWTJZLBY-SNVBAGLBSA-N 279.336 2.026 10 20 CECD Cc1cccc(O)c1CNC[C@@H]1CCN(C2CC2)C1 876929655 LJZJUTJYFZSXKS-ZDUSSCGKSA-N 260.381 2.275 10 20 CECD COc1ccc(O)c(CN2CCC(NC(C)C)CC2)c1 179965078 KHNNGJKHZARMPG-UHFFFAOYSA-N 278.396 2.363 10 20 CECD CCCNC(=O)C1CCN(Cc2cccc(C)c2O)CC1 179662606 AHGHYRWNBFPNOE-UHFFFAOYSA-N 290.407 2.439 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)NCC(F)F 175225293 GCSMFMGSDKAIPU-UHFFFAOYSA-N 281.306 2.127 10 20 CECD Cc1nc(N(C)Cc2ccccc2O)c2cnn(C)c2n1 179253842 XELKNDDJTNPREB-UHFFFAOYSA-N 283.335 2.014 10 20 CECD COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1cc(F)cc(F)c1O 1262110550 HMTHKXJLIFKZEJ-ZANVPECISA-N 299.317 2.444 10 20 CECD Cc1ccc(O)c([C@@H](C)NCc2nnc3n2CCCC3)c1 183847630 IFGINLCENNUGIM-GFCCVEGCSA-N 286.379 2.479 10 20 CECD CO[C@@H](C)CN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 188107016 MTIOLXGPGOMBSG-STQMWFEESA-N 296.386 2.348 10 20 CECD Cc1cc(CC(=O)NCc2ccc3c(c2)CCCN3C)no1 74536843 LLRFERUTDLHDND-UHFFFAOYSA-N 299.374 2.224 10 20 CECD CC1(O)CCN(Cc2cccc(Cl)c2O)CC1 180285946 AVLJGBGVLSKEGM-UHFFFAOYSA-N 255.745 2.392 10 20 CECD COCCC(C)(C)C(=O)NCc1ccc(N(C)C)cc1 183845823 CUFULHBZZVPOEN-UHFFFAOYSA-N 278.396 2.432 10 20 CECD CCCOc1ccc(CNC[C@H](C)OC)c(O)c1 191139011 PEBWLGQHBHFZGO-NSHDSACASA-N 253.342 2.306 10 20 CECD CNC(=O)c1ccc(CNCc2cc(F)ccc2O)cc1 226584401 BLXVXZLKHKGZPF-UHFFFAOYSA-N 288.322 2.181 10 20 CECD CCCNCc1ccc(OC)c(Cn2cccn2)c1 50125469 XVQPCWHAQKJHMN-UHFFFAOYSA-N 259.353 2.440 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCCC[C@@H]2O)c1 275093257 AEBBDKCEVHSEHU-DGFSRKRXSA-N 293.363 2.133 10 20 CECD CCO[C@@H]1C[C@H](NCc2c(O)cccc2Cl)[C@H]1OC 273813027 WXHMOZLARJAACE-IACUBPJLSA-N 285.771 2.328 10 20 CECD COc1cccc(CN2CCC[C@@](C)(O)CC2)c1O 279741582 XJGXBKJVVDGESG-OAHLLOKOSA-N 265.353 2.138 10 20 CECD CN(Cc1ccccc1O)C(=O)C1(C)COC(C)(C)OC1 270906353 ARGFNMVPPUOEGY-UHFFFAOYSA-N 293.363 2.140 10 20 CECD C[C@@H](Cn1ccnc1)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273363762 DNZCJGQNOGYLKJ-QWRGUYRKSA-N 290.323 2.236 10 20 CECD Cc1nccn1CCN(C)c1ccc2c(c1)OCO2 270820571 BCCFYBWLVPKTSR-UHFFFAOYSA-N 259.309 2.057 10 20 CECD COc1ccc(O)c(CN(CCO)C2CCCC2)c1 271841865 TWINCQJULLJGKM-UHFFFAOYSA-N 265.353 2.138 10 20 CECD CC(=O)N1C[C@H]2[C@@H](NCc3ccccc3O)CCC[C@H]2C1 808445185 AIIWYUARLCKPMM-XHSDSOJGSA-N 288.391 2.129 10 20 CECD CC[C@H](N)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 817978838 FPKDJJPKDNVBRJ-WCABBAIRSA-N 252.333 2.407 10 20 CECD CC[C@H](NCCCN1CCNCC1)c1ccc(C)cc1O 817936587 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CN(C)c1ccc([C@@H](N)CNC(=O)C2(C)CCCC2)cc1 843296874 HLUMVPCQGVMHFQ-HNNXBMFYSA-N 289.423 2.449 10 20 CECD COc1ccc(N(C)Cc2ccc(C(=O)N(C)C)[nH]2)cc1 845997939 FXQQODSTCPKWGN-UHFFFAOYSA-N 287.363 2.362 10 20 CECD Oc1ccc(Cl)cc1CNCCn1cccn1 42538881 CJOWJLHLWBIEQR-UHFFFAOYSA-N 251.717 2.032 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@@H]2CNC(=O)C2)cc1 851717007 UCCDQHWSUBWZOF-HNNXBMFYSA-N 289.423 2.101 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1cscn1 857547841 WNMZPVUFVIPQHR-UHFFFAOYSA-N 268.725 2.432 10 20 CECD CCC[C@H](O)CN[C@H](C)c1cc(F)cc(F)c1O 756576132 JYDQYJQVOWMQDW-SCZZXKLOSA-N 259.296 2.482 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2ccc(N(C)C)cc2)CCC1=O 763263306 TTZPUZNFPYAQBC-OCCSQVGLSA-N 288.391 2.374 10 20 CECD CCOC(C)(C)C(=O)N[C@H](C)c1cc(OC)ccc1O 866763876 IXPOEAZTBWESIO-SNVBAGLBSA-N 281.352 2.393 10 20 CECD Cc1cccc(-n2c(C)cc(CN3C(=O)CNC3=O)c2C)c1 863532599 KDFIOZXPBIMJMP-UHFFFAOYSA-N 297.358 2.454 10 20 CECD O=C(NCc1ccccc1O)Nc1ccc(F)nc1 766199016 KJWCIBZIPKMZGW-UHFFFAOYSA-N 261.256 2.248 10 20 CECD CCC[C@H]1CN(C(=O)c2cc(O)cs2)CCO1 760889984 FDLRPZWOVLLMCW-JTQLQIEISA-N 255.339 2.095 10 20 CECD Cc1cc(O)c(CN[C@@H](CCO)C2CCOCC2)cc1C 763467235 QNDVUDVBNATNMV-INIZCTEOSA-N 293.407 2.276 10 20 CECD CCOCCN(C)Cc1ccc(N2CCOCC2)c(F)c1 779598491 JYYUWINTNQWKNE-UHFFFAOYSA-N 296.386 2.131 10 20 CECD Cc1ccc(CN2CCC[C@@H](CCC(N)=O)C2)c(O)c1 876649796 FWVIIGBTEFODEL-ZDUSSCGKSA-N 276.380 2.178 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCCON 1120255694 LXQVHAAPRGTCTF-MNOVXSKESA-N 250.342 2.119 10 20 CECD COC(=O)[C@](C)(CNCc1ccc(N)cc1)c1ccccc1 1120269427 SIOPFYYUUVLIEA-GOSISDBHSA-N 298.386 2.489 10 20 CECD COc1cc(CNC[C@H]2COCO2)c(O)c(C(C)(C)C)c1 894886047 UGLVKRRETOUGSW-ZDUSSCGKSA-N 295.379 2.161 10 20 CECD COC(=O)[C@@H](CNCc1cc(OC)ccc1O)CC(C)C 894791150 PEBAPMUODATNGF-CYBMUJFWSA-N 295.379 2.326 10 20 CECD CC(=O)OC[C@@H](C)NCc1ccc2c(c1)CCCN2C 892732715 JPSZBLGUYOLABF-GFCCVEGCSA-N 276.380 2.110 10 20 CECD COc1ccc(CN(C)[C@@H]2CCCC[C@H]2O)c(O)c1OC 895728230 TWEFIQKXWIMGMI-CHWSQXEVSA-N 295.379 2.145 10 20 CECD O=C(Cc1ccc2c(c1)CCC2)NCc1cccc(O)c1O 1350299618 GRRDMTNUULSSJU-UHFFFAOYSA-N 297.354 2.445 10 20 CECD COCCCCOc1ccc(N(C)C)c(C(=O)O)c1 1606868954 DVYFCPLRIOKLBW-UHFFFAOYSA-N 267.325 2.256 10 20 CECD C/C=C\C[C@H](CO)N[C@H](C)c1cc(C(=O)O)ccc1O 1604851108 JTZXLKYSFJEGOY-YZKQYGISSA-N 279.336 2.068 10 20 CECD CCCC[C@H](CN)N[C@@H](C)c1cc(C(=O)O)ccc1O 1605237913 MIAXSSNDIRJHGI-CMPLNLGQSA-N 280.368 2.259 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@]12CCC[C@H]1CNC2 1579617198 MWUCJBHDXJOQJQ-RDJZCZTQSA-N 273.424 2.293 10 20 CECD C[C@](CCF)(NCc1ccc(Cl)cc1O)C(=O)O 1592505433 BPMZXPRJHARNLD-GFCCVEGCSA-N 275.707 2.338 10 20 CECD COc1cc(C)cc(CN(C)CC(=O)OC(C)(C)C)c1O 164364747 UZLSNOQEFPDKPI-UHFFFAOYSA-N 295.379 2.483 10 20 CECD COc1ccc(N2CCN(CCCF)CC2)cc1F 151734786 RMFSJINZEYSBNG-UHFFFAOYSA-N 270.323 2.316 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1csnn1 156322117 YODUJEYLVOASIE-UHFFFAOYSA-N 289.360 2.053 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ccc2nnc(C)n2n1 301283310 KUDRPPIPKBZRFG-UHFFFAOYSA-N 296.378 2.419 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@H]2CCOC2)cc1 179113318 CUQZIQPBDLTDRG-AWEZNQCLSA-N 291.395 2.121 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1cccc(OCC)c1O 77475182 ZRKSRKCCEPYMGQ-HNNXBMFYSA-N 278.352 2.021 10 20 CECD CC[C@]1(CO)CCCN1Cc1ccc(N(C)C)cc1 191957789 PMKJCSBDOIBRLO-MRXNPFEDSA-N 262.397 2.490 10 20 CECD Cc1nnsc1C(=O)N(C)Cc1ccc(N(C)C)cc1 194821438 DEYIBUYKFAENJP-UHFFFAOYSA-N 290.392 2.185 10 20 CECD CC(=O)c1cc(F)cc(CN2CCc3[nH]ncc3C2)c1O 91077792 ZWYQBBJCMABWAO-UHFFFAOYSA-N 289.310 2.015 10 20 CECD COc1ccc(O)c([C@H](C)NCCCC(=O)NC2CC2)c1 92987191 CHZRGOFQBHMZIV-NSHDSACASA-N 292.379 2.110 10 20 CECD CCOc1ccc(O)c(CNCC[C@@H](C)OC)c1 263844101 ZGYNEWUOZHLULQ-LLVKDONJSA-N 253.342 2.306 10 20 CECD CC[C@H](CO)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 268724204 PZZCORSIGQERLK-TZMCWYRMSA-N 296.386 2.084 10 20 CECD CC[C@H](O)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273605142 TVZJGPJOKHCYJX-ONGXEEELSA-N 268.313 2.112 10 20 CECD O=C(CCC(F)(F)F)NCc1ccc(O)c(O)c1 272341524 OUPQLCNZNUHLHL-UHFFFAOYSA-N 263.215 2.057 10 20 CECD Cc1ccc([C@H](C)NCCNC(=O)C(C)C)c(O)c1C 273413710 QFIJUNHLYLJSPC-ZDUSSCGKSA-N 278.396 2.432 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cccc(F)c2O)C[C@H]1C 276517634 UTQDNMYZXSXJQU-ZYHUDNBSSA-N 281.327 2.162 10 20 CECD CC(C)(C)OC(=O)C1CN(Cc2cc(F)ccc2O)C1 297304141 BJXPEEWBURAAOM-UHFFFAOYSA-N 281.327 2.305 10 20 CECD C[C@@H](NC[C@@H]1C[C@H](F)CN1)c1cc(F)cc(F)c1O 817976503 MGNRRARZKYMJHA-JEZHCXPESA-N 274.286 2.021 10 20 CECD CO[C@H]1COCC[C@@H]1CNCc1c(O)cccc1Cl 824710448 YWFQGPSIOVDLSU-YGRLFVJLSA-N 285.771 2.187 10 20 CECD CCn1ccc(CC(=O)N[C@H](C)c2ccccc2O)n1 827952431 RWQXNOGTEJFMEK-LLVKDONJSA-N 273.336 2.029 10 20 CECD COc1ccc(N(C)Cc2nc(C3CC3)nn2C)cc1F 827996905 TYIWEZIJLYUROF-UHFFFAOYSA-N 290.342 2.477 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCCCCN)c1 828668099 YTXSJWRMVANMNB-LLVKDONJSA-N 280.368 2.097 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H](c2cc[nH]n2)C1 732278109 XVEJMHJHAWFSNU-SECBINFHSA-N 277.349 2.197 10 20 CECD COc1ccc(CNC(=O)COCC2CCCC2)c(O)c1 836785125 MWZXWVSCFRTNGV-UHFFFAOYSA-N 293.363 2.224 10 20 CECD CCc1cccc(CNCCNC(=O)c2ccco2)c1O 848892567 APDYULUHSLTYDB-UHFFFAOYSA-N 288.347 2.067 10 20 CECD CCOc1ccc(O)c(CN2CCC([C@@H](C)N)CC2)c1 843052499 MRQCVMJBAGHNST-GFCCVEGCSA-N 278.396 2.350 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1cc(Cl)ccc1O 843122932 XHQLQVDZIMNFIL-RYUDHWBXSA-N 272.751 2.177 10 20 CECD CO[C@H](CS(=O)(=O)Nc1ccc(O)c(C)c1)C(C)C 842584717 ISKXGTUWIWWYIG-CYBMUJFWSA-N 287.381 2.113 10 20 CECD COc1ccc(N(C)CC(=O)OCC(C)C)cc1 844352658 AWQHZAXVLVRCML-UHFFFAOYSA-N 251.326 2.331 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CCCC[C@H]1CN 841950651 VEGZINYDABREPN-JSGCOSHPSA-N 291.395 2.051 10 20 CECD COc1cc(C)cc(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1O 844754743 YQHDVFUGLTZACY-GHMZBOCLSA-N 269.291 2.406 10 20 CECD CC[C@@H]1CN(C(=O)c2cc(O)cs2)CCS1 743801423 OKFVFTRSMBHDAT-SECBINFHSA-N 257.380 2.421 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CC1(O)CCOCC1 840940318 XEPQJIBQXJJGSW-UHFFFAOYSA-N 292.423 2.034 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)CCCO)c1O 846150324 POCPKWMVJCFMJZ-GHMZBOCLSA-N 253.342 2.212 10 20 CECD CC(C)[C@@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 756336968 RDYVAXJRYFLESO-LLVKDONJSA-N 275.707 2.384 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1cccnc1 759587813 FELYQEVOIKJAFR-XQRVVYSFSA-N 271.272 2.249 10 20 CECD C[C@H]1CN(Cc2cccc(F)c2O)CC[C@H]1C(=O)O 863739588 MWSBISXSUALTGW-GXSJLCMTSA-N 267.300 2.074 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H](O)C(F)(F)F 865712469 YHSMYVMMLVPYEX-QPUJVOFHSA-N 294.292 2.293 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2N[C@@H]1CC[C@H](C(N)=O)C1 1117779001 CWQRAJSMMCSADS-WUHRBBMRSA-N 288.391 2.493 10 20 CECD CC(C)[C@H]1NC(=O)N([C@H](C)c2ccc(N(C)C)cc2)C1=O 761582045 ZCYYAUULYMBQNK-BXUZGUMPSA-N 289.379 2.390 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCC[C@@H](C(=O)N(C)C)C1 877044974 MXTJDRUKESKTIK-KGLIPLIRSA-N 290.407 2.437 10 20 CECD CC[C@@H]1C[C@H](C(=O)N(C)c2ccc(N)cc2)CCO1 877076159 MUATVLVLYPCHQU-BXUZGUMPSA-N 262.353 2.437 10 20 CECD CCCN(Cc1ccccc1O)c1cc(C)nc(CO)n1 1117296556 GVOIBYNQCRMIBZ-UHFFFAOYSA-N 287.363 2.400 10 20 CECD COCC1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 773018408 LSJBQGNIDQEYHH-GFCCVEGCSA-N 276.380 2.356 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773028131 YBQQPPWBKHNATP-NILFDRSVSA-N 276.380 2.355 10 20 CECD Cc1ccc(CN2CCN(c3ccccn3)CC2)c(O)c1 876528345 USRXTBOZRSQOHO-UHFFFAOYSA-N 283.375 2.418 10 20 CECD COC[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 784668565 QLZGUCKJTKYALC-OCCSQVGLSA-N 296.386 2.127 10 20 CECD C[C@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CN1C1CC1 883034213 ODQGWYBMIXXTFQ-JOYOIKCWSA-N 282.334 2.385 10 20 CECD O=C1CCCCN1CCCNCc1cc(F)cc(F)c1O 882988408 OCUIOUSEOFOIAZ-UHFFFAOYSA-N 298.333 2.163 10 20 CECD COc1cccc(O)c1CN1CC(C(F)(F)F)C1 894892015 IXTQOHOVQDPUCL-UHFFFAOYSA-N 261.243 2.395 10 20 CECD COc1cc(C)cc(CN(C)C[C@H]2CCCN(C)C2)c1O 893953330 RXWIWZVNVWEHFD-AWEZNQCLSA-N 292.423 2.483 10 20 CECD COc1cc(C)cc(CN2CC[C@H](C)[S@](=O)CC2)c1O 894568008 VAIBMKFWDAWDQT-FKIZINRSSA-N 297.420 2.052 10 20 CECD C[C@@H]1NC(=O)[C@@H](C)N(Cc2cccc(Cl)c2O)[C@@H]1C 895119475 YQVHPVXLIPKLCX-IVZWLZJFSA-N 282.771 2.143 10 20 CECD COc1cccc(CN(C)Cc2cccc(O)n2)c1O 897392093 MPZJEBLDAFWRFP-UHFFFAOYSA-N 274.320 2.133 10 20 CECD CC[C@]1(C)CN(Cc2cc(OC)ccc2O)CCO1 191150057 SQSNRBLBQVQQMA-OAHLLOKOSA-N 265.353 2.402 10 20 CECD CC[C@H](NCC(C)(C)C(N)=O)c1ccc(C)cc1O 794815021 HBNMINGVLHAFNQ-LBPRGKRZSA-N 264.369 2.253 10 20 CECD Cc1noc2ncnc(NCc3ccccc3O)c12 799934340 VVYLPEPPHCTEBT-UHFFFAOYSA-N 256.265 2.244 10 20 CECD C[C@@H]1c2nncn2CCN1Cc1ccc(N2CCCC2)cc1 1326278813 CAYQYOMARFZGTD-CQSZACIVSA-N 297.406 2.455 10 20 CECD Oc1ccc(F)cc1CNCc1nc(C(F)F)no1 1335089545 PUZKONZVESAIMS-UHFFFAOYSA-N 273.214 2.142 10 20 CECD COCCOCCN(C)Cc1ccc(N2CCCC2)cc1 1347223847 NUWCVJZLDQWMJO-UHFFFAOYSA-N 292.423 2.382 10 20 CECD COCC1(CN[C@@H](C)c2cc(C(=O)O)ccc2O)CC1 1606841181 UHWMVGKHGSOBDY-JTQLQIEISA-N 279.336 2.168 10 20 CECD C[C@H](CNCc1cc(F)ccc1O)CN1CCCC1 226585313 FDBZNXMMVIINGR-GFCCVEGCSA-N 266.360 2.353 10 20 CECD C[C@@H](NCc1cc(F)ccc1O)C1CCOCC1 226615594 FXXINJUKUCDPCL-SNVBAGLBSA-N 253.317 2.436 10 20 CECD COc1cc(CN(C)[C@H](C)CN)c(O)c(C(C)(C)C)c1 1579150317 GTQFMBWEXHSUJP-LLVKDONJSA-N 280.412 2.477 10 20 CECD CCOc1cccc(CN[C@@]2(C)CCO[C@@H]2C)c1O 230153080 KHFYYFRPNDHFIN-ABAIWWIYSA-N 265.353 2.448 10 20 CECD CN(C)c1ccc(CN[C@]2(C(=O)O)CC[C@@H]3C[C@H]32)cc1 1777040004 VHPABVXOBMFJNY-XNRPHZJLSA-N 274.364 2.096 10 20 CECD COc1cccc(CN2CC[C@H]3[C@H](CCCN3C)C2)c1O 156094678 ZRYRIZJAVFJRRV-HIFRSBDPSA-N 290.407 2.317 10 20 CECD Cc1ccccc1S(=O)(=O)NCc1ccccc1O 158578671 OPYOOYYTYMOVSD-UHFFFAOYSA-N 277.345 2.179 10 20 CECD Cc1ccc([C@@H](C)NCCc2n[nH]c(C)n2)c(O)c1 273418517 IWXXNCWHIFOZKU-SNVBAGLBSA-N 260.341 2.020 10 20 CECD c1cn(CCCCNCc2ccc3c(c2)CCO3)cn1 44353162 LNIWHGMOMSRKIC-UHFFFAOYSA-N 271.364 2.388 10 20 CECD CN(C)c1cccc(C(=O)NCc2ccccc2O)c1 82293995 ZYHRZHZFXDVDRN-UHFFFAOYSA-N 270.332 2.388 10 20 CECD CC(C)(C)CN(CC(=O)O)Cc1ccccc1O 692083006 PIHPUOXAMHEEPT-UHFFFAOYSA-N 251.326 2.325 10 20 CECD C[C@@H](NC(=O)CC[C@H]1CCCNC1)c1ccccc1O 870988743 YHISYCWJDHQPEZ-CHWSQXEVSA-N 276.380 2.349 10 20 CECD CCCOC(=O)[C@H](C)N(C)Cc1ccccc1O 119529880 XMRAXGOKWTXHOF-NSHDSACASA-N 251.326 2.166 10 20 CECD Cc1cccc(NC(=O)c2ccc(C)c(O)c2O)n1 177661974 BTHAXMNIDZOBFP-UHFFFAOYSA-N 258.277 2.362 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)[C@@H](C)N2CCOCC2)c1 185375761 XOCRHWQWKABQPJ-SOUVJXGZSA-N 292.423 2.460 10 20 CECD COc1ccc(O)c([C@H](C)NS(=O)(=O)c2ccco2)c1 188710842 BOJAUIVKEBRPND-VIFPVBQESA-N 297.332 2.033 10 20 CECD Oc1ccc(Cl)cc1CNC[C@@H]1CC[C@H](O)C1 188831424 KYQGWEAAYZBLKK-SKDRFNHKSA-N 255.745 2.296 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CC=CCC2)c1 77600090 QLIANIXULAZLAH-LBPRGKRZSA-N 276.336 2.309 10 20 CECD CC[C@@]1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CCCN1 214497864 VVYNHTSTCGSZMD-KRWDZBQOSA-N 289.423 2.243 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)[C@H]1CCSC1 130542755 AQKJGWYYGTWSEM-INIZCTEOSA-N 292.448 2.461 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)Nc1ccncn1 194125157 CZOTXQYJTYQDGL-UHFFFAOYSA-N 295.346 2.175 10 20 CECD CO[C@H](C)CNC(=O)NCc1ccc(N2CCCC2)cc1 190324654 HFYMLZTUNOLGEI-CYBMUJFWSA-N 291.395 2.121 10 20 CECD CO[C@@H](C)CNC(=O)NCc1c(C)c2ccccc2n1C 350256153 RKMTYCYGSBFSNW-NSHDSACASA-N 289.379 2.321 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 268802955 DZXNSTASFIFWFY-UKRRQHHQSA-N 275.396 2.024 10 20 CECD CC1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CCOCC1 272684259 SKZLLHREJMORJJ-HWKANZROSA-N 291.347 2.044 10 20 CECD CCOCc1nnc(NCc2ccc(N(C)C)c(F)c2)o1 272307147 XNYFLJWDENSGSV-UHFFFAOYSA-N 294.330 2.423 10 20 CECD COc1cccc(CN[C@@H](C)CCn2cccn2)c1O 289186396 BASLMYWVIYMHRM-LBPRGKRZSA-N 275.352 2.166 10 20 CECD CC[C@@H](NCC1(CO)CCOCC1)c1ccc(F)cc1O 286200082 RHQGGPQPMBZQKM-CQSZACIVSA-N 297.370 2.361 10 20 CECD Cc1cc(C)c([C@@H](C)NCC(C)(C)C(N)=O)c(O)c1 284966587 FQFGCPUSZSXNMF-LLVKDONJSA-N 264.369 2.171 10 20 CECD Cc1nnc(CN(Cc2ccc(N(C)C)cc2)C2CC2)n1C 299088419 SZTRORRNSNKDIF-UHFFFAOYSA-N 299.422 2.354 10 20 CECD CCc1nc2ccccc2c(C(=O)OCC(=O)C(C)=O)c1C 808486521 DCBKLEXCCTVAOQ-UHFFFAOYSA-N 299.326 2.421 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc2n(n1)CCC2 294373410 KLQKXRVEIFYVFG-UHFFFAOYSA-N 298.390 2.168 10 20 CECD CCOc1ccc(CN(C)CCN(C)C2CC2)c(O)c1 809755062 OBFWIIDSUQEEAM-UHFFFAOYSA-N 278.396 2.317 10 20 CECD CCc1nc([C@@H](C)N[C@H]2CCc3cccc(O)c32)n[nH]1 297073408 WLZYNSIBVQBIAH-KOLCDFICSA-N 272.352 2.411 10 20 CECD C[C@H](NCCCC(=O)O)c1ccc(N2CCOCC2)cc1 818051874 BJZJOHJWANYESH-ZDUSSCGKSA-N 292.379 2.039 10 20 CECD C[C@@H](N[C@@H]1CCCC[C@H]1N)c1cc([N+](=O)[O-])ccc1O 818615100 LYXGQONQOLCKDC-OASPWFOLSA-N 279.340 2.221 10 20 CECD CC(C)OC(=O)[C@H](C)NCc1ccc(N(C)C)c(F)c1 825118135 PARPMSYOVDVRNV-NSHDSACASA-N 282.359 2.321 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)Cc2cnn(C)c2)c1 825046498 UWNSJOINJXMMIT-LBPRGKRZSA-N 289.379 2.245 10 20 CECD Cc1cccc(CN2CC[C@@H](CN3CCCC3=O)C2)c1O 827633696 BVRBZFNOBYFOLP-CQSZACIVSA-N 288.391 2.145 10 20 CECD CCC(=O)[C@@H]1CCCN1C(=O)/C=C\c1ccc(O)c(O)c1 909354621 YBGWKUTXZTYSFB-VFFGBVLKSA-N 289.331 2.081 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H](c2ncc[nH]2)C1 732285065 PLOIYHZBTGHMMB-SECBINFHSA-N 277.349 2.197 10 20 CECD CCN(C)c1ccc(CN[C@](C)(C(N)=O)C(C)C)cc1 839007329 GNZVZWNYSLAWMM-INIZCTEOSA-N 277.412 2.132 10 20 CECD O=C(O)c1cnc(NCc2c(O)ccc3c2CCCC3)nc1 910362614 LQROYWRVGWFESV-UHFFFAOYSA-N 299.330 2.371 10 20 CECD CCOc1ccc(O)c(CN2CC(c3nc(C)no3)C2)c1 839131698 YRIPIFWKNNGBQY-UHFFFAOYSA-N 289.335 2.082 10 20 CECD CC1(C)NCC[C@H]1NCc1cc(Cl)ccc1O 841085655 JHRAAZWPUDGIGW-GFCCVEGCSA-N 254.761 2.276 10 20 CECD Cc1cc(O)c(CN2CC[C@H]3CC[C@@H](C2)N3)cc1C 843054622 XBTMFJWGFQWPPR-CABCVRRESA-N 260.381 2.335 10 20 CECD CCN(C(=O)NC[C@H](N)c1ccc(N(C)C)cc1)C(C)C 842786344 YFHXGOQAPPCHJP-HNNXBMFYSA-N 292.427 2.192 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCNCC1 846673984 UMDGGQAEYSRKLL-AWEZNQCLSA-N 289.423 2.067 10 20 CECD COc1ccc(N(C)Cc2ccn(C)c(=O)c2)cc1 844353289 KWDHAYJJVCQPCX-UHFFFAOYSA-N 258.321 2.030 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1N 843052332 OPTXIDQXOITQHN-UKRRQHHQSA-N 279.403 2.451 10 20 CECD Cc1ccc(O)c(CNC(C)(C)c2cnn(C)c2)c1 742374008 OIMSYNDJACQDNV-UHFFFAOYSA-N 259.353 2.459 10 20 CECD C[C@@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@H](C)C1 927859250 SDJDUEVGGGOWDZ-VXGBXAGGSA-N 289.379 2.102 10 20 CECD C[C@H](N[C@@H](CO)CCF)c1ccc(N(C)C)cc1 846208775 KZGRNKOEEXXRGW-WCQYABFASA-N 254.349 2.124 10 20 CECD COC[C@@H](NCc1ccc2c(c1)CCCO2)[C@@H]1CCCO1 922078726 GUXAQOKWMQQZTK-WBVHZDCISA-N 291.391 2.295 10 20 CECD C[C@@H](N[C@H]1C[C@H](O)C1)c1ccc(Br)cc1O 850578271 IVBQDXXDKDEVHR-SZEHBUNVSA-N 286.169 2.329 10 20 CECD Cc1cc(CN2CCC[C@H]2C2OCCO2)ccc1N(C)C 933899660 FLRXOURFKLAHHF-INIZCTEOSA-N 290.407 2.398 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccnc(C3CC3)n2)c1 862759763 IJTYHRHFAZXLQJ-UHFFFAOYSA-N 283.331 2.298 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@@H]2COCC[C@H]2O)c1O 866497665 OUBJQBIGWXNHIS-OASPWFOLSA-N 285.771 2.154 10 20 CECD CC[C@@H](CO)N(C)Cc1ccc(N2CCCC2)cc1 1117788946 CLGGFJGTVHEITI-HNNXBMFYSA-N 262.397 2.490 10 20 CECD Cc1nc(C(=O)NCc2ccc(O)c(O)c2)sc1C 772402835 CXSKHBUJIHXQIT-UHFFFAOYSA-N 278.333 2.101 10 20 CECD COc1ccc(O)c(CN2CCCC3(CCNCC3)C2)c1 1118181448 WQZDMNMKRBRXRA-UHFFFAOYSA-N 290.407 2.366 10 20 CECD COC(=O)C1CCN(Cc2c(C)cccc2O)CC1 876529089 AFDUTGAOYLMOLN-UHFFFAOYSA-N 263.337 2.086 10 20 CECD C[C@H](CC(=O)N(C)c1ccc(N)cc1)C1CCNCC1 877078863 IDBZCEDCRTYNEX-GFCCVEGCSA-N 275.396 2.257 10 20 CECD CC[C@@H](CSC)N(C)Cc1cc2c(cc1O)OC[C@H]2O 773255042 LPXTXZKEUJGROW-SMDDNHRTSA-N 297.420 2.391 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1ccc(C)cc1O 877549160 IAQLMNYTUIYRFI-CYBMUJFWSA-N 278.396 2.343 10 20 CECD Cc1cc(O)c(CN[C@H]2CCC[C@@H]2O)cc1Cl 877700458 PQERCGIVAOVBIG-RYUDHWBXSA-N 255.745 2.357 10 20 CECD C[C@H](Nc1ccnc(N)n1)c1ccc(N2CCOCC2)cc1 1120806064 SSQFJCSVOIVUDU-LBPRGKRZSA-N 299.378 2.069 10 20 CECD CC[C@H](NCc1cc(Br)ccc1O)[C@H](C)O 386816557 SRQAISCJMMLULQ-KWQFWETISA-N 288.185 2.404 10 20 CECD COc1ccc(CNCc2c(O)cccc2OC)c(O)c1 793386463 RMPSCUHOEMABOE-UHFFFAOYSA-N 289.331 2.405 10 20 CECD C[C@H]1c2nncn2CCN1Cc1cc(Cl)cc(F)c1O 792187425 LLCRXBYZCFXUTC-QMMMGPOBSA-N 296.733 2.353 10 20 CECD C[C@@H](NCc1c(O)ccc(Cl)c1F)c1ncnn1C 790991129 KYRMMKPTEKFEQY-SSDOTTSWSA-N 284.722 2.164 10 20 CECD C[C@H](N[C@H](C)c1nncn1C)c1cc(F)ccc1O 94617331 SZGGYRKQBHWMMF-DTWKUNHWSA-N 264.304 2.072 10 20 CECD CCOc1cccc(CN(C)C(C)(C)CC(=O)O)c1O 1597153760 NPRJLICDCQXPPL-UHFFFAOYSA-N 281.352 2.476 10 20 CECD COc1ccc(CNCc2cc(C)c(C(=O)O)o2)c(O)c1 1607260465 SBUKHBDAMMEVFA-UHFFFAOYSA-N 291.303 2.290 10 20 CECD CO[C@H](CN[C@H](C)c1cc(C(=O)O)ccc1O)C1CC1 1606680140 OKWBVANHFXMXRU-YMTOWFKASA-N 279.336 2.166 10 20 CECD Cc1c(/C=C/C(=O)N2CCOc3ccccc32)cnn1C 158245258 FCLDDVLJXLKIGY-BQYQJAHWSA-N 283.331 2.167 10 20 CECD C[C@@H](O)CCCN1CCOc2cc(N(C)C)ccc21 828538294 JZIOTYGEINLNLP-GFCCVEGCSA-N 264.369 2.112 10 20 CECD Cc1ccc(CN[C@@H](CO)Cc2ccccc2)c(O)c1 877036736 ICEZCZHWKKXMLU-MRXNPFEDSA-N 271.360 2.394 10 20 CECD Cc1ccccc1OCCNC(=O)c1cccc(O)c1O 186991518 ADSWAUQXJZERIN-UHFFFAOYSA-N 287.315 2.215 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1cccnc1 183474763 VNFFLQLFPIEYIZ-PZBABLGHSA-N 298.342 2.253 10 20 CECD CN(CC(=O)N1CCCCCC1)c1ccc2c(c1)OCO2 121312727 ZUKIBCCLSNTVHY-UHFFFAOYSA-N 290.363 2.254 10 20 CECD CC(C)CNC(=O)N1CCOc2cc(N(C)C)ccc21 184205309 COKCBWYRLSWOQX-UHFFFAOYSA-N 277.368 2.317 10 20 CECD C[C@@H](NC[C@@]1(O)CCSC1)c1ccc(F)c(F)c1O 187744958 QJKVNZLEHFXMHY-OQPBUACISA-N 289.347 2.189 10 20 CECD CC(C)CCO[C@@H]1CCN(C(=O)c2cccc(O)c2O)C1 187174424 ISVTXYUROVNYQM-GFCCVEGCSA-N 293.363 2.375 10 20 CECD COc1cc(N(C)CCCCCO)c([N+](=O)[O-])cc1OC 227108977 DSBQCEDKMQKMQA-UHFFFAOYSA-N 298.339 2.211 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCCCN1 81016146 WFDIOTLUHAVGGV-INIZCTEOSA-N 289.423 2.243 10 20 CECD C[C@@H]1O[C@H](C)[C@H](C(=O)N(C)Cc2ccccc2O)[C@H]1C 383981631 SESPYOXHGMUYBY-UUIJZJDISA-N 277.364 2.410 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@]2(C)CCCO)c(O)c1O 273347329 SDGDCKABDGNMKT-INIZCTEOSA-N 293.363 2.173 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2C[C@H]3CC[C@@H]2O3)c1 273368768 BYDTYOTYAKVUIA-YYWQGFNFSA-N 291.347 2.149 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCS1 274934288 OGICWSMSORNFQF-IINYFYTJSA-N 295.404 2.431 10 20 CECD NC(=O)CCC1CCN(Cc2cc(F)ccc2O)CC1 272257905 JOAGXCZWQJSVHY-UHFFFAOYSA-N 280.343 2.009 10 20 CECD COCC[C@H](CO)N[C@H](C)c1cc2c(cc1O)CCCC2 281719267 UMIBUXRSBGOTPD-IUODEOHRSA-N 293.407 2.319 10 20 CECD C[C@@H]1CC[C@H](CCC(=O)NCc2ccc(N)cc2)O1 297264639 RZKDCHCVFTZUNH-BXUZGUMPSA-N 262.353 2.233 10 20 CECD CCN(Cc1nccn1C)c1ccc(OC)c(OC)c1 299560531 FHNURMJKSCFRRF-UHFFFAOYSA-N 275.352 2.464 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H]2CNCCCO2)c(O)c1 817981908 OIUGOSWZPSSULL-ZIAGYGMSSA-N 278.396 2.038 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3c(F)cccc32)cn1 492743377 VLTCYQDLEVZEBU-WAYWQWQTSA-N 299.305 2.227 10 20 CECD Cc1cc(O)c(CN[C@@H](C)C[S@@](C)=O)cc1Cl 825498103 VJEXKPKCKMDXFQ-HUTHGQBESA-N 275.801 2.211 10 20 CECD CC[C@H](NC[C@@H]1CCN1C)c1ccc(F)cc1O 903319414 ZABRAHWOOAGJOY-AAEUAGOBSA-N 252.333 2.276 10 20 CECD C[C@@H]1C[C@@H]1CNCc1ccc(N2CCC(O)CC2)cc1 827662397 QISXTXJJFXGONV-UKRRQHHQSA-N 274.408 2.393 10 20 CECD CN(C)c1ccc(CN2C[C@H]3C[C@@H](O)CC[C@H]3C2)cc1 839666490 RTLBGECWIOZPOU-UXLLHSPISA-N 274.408 2.345 10 20 CECD Cc1cc(O)c(CN(C)[C@@H](COC(C)C)C(=O)O)cc1C 833746490 ATXIMHANERRRQY-AWEZNQCLSA-N 295.379 2.319 10 20 CECD COc1ccc(N(CCN2CCOC2=O)CC2CC2)cc1 831582644 BBLXTODKHCLJSH-UHFFFAOYSA-N 290.363 2.364 10 20 CECD CCOc1ccc(O)c(CN(CC)CCC(=O)O)c1 833662918 MNGUXCAIKYVOPV-UHFFFAOYSA-N 267.325 2.088 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C)S1 743728759 WJLWLTNRXXZISF-OCAPTIKFSA-N 257.380 2.420 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2cc(C)ccc2O)C1 840975148 LUWBPGZDKQIHFF-INIZCTEOSA-N 277.364 2.476 10 20 CECD C[C@H](Nc1ncc(C(=O)O)cn1)c1ccc(N(C)C)cc1 844211916 KZCGCWWCTCYNJQ-JTQLQIEISA-N 286.335 2.414 10 20 CECD CCNC(=O)C(C)(C)CN[C@H](C)c1cccc(OC)c1O 846159263 DXTQDGZBUNCMGP-LLVKDONJSA-N 294.395 2.214 10 20 CECD CC[C@H](C(=O)OC)N(C)CCN(C)c1ccc(OC)cc1 844399458 KDPCRJLBUAINLQ-OAHLLOKOSA-N 294.395 2.015 10 20 CECD CCN(C(=O)/C=C/c1ccc(C)nc1)c1cnn(C)c1 848343433 FMPPPQNRGMJMDT-BQYQJAHWSA-N 270.336 2.190 10 20 CECD CN(C)c1ccc(OCc2cc3n(n2)CCC3)cc1 844766639 ODGNUEKNRKNOCD-UHFFFAOYSA-N 257.337 2.474 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1cc(Cl)cc(F)c1O 840838690 RREVSMRAWJNLNJ-NSHDSACASA-N 286.734 2.414 10 20 CECD Nc1ccc(CCNC(=O)N2CC[C@H](C3CC3)C2)cc1 841956454 BDMOZHHKQPFYIX-AWEZNQCLSA-N 273.380 2.253 10 20 CECD CN(Cc1cc2c(cc1O)CCCC2)C[C@@H]1COCCO1 853558341 RMACHXQUBGNVRZ-MRXNPFEDSA-N 291.391 2.118 10 20 CECD CC(C)CN1CC[C@H](CNC(=O)c2cc(O)cs2)C1 757440875 ZYRLZIHBOTVWDQ-LLVKDONJSA-N 282.409 2.161 10 20 CECD COC(=O)C(C)(C)NCc1cc(F)c(N(C)C)cc1F 858132677 BPFCZUSGHOQXAH-UHFFFAOYSA-N 286.322 2.072 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)N(C)C[C@H]2C)c1O 768762652 FDJCPGBKPWYUIV-GHMZBOCLSA-N 294.370 2.258 10 20 CECD CO[C@@H]1CCN(Cc2cc3c(cc2O)CCCC3)C1 768464450 RUQOQPCOMIQUBH-OAHLLOKOSA-N 261.365 2.492 10 20 CECD C[C@@H](O)[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1116511788 BMMANIVACGVAGE-GDBMZVCRSA-N 274.408 2.490 10 20 CECD CCCOc1ccc(CN[C@](C)(CO)COC)cc1C 873069249 ABKNVWAIUUQSKF-MRXNPFEDSA-N 281.396 2.271 10 20 CECD CCOc1ccc(CN2CCC(C)(O)CC2)c(O)c1 769445855 GYVDKNCTBXVTOK-UHFFFAOYSA-N 265.353 2.138 10 20 CECD C[C@H](NC(=O)[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 773013817 ZWVBMAMLBWASRM-WFASDCNBSA-N 276.380 2.499 10 20 CECD CCOc1ccc(CN2CCN(C)[C@H](C)[C@H]2C)c(O)c1 775987881 WVMPTMHZJYPARV-CHWSQXEVSA-N 278.396 2.315 10 20 CECD COC(C)(C)CNCc1ccc(N2CCC(O)CC2)cc1 877067687 KUHPSFAFRIKDHC-UHFFFAOYSA-N 292.423 2.162 10 20 CECD CN(Cc1cc(F)c(N(C)C)cc1F)CC1CC(O)C1 877466168 ZUASIQYFMGWUCY-UHFFFAOYSA-N 284.350 2.234 10 20 CECD C[C@@H]1OCC[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 770618450 OXTRHWZZZQBTJP-SWLSCSKDSA-N 276.380 2.136 10 20 CECD CN1CCC(NC(=O)c2ccc(CN=[N+]=[N-])s2)CC1 1537962949 KYBAZGGRJDIWNS-UHFFFAOYSA-N 279.369 2.382 10 20 CECD C[C@@H](NCC(C)(C)N1CCOCC1)c1c(O)cccc1F 886489713 PBVNGRYZKWPWAV-GFCCVEGCSA-N 296.386 2.293 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2c(O)cccc2F)C1 886541701 ZYGLEYJXIWUCLH-WDEREUQCSA-N 280.343 2.193 10 20 CECD CCN(C)c1ccc(Cn2cc([C@@](C)(O)CC)nn2)cc1 881314832 GGWHVLIYZYRZJP-INIZCTEOSA-N 288.395 2.400 10 20 CECD C[C@@H]1C[C@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CO1 784163262 MTRNVXQGXHTVIK-BZPMIXESSA-N 276.380 2.355 10 20 CECD Cc1cccc(N(C)C(=O)c2ccc(C)c(O)c2O)n1 780943145 AVWFERVUHAHFNE-UHFFFAOYSA-N 272.304 2.386 10 20 CECD COc1ccc(CNCc2ccn(C)c2)c(O)c1OC 893100528 NCCQWBYTQCXOQN-UHFFFAOYSA-N 276.336 2.038 10 20 CECD COc1ccc(CN(C)C[C@H]2CCC[C@H]2O)c(O)c1OC 892217600 ZEHPWSPRJDTERJ-DGCLKSJQSA-N 295.379 2.002 10 20 CECD O=C(COC(=O)C(C1CC1)C1CC1)c1ccc(O)c(O)c1 784361489 QYOQLTRXSIAVBF-UHFFFAOYSA-N 290.315 2.260 10 20 CECD CCO[C@H]1CCN(Cc2cc(OC)c(OC)cc2O)C1 897067667 BUHJBDYXGJYMQS-LBPRGKRZSA-N 281.352 2.020 10 20 CECD CO[C@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 792164646 BRMYKRGGJPPAKD-QMMMGPOBSA-N 259.708 2.405 10 20 CECD CCC[C@](C)(NCc1cccc(OC)c1O)C(=O)O 86731956 SOMBCEACQDVNIP-AWEZNQCLSA-N 267.325 2.134 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@H](C(=O)O)C2)cc1 86786071 LQZXZOLQQGTTHA-KBPBESRZSA-N 276.380 2.486 10 20 CECD C[C@H](N[C@H]1CCn2ccnc2C1)c1ccccc1O 779060676 HXZMTXTWBQHKPI-RYUDHWBXSA-N 257.337 2.254 10 20 CECD COc1ccc(N(C)Cc2ccc(C(=O)O)[nH]2)cc1F 1599584117 NAJLJUSBZFXXFJ-UHFFFAOYSA-N 278.283 2.497 10 20 CECD CCc1cccc(CN[C@@]2(CC(=O)O)CCCOC2)c1O 1597586265 DCLATOHQDSTLCI-MRXNPFEDSA-N 293.363 2.068 10 20 CECD CO[C@@]1(CN[C@H](C)c2cc(C)ccc2O)CCOC1 123156177 ONORRWYVXNLKIO-IUODEOHRSA-N 265.353 2.157 10 20 CECD Nc1ccc(CCNC(=O)C2[C@H]3[C@@H]4CC[C@H](C4)[C@@H]23)cc1 152547762 TVEQSYVZAXUBSE-PCUAHHGDSA-N 270.376 2.220 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 157419401 KTQJKJLWYCPZAZ-UHFFFAOYSA-N 265.376 2.029 10 20 CECD Cc1nc(CNCc2ccc3c(c2)CCO3)[nH]c1C 850110840 ACOKFYRRPDEFMI-UHFFFAOYSA-N 257.337 2.251 10 20 CECD CO[C@H](CN(C)Cc1ccccc1O)C1CCOCC1 876616557 ZKDOOOYCINLPET-MRXNPFEDSA-N 279.380 2.266 10 20 CECD C[C@H](Cn1cccn1)NCc1cc(Cl)ccc1O 37155666 QJXXHBMCMTTZFA-SNVBAGLBSA-N 265.744 2.420 10 20 CECD C[C@H](NCCCC(=O)N(C)C)c1ccc(N(C)C)cc1 161835747 WRDHTWHOARHVDD-ZDUSSCGKSA-N 277.412 2.272 10 20 CECD OC[C@H]1C[C@H](NCc2cccc(Br)c2O)C1 923007738 NLJQCDWAGCHOMT-CZMCAQCFSA-N 286.169 2.015 10 20 CECD COCCCC(=O)NCc1ccc2c(c1)CCCN2C 58770146 OGEHOGDWCKQSKK-UHFFFAOYSA-N 276.380 2.112 10 20 CECD CN(C)c1ccc(CNc2ncc(F)cn2)cc1F 301794721 SQRQJXRYAZNKTE-UHFFFAOYSA-N 264.279 2.433 10 20 CECD CN(C)c1ccc(CNC(=O)CCn2cccc2)cc1 21016653 GSPFKCMQPOUOAG-UHFFFAOYSA-N 271.364 2.261 10 20 CECD COC[C@@H](O)CN(c1ccc(OC)cc1)[C@H](C)C1CC1 178858986 PIXKMGFMWLETFI-DOMZBBRYSA-N 279.380 2.307 10 20 CECD C[C@H](O)C[C@@H]1CCCN1Cc1cc(F)ccc1O 180170853 MZHHCRRAQOXSQF-GWCFXTLKSA-N 253.317 2.267 10 20 CECD C[C@H](NCc1ccc(N2CCCCC2)cc1)C(=O)N(C)C 36793870 RKVNWRYVFIQSEZ-AWEZNQCLSA-N 289.423 2.243 10 20 CECD CC[C@@H]1COCCN1Cc1cc(OC)ccc1O 132339030 OPWVHBODHUKJOO-GFCCVEGCSA-N 251.326 2.012 10 20 CECD COCCOCCN(C)Cc1cc(Cl)ccc1O 381157715 FBZKJTIGFNMZSF-UHFFFAOYSA-N 273.760 2.140 10 20 CECD CCCOc1ccc(CNCCCCO)c(O)c1 193254425 JPSUCDMVXIGLRR-UHFFFAOYSA-N 253.342 2.043 10 20 CECD COCCCN(Cc1ccccc1O)C[C@@H]1CCCO1 264760740 YREKJQKZGQPARF-HNNXBMFYSA-N 279.380 2.410 10 20 CECD CCOc1ccc(N2CCN(C(=O)NC(C)C)CC2)cc1 244016514 SNXLTUWHENQUPZ-UHFFFAOYSA-N 291.395 2.325 10 20 CECD CCN(CCn1ccc([N+](=O)[O-])n1)c1ccc(OC)cc1 267080986 MXBQPMZFMKQCNC-UHFFFAOYSA-N 290.323 2.326 10 20 CECD Cc1cccc(CCNCc2cc([N+](=O)[O-])ccc2O)n1 279548811 ACZPWYPBABKMCW-UHFFFAOYSA-N 287.319 2.336 10 20 CECD CC[C@H](CSC)NC(=O)NCc1ccccc1O 271683028 KGPQTDYXHQGFJW-LLVKDONJSA-N 268.382 2.333 10 20 CECD c1cncc(-c2n[nH]cc2CN2CCCc3n[nH]cc32)c1 279447063 DWCCXGGCVCYASM-UHFFFAOYSA-N 280.335 2.148 10 20 CECD CCOC[C@@H](O)CN1CCCCc2cc(OC)ccc21 270877561 MTMSCILTJOSULD-AWEZNQCLSA-N 279.380 2.235 10 20 CECD C[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(F)(F)F 277093562 KUYUCGMYDUMEOA-LURJTMIESA-N 264.203 2.341 10 20 CECD C[C@@H]1OCC[C@]12CN(Cc1ccccc1O)C[C@@H](C)O2 280570364 VSUIHONQSOKDCM-WWGRRREGSA-N 277.364 2.161 10 20 CECD C[C@H](NC[C@@H](CO)[C@H]1CCOC1)c1cc(Cl)ccc1O 280921510 RCYZBFNLHJYTIC-SRVKXCTJSA-N 299.798 2.341 10 20 CECD CC(=O)N1CCC[C@@H](CN[C@@H](C)c2ccc(F)cc2O)C1 281170809 PXFHMKAIQSMHIA-AAEUAGOBSA-N 294.370 2.440 10 20 CECD CC(=O)C(=O)COc1cc(Cl)c(Cl)cc1[N+](=O)[O-] 808035711 ZFTBDAKQYGXIJT-UHFFFAOYSA-N 292.074 2.439 10 20 CECD Cc1cc(Cn2cnc([N+](=O)[O-])c2)ccc1N(C)C 292666181 NVFGQFPCWFNFQV-UHFFFAOYSA-N 260.297 2.214 10 20 CECD COCC1(CN[C@@H](C)c2ccc(C)cc2O)CCNCC1 817975683 XTYXRRPRGAXEME-AWEZNQCLSA-N 292.423 2.367 10 20 CECD C[C@@H](NC[C@@H]1CNCCO1)c1ccc2ccccc2c1O 817983948 SFDIYOHILYMPNX-OCCSQVGLSA-N 286.375 2.184 10 20 CECD CC1(C)CN(C(=O)c2cc(O)cs2)[C@@H]1[C@H]1CCCO1 811595524 PSYCVWHSWYGNSG-ZYHUDNBSSA-N 281.377 2.483 10 20 CECD Cc1ccc(C(=O)OCCC2CCOCC2)c(O)c1O 814449991 HHVPYEJAPXSSLM-UHFFFAOYSA-N 280.320 2.380 10 20 CECD CCc1cccc(CN2CC[C@@H]3NC(=O)CC[C@H]3C2)c1O 827134024 ZRPPCKDBSYRAAW-ZFWWWQNUSA-N 288.391 2.055 10 20 CECD O=C(Nc1ccc(-c2nc[nH]n2)cc1)c1cc(O)cs1 735519530 BSVKZHXNHMFKON-UHFFFAOYSA-N 286.316 2.491 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2C[C@H]2C(C)C)c1O 838769074 ZRVUGTBOUREGMJ-NWDGAFQWSA-N 278.352 2.245 10 20 CECD Cc1ccc(O)c(CNc2nc3n(n2)CCCC3)c1 834482396 JBVQWHJUGLBFNH-UHFFFAOYSA-N 258.325 2.241 10 20 CECD Cc1cccn2cc(CNC(=O)c3cc(O)cs3)nc12 736673033 DONQZNBBTNHSPE-UHFFFAOYSA-N 287.344 2.340 10 20 CECD O=C(NC[C@H](CO)C1CCCCC1)c1cc(O)cs1 832890247 WHYZRFZRBKDGAH-LLVKDONJSA-N 283.393 2.372 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CC(C)(C)O 839922493 WCWLRSWUYAHGAK-ZDUSSCGKSA-N 292.423 2.269 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@]2(C)CCC(=O)N2)cc1 834910069 VLVVSDOIMQDZSG-CXAGYDPISA-N 289.423 2.462 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCCN[C@H]1C 841063146 IWFXHLGXXHBPLH-BBRMVZONSA-N 261.413 2.291 10 20 CECD CN(CCC1CCOCC1)c1ccc(OCC(=O)O)cc1 846279833 NBIWTYGMZZOOTK-UHFFFAOYSA-N 293.363 2.403 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN[C@@H](C)[C@@H]2C)c1O 843376858 FGAJQTWYHRFXRO-UWVGGRQHSA-N 296.798 2.430 10 20 CECD CO[C@@H](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 749562772 NJTVDAVWLDTFIO-LBPRGKRZSA-N 264.369 2.136 10 20 CECD CCOc1ccc(CN2CCCC[C@H]2[C@@H](C)N)c(O)c1 843045862 LHTNHQJKIBBPQM-DOMZBBRYSA-N 278.396 2.493 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@H]2NCC[C@@H]2C1 843126604 LPYVMLNABLLSQC-BXKDBHETSA-N 284.762 2.369 10 20 CECD CO[C@@H](CC(C)C)C(=O)NCc1ccc(N(C)C)cc1 841018297 SEZJJQSOWJNPEL-HNNXBMFYSA-N 278.396 2.430 10 20 CECD C[C@H]1C[C@@H](NCC2(C)OCCO2)c2c(O)ccc(F)c21 756779898 NSDHUPOEWPAKGD-GXSJLCMTSA-N 281.327 2.432 10 20 CECD O[C@@]1(CCNCc2ccc3c(c2)CCCO3)CCCOC1 922219859 MLGBTBNALJAGKA-QGZVFWFLSA-N 291.391 2.033 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](O)C2CCOCC2)c(O)c1 756738308 NUMAFTSXYBUJDH-WBMJQRKESA-N 279.380 2.139 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCO[C@H](C)C2)c1 756542505 ASPMNNACGPEWHV-ZIAGYGMSSA-N 278.396 2.072 10 20 CECD C[C@@H](NC(=O)c1nc(C2CC2)no1)c1ccccc1O 866161930 ZNFGANGOPSYKHF-MRVPVSSYSA-N 273.292 2.144 10 20 CECD Cc1cccc(CN2CC[C@H](C)[S@@](=O)CC2)c1O 763491063 MKLUAOLWNWGYEE-SGTLLEGYSA-N 267.394 2.044 10 20 CECD CC[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O 768450985 KYMOPICSBJEAQF-FZMZJTMJSA-N 263.337 2.192 10 20 CECD Cc1cc(O)c(CN2CCCNC(=O)C2)cc1C(C)C 872825098 HJDXLUFCQMSKGP-UHFFFAOYSA-N 276.380 2.146 10 20 CECD Cc1ccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)c(O)c1 877424824 QCYNXICKHGBKIN-LBPRGKRZSA-N 278.396 2.436 10 20 CECD CCCOc1ccc(CNCCC(=O)NC)cc1C 873023976 CZWKAXOIYNCQJQ-UHFFFAOYSA-N 264.369 2.010 10 20 CECD Cc1ccc(CN2CCOC[C@H]2[C@@H]2CCCO2)c(O)c1 877516146 BPNDSLXQLVCEHR-HOCLYGCPSA-N 277.364 2.080 10 20 CECD Cc1ccc(CNC[C@H](O)c2ccc(C)o2)c(O)c1 877060232 VQPUUWLPWXOIGV-AWEZNQCLSA-N 261.321 2.425 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](CC)CO 779649472 VQSMJCFRBKYQKB-GFCCVEGCSA-N 265.353 2.149 10 20 CECD CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccc(N)cc1)CC2 1120370803 FTOLZAXHNBPLGE-HZPDHXFCSA-N 290.407 2.021 10 20 CECD C=C/C=C\CCNC(=O)NCc1cc(OC)ccc1O 883411546 AXCZBDSIWIYKAK-PLNGDYQASA-N 276.336 2.332 10 20 CECD C[C@@H](NCCN1CCCC1)c1c(O)cccc1F 886491546 HPTGBVRFNXAPJR-LLVKDONJSA-N 252.333 2.278 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2ccc(OCC)cc2O)C1 896962002 HJORTIPBFCCUDL-ZDUSSCGKSA-N 293.363 2.176 10 20 CECD CC(C)(C(=O)OCC(=O)c1ccc(O)c(O)c1)C(F)F 795859630 HFDONCSXOCYWIA-UHFFFAOYSA-N 288.246 2.115 10 20 CECD COCCN1CC[C@@H](N[C@@H](C)c2cc(C)ccc2O)C1 273610455 VRMBGPUWSRLMCM-UONOGXRCSA-N 278.396 2.072 10 20 CECD COCC(=O)CSc1ncc(-c2ccccc2)n1C 794425371 GJWFECZPQFPKRN-UHFFFAOYSA-N 276.361 2.395 10 20 CECD COC(=O)N1CCCN(Cc2ccc(N(C)C)cc2)CC1 1203931479 RDLRGFLABLROQZ-UHFFFAOYSA-N 291.395 2.027 10 20 CECD C[C@@H](N)[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 70171808 KMYLCFWXEKEZOZ-HIFRSBDPSA-N 261.413 2.312 10 20 CECD CCc1cccc(CNCCc2ccn(C)n2)c1O 691513793 QHANGKXGKHJIKN-UHFFFAOYSA-N 259.353 2.020 10 20 CECD Cc1nnc(O)c(CN[C@H](C)c2ccccc2O)c1C 1254493206 SSUUIDAYRDINQN-LLVKDONJSA-N 273.336 2.355 10 20 CECD C[C@H](Nc1cncc(C(=O)O)n1)c1ccc(N(C)C)cc1 1609786105 PQMXHXCQHNJEOH-JTQLQIEISA-N 286.335 2.414 10 20 CECD Cc1ccc(O)c(CNC(C)(C)c2nocc2C(=O)O)c1 1607811134 BYRUXSUSYJXPKQ-UHFFFAOYSA-N 290.319 2.412 10 20 CECD COc1cc(CNC[C@@H]2CCN2)c(O)c(C(C)(C)C)c1 1579152803 ILUQFPDFEGAGRD-LBPRGKRZSA-N 278.396 2.150 10 20 CECD CC(C)[C@@H]1NCC12CCN(C(=O)c1cc(O)cs1)CC2 1575519191 AKBDCIYFXRVACM-ZDUSSCGKSA-N 294.420 2.304 10 20 CECD C[C@@H](NC(=O)[C@@H](N)c1ccccc1)c1ccccc1O 1579412935 FEZVLJLJCJBQGF-ABAIWWIYSA-N 270.332 2.269 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)C(=O)N1CCCC1 134588962 VYKULIDJXWXQCR-JTQLQIEISA-N 282.771 2.146 10 20 CECD Cc1cc(C(=O)NCCN)c(C)n1-c1ccc(Cl)cc1 158625933 YUEYWETZYHBOMV-UHFFFAOYSA-N 291.782 2.436 10 20 CECD COc1cc(CN(C)CC2CCN(C)CC2)c(O)cc1C 160144902 LZKGXADTCOTZNH-UHFFFAOYSA-N 292.423 2.483 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](C)[C@H]2C(=O)O)c1 818631629 LQKRPPRBQAKOMF-HZMBPMFUSA-N 279.336 2.086 10 20 CECD O=C(CSc1nc(C2CC2)n[nH]1)c1ccc(O)c(O)c1 30627630 ICVGQMYQSORTRW-UHFFFAOYSA-N 291.332 2.068 10 20 CECD CCC(C)(C)OCCNCc1cc2c(cc1O)OCO2 308762896 YXDNKCCHFVYXKR-UHFFFAOYSA-N 281.352 2.416 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1Cc2ccccc2O1 175505122 PQDHOQVBNVHPDS-INIZCTEOSA-N 283.327 2.354 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@H](C)OC)c1 170900522 GKLHAIYMHOEHEY-VHSXEESVSA-N 267.325 2.003 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1cncc(O)c1 171763819 NUVKVTZAPRJYPA-UHFFFAOYSA-N 297.358 2.317 10 20 CECD COc1ccc(N(C)Cc2nnc(C)o2)cc1OC 63616940 ABAVNRCCYZOMAN-UHFFFAOYSA-N 263.297 2.032 10 20 CECD CN(CC(=O)NCCC(C)(C)C)c1ccc2c(c1)OCO2 121373451 RGWDOBFGCLKLKZ-UHFFFAOYSA-N 292.379 2.404 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CO)CC(C)C)c1 40774038 KNIBODOAPATVDJ-NEPJUHHUSA-N 267.369 2.458 10 20 CECD COc1ccc(N(C)C[C@H](O)COC(C)C)cc1F 305028002 HDMQXZWDXKVCDQ-LBPRGKRZSA-N 271.332 2.056 10 20 CECD CN1[C@H]2CC[C@@H]1CN(Cc1cc(F)ccc1O)CC2 180194318 YXNQLEVOUUBYSB-UONOGXRCSA-N 264.344 2.200 10 20 CECD CCCN(CC(=O)OCC)Cc1ccc(N)cc1 35064524 OSGVZOBLCQIJCA-UHFFFAOYSA-N 250.342 2.044 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](CCO)CSC)c1 185530333 BIRAITGTEBUKGF-MNOVXSKESA-N 285.409 2.165 10 20 CECD CC[C@H](NC[C@H](O)COCC(C)C)c1ccccc1O 121081467 MWXAUFZKUTZGTH-ZFWWWQNUSA-N 281.396 2.466 10 20 CECD COC[C@H](O)CCN[C@H](C)c1cc2c(cc1O)CCCC2 186203111 YKBYBKNKYOZDON-IUODEOHRSA-N 293.407 2.319 10 20 CECD CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(Cc1ccccc1O)C[C@@H]3C2 289752878 QRQGVONXDJKCSF-YOPIWALVSA-N 259.349 2.247 10 20 CECD Cc1nn(C)cc1C(=O)NCc1c(C)c2ccccc2n1C 348659356 IXOHKHYKOMXYKM-UHFFFAOYSA-N 296.374 2.459 10 20 CECD C[C@H](NCCC1(C)OCCO1)c1ccc(F)cc1O 183885863 QPSGFTQMNFFYBY-JTQLQIEISA-N 269.316 2.335 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N(C)CCO)c1 269452379 GMZFZDKWCJKWIT-UHFFFAOYSA-N 286.375 2.467 10 20 CECD COC[C@@H](NC(=O)NCc1ccccc1O)c1ccco1 266924204 DCATXHYYAFYDMR-GFCCVEGCSA-N 290.319 2.172 10 20 CECD Cc1cccc(CNC2CCN(c3cccnn3)CC2)c1O 277769184 WBAPVRNZXULKDU-UHFFFAOYSA-N 298.390 2.249 10 20 CECD Cc1cccc(CN2CCOC3(CCOCC3)CC2)c1O 372127403 BJRAQHPQHXEBOR-UHFFFAOYSA-N 291.391 2.472 10 20 CECD C[C@H](NCCc1cnn(C)c1)c1ccc(F)c(F)c1O 276852727 BEPSZNRAQINZFZ-VIFPVBQESA-N 281.306 2.297 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCc3c[nH]nc3C2)c1 376200506 XFGMDTSOQWXVAO-CYBMUJFWSA-N 287.363 2.161 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCCOCCO)c1O 808714089 SGCRWDSSIXZERA-NSHDSACASA-N 287.787 2.404 10 20 CECD O=C(NC[C@H]1CC=CCC1)c1c(F)ccc(O)c1O 295038573 JBIRORJKSMFXRC-VIFPVBQESA-N 265.284 2.323 10 20 CECD CCc1nc(C)c(C(=O)NCc2cc(OC)ccc2O)o1 815834878 DGSIOAZNXPMAQO-UHFFFAOYSA-N 290.319 2.190 10 20 CECD O=C(CC[C@H]1CCNC1)NCCCSc1nccs1 829527615 AZYADONGUWRSBW-NSHDSACASA-N 299.465 2.131 10 20 CECD CC[C@H](NCc1cc(Cl)c(F)cc1O)[C@H](C)O 824921314 ITXDHTDWTPMCMQ-CPCISQLKSA-N 261.724 2.434 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cocn1 839919444 QTYIAFDWHBQLNE-GFCCVEGCSA-N 287.363 2.410 10 20 CECD Oc1c(Br)cccc1CNCC[C@@H]1CCNC1 841036405 MTVKMIAQNAVLEA-JTQLQIEISA-N 299.212 2.244 10 20 CECD C[C@@H]1CN(C(=O)/C=C/c2cnn(C)c2)c2ccccc2O1 732033034 GBEZRUICNOVRJR-ABZNLYFFSA-N 283.331 2.247 10 20 CECD O=C1NC(=S)S/C1=C1\COc2ccc(F)cc21 918155529 TZFCPAMLPWDIDV-VQHVLOKHSA-N 267.306 2.077 10 20 CECD C[C@@H]1C(=O)CCCN1C(=O)NCc1ccc(N(C)C)cc1 913927121 VHLYMPNDEWKXQR-GFCCVEGCSA-N 289.379 2.016 10 20 CECD O=C(NCCC(F)(F)F)NCc1ccccc1O 743700521 BCHFUKYDLLUKMY-UHFFFAOYSA-N 262.231 2.144 10 20 CECD CC(C)(C(=O)NCc1ccc(O)cc1O)c1ccccn1 910946784 UVWZEIQVKHTLJK-UHFFFAOYSA-N 286.331 2.087 10 20 CECD Cc1cc(C)c2c(N)c(C(=O)OCCCO)sc2n1 744576143 NJBJMBPFJLZFAA-UHFFFAOYSA-N 280.349 2.035 10 20 CECD C[C@@]1(CNC(=O)NCc2cc(Cl)ccc2O)CCCO1 845028921 ARKXAARMKPBKGY-AWEZNQCLSA-N 298.770 2.414 10 20 CECD CCCN(CC(=O)OC)Cc1ccc(N(C)C)cc1C 840908763 XDBUZKKLBUFMAW-UHFFFAOYSA-N 278.396 2.446 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](OC(=O)N(C)C)C2)c1 840104058 GPXRNFBGPOMSNT-AWEZNQCLSA-N 292.379 2.282 10 20 CECD CON(C)CCN[C@H](C)c1cc(Cl)cc(C)c1O 850477459 GVQMCJWIBLECKB-SNVBAGLBSA-N 272.776 2.498 10 20 CECD C[C@@H]1SCC[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 844106850 LFUMBOVADTYDJV-DLSFUBIUSA-N 279.361 2.121 10 20 CECD Cc1cnccc1CCNC(=O)NCCc1ccc(N)cc1 841865512 SQNRFWRQXUFJHA-UHFFFAOYSA-N 298.390 2.057 10 20 CECD COc1ccccc1-n1nnnc1Sc1nccs1 920958133 AVVUDEKNOQJZHT-UHFFFAOYSA-N 291.361 2.279 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@@H](OC2CCC2)C1 848301762 DUVVLFCPVIFGTF-GFCCVEGCSA-N 291.347 2.272 10 20 CECD Cc1nnc([C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)o1 759597441 ZPRZYTYXTPDBNO-HORMHSFOSA-N 290.275 2.107 10 20 CECD Cc1ncoc1C(=O)NCc1c(O)ccc2c1CCCC2 751070313 YTWLMOIPNJYESR-UHFFFAOYSA-N 286.331 2.497 10 20 CECD CCc1noc(CC)c1CNC(=O)c1cc(O)cs1 755860674 VCXUUMUPHOGEKZ-UHFFFAOYSA-N 280.349 2.497 10 20 CECD CCO[C@H](CC(=O)NCc1ccccc1O)C(C)C 761500003 ZIDGKXAJPYQWIY-CQSZACIVSA-N 265.353 2.460 10 20 CECD Cc1ccc(O)c(CNC(=O)/C=C\C2CCOCC2)c1 862759634 HMWFCIDWVQFRCC-HYXAFXHYSA-N 275.348 2.300 10 20 CECD COC(=O)c1cnc(SC[C@@H]2CCO[C@H]2C)s1 865368917 GKBCAUAUBAIFRN-YUMQZZPRSA-N 273.379 2.447 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1CC12CCC2 871914152 KNBKYKUFWAXCLM-CYBMUJFWSA-N 286.331 2.099 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccccc1O 779537498 PXLNDWNOLZBOGV-VURMDHGXSA-N 285.299 2.133 10 20 CECD Cc1ccc(CN2CCC[C@@H](S(C)(=O)=O)CC2)c(O)c1 877500339 SBJVEDJVYVJODA-CQSZACIVSA-N 297.420 2.100 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCN(c2ccccn2)C1 877120801 IVDNZIATCANTMX-AWEZNQCLSA-N 283.375 2.464 10 20 CECD COc1cc(O)c(CN[C@]2(C)CCCOC2)cc1OC 777508020 WJJUJKQKZQYHPL-OAHLLOKOSA-N 281.352 2.068 10 20 CECD CCC1(NC(=O)/C=C/c2ccc(O)c(O)c2)CCOCC1 779540966 VDPREEOCMYOHDM-GQCTYLIASA-N 291.347 2.186 10 20 CECD CCc1nnc(SCC(=O)c2ccc(O)c(O)c2)o1 882333770 XRDGXOLRRHVXIC-UHFFFAOYSA-N 280.305 2.018 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H](CF)C2)cc1 883077170 AYHPAJNKMWSFOX-CYBMUJFWSA-N 279.359 2.254 10 20 CECD Cc1cc(Cn2cc([C@@H](N)C(C)C)nn2)ccc1N(C)C 881377966 ZYMYUWUVPHGGKX-INIZCTEOSA-N 287.411 2.357 10 20 CECD COC(C)(C)CC(=O)NCc1ccc(N(C)C)cc1C 783587177 DDJFEXAJOLFBFQ-UHFFFAOYSA-N 278.396 2.492 10 20 CECD Cc1cc(O)c(CN[C@@H]2COC[C@H]2C)cc1Cl 896732568 IMRUGQXHSQUVCA-BXKDBHETSA-N 255.745 2.479 10 20 CECD COc1cc(N2CC(C)(C)C2)c([N+](=O)[O-])cc1OC 788575642 IGBYAEUTHCOECG-UHFFFAOYSA-N 266.297 2.458 10 20 CECD COc1cc(C)cc(CNCCCn2cccn2)c1O 894167294 XOCWPIFRDOYDOK-UHFFFAOYSA-N 275.352 2.086 10 20 CECD Cc1ccc(O)c(CN2[C@H](C)C(=O)N(C)[C@H](C)[C@H]2C)c1 895923622 XOCLTXMALAQZRI-JHJVBQTASA-N 276.380 2.140 10 20 CECD Cc1cc(O)c(CNC[C@H]2CCN2C)cc1Cl 896595801 OVHNSEYCMVWGCV-LLVKDONJSA-N 254.761 2.148 10 20 CECD CC[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@H]1O 792173173 TXCRVBIOMXSEJI-PRHODGIISA-N 273.735 2.387 10 20 CECD COc1ccc(CNC(=O)c2ccsc2)c(O)c1 794370582 QCXFXUREXQGNCV-UHFFFAOYSA-N 263.318 2.392 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H]3[C@H](C2)C3(F)F)c1O 715518050 ZISORVSGFCYDHZ-TXEJJXNPSA-N 285.265 2.431 10 20 CECD COc1ccccc1NC[C@H](O)COCC(C)C 37874542 BLPDEIGRKSNKLW-LBPRGKRZSA-N 253.342 2.141 10 20 CECD CCN(C)c1ccc(CN2CC[C@@](O)(C3CC3)C2)cc1 1324212542 DFTSBIVBJPDOFR-KRWDZBQOSA-N 274.408 2.490 10 20 CECD C[C@@H]1CCN(CCN[C@H](C)c2cc(C(=O)O)ccc2O)C1 1609859481 VGFFLBIVMPOURS-VXGBXAGGSA-N 292.379 2.083 10 20 CECD Cc1ccc(CN(C[C@H](C)C(=O)O)C2CC2)c(O)c1 1600410871 OPSOSTZAWFQXMJ-NSHDSACASA-N 263.337 2.386 10 20 CECD CN(C)c1ccc(CNc2ccc(C(=O)O)cn2)cc1 1598320862 XDCHXAWVAVEKBN-UHFFFAOYSA-N 271.320 2.458 10 20 CECD C[C@H](N[C@H]1CCC[C@H](N)C1)c1cc(C(=O)O)ccc1O 1593221822 BIQBLOZMSYQVKU-DLOVCJGASA-N 278.352 2.011 10 20 CECD C[C@@H](NCC(C)(C)OCCO)c1ccc(N(C)C)cc1 287402319 QZUPVYHSTRLKRX-CYBMUJFWSA-N 280.412 2.191 10 20 CECD CC(C)n1cc(CNCc2ccc(N(C)C)cc2)nn1 289800212 RFYFGXGHMCUGCK-UHFFFAOYSA-N 273.384 2.215 10 20 CECD CCCCN(CC(N)=O)Cc1cccc(CC)c1O 692083759 AFTXTMKXRXKIFW-UHFFFAOYSA-N 264.369 2.042 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@](C)(O)C(F)F)c1 698571508 UQCFHWCHGJOEHP-OQPBUACISA-N 275.295 2.068 10 20 CECD c1cc(N2CCCC2)ccc1CNCc1csnn1 398462745 JPNUZMXIZZPGKP-UHFFFAOYSA-N 274.393 2.428 10 20 CECD O=C(NCc1ccccc1O)c1cccnc1Cl 133935409 CIKBQVOBYPWSIJ-UHFFFAOYSA-N 262.696 2.371 10 20 CECD COc1ccc(O)c(CNc2c(C)c(C)nc3ncnn23)c1 301531518 KCOLMXBRIVIGLZ-UHFFFAOYSA-N 299.334 2.067 10 20 CECD CN(C)c1ccc(CNC(=O)c2cscn2)cc1 62663146 IXWZBWQEMMYBNN-UHFFFAOYSA-N 261.350 2.139 10 20 CECD CCC[C@](C)(O)C(=O)NCc1ccc(N(C)C)cc1C 126143385 NWXIBVBKCCGAFQ-INIZCTEOSA-N 278.396 2.228 10 20 CECD Cc1ccc([C@H](C)NCc2nnc3n2CCCC3)c(O)c1 183847789 ZDDSEGMPELQJAR-LBPRGKRZSA-N 286.379 2.479 10 20 CECD Cc1cc(C(=O)NCCCSc2nccs2)on1 78713511 HTBVCCOBFNAGTD-UHFFFAOYSA-N 283.378 2.352 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2C[C@H]3CC[C@@H]2O3)c1 185460093 INFJNBSMFJMEBR-XKFJNSEWSA-N 263.337 2.371 10 20 CECD CN1CCC[C@H]2CN(C(=O)Nc3ccc(N)cc3)CC[C@H]21 227341279 SHQWCRYRQKEMHE-SWLSCSKDSA-N 288.395 2.217 10 20 CECD CO[C@@H]1C[C@H](NCc2cc(F)ccc2O)C1(C)C 226613503 GFCYOCWAXQRSML-QWHCGFSZSA-N 253.317 2.434 10 20 CECD Cc1cc(C(=O)N2CCNCC2)c(C)n1-c1ccccc1 237698039 ATZIQUAZJUJRRY-UHFFFAOYSA-N 283.375 2.140 10 20 CECD Nc1ccc(CC(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)cc1 238073358 GDRXYUBRZQNEBV-RYQLBKOJSA-N 278.355 2.266 10 20 CECD CCn1ccnc(NCc2ccc(N3CC=CC3)cc2)c1=O 271412073 YUFZEMKXSYOURH-UHFFFAOYSA-N 296.374 2.252 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCC2(C)C)c1O 288139069 YDFMDMDINNPSFL-LBPRGKRZSA-N 278.352 2.389 10 20 CECD COc1cccc(CN2CC[C@@]3(CCCN(C)C3)C2)c1O 293755514 XFDQALNCKWZELT-QGZVFWFLSA-N 290.407 2.319 10 20 CECD COc1cccc(O)c1CN1C[C@@H](N2CCCC2)C[C@H]1C 809703903 RRYCHNBJOLYPPD-KGLIPLIRSA-N 290.407 2.459 10 20 CECD Cc1ccc(C(=O)NCC2CC(F)(F)C2)c(O)c1O 293659577 MMNFJBFXEXBKGY-UHFFFAOYSA-N 271.263 2.181 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]3CN(C)CC[C@@H]32)c1 290611145 WPKIGHQENSOUCS-BBRMVZONSA-N 290.407 2.317 10 20 CECD CCCOc1ccccc1NC[C@H](O)Cn1cccn1 819399807 YLWUFTQFEXVLOP-ZDUSSCGKSA-N 275.352 2.145 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@](C)(O)C1CCC1 813386330 MJTFHPPXOROQIL-KRWDZBQOSA-N 290.407 2.262 10 20 CECD Cc1cc(CN2CCN(C(C)C)C(=O)C2)ccc1N(C)C 815086321 HDOZVBGWPUXVHG-UHFFFAOYSA-N 289.423 2.114 10 20 CECD O=C(CCCC1CC1)NCCc1ccc(O)c(O)c1 812536123 RASDCMVWNMSYSH-UHFFFAOYSA-N 263.337 2.337 10 20 CECD C[C@@H]1C[C@H](N[C@H](CN)C2CC2)c2c(O)ccc(F)c21 817961315 XCSPGXHTZJNTHN-JFUSQASVSA-N 264.344 2.407 10 20 CECD Cc1c(Cl)c(C(=O)N(C)Cc2ccccc2O)nn1C 817547359 OBUVXLOWAAYVOY-UHFFFAOYSA-N 293.754 2.360 10 20 CECD CCOCCO[C@@H](C)C(=O)N[C@H](C)c1ccccc1O 827931076 XOAQVRBQLDZOFQ-NEPJUHHUSA-N 281.352 2.011 10 20 CECD Cc1cc(O)c(CN[C@H](CO)[C@H]2CCCOC2)cc1Cl 826120464 DPUJLHPNBJNLRD-SMDDNHRTSA-N 299.798 2.231 10 20 CECD COc1ccc(CN[C@H](CC(F)F)C(=O)O)cc1C 901810762 BTSKVEPTOUDFAS-SNVBAGLBSA-N 273.279 2.202 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H](C)C(C)(C)O 739019493 KOPJIJAWGCEQLB-LBPRGKRZSA-N 293.411 2.020 10 20 CECD CCOC[C@H](O)CN(C)Cc1ccc(N(CC)CC)cc1 733610310 IBERZUBZBBQYKO-QGZVFWFLSA-N 294.439 2.362 10 20 CECD CC(C)(C)c1nnc(COC(=O)c2cc(O)cs2)o1 732354689 QIAWVYBFNAHSOD-UHFFFAOYSA-N 282.321 2.491 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H](C)CC(=O)O 911410178 QFRKULZLKRVDAW-LLVKDONJSA-N 292.379 2.178 10 20 CECD COc1cccc(O)c1CNCCC[C@@H]1CCCN1 841071810 BWXYCQQSAUUWGZ-GFCCVEGCSA-N 264.369 2.023 10 20 CECD COc1cccc([C@H](C)N[C@H]2C[C@@H](O)C2(C)C)c1O 846165574 VVKAFHAGAADCTI-TVYUQYBPSA-N 265.353 2.211 10 20 CECD CC[C@@H](CO)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840554342 GGRMJLVLWDKRJG-KBPBESRZSA-N 292.423 2.127 10 20 CECD CCS(=O)(=O)CCN[C@H](C)c1ccc(Cl)cc1O 841748639 XWUJVBCKGYRMFQ-SECBINFHSA-N 291.800 2.131 10 20 CECD CCC[C@H](O)CN[C@H](C)c1cccc(OC)c1O 846142549 ARFPAZMPILBKDD-MNOVXSKESA-N 253.342 2.212 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)cc2C)[C@H]1C 840942212 VPAOFGRSNZJORA-BBRMVZONSA-N 290.407 2.444 10 20 CECD O=C(OCc1cc2n(n1)CCCC2)c1cc(O)cs1 845116166 YMTCXMLSCQARPY-UHFFFAOYSA-N 278.333 2.344 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CCN(CC(F)F)C1 841894546 QVNRTAKLZQQGPT-SECBINFHSA-N 290.741 2.475 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCC(=O)C1 843776941 WMWTZUWXEOARLZ-CQSZACIVSA-N 288.391 2.470 10 20 CECD C[C@H](N[C@H](CO)CCF)c1cc(Cl)ccc1O 846209847 VUJDFTVEQAMKDZ-WPRPVWTQSA-N 261.724 2.417 10 20 CECD COCC1CCC(NCc2cc3c(cc2O)OCO3)CC1 840963780 VGKIJXFIFWYHAJ-UHFFFAOYSA-N 293.363 2.416 10 20 CECD C[C@@H]1CC[C@@H](C)N1C(=O)NCCc1ccc(N)cc1 841956441 BATWROOAFOBQSE-VXGBXAGGSA-N 261.369 2.394 10 20 CECD COc1ccc(N(C)C[C@@H]2CCNC(=O)CC2)cc1 844354652 FNVXKGCXNUQDAA-LBPRGKRZSA-N 262.353 2.048 10 20 CECD C[C@@H]1CCN2[C@H](C1)C(=O)N[C@H]2c1cc(Cl)c(F)cc1O 840820226 QVWHIRDCUAEXPM-TWPQKTAQSA-N 298.745 2.414 10 20 CECD C[C@H](NC[C@](C)(O)C1CC1)c1cc([N+](=O)[O-])ccc1O 756570721 XKIRWBPGQXDQLO-XPTSAGLGSA-N 280.324 2.112 10 20 CECD CC[C@@H]1COC[C@@H]1NCc1ccc(N(C)C)c(F)c1 850383132 LFFJKAIVWFQKNN-OCCSQVGLSA-N 266.360 2.406 10 20 CECD CCc1nncn1CCN[C@@H](C)c1cc(F)cc(F)c1O 756618443 BPPVSSRPRSKZBG-VIFPVBQESA-N 296.321 2.175 10 20 CECD O=C(N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1cc(O)cs1 754498873 OULAHLHDFFVGAP-MVWJERBFSA-N 279.361 2.141 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cncs1 935946082 WXRJWLRSOHNERM-UHFFFAOYSA-N 283.349 2.264 10 20 CECD COC[C@H](C)CC(=O)NCCCSc1nccs1 755368738 GSIAKAJEGVSBFT-SNVBAGLBSA-N 288.438 2.414 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CCC[C@@H]2O)cc1F 865734735 MNDXYLUZMYPPNO-JSGCOSHPSA-N 270.323 2.034 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C3CC3)no2)c1 862756226 UFQWMDHGRRIVCH-UHFFFAOYSA-N 272.304 2.496 10 20 CECD O=C(CCC1(O)CCC1)NCc1cc(Cl)ccc1O 869145811 AEPWRACIPBDZIN-UHFFFAOYSA-N 283.755 2.357 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cn(C(C)C)cn2)c1 862755886 MIEAZZWOSRWTJI-UHFFFAOYSA-N 273.336 2.408 10 20 CECD CN(C)c1cc(F)c(CN2CCO[C@H](CF)C2)cc1F 862391442 CISHBZDZDMWRFE-LLVKDONJSA-N 288.313 2.201 10 20 CECD COC/C=C/C(=O)N[C@H](C)c1ccc(N(C)C)cc1 867504720 ZDGJJQPQAXOEGR-BTDICHCPSA-N 262.353 2.132 10 20 CECD CO[C@H]1CCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 776237749 IGZUYHIWWQTCHX-WFASDCNBSA-N 291.395 2.244 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCC[C@@H]2OC)c1 776256926 SVRJSFMMSRENEG-ABAIWWIYSA-N 265.353 2.306 10 20 CECD CCN(C)c1ccc(CN2CCC[C@H]2C(=O)OC)cc1 773747236 DLVLRJVBWDRCFH-HNNXBMFYSA-N 276.380 2.280 10 20 CECD COC[C@@H](NCc1cc(Cl)ccc1O)[C@H]1CCCO1 788535249 LDYMXEWHRVILTE-TZMCWYRMSA-N 285.771 2.329 10 20 CECD CN(Cc1ncc[nH]1)Cc1cc(Cl)ccc1O 894583482 BHPYUKLHKJIAEB-UHFFFAOYSA-N 251.717 2.401 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]([C@@H](C)O)C2)cc1OC 780891856 AOAOKUABIYAURT-VXGBXAGGSA-N 295.379 2.002 10 20 CECD CCN(CCc1ccccn1)C(=O)c1cccc(O)c1O 790772972 NPAJQFIUCQDMMK-UHFFFAOYSA-N 286.331 2.198 10 20 CECD Oc1ccc(Br)cc1CNCCOCCF 702626596 JJVLPIVCPQEXTE-UHFFFAOYSA-N 292.148 2.230 10 20 CECD CCOCCN(CC)Cc1c(O)cccc1OC 769138906 CMVZEKQDZVFSSI-UHFFFAOYSA-N 253.342 2.259 10 20 CECD COC[C@H]1CN(Cc2ccc(N3CCCC3)cc2)CCO1 1319707195 KYVDSBWZTNJCMS-QGZVFWFLSA-N 290.407 2.134 10 20 CECD CCOc1ccc(N2CCN(C(=O)c3cc[nH]c3)CC2)cc1 1319870926 QZEYUFMNGJWSHB-UHFFFAOYSA-N 299.374 2.376 10 20 CECD COC(=O)CN(Cc1c(O)cccc1OC)CC(C)C 1320506891 KIYIOGXMUXXDDC-UHFFFAOYSA-N 281.352 2.032 10 20 CECD C[C@H](NCCc1ccn(C)n1)c1ccc(N(C)C)cc1 230898446 FHSRXIRGMOEOEO-ZDUSSCGKSA-N 272.396 2.379 10 20 CECD C[C@H](N[C@H](C)C[S@@](C)=O)c1ccc(N(C)C)cc1 168515951 IRNMNHHTHYJJGL-SOZUMNATSA-N 268.426 2.170 10 20 CECD CCNC(=O)CN1CCCc2cc(OC(F)F)ccc21 157838684 OKFOSACOJXEUNN-UHFFFAOYSA-N 284.306 2.177 10 20 CECD CCN(Cc1cc(OC)c(OC)cc1O)C[C@H]1CCCO1 159923757 VHVPLBLZZPLSFC-CYBMUJFWSA-N 295.379 2.410 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccccc1 6864001 XRZQOGYTMIVASG-UHFFFAOYSA-N 257.289 2.070 10 20 CECD Cc1cccc(CN2CCN(CC(C)C)CC2)c1O 124515745 LAWVSGKDSDQWJC-UHFFFAOYSA-N 262.397 2.474 10 20 CECD C[C@@H](CCCC(=O)O)NCc1ccc2c(c1)CCO2 1255786502 LGPAXKYXUULOFZ-NSHDSACASA-N 263.337 2.355 10 20 CECD COc1cccc(O)c1CN1CC[C@H]2OCCC[C@@H]2C1 1116444086 QDYJVIYBEUIIAG-IUODEOHRSA-N 277.364 2.402 10 20 CECD COc1cccc(CNCC[C@H]2C[C@H]3CC[C@H]2O3)c1O 839163741 KQZCDRQOARVCMA-IACUBPJLSA-N 277.364 2.448 10 20 CECD COc1ccc(N(C)CCOC[C@H]2CCCO2)cc1 844353652 UBXMNSYEZNRQGS-OAHLLOKOSA-N 265.353 2.327 10 20 CECD CCCNC(=O)CNCc1ccc(N(CC)CC)cc1 35134110 CNWPVEWKPJTMDA-UHFFFAOYSA-N 277.412 2.149 10 20 CECD COc1cccc(CNC[C@H]2CCCCN(C)C2)c1O 700819770 TXGKXKKPEVKBNO-CYBMUJFWSA-N 278.396 2.222 10 20 CECD COc1cncc(CNCc2ccc(N(C)C)cc2)c1 704216539 FIUSHFVLZFNTDL-UHFFFAOYSA-N 271.364 2.446 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)[C@@H](C)CO1 708423567 STFRECNRUKHWBE-IUCAKERBSA-N 257.280 2.280 10 20 CECD CCOC(=O)CC[C@@H](O)CNc1ccccc1OCC 385406809 FLQZDGHDIFQYNS-GFCCVEGCSA-N 281.352 2.201 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CC[C@H](C)O2)c1 398118634 ADXOPCLWVNDLCV-GWCFXTLKSA-N 251.326 2.058 10 20 CECD Nc1ccc(Cc2nc([C@H]3CN4CCC3CC4)no2)cc1 1345958378 WYOJSJBCNKDYPE-AWEZNQCLSA-N 284.363 2.052 10 20 CECD CN1C(=O)c2ccccc2N[C@@H]1c1cc([N+](=O)[O-])ccc1O 61742779 UKCNODYQYNHGMN-AWEZNQCLSA-N 299.286 2.497 10 20 CECD COCC1=CCN(Cc2cccc(OC)c2O)CC1 187620210 VYDFXUODPYEQKW-UHFFFAOYSA-N 263.337 2.179 10 20 CECD Cc1cccc(CN2CCN(Cc3cccnc3)CC2)c1O 182054364 KFRYWYNTJQSDIK-UHFFFAOYSA-N 297.402 2.413 10 20 CECD COCCCCC(=O)NCc1ccc(N(C)C)cc1 120828140 QYSSQZWJRGDISW-UHFFFAOYSA-N 264.369 2.186 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CCCOCC1 181770574 IRNJLPNYUUHJFX-ZDUSSCGKSA-N 278.352 2.103 10 20 CECD CCCCCOCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186395170 NGHLRIWTDMGWPO-GFCCVEGCSA-N 295.379 2.352 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCO[C@@H]2C)c1 134244047 BPCQPYGYXPKMLB-CWSCBRNRSA-N 251.326 2.229 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NCCN)c2C)c1 237730608 BECXMORZOQCJPH-UHFFFAOYSA-N 271.364 2.091 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H](O)COC(C)C 266594508 VHPKNWOBXRIPDL-OAHLLOKOSA-N 281.396 2.390 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H](N)c2ccccc2)cc1 237082751 MLVBSJCFGWPAEK-QGZVFWFLSA-N 297.402 2.459 10 20 CECD CC(C)(C)c1cnc(SCc2nnn[nH]2)s1 268279996 ATYCYNAGKXPQFS-UHFFFAOYSA-N 255.372 2.246 10 20 CECD CC(C)(C)[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCO1 279792013 OKDWTLREMRQNHL-OAHLLOKOSA-N 293.363 2.368 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCCOCC2)c1 273519299 TYYSIDLWWUFKIZ-AAEUAGOBSA-N 293.363 2.399 10 20 CECD CCOc1nnc(CN(C)c2ccc3c(c2)OCO3)s1 270325410 KXNGOVYDCLOFCQ-UHFFFAOYSA-N 293.348 2.302 10 20 CECD COC(=O)[C@H]1CCCCCN1Cc1cccc(OC)c1O 360021464 WDYJCINZOBKMJU-CYBMUJFWSA-N 293.363 2.318 10 20 CECD CC[C@H](NC[C@@H](O)c1cnn(C)c1)c1ccc(C)cc1O 280239239 VWYHDBWPDXSFIW-GOEBONIOSA-N 289.379 2.208 10 20 CECD CCN(C)c1ccc(CN[C@H]2CCC[C@H]2C(=O)NC)cc1 815102545 PZXBHWNTMFICAQ-CVEARBPZSA-N 289.423 2.147 10 20 CECD CCOc1ccc(CN[C@H](C)[C@@H](C)OC)c(O)c1 810174261 QTNDJKHPNOCGJQ-GHMZBOCLSA-N 253.342 2.304 10 20 CECD CN(C)c1ccc(/C=C2/SC(=S)NC2=O)cc1F 727653625 SYEOYDQPLZMJRO-UXBLZVDNSA-N 282.365 2.381 10 20 CECD CO[C@@H]1CCC[C@@H]([C@H](NCc2ccccc2O)C(=O)O)C1 901762759 QKENKDVIPPODKQ-KYOSRNDESA-N 293.363 2.140 10 20 CECD CCc1nnc([C@@H](C)OC(=O)c2ccc(C)c(O)c2O)o1 732334613 AUGWLHIBXIITMH-MRVPVSSYSA-N 292.291 2.270 10 20 CECD CN(CCCCNC(=O)c1cc(O)cs1)C1CC1 839790877 GLNBBMWAVWZTHV-UHFFFAOYSA-N 268.382 2.058 10 20 CECD O=C(NCCN1Cc2ccccc2C1)c1cc(O)cs1 732278306 HKVKJTBQNAOYME-UHFFFAOYSA-N 288.372 2.199 10 20 CECD CNCC1CCN(Cc2ccc(N(C)C)cc2C)CC1 843049222 HRDDNDNZCDGIOC-UHFFFAOYSA-N 275.440 2.492 10 20 CECD N[C@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 843043762 GMGQSYPBVNIPCX-JTQLQIEISA-N 258.724 2.108 10 20 CECD NC1(CNCc2cc(F)ccc2O)CCCCC1 841039547 TWLHVYYGULROLC-UHFFFAOYSA-N 252.333 2.283 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)CCN1 841061416 IRQSLNRGSIBEKO-AAEUAGOBSA-N 265.376 2.122 10 20 CECD C[C@H](C(=O)NCc1ccc(O)cc1O)C(C)(C)C 910951045 OECFUQBMDMALJA-SECBINFHSA-N 251.326 2.396 10 20 CECD CCCS(=O)(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 919928176 UZLUFLOBTYTNGR-UHFFFAOYSA-N 296.436 2.457 10 20 CECD CCc1cccc(CNCCCc2nc(C)no2)c1O 848896161 UCPYEUSZLUZXKF-UHFFFAOYSA-N 275.352 2.368 10 20 CECD COc1cccc([C@H](C)NC[C@](C)(O)C2CC2)c1O 846148260 YUUDXNJBGPZWAO-BONVTDFDSA-N 265.353 2.212 10 20 CECD Cc1ccc(C(N)=O)cc1NC(=O)NCc1ccccc1O 748445240 WHIFXBAFWJKWPP-UHFFFAOYSA-N 299.330 2.121 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCN[C@@H](C)C1 841062515 MQVXTKATEMGYLI-DZGCQCFKSA-N 261.413 2.291 10 20 CECD C[C@@H](NCC(C)(C)CO)c1cc(F)cc(F)c1O 756762403 ZMYIJZGFVORLBC-MRVPVSSYSA-N 259.296 2.340 10 20 CECD Cc1cc(C(=O)NCc2ccc(N3CCCC3)cc2)ncn1 758406768 AQJMOCAREFDQLG-UHFFFAOYSA-N 296.374 2.315 10 20 CECD C[C@@H](NCCN1CCC[C@H]1C)c1cc([N+](=O)[O-])ccc1O 756617711 PGLLOPUEWBEIDH-VXGBXAGGSA-N 293.367 2.435 10 20 CECD CO[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)C1(C)C 753375014 XQGBJGOTKXLTRZ-QWHCGFSZSA-N 280.324 2.204 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(C(=O)C3CC3)CC2)c1 862755508 UQRIFZSQFCEMKE-UHFFFAOYSA-N 273.332 2.076 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1C[C@H]1c1ccco1 863863644 ZIFISBYFCDKZIL-VXGBXAGGSA-N 257.289 2.405 10 20 CECD CCN[C@H](C)C(=O)NCc1ccc(N(CC)CC)cc1 876728456 MJUXOPQEIVMTON-CYBMUJFWSA-N 277.412 2.147 10 20 CECD C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@@H]2c1ccc(N(C)C)c(F)c1 777899836 OXEQVLRKIFXTEN-ONERCXAPSA-N 291.370 2.121 10 20 CECD C[C@@H](CC(=O)O)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 872859760 SCBBPUVYCZAPOK-VXGBXAGGSA-N 292.379 2.431 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@H](C)c1c(O)cccc1F 886598577 FMJCOEZPEQBLEX-ZJUUUORDSA-N 268.332 2.049 10 20 CECD CO[C@H]1CCC[C@H]1CNCc1cc(F)ccc1O 779106252 BACBXJKHLVUVNG-HZMBPMFUSA-N 253.317 2.436 10 20 CECD Cc1ccn(-c2ccc(NCc3ccccc3O)nn2)n1 774523208 HUMWNKQIVXUQEA-UHFFFAOYSA-N 281.319 2.288 10 20 CECD Cc1ccc(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)o1 773762790 KGFVOXKEYRYRFH-JTQLQIEISA-N 289.331 2.289 10 20 CECD C[C@@H](NCc1ccnc(N(C)C)n1)c1c(O)cccc1F 886561664 FRZJJOOVPDYGPB-SNVBAGLBSA-N 290.342 2.238 10 20 CECD C[C@H](O)[C@H]1C[C@H](C)CCN1Cc1cc2c(cc1O)OCO2 785987790 IMVHDZDISARFTL-NTZNESFSSA-N 293.363 2.102 10 20 CECD COc1cc(C)cc(CNCCOc2cccnc2)c1O 894259876 HHWFDXDAEQIXJM-UHFFFAOYSA-N 288.347 2.273 10 20 CECD COc1ccc(CNCc2cccnc2)c(O)c1OC 1333699038 YCYPFJAESZANPF-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CS[C@@H]1CC[C@H](NC(=O)NCc2ccc(N)cc2)C1 1336841918 ZDYRQXDVOSWCOD-QWHCGFSZSA-N 279.409 2.352 10 20 CECD Nc1ccc(CN(CCCO)CC(F)(F)F)cc1 1334753597 HGKQLXPAXMKSJP-UHFFFAOYSA-N 262.275 2.016 10 20 CECD C[C@H]1CCN(C(=O)NCc2ccc(N)cc2)CCS1 1338793677 RLLLFGALAUPQEQ-NSHDSACASA-N 279.409 2.306 10 20 CECD O=C([C@@H]1C[C@H]1F)N(Cc1ccccc1O)C[C@H]1CCCO1 1349356116 SONZDSBBLQQPGL-MGPQQGTHSA-N 293.338 2.258 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](C(=O)O)C(C)C)c1 1604821254 USLAUGOMPSACDE-MFKMUULPSA-N 281.352 2.408 10 20 CECD CCOc1ccc(N2CCN([C@H](CC)C(=O)O)CC2)cc1 1605691246 VABLMQBSQJHCPM-OAHLLOKOSA-N 292.379 2.071 10 20 CECD Cc1ccc(O)c(CNc2ccc(C(=O)O)nc2)c1 1600467320 QPOIHWWJOUMDOU-UHFFFAOYSA-N 258.277 2.406 10 20 CECD COc1ccc(O)c([C@H](C)NCCN2CCSCC2)c1 223740358 WGSCDTLVVLWRDX-LBPRGKRZSA-N 296.436 2.100 10 20 CECD N[C@H]1C[C@H]1C1CCN(Cc2cc(F)c(F)cc2O)CC1 1574268870 JKQWRYDZTMANOH-FZMZJTMJSA-N 282.334 2.230 10 20 CECD C[C@H](C(=O)O)N(C)Cc1ccc2ccccc2c1O 1599886779 HGEKTOFZKGBFQI-SNVBAGLBSA-N 259.305 2.450 10 20 CECD C[C@H](Nc1cccc(-c2nn[nH]n2)n1)c1ccccc1O 1591770621 AQIGALQHDQDQKO-VIFPVBQESA-N 282.307 2.140 10 20 CECD CC[C@H](C(=O)O)N1CCCc2ccc(N(C)C)cc2C1 1776682276 ASBKUTZFYLRCAK-OAHLLOKOSA-N 276.380 2.364 10 20 CECD C[C@@H]1OCCN(C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 151473186 JPWYTCOIHZXEFA-OLZOCXBDSA-N 291.395 2.071 10 20 CECD COc1ccc(O)c(CNCc2c(Cl)c(C)nn2C)c1 921741763 ZZSHQADMMHDDHE-UHFFFAOYSA-N 295.770 2.386 10 20 CECD C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)c1nncn1C 37293641 KVZYSNHQQIYQLY-NEPJUHHUSA-N 273.384 2.293 10 20 CECD COc1ccc(O)c(CN(C)[C@@H]2CCCOC2)c1 401586842 TYUWIXSMTOQBDP-GFCCVEGCSA-N 251.326 2.012 10 20 CECD CCOc1cccc(CN2CC[C@](C)(C(=O)O)C2)c1O 86780045 LEMBUVXKFDCMCG-HNNXBMFYSA-N 279.336 2.088 10 20 CECD Cc1ccc(O)c([C@H](C)NCCCCS(C)(=O)=O)c1 710303226 OQPODIPXYKWZGW-LBPRGKRZSA-N 285.409 2.176 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@H](N)C2)c1O 50149790 UJQQHOBUXXAGQK-LBPRGKRZSA-N 282.771 2.171 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2[C@H]3CCCO[C@H]32)c1 1346920785 LPTCOONGEPXGBX-NZQZLILVSA-N 291.347 2.003 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1CCCOC1 114375517 IZCLFTVUGYQISG-JTQLQIEISA-N 286.422 2.168 10 20 CECD CCc1ccnc(C(=O)NCc2cc(OC)ccc2O)c1 181669981 MGVBRWRNULNATO-UHFFFAOYSA-N 286.331 2.288 10 20 CECD CCCN(CCC(=O)N(C)CC)Cc1ccccc1O 130567258 ACXPYYXRBGUYFR-UHFFFAOYSA-N 278.396 2.473 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc[nH]c(=O)c1 136243202 VQNOBHYWJNEALA-UHFFFAOYSA-N 286.331 2.133 10 20 CECD CCOc1cccc(CN2CC[C@@H](N3CCCC3)C2)c1O 133956749 BPSSFEKBABGTRP-OAHLLOKOSA-N 290.407 2.461 10 20 CECD COc1ccc2c(c1)CCCCN2CC(OC)OC 275446251 KKCYRHYMQWNTHR-UHFFFAOYSA-N 265.353 2.457 10 20 CECD OCCN(Cc1cccc(Cl)c1O)C1CCC1 276025334 PPBJTNXQNCRNCM-UHFFFAOYSA-N 255.745 2.392 10 20 CECD CC[C@H](NC[C@]1(O)CCO[C@@H]1C)c1ccc(F)cc1O 287713650 XTSRNIGMXUCITI-RIEGTJTDSA-N 283.343 2.112 10 20 CECD COCC1(CCNC(=O)c2c(F)ccc(O)c2O)CCC1 295536569 HNZGLBBSQAECRH-UHFFFAOYSA-N 297.326 2.174 10 20 CECD NC(=O)[C@H]1CC[C@H](CNCc2cccc(Cl)c2O)CC1 817411570 UZBCJLMBHCTPBD-XYPYZODXSA-N 296.798 2.427 10 20 CECD CN(C)c1ccc(OCc2nnnn2-c2ccccc2)cc1 810002460 XWWAEHIFASVRII-UHFFFAOYSA-N 295.346 2.307 10 20 CECD CCN(CC)CCCCNC(=O)c1cc(O)cs1 827515378 DGDKIWZCOSQFDL-UHFFFAOYSA-N 270.398 2.306 10 20 CECD CCO[C@H](C(=O)N[C@H](C)c1ccccc1O)C1CC1 827957294 SMJDIBJMEPTRJW-YGRLFVJLSA-N 263.337 2.385 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](C3OCCO3)C2)c1 905694828 JINHKXWOROHPNC-CYBMUJFWSA-N 277.364 2.204 10 20 CECD Cc1nc(CCNC(=O)c2cc(O)cs2)cs1 732266324 XTLRZEZNEPPGDQ-UHFFFAOYSA-N 268.363 2.191 10 20 CECD CCN1C[C@@H](N[C@@H](C)c2ccc(N(C)CC)cc2)CC1=O 834892469 VLDAIOJPGWQWFU-ZFWWWQNUSA-N 289.423 2.414 10 20 CECD COc1ccc(N(CC(=O)N(C)C)CC(C)C)cc1 746171142 QRCYWRGOQPOGSX-UHFFFAOYSA-N 264.369 2.246 10 20 CECD CCN(CC)C(=O)CN(C)Cc1ccc(N(C)CC)cc1 741753168 QNSLYVGSMNGHAO-UHFFFAOYSA-N 291.439 2.443 10 20 CECD CCOc1ccc(CN2CCC[C@@H]([C@H](C)N)C2)c(O)c1 843051493 JKEOGGIBAKQEGZ-QWHCGFSZSA-N 278.396 2.350 10 20 CECD CCCNC(=N)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 849043410 BZKZEIIJUKZOJY-ZDUSSCGKSA-N 290.411 2.045 10 20 CECD CCOc1cccc(CN[C@H](CC2CC2)C(=O)OC)c1O 840959167 VKMHYTXNANFBMG-CYBMUJFWSA-N 293.363 2.222 10 20 CECD OC[C@H]1C=C[C@@H](NCc2ccc3c(c2)CCCO3)C1 921856332 XDYFDKFCNGOVGQ-DZGCQCFKSA-N 259.349 2.038 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@H](O)COCC2CC2)c1 756511937 SLIALROZVLCBKW-OCCSQVGLSA-N 279.380 2.139 10 20 CECD CCCN1CCN(Cc2cccc(OCC)c2O)CC1 131697829 ZXEJWJRZCCIGBU-UHFFFAOYSA-N 278.396 2.319 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cn(C)nc2C(C)C)c1 862759229 YRCCZCNLZSCENJ-UHFFFAOYSA-N 287.363 2.488 10 20 CECD COc1ccc(N(C)CCN(C)CCOC2CC2)cc1 930851805 AKPWDSLYVNWSMB-UHFFFAOYSA-N 278.396 2.242 10 20 CECD CN(C)c1cc(F)c(CN2CCC(CO)CC2)cc1F 862216918 SZEKBWRTWRDBFN-UHFFFAOYSA-N 284.350 2.235 10 20 CECD COC(=O)c1ccc(CNCc2cc(C)ccc2O)n1C 873141631 HYXYIGJAUXTYNS-UHFFFAOYSA-N 288.347 2.116 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC(C)(C)CCCO 772626968 FRNGQVOMMZUIFV-UHFFFAOYSA-N 294.395 2.332 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCN(c2ccccn2)C1 877120802 IVDNZIATCANTMX-CQSZACIVSA-N 283.375 2.464 10 20 CECD CC[C@H](NC[C@]1(O)CCOC1)c1cc(Cl)ccc1O 775522913 BQDGEZGNEGPESF-GXTWGEPZSA-N 285.771 2.238 10 20 CECD CCOCCN(C)Cc1ccc(OCC)cc1O 779597693 DKYKLRNAXWFRJU-UHFFFAOYSA-N 253.342 2.259 10 20 CECD COc1ccc(N(C)CCN(C)c2ncncc2C)cc1 882526546 MJKOJCXJSJCSIO-UHFFFAOYSA-N 286.379 2.366 10 20 CECD O=C(C=C1CCSCC1)NCc1cccc(O)c1O 1123889981 SRFBRGDQDDPWGO-UHFFFAOYSA-N 279.361 2.167 10 20 CECD COc1ccc(CNc2cc(C)nc3nc(C)nn23)c(O)c1 882290778 BMSLIWDWRAZGQP-UHFFFAOYSA-N 299.334 2.067 10 20 CECD COCC[C@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898449383 DDDNPSSWSDFRHW-WMLDXEAASA-N 293.455 2.370 10 20 CECD COc1ccc(CNCC2CCC2)c(O)c1OC 892714333 NLXLFPGHLJXBAF-UHFFFAOYSA-N 251.326 2.299 10 20 CECD C[C@@H](NCc1cc(Cl)cc(F)c1O)c1ncnn1C 789595387 UFAVXNHBKXNFMD-SSDOTTSWSA-N 284.722 2.164 10 20 CECD OCC[C@@H]1CCCN1Cc1cc(F)cc(F)c1O 894501340 WYYYJGDJLBTDFO-NSHDSACASA-N 257.280 2.017 10 20 CECD COc1cc(C)cc(CN2CC[C@H](C)[S@@](=O)CC2)c1O 894568013 VAIBMKFWDAWDQT-YUNKPMOVSA-N 297.420 2.052 10 20 CECD COc1ccc(N(C)CCC2OCCCO2)cc1 91465681 NPNPECRFEBYWJG-UHFFFAOYSA-N 251.326 2.285 10 20 CECD CCn1cc(/C=C2\C(=O)N(C)c3ccc(C)cc32)nn1 899377578 AZDJMCZMCRHPLD-JYRVWZFOSA-N 268.320 2.123 10 20 CECD CCN1CC[C@H](CNCc2cc(F)cc(F)c2O)C1 708504558 RXVJPUBEMOCDFU-SNVBAGLBSA-N 270.323 2.102 10 20 CECD O=C(NCc1ccsc1)c1c(F)ccc(O)c1O 790069151 LYXMXEMORLHLHR-UHFFFAOYSA-N 267.281 2.228 10 20 CECD COc1ccc(N(CCC(C)C)Cc2nnn(C)n2)cc1 799324371 QIMQPSOKQDOOPV-UHFFFAOYSA-N 289.383 2.271 10 20 CECD CC[C@@H](C(=O)O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1594749989 YSTSGFGQZWGXLF-ZWNOBZJWSA-N 278.352 2.041 10 20 CECD C[C@H]1OCC[C@H]1COc1ccc(N(C)C)c(C(=O)O)c1 1594646478 XYLPIYAHFDHTEK-MNOVXSKESA-N 279.336 2.255 10 20 CECD C[C@H](Cn1cccn1)NCc1ccc(N(C)C)cc1 35259086 KKVRTXUUDVVEJH-CYBMUJFWSA-N 258.369 2.127 10 20 CECD CCn1cc(CN[C@H](C)c2cc(OC)ccc2O)cn1 273450645 FWQHPDXGPXFYMO-LLVKDONJSA-N 275.352 2.468 10 20 CECD COc1ccc(CNC2CCC(OC)CC2)c(O)c1 703831152 CLDIAOYVTGCXQS-UHFFFAOYSA-N 265.353 2.448 10 20 CECD C[C@H](NCCc1cnccn1)c1ccc(F)cc1O 390036207 IDHUMSGTKGKWIG-JTQLQIEISA-N 261.300 2.215 10 20 CECD COc1ccc(O)c(CN[C@@H]2COC(C)(C)C2)c1 396517090 DZUHQSALCCDNMM-NSHDSACASA-N 251.326 2.058 10 20 CECD COc1ccc(O)c(CNC(=O)NC(C2CC2)C2CC2)c1 114585365 LZPSPLHVPIPVID-UHFFFAOYSA-N 290.363 2.389 10 20 CECD C[C@H](CO)N[C@H](C)c1ccc(Br)cc1O 134913978 RTNXFNJTAWYOGD-HTQZYQBOSA-N 274.158 2.186 10 20 CECD CC1(C)[C@@H](O)C[C@@H]1NCc1cccc(Cl)c1O 128179393 LAPNKKFRBOQTLP-QWRGUYRKSA-N 255.745 2.295 10 20 CECD CCC[C@@]1(C)C(=O)NCCN1Cc1cc(F)ccc1O 189038208 AYEZAVFSGNKBKM-HNNXBMFYSA-N 280.343 2.022 10 20 CECD COC[C@H]1CN(Cc2cccc(Cl)c2O)C[C@H](C)O1 188360555 OMNPVGSSDCLINV-CMPLNLGQSA-N 285.771 2.281 10 20 CECD COc1ccc(O)c([C@H](C)NCCCc2cnn(C)c2)c1 182372210 NZVMPQUDMHMMTC-LBPRGKRZSA-N 289.379 2.418 10 20 CECD Cc1nn(C)c(NCc2ccc(N(C)C)cc2)c1[N+](=O)[O-] 47331102 IEJBIYDDOZQLLF-UHFFFAOYSA-N 289.339 2.315 10 20 CECD CCOC(=O)[C@@H](C)N(Cc1cc(F)ccc1O)C1CC1 191711435 PXSKIMXEGDRYFE-SNVBAGLBSA-N 281.327 2.447 10 20 CECD C[C@@H](NCCS(=O)(=O)C(C)(C)C)c1ccccc1O 183602778 FBXJBYUWLHHKHH-LLVKDONJSA-N 285.409 2.256 10 20 CECD CN(C(=O)/C=C\c1cccnc1)c1ncccc1F 255628700 CFAJDRAPICLPPT-SREVYHEPSA-N 257.268 2.292 10 20 CECD Cc1cc(NS(=O)(=O)C[C@@H]2CCCCO2)ccc1O 182475350 PKHDCGBYWIJGTI-LBPRGKRZSA-N 285.365 2.011 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)C2CC2)c1O 278889888 PMNIHWJLLGPUSS-QMMMGPOBSA-N 266.297 2.197 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC=C(F)C2)c1O 278540981 XFSDUJBIHIRSIH-UHFFFAOYSA-N 282.271 2.368 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](O)c2cnn(C)c2)c(O)c1C 273555401 GUCYPLAFKLUZET-IUODEOHRSA-N 289.379 2.127 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(N)n1 379011380 MPWKGIYJLFPCIS-UHFFFAOYSA-N 298.390 2.392 10 20 CECD O=C(NCCC[C@@H]1CCCCO1)c1c(F)ccc(O)c1O 295060566 YRFUJNBVWRLEDI-JTQLQIEISA-N 297.326 2.316 10 20 CECD O=C(OCCCN1CCCCC1)c1cc(O)cs1 800164716 DNFCOCLKKXESAN-UHFFFAOYSA-N 269.366 2.487 10 20 CECD Cc1ccc(C(=O)N2C[C@@H](CO)c3ccccc32)c(O)c1O 817796481 MVCNPJVNKFNINQ-NSHDSACASA-N 299.326 2.143 10 20 CECD COCC[C@](C)(O)CNCc1ccc2ccccc2c1O 816549859 ALIFXXCIGVTCPX-KRWDZBQOSA-N 289.375 2.423 10 20 CECD Cc1cccc(CNCc2ccc(-c3nn[nH]n3)cc2)c1O 826298349 OWVBGZZOHJHWTA-UHFFFAOYSA-N 295.346 2.171 10 20 CECD Cc1ccncc1/C=C\C(=O)N1CCN(C)c2ncccc21 492498949 HZPIYCOROJFPLH-WAYWQWQTSA-N 294.358 2.281 10 20 CECD O=C(Nc1ccc(-n2ccnc2)nc1)c1cc(O)cs1 732267218 DBQOTSABPOALGA-UHFFFAOYSA-N 286.316 2.287 10 20 CECD NC1(CNCc2ccc(N3CCCCC3)cc2)CC1 904450280 QPURGCITQUAYHA-UHFFFAOYSA-N 259.397 2.258 10 20 CECD COc1ccc(O)c(CNC(=O)COCC2CCCC2)c1 836777245 HYVIFVLATJHIFW-UHFFFAOYSA-N 293.363 2.224 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCN2C)cc1 748561574 DSLGPIGYFNWGDQ-INIZCTEOSA-N 289.423 2.243 10 20 CECD O=C(NCc1cc(Cl)ccc1O)OC[C@H]1CCCO1 845996461 PUGGQEHESLOGGO-LLVKDONJSA-N 285.727 2.451 10 20 CECD COCCOC[C@H](C)NCc1cc(Cl)ccc1O 742376677 BPKWMARREZHHRA-JTQLQIEISA-N 273.760 2.187 10 20 CECD O=C(c1cc(O)cs1)N1CCC2(CCOCC2)C1 743817574 ZZCLHFJWCXRMGQ-UHFFFAOYSA-N 267.350 2.096 10 20 CECD Oc1ccc(F)cc1CN1CCNC[C@H]1c1ccncc1 843120560 PPKTVMIJWXDXQX-HNNXBMFYSA-N 287.338 2.073 10 20 CECD CCC(=O)N1CC[C@@H](NCc2cccc(CC)c2O)C1 848899294 MSDAIBSNGSPKHB-CQSZACIVSA-N 276.380 2.055 10 20 CECD CCc1cccc(CN[C@H](COC)[C@@H]2CCCO2)c1O 848907167 JTHKVJTYKUOKLX-CABCVRRESA-N 279.380 2.238 10 20 CECD C[C@@H](NC[C@@]1(O)CCSC1)c1cc(F)cc(F)c1O 756639198 YUJFATKZMUCNSH-OQPBUACISA-N 289.347 2.189 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCN2C)c1cnnn1C 924871471 NKAKHWUWPQPZCJ-GFCCVEGCSA-N 285.395 2.048 10 20 CECD C[C@H](NCc1ccc(N2CCCC2)cc1)c1cnn(C)n1 924647404 GEDITOGJIJNJMY-ZDUSSCGKSA-N 285.395 2.266 10 20 CECD C[C@@]1(C(=O)O)CCC[C@@H]1NCc1ccc2c(c1)CCO2 756388558 PHTGUDLROVSNNV-GOEBONIOSA-N 275.348 2.355 10 20 CECD CS/C=C/C(=O)NCc1ccc(N2CCOCC2)cc1 751459870 BFZGCNNLAQBNCN-IZZDOVSWSA-N 292.404 2.016 10 20 CECD CCOc1ccc(CN2CCC3(CC2)OCCO3)c(O)c1 768239170 HNGQDCQRGGRIHR-UHFFFAOYSA-N 293.363 2.130 10 20 CECD O=C(NC1Cc2ccccc2C1)c1cc(O)cs1 762816047 XRAHXSXJNQAVHW-UHFFFAOYSA-N 259.330 2.351 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)C1CSC1 864863696 WJWWZCRGAHFIGD-UHFFFAOYSA-N 276.405 2.266 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H](C)CC(N)=O)cc1 763399509 WZJPSMYGUYLZDE-VXGBXAGGSA-N 263.385 2.057 10 20 CECD C[C@H]1C(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C(=O)N1C 761578834 XIFKBWDHGAPXOK-QWRGUYRKSA-N 275.352 2.096 10 20 CECD C[C@@H](CCN(C)C)NCc1cc(Cl)ccc1O 49553261 HANIRLMKTGNOSY-JTQLQIEISA-N 256.777 2.475 10 20 CECD CCCNC(=O)[C@@H]1CCCN(Cc2ccc(C)cc2O)C1 876657933 LQRBGGIIWRHYQQ-OAHLLOKOSA-N 290.407 2.439 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2ccc(C)cc2O)C1 877401159 ZFSLQUXZSACEHY-CYBMUJFWSA-N 278.352 2.021 10 20 CECD CC[C@@H](N[C@@H](C)CC(N)=O)c1cc(Cl)ccc1O 775514001 QMVCMVOXGVYEOJ-GZMMTYOYSA-N 270.760 2.350 10 20 CECD O=C(O)[C@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 874044741 HVPNSUOEOKCVNO-QMMMGPOBSA-N 287.718 2.481 10 20 CECD CCN(C)C(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 775836172 KDLNASXLACMGQS-ZDUSSCGKSA-N 277.412 2.272 10 20 CECD CC(=O)Nc1ccc(CNCc2ccccc2O)cn1 788523389 BTLQBNQSSOSYOL-UHFFFAOYSA-N 271.320 2.035 10 20 CECD COC(=O)[C@H](CNCc1c(O)cccc1OC)CC(C)C 894791165 POYPETAYOFZLDI-LBPRGKRZSA-N 295.379 2.326 10 20 CECD COc1ccc(CNC(=O)c2ccc(O)c(F)c2)c(O)c1 794381097 KWYMHPXIADRKHB-UHFFFAOYSA-N 291.278 2.176 10 20 CECD COC(=O)c1occc1CNCc1ccc(OC)cc1O 793388134 MUCVKOWTJFGXLI-UHFFFAOYSA-N 291.303 2.070 10 20 CECD CCc1cccc(CNC[C@](C)(O)CSC)c1O 691499941 KTWGZRPDURBLPO-AWEZNQCLSA-N 269.410 2.158 10 20 CECD Cc1ccc(C[C@@H](CO)NCc2ccc(N)cc2)cc1 1337838240 LZLKVPIBXFNMPR-KRWDZBQOSA-N 270.376 2.270 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN(C)[C@@H](C)C2)c1O 110727318 VZILWMSSDDRPBI-JTQLQIEISA-N 296.798 2.384 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)CC(C)C)c1 223739309 ZRXQBSABUWECFH-NWDGAFQWSA-N 267.369 2.458 10 20 CECD COc1ccc(O)c(CN2CC[C@H](C)C[C@H]2C(=O)O)c1 1607277566 HQAITSFVYPYFAT-GWCFXTLKSA-N 279.336 2.086 10 20 CECD CCN(Cc1cc(F)cc(C(C)=O)c1O)C(C)(C)C(=O)O 1596355737 BJBBOKWLYCUQSX-UHFFFAOYSA-N 297.326 2.419 10 20 CECD O=C(O)[C@]1(C(=O)N2Cc3cccc(O)c3C2)CC=CCC1 1594851989 OBAQWKOMERXPNH-MRXNPFEDSA-N 287.315 2.046 10 20 CECD COc1cc(CN2CCC[C@H](OC)C2)c(O)cc1C 160126113 LVYYKLYJKCGMLI-ZDUSSCGKSA-N 265.353 2.320 10 20 CECD COc1ccc(N2CCN(C(=O)C3(C)CC3)CC2)cc1F 155898468 PQAGKXZLUQBFLC-UHFFFAOYSA-N 292.354 2.283 10 20 CECD Nc1cccc(CNCc2ccc3c(c2)CCO3)c1 259001044 MIEFMIKJQBONPA-UHFFFAOYSA-N 254.333 2.494 10 20 CECD Nc1ccc(CN[C@@H]2COc3ccccc3C2)cc1 1120370557 AIUYQINLXSNKOQ-HNNXBMFYSA-N 254.333 2.362 10 20 CECD Cc1ccc(CNCCOCC(F)(F)F)c(O)c1 876909487 ABLMLXPXSQSXGN-UHFFFAOYSA-N 263.259 2.369 10 20 CECD COc1ccc(O)c(CNC[C@](C)(OC)C2CC2)c1 291033072 JGWAULHMEMOROQ-HNNXBMFYSA-N 265.353 2.306 10 20 CECD CC[C@@H](C)NCCN1CCN(c2ccc(OC)cc2)CC1 57868793 RGLWBZOWUKATMC-OAHLLOKOSA-N 291.439 2.205 10 20 CECD COCCCN(CCOC)Cc1cc(C)c(C)cc1O 68963700 IRXOFIMVWSECOG-UHFFFAOYSA-N 281.396 2.494 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@@H]1CCCS1 126515360 CUSCWTBLTRYBDX-LBPRGKRZSA-N 280.393 2.429 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H](O)COCC(C)C)c1 185116918 JRIJOKSETXZEFT-ZIAGYGMSSA-N 281.396 2.385 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CC=CCC1 181103223 FILVEOLTMGUKCF-CRALRDPISA-N 259.305 2.336 10 20 CECD Cc1cc(Br)cc(CNCC(C)(C)O)c1O 133193249 ZAXJBEOJJVFPMK-UHFFFAOYSA-N 288.185 2.324 10 20 CECD COc1cccc(CNC[C@@H](O)c2ccc(F)cc2)c1O 237209234 VGRSMBQUDJUETH-CQSZACIVSA-N 291.322 2.363 10 20 CECD C[C@@H]1C[C@@H](CCNC(=O)NCc2ccccc2O)CCO1 273104693 PGIYJSQOJDJWQB-OLZOCXBDSA-N 292.379 2.397 10 20 CECD CCn1c(C)nc([N+](=O)[O-])c1N(C)Cc1ccccc1O 288961546 TWPRKSWCRDVQHQ-UHFFFAOYSA-N 290.323 2.462 10 20 CECD CC(=O)C(=O)CSc1ccc(C(F)(F)F)cn1 289599136 KCTFIPWZPQCSOD-UHFFFAOYSA-N 263.240 2.351 10 20 CECD CC[C@H](NC[C@@H](CO)[C@H]1CCOC1)c1ccc(F)cc1O 286937150 BAKKRVMJXDGVLM-HUBLWGQQSA-N 297.370 2.217 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](CO)[C@H]2CCOC2)c(O)c1C 280975236 VUFYSOYOOUCCGM-KKUMJFAQSA-N 293.407 2.305 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H](O)C1CC1 809739596 PCKVETCTYDDRMK-NSHDSACASA-N 259.708 2.045 10 20 CECD Oc1cccc2c1[C@@H](NCCCO[C@@H]1CCOC1)CC2 297540141 DYWBIMHDKVUDBG-KGLIPLIRSA-N 277.364 2.165 10 20 CECD CC[C@@H](NC(=O)c1ccc(-n2c(C)ccc2C)cc1)C(N)=O 291460438 DGANGJSRLUMWQN-OAHLLOKOSA-N 299.374 2.088 10 20 CECD OC[C@]1(F)CCN(Cc2cc(Cl)cc(F)c2O)C1 802660521 OBHPGXNNDKKSSR-LBPRGKRZSA-N 277.698 2.091 10 20 CECD CCOc1cc(C(=O)NCc2ccc(N(C)C)cc2)on1 294296498 GFIMLZSXGQZAQD-UHFFFAOYSA-N 289.335 2.069 10 20 CECD CC[C@H](C)NC(=O)CN(CC)c1ccc(OC)c(OC)c1 299273166 KPVVASKWYBAVMP-LBPRGKRZSA-N 294.395 2.445 10 20 CECD COc1cccc(O)c1CN1CC[C@H](n2cccn2)C1 812780854 VPYJZXVBZHFQLQ-LBPRGKRZSA-N 273.336 2.044 10 20 CECD C[C@H](O)CN(Cc1ccc(N(C)C)c(F)c1)CC(F)F 825098824 OTOJPQCSWMXJBF-JTQLQIEISA-N 290.329 2.340 10 20 CECD CCOc1ccc(CNC[C@H](OC)C(F)(F)F)c(O)c1 733329946 MEDUWXRUXGRJGE-LBPRGKRZSA-N 293.285 2.458 10 20 CECD C[C@@H](NC(=O)CCOC[C@H]1CCCO1)c1ccccc1O 827930427 JZYQEGSVJYDKDX-CHWSQXEVSA-N 293.363 2.155 10 20 CECD C[C@H](N[C@H]1C[C@H]2CCCCN2C1=O)c1cc(F)ccc1O 834911807 BDONDGDUFBKQSI-SUHUHFCYSA-N 292.354 2.335 10 20 CECD COC[C@H](C)NC(=S)NCc1ccc(N(C)C)cc1C 734383837 FUILEWPBWWAERN-LBPRGKRZSA-N 295.452 2.060 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(N(C)C)cc1 837543547 XJZQBJHTVDQHOQ-SRMUXQRQSA-N 288.391 2.497 10 20 CECD COc1ccc(O)c(CNC(=O)OC2CCC2)c1 830638930 YLAZXBVXYOUXII-UHFFFAOYSA-N 251.282 2.180 10 20 CECD COC[C@@H](O)CCN[C@H](C)c1ccc(Cl)cc1O 841748151 HQHOYUNUGQBVMP-KOLCDFICSA-N 273.760 2.094 10 20 CECD C[C@@H]1CCCCN1NC(=O)/C=C\c1ccc(O)c(O)c1 912147763 NWACGTGRBNPTNY-BPOWMSRESA-N 276.336 2.017 10 20 CECD C[C@@H]1[C@H](C(=O)NCc2cc(Cl)ccc2O)CCN1C 846476790 OVBPNWBYTJMQMT-BXKDBHETSA-N 282.771 2.002 10 20 CECD C[C@H](N[C@@H]1CCCCNC1=O)c1ccc(Cl)cc1O 841743567 AYNQOOHFGFRZDN-JOYOIKCWSA-N 282.771 2.365 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccccn2)c(O)c1O 751533736 CBZRJMQWRKTMOF-UHFFFAOYSA-N 272.304 2.073 10 20 CECD Cc1cc(CN2CC[C@H]([C@@H](C)N)C2)ccc1N(C)C 923331447 MBXWYTNUCWKCGS-HIFRSBDPSA-N 261.413 2.230 10 20 CECD COC[C@@H](C)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756466263 NWMMFWOUAJCLCR-UWVGGRQHSA-N 268.313 2.234 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H](C)c2ccc[nH]2)c1 760831466 DWRQWLDGIIRLKB-SNVBAGLBSA-N 289.335 2.289 10 20 CECD CSC[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O 768464007 YTWMQEVAEFLGPZ-RISCZKNCSA-N 295.404 2.145 10 20 CECD N[C@H]1CC[C@@H](C(=O)NCCCSc2nccs2)CC1 870886316 DDCOKISHTNGJQM-PHIMTYICSA-N 299.465 2.259 10 20 CECD C[C@H]1OCC[C@@H]1CN(C)c1ccc(OCC(=O)O)cc1 872161083 RVKZHYPEJKYRQY-VXGBXAGGSA-N 279.336 2.011 10 20 CECD CN(C(=O)CCC(=O)NC1CCCC1)c1ccc(N)cc1 877075789 HMHDVBRQPLCOBQ-UHFFFAOYSA-N 289.379 2.071 10 20 CECD CC[C@H](C[C@H](C)CO)NC(=O)/C=C\c1ccc(O)c(O)c1 779534183 OIBREBGJYSGXBY-PDCNKGEESA-N 293.363 2.024 10 20 CECD C[C@@H](OC[C@@H]1CCCCO1)C(=O)N(C)c1ccc(N)cc1 877078516 SFRZHYYKUQIAJV-DOMZBBRYSA-N 292.379 2.206 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)O[C@]2(CCO[C@H]2C)C1 877487082 UQZVMEZTZKNZEF-GRDNDAEWSA-N 291.391 2.469 10 20 CECD C[C@H](NCc1cc(Cl)cc(F)c1O)C(C)(C)O 776151413 MRIRVUNMVNSOLL-ZETCQYMHSA-N 261.724 2.434 10 20 CECD CC[C@H](N[C@@H](C)[C@@H]1CN(C)CCO1)c1ccccc1O 775522023 HMRPHOBZEAUHGV-NOLJZWGESA-N 278.396 2.152 10 20 CECD Cc1ccc(CN(C)CC(=O)NCc2ccco2)c(O)c1 876543164 GWXILALKKJSQOZ-UHFFFAOYSA-N 288.347 2.042 10 20 CECD C[C@H](N[C@@H](C)[C@H]1CN(C)CCO1)c1ccc(N(C)C)cc1 773071998 MRNNJCUXHWELQO-GRDNDAEWSA-N 291.439 2.122 10 20 CECD C[C@H](N[C@@H](CCO)C1CCOCC1)c1c(O)cccc1F 886590045 MJGJDQPIZFMSOF-FZMZJTMJSA-N 297.370 2.360 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)c1ccncn1 778606540 HDCHURVTACPFGQ-UHFFFAOYSA-N 296.374 2.397 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@H]1C 787421825 XFPYCGRKSXQSCV-WCQYABFASA-N 294.370 2.275 10 20 CECD Cc1cccc(CN2[C@@H](C)[C@H](C)N(C)C(=O)[C@H]2C)c1O 895919262 DZTKFHKSXWQRBO-RWMBFGLXSA-N 276.380 2.140 10 20 CECD COc1cc(C)cc(CN[C@H]2CCc3n[nH]cc3C2)c1O 894283439 FFMKMJXHLOQVBT-ZDUSSCGKSA-N 287.363 2.079 10 20 CECD CCn1cnnc1CNCc1c(O)ccc(Cl)c1F 790948930 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c1cc(N2CCCC2)ccc1CN1CCC[C@H]2CNC[C@H]21 1345099702 KGRLNFFVGGGUSG-FUHWJXTLSA-N 285.435 2.471 10 20 CECD C[C@@H]1CSCCN(C(=O)NCc2ccc(N)cc2)C1 1353538952 GAQVBWRWOJYQEX-NSHDSACASA-N 279.409 2.163 10 20 CECD Nc1ccc(CNC(=O)CCCc2ccccn2)cc1 1515332161 ILAJOCNMWPXCRW-UHFFFAOYSA-N 269.348 2.303 10 20 CECD CNC[C@@H]1CCCN(Cc2cc(Cl)cc(OC)c2O)C1 229102448 ZGSJZDVZIDGTFD-NSHDSACASA-N 298.814 2.486 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3)cc1 1579673695 CZGNGMQOTACBPD-RDJZCZTQSA-N 295.386 2.280 10 20 CECD COc1cc(C)cc(CNCCC(C)(C)C(=O)O)c1O 1594054414 FXRUBADSCVGAJT-UHFFFAOYSA-N 281.352 2.300 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCc2ccn(C)n2)c1 230897831 ODHAWFSWYMPXAJ-GFCCVEGCSA-N 259.353 2.327 10 20 CECD CCC[C@@H](CC(=O)O)NCc1ccc2c(c1)CCO2 1776827835 BSUWKEOGCVULEN-ZDUSSCGKSA-N 263.337 2.355 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCCSC1 810156863 XBWPTWZUZPXLDK-LBPRGKRZSA-N 265.378 2.494 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCCC[C@]1(C)N 827205400 MINDJSGTBYRCKT-CJNGLKHVSA-N 276.380 2.258 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2C[C@H](O)C2(C)C)c1 128099715 OMBBBZUMIWSVCO-FZZIBODNSA-N 265.353 2.211 10 20 CECD COc1ccc(O)c(CN2CCCC[C@@H]2CCN)c1 70148649 QYNAFVNGDSFMBN-CYBMUJFWSA-N 264.369 2.104 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H]2CC(=O)OC)c1 179895483 LOLMQXYCROKZRG-ZDUSSCGKSA-N 293.363 2.318 10 20 CECD Cc1cc(C(=O)N[C@@H]2CCOC2)c(C)n1-c1ccccn1 179200957 GARBPOGGNVUEMC-CYBMUJFWSA-N 285.347 2.008 10 20 CECD O=C(C[C@H]1C=CCCC1)NCc1cccc(O)c1O 1349078566 ITEVMBPFOWRFIJ-NSHDSACASA-N 261.321 2.460 10 20 CECD CC(C)CSCCNC(=O)c1cccc(O)c1O 280011455 WDUYRGUZGSRJMZ-UHFFFAOYSA-N 269.366 2.217 10 20 CECD CCc1ncc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 181238953 TYDHWBXMPDMENC-GQCTYLIASA-N 285.303 2.102 10 20 CECD COc1ccc(O)c(CN2CCN(C3CCCC3)CC2)c1 133880807 KYXSRSNJJVYBMP-UHFFFAOYSA-N 290.407 2.461 10 20 CECD CSCCCNC(=O)NCc1ccc(N(C)C)cc1 130916022 JLYVOSKSUVYJCX-UHFFFAOYSA-N 281.425 2.305 10 20 CECD COC(=O)CC(C)(C)NCc1cc(C)ccc1O 237128476 ABAINZQRAFUZLQ-UHFFFAOYSA-N 251.326 2.132 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CC(=O)N(C(C)C)C2)c1 273516863 SSHFQHLKPVQLAD-NEPJUHHUSA-N 292.379 2.061 10 20 CECD CC1(C)CCC[C@]1(O)CNCc1cc([N+](=O)[O-])ccc1O 292916387 HVMJNEJAXNJXMX-HNNXBMFYSA-N 294.351 2.331 10 20 CECD C[C@@H](CCCO)CNCc1ccc(N2CCOCC2)cc1 384408145 WASURQQSAYXJGG-HNNXBMFYSA-N 292.423 2.021 10 20 CECD Cc1cc(CN2CC[C@H](C)C[C@H]2C(N)=O)ccc1N(C)C 815095167 AMUJVLPQKGKLMP-LRDDRELGSA-N 289.423 2.147 10 20 CECD CCN(CC)CCOc1ccccc1NC[C@@H](C)O 819435471 MTIUDZQEOUKTSP-CYBMUJFWSA-N 266.385 2.200 10 20 CECD O=C(O)C[C@H]1CCCN(Cc2cccc(F)c2O)C1 821515689 MKICEGFMYMCJQS-SNVBAGLBSA-N 267.300 2.218 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(OC)cc2O)[C@H]1SC 839067027 MCBVBZSOTKXPNL-NWANDNLSSA-N 297.420 2.399 10 20 CECD COc1cc(CN2CCC[C@H]2C2OCCO2)c(O)cc1C 902624279 HPBJOPLVJQZGQT-ZDUSSCGKSA-N 293.363 2.047 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 843056807 AICTXFDFMZVADI-BDAKNGLRSA-N 272.751 2.354 10 20 CECD CC(C)CCN(C)C(=O)NCCc1ccc(N)cc1 841956346 CSUQFDGZNPVPIG-UHFFFAOYSA-N 263.385 2.499 10 20 CECD COc1cccc([C@@H](C)NCC2(C(N)=O)CCCC2)c1O 846148380 YJZJBAACEJLVLH-LLVKDONJSA-N 292.379 2.097 10 20 CECD CCc1cccc(CN(C)CCOCCCOC)c1O 848901225 PPSNSIIMHJHHPA-UHFFFAOYSA-N 281.396 2.440 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC(C)(O)CC1 840916306 ZIXWBOJLKJYIMA-UHFFFAOYSA-N 262.397 2.408 10 20 CECD c1cc(N2CCCC2)ccc1CNC1CCNCC1 841026884 USXNDRLRNORMTN-UHFFFAOYSA-N 259.397 2.128 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCO[C@@H](C)C2)c1 756782077 MJRNASVXYGUXLV-GVXVVHGQSA-N 293.363 2.397 10 20 CECD CC(C)[C@H](NC(=O)c1cc(O)cs1)C1(CO)CCC1 854601395 VQQXLUPZQBSADE-LBPRGKRZSA-N 283.393 2.371 10 20 CECD CCOc1ccc(CN[C@@H]2CCO[C@H](C)C2)c(O)c1 769709731 JKALBZAACSABLZ-DGCLKSJQSA-N 265.353 2.448 10 20 CECD COC[C@H](NC(=O)N[C@H](C)c1ccccc1O)C1CC1 868430030 CHMGSIGEEBBDKZ-MFKMUULPSA-N 278.352 2.177 10 20 CECD CC[C@@](C)(O)C(=O)NCc1ccc(N2CCCC2)cc1 930204890 FBGNJWJHKLVDAX-MRXNPFEDSA-N 276.380 2.064 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@@H]1C 768465198 YNNSFAYHGUBEGW-GPCCPHFNSA-N 263.337 2.048 10 20 CECD COC(C)(C)CCNC(=O)NCc1ccccc1O 868991638 JYLXLTGSIUKOQS-UHFFFAOYSA-N 266.341 2.007 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCSC2)c1 762536343 NBEXSUSCTSJYHQ-VHSXEESVSA-N 281.377 2.331 10 20 CECD CCOC(=O)N1CCCN(Cc2ccc(C)cc2O)CC1 876655135 XODHSMPGGCSNSI-UHFFFAOYSA-N 292.379 2.365 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](C(C)(C)O)C1 877797367 UPDORBIBUVAWCA-LBPRGKRZSA-N 279.380 2.384 10 20 CECD CCN[C@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 876874105 ABQWJUVTQNNGKG-CQSZACIVSA-N 291.439 2.488 10 20 CECD CCOC(=O)CN(CC(C)C)C(=O)c1cc(O)cs1 777525730 OFNPGMNDZQFGHV-UHFFFAOYSA-N 285.365 2.115 10 20 CECD CN(C)c1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)ccn1 779531975 PNWUOZAHMBWUFF-XQRVVYSFSA-N 299.330 2.211 10 20 CECD CO[C@@H](C)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 785894374 QBYMUAZNDUXZOX-NWDGAFQWSA-N 279.384 2.148 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cc(C)ccc2O)C1 93770584 YQYUJWOLBHSIRM-CQSZACIVSA-N 262.397 2.474 10 20 CECD COc1ccc(CN[C@H]2C[C@@H](OC(C)C)C2)c(O)c1OC 894845303 DKHHTPUKLSPIAH-BETUJISGSA-N 295.379 2.455 10 20 CECD CC[C@H](NCCOCCN(C)C)c1ccc(C)cc1O 794814585 MEKBXEWYWLCNSW-HNNXBMFYSA-N 280.412 2.320 10 20 CECD OCCCCNCc1ccc(Br)cc1O 691402938 NAALVUOFCBVZIJ-UHFFFAOYSA-N 274.158 2.017 10 20 CECD CC[C@H]1CN(Cc2c(O)cccc2OC)CCCO1 798965369 WCBJGZNUJQZQAS-LBPRGKRZSA-N 265.353 2.402 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2C=C[C@@H](C(=O)O)C2)cc1F 1330275636 VPMPELAUOYLTFD-KOLCDFICSA-N 296.317 2.150 10 20 CECD C[C@H]1CC[C@@H](C(=O)O)N(Cc2ccc(N(C)C)cc2)C1 1776619910 XKDGQERLZDICRZ-WFASDCNBSA-N 276.380 2.438 10 20 CECD C[C@H]1C[C@H](NC(=O)NCc2ccc(N)cc2)C[C@@H](C)O1 1335545419 GUAZVVLNZXUJJX-GNXNZQSNSA-N 277.368 2.024 10 20 CECD CCOc1ccc(N2CCN([C@@H](CC)C(=O)O)CC2)cc1 1605691245 VABLMQBSQJHCPM-HNNXBMFYSA-N 292.379 2.071 10 20 CECD COc1cc(CN(CC(=O)O)CC(C)C)c(O)cc1C 1610296044 PUZPHLVLNKGWOY-UHFFFAOYSA-N 281.352 2.252 10 20 CECD CC(C)(C)C[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776245750 NQLDQVYKWIDUMY-LLVKDONJSA-N 296.323 2.279 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2C[C@@H]2C(=O)O)cc1 1776861072 KAFPAVLSIXCNAX-ZFWWWQNUSA-N 276.380 2.343 10 20 CECD COc1cccc(CNCc2ccc3c(c2)OCO3)c1O 20124389 FCULIOGFLZYXQJ-UHFFFAOYSA-N 287.315 2.419 10 20 CECD NC[C@H]1CC[C@@H](NCc2ccc3c(c2)CCCO3)C1 904354127 ARAUOTDNQGSCOX-SWLSCSKDSA-N 260.381 2.229 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)N(C)c2ccc(N)cc2)[C@H]1C 252680524 BAPKSDHTGHROAH-DYNIEEOBSA-N 262.353 2.291 10 20 CECD Cn1ncc2c1CCC[C@@H]2NCc1ccccc1O 37087265 WASPSMPNILFIPT-ZDUSSCGKSA-N 257.337 2.293 10 20 CECD COc1cccc(CN[C@H](C)CC(C)(C)O)c1O 295121306 WORQCSYONQONII-SNVBAGLBSA-N 253.342 2.040 10 20 CECD NC(=O)c1cccc(CNCc2c(O)cccc2Cl)c1 83551669 YPWIBLIAIMYXMP-UHFFFAOYSA-N 290.750 2.434 10 20 CECD CO[C@H]1CC[C@@H](NCc2cc(F)cc(F)c2O)C1 708436482 MWZJMOIHKUSVCT-MNOVXSKESA-N 257.280 2.328 10 20 CECD CO[C@H](C1CC1)[C@H](C)NCc1cc(F)ccc1O 388278595 KNCIOTGZYAIBOL-XPTSAGLGSA-N 253.317 2.434 10 20 CECD CC(C)CNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 58062734 KMSQXONDCLVLKK-OAHLLOKOSA-N 289.423 2.134 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccnn1C 170732447 KPKYLHWTCJAKBN-UHFFFAOYSA-N 273.336 2.178 10 20 CECD C[C@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)CCN1C 174514727 WBWVGKFYQJODSP-GXTWGEPZSA-N 279.403 2.464 10 20 CECD COc1cccc(CN(C)CCc2ccncc2)c1O 183760183 QKLYXXZETCKABR-UHFFFAOYSA-N 272.348 2.470 10 20 CECD Cc1nnnn1-c1cccc(NCc2ccccc2O)c1 37105742 XZRTZTLVXXSCKT-UHFFFAOYSA-N 281.319 2.288 10 20 CECD CO[C@H]1CCN(Cc2cc3c(cc2O)OCO3)[C@H](C)C1 282367585 QCINKKGMFFALDE-PWSUYJOCSA-N 279.336 2.120 10 20 CECD CSC[C@@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183450249 NOWHMGSYJWDEIH-NXEZZACHSA-N 283.393 2.144 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cnccn2)cc1 79390096 BWGFOUHWGWBXLZ-UHFFFAOYSA-N 284.363 2.253 10 20 CECD CCOCCOCCN(C)Cc1cc(C)c(C)cc1O 189237047 TZHIDIRWEXUTJB-UHFFFAOYSA-N 281.396 2.494 10 20 CECD CN1CCC(CNCc2ccc3c(c2)CCO3)CC1 44516917 XXKHXIWOSLLNQT-UHFFFAOYSA-N 260.381 2.053 10 20 CECD C[C@@H](N)CC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 40855919 GDEYAADNOLYSIS-CQSZACIVSA-N 289.423 2.373 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)NCCCN)c1C 237725399 NUJIWCGVMGDJJJ-UHFFFAOYSA-N 285.391 2.481 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@]1(C)C[C@@H]1F 335602418 ZNJJKIYVQXKCDG-ZFWWWQNUSA-N 278.327 2.226 10 20 CECD C[C@H](NC[C@@H]1CN2CCC[C@H]2CO1)c1cc(F)ccc1O 251791522 VZBKCRZSEROYNE-FPMFFAJLSA-N 294.370 2.045 10 20 CECD CO[C@@H]1CCCC[C@@H]1NC(=O)NCc1ccccc1O 266566196 NNGIFAOBPCWOAR-GXTWGEPZSA-N 278.352 2.149 10 20 CECD CCCCN1CC(=O)N[C@H]1c1cc(Cl)cc(OC)c1O 273477943 IFKFWFIOFQAWID-CQSZACIVSA-N 298.770 2.285 10 20 CECD OC[C@@H]1c2ccccc2CCN1Cc1ccccc1O 271244785 BTQIQXLTBQMDFW-MRXNPFEDSA-N 269.344 2.484 10 20 CECD CC[C@@H](NCc1ccccc1O)[C@H](O)C(F)(F)F 270973769 KHRBLDQIFGBKJI-KOLCDFICSA-N 263.259 2.184 10 20 CECD Cc1ccc(O)c(CNCCCN2CCCO[C@H](C)C2)c1 277826154 LIRYZKZZQSDRAF-OAHLLOKOSA-N 292.423 2.291 10 20 CECD C[C@H](CO)N(Cc1cc2c(cc1O)OCO2)CC1CCC1 289345034 IJTYYIOYBMLHRJ-LLVKDONJSA-N 293.363 2.104 10 20 CECD Cc1nonc1CNCc1c(O)cccc1Cl 809744752 BGIXYNUZPJAVBO-UHFFFAOYSA-N 253.689 2.027 10 20 CECD C[C@@H](NC[C@@H]1CCCN1)c1cc(Cl)ccc1O 817952538 RMZBOPIPBXVTON-KOLCDFICSA-N 254.761 2.448 10 20 CECD COC[C@@]1(CN[C@H](C)c2ccc(N(C)C)cc2)CCCN1 817974207 JKIWGHGFFOIEOQ-PBHICJAKSA-N 291.439 2.172 10 20 CECD OC[C@@H](CNCc1cc(F)ccc1O)CC1CC1 827358899 GCLDOINCTVWXOO-LLVKDONJSA-N 253.317 2.030 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cncs2)c1 728979714 KYKCZCHJKQXXQC-QMMMGPOBSA-N 278.333 2.348 10 20 CECD COc1ccc(CN[C@@](C)(CCF)C(=O)O)cc1C 901914529 BZKSYXIYVQCRSD-AWEZNQCLSA-N 269.316 2.296 10 20 CECD CO[C@@H]1C[C@@H](N(C)C(=O)c2cccc(O)c2O)C12CCC2 837017842 RXDVZMVIXVRNNX-CHWSQXEVSA-N 291.347 2.127 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C(=O)O)C1CC1 901476483 HCMCUINDFDOTEO-AWEZNQCLSA-N 262.353 2.014 10 20 CECD CC(=O)c1cc(F)cc(CNC(C)(C)CN(C)C)c1O 839092577 SEAFJNGRTKMVHN-UHFFFAOYSA-N 282.359 2.164 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H]2CCNC[C@@H]2C1 904419080 LYASGWXSDVBRHI-JKSUJKDBSA-N 273.424 2.102 10 20 CECD CCOc1ccc(O)c(CNCc2ccc(C(=O)O)o2)c1 737202667 ALOJCZPHZHFXRV-UHFFFAOYSA-N 291.303 2.372 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1C[C@H]2CC[C@H]1C2 910951350 FYUVYWNJSNYAPQ-OUJBWJOFSA-N 261.321 2.150 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2ccc(N(C)C)cc2C)C1 840942169 UQPXCAHZBGZKKA-HIFRSBDPSA-N 290.407 2.492 10 20 CECD CC(C(=O)N(CC(=O)O)Cc1ccccc1O)=C1CCC1 911487678 GQVKLTGVJJXBCM-UHFFFAOYSA-N 289.331 2.306 10 20 CECD C[C@H](CNCc1ccc2c(c1)CCO2)Cn1cccn1 917397703 ZVXMMCLGRLLVHK-CYBMUJFWSA-N 271.364 2.244 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCOC[C@@]12CCOC2 840942410 KHJVTBRSSLALTL-KRWDZBQOSA-N 290.407 2.052 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CCN)C2)cc1F 843113605 YMNRZWZEMCHKPY-CYBMUJFWSA-N 279.403 2.453 10 20 CECD CC(C)Cn1nccc1C(=O)Nc1ccc(N)cc1 843291813 BJJWJTJMANRQAW-UHFFFAOYSA-N 258.325 2.374 10 20 CECD Cc1cc(N(C)C)ccc1CNCCc1ccn(C)n1 840938774 GZOMOFPAJBJOFN-UHFFFAOYSA-N 272.396 2.127 10 20 CECD COc1cccc([C@H](C)NCCC[C@H](C)CO)c1O 846158351 WUZCLKQHHBOMIC-RYUDHWBXSA-N 267.369 2.460 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@]1(O)CCSC1 840935356 MYBBSIUNTZECBZ-OAHLLOKOSA-N 280.437 2.019 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)C[C@H](C)O 840936507 KKXZDKFMQNWTMY-OLZOCXBDSA-N 250.386 2.310 10 20 CECD Cc1cc(CN(C)C[C@H]2C[C@@H](O)C2)ccc1N(C)C 859969662 BELXWKDCSWEMFB-GASCZTMLSA-N 262.397 2.264 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CCCN(C)C2=O)c(O)c1C 756639433 YTEYZUDIKLCTKX-GXTWGEPZSA-N 276.380 2.280 10 20 CECD CN1CCCc2cc(CN[C@@H]3[C@H]4C[C@@H]5CN[C@H]3[C@H]5C4)ccc21 925532533 SPPPRTBHBBSXTG-CTRAYCPCSA-N 297.446 2.155 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@](C)(O)C(C)C)c1 756578031 VLHVNGMOKWALDJ-MEDUHNTESA-N 295.379 2.236 10 20 CECD CO[C@H]1C[C@@H](NC(=O)NCc2cc(C)ccc2O)C1(C)C 858273832 IIHBOKHKUHDZCC-KGLIPLIRSA-N 292.379 2.313 10 20 CECD Cc1cc(CNC(=O)[C@H](C)O)c(C)n1-c1ccccc1 863164597 PHRISKYTTPTNII-ZDUSSCGKSA-N 272.348 2.091 10 20 CECD O=C1N[C@H](c2cccc(F)c2O)N2CCc3ccccc3[C@@H]12 877856660 TVLZBNVGOAZZQK-HOCLYGCPSA-N 298.317 2.259 10 20 CECD CC(C)CNC(=O)CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 1116569038 YZVDGZXHPRECKY-JQWIXIFHSA-N 294.370 2.441 10 20 CECD COc1cc(N2CCOC[C@H](C)C2)c([N+](=O)[O-])cc1OC 874082692 YKXIAMTYPZKYTI-SNVBAGLBSA-N 296.323 2.085 10 20 CECD Cc1nc(CCC(=O)NCc2ccc(O)c(O)c2)cs1 778916339 FEJFATQJTXZCNG-UHFFFAOYSA-N 292.360 2.112 10 20 CECD CCN(C)c1ccc(CN2CCn3cnnc3[C@@H]2C)cc1 773889591 YDTZZPYJUXSNRX-ZDUSSCGKSA-N 285.395 2.311 10 20 CECD C[C@H](NCC1([S@@](C)=O)CCC1)c1c(O)cccc1F 886605613 VEXJVNARFXQISL-APBUJDDRSA-N 285.384 2.483 10 20 CECD C[C@@H]1OCC[C@H]1NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898449284 AJLIOLUBVPQVER-XKQJLSEDSA-N 291.439 2.122 10 20 CECD COc1ccc(CN(C)Cc2ccccc2O)cn1 85795158 RVYAFVTYSBTZER-UHFFFAOYSA-N 258.321 2.428 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)C(F)F 792306187 DTBXOCGSHSGLJC-QMMMGPOBSA-N 287.306 2.436 10 20 CECD C[C@H]1COCCCN1Cc1cc(F)cc(F)c1O 708424115 WVAHQJXSAAFHHP-VIFPVBQESA-N 257.280 2.281 10 20 CECD O=C(NCC1(C2CC2)CCC1)c1cccc(O)c1O 193145383 CCJYLQFQWTZQSI-UHFFFAOYSA-N 261.321 2.408 10 20 CECD C[C@H](NCCOC[C@@H]1CCCO1)c1cc(F)ccc1O 756582981 MMTCXSJRCZIZRC-AAEUAGOBSA-N 283.343 2.378 10 20 CECD Cc1c[nH]cc([N+](=O)[O-])c1=NCc1ccccc1O 1322490517 HFIQRAPYIOTJTF-UHFFFAOYSA-N 259.265 2.038 10 20 CECD COc1ccc(CNCCC2CCOCC2)c(O)c1OC 1335467340 SHPIEJAOAIONHP-UHFFFAOYSA-N 295.379 2.316 10 20 CECD CC(C)[C@H](NCc1cc(Cl)c(F)cc1O)C(=O)O 1609849271 UFFRPOIZLDLBSL-NSHDSACASA-N 275.707 2.384 10 20 CECD CCNCCCNCc1cc(Cl)cc(F)c1O 1577845750 ABCFVZWWTDGSDY-UHFFFAOYSA-N 260.740 2.274 10 20 CECD C[C@@H](N[C@H]1CCCC[C@@H]1O)c1cc(C(=O)O)ccc1O 1593354405 PFINMPZWAKKAAV-LQJRIPTKSA-N 279.336 2.045 10 20 CECD C[C@@H](NC[C@H]1CCCC[C@@H]1O)c1cc(C(=O)O)ccc1O 1593286014 NPYIJZMWZBANHF-QKCSRTOESA-N 293.363 2.292 10 20 CECD NC(=O)NCc1ccc(NCc2cc(F)ccc2O)cc1 152885781 XRKITNIEZKLQDG-UHFFFAOYSA-N 289.310 2.312 10 20 CECD CCOCCOCCN[C@H](CC)c1ccccc1O 927085573 ASDFADOATCIQPD-CQSZACIVSA-N 267.369 2.486 10 20 CECD Oc1ccc(Cl)cc1CNCC12CC(CO1)C2 527791391 YGMDNESXGGLUCI-UHFFFAOYSA-N 253.729 2.314 10 20 CECD O=S(=O)(Nc1ccc(O)cc1F)c1ccsc1 714379098 ZUDPEONEHZMAHU-UHFFFAOYSA-N 273.310 2.394 10 20 CECD COCc1nc(C(=O)N[C@H](C)c2ccccc2O)cs1 827930401 JFSKHNORORNBHO-SECBINFHSA-N 292.360 2.486 10 20 CECD CCc1ncc(C(=O)NCc2cc(OC)ccc2O)s1 114541921 SZBWTUCZBFWNPO-UHFFFAOYSA-N 292.360 2.350 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)OC)cc1F 66841305 SETHVVZSFMEHNZ-NSHDSACASA-N 282.359 2.323 10 20 CECD Cc1ccc(C(=O)N2CCS[C@H](C)[C@@H]2C)c(O)c1O 179507710 XSMIGBGJZGJTLL-VHSXEESVSA-N 281.377 2.372 10 20 CECD CC(C)N1CCCN(Cc2cc3c(cc2O)OCO3)CC1 68879384 BMMPPANUZSELTN-UHFFFAOYSA-N 292.379 2.037 10 20 CECD C[C@@H](NC(=O)NC1CC1)c1ccc(N2CCOCC2)cc1 65278626 ISPVLXBQXVSLRA-GFCCVEGCSA-N 289.379 2.046 10 20 CECD CN(Cc1ccc(O)cc1)C(=O)/C=C/c1ccc(O)c(O)c1 180854925 SODBQIAIWYAYSV-WEVVVXLNSA-N 299.326 2.475 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)C(=O)OC(C)(C)C 158039325 RQVFIATVWMXHEY-NSHDSACASA-N 277.364 2.441 10 20 CECD COc1ccc(O)c(CNCc2csc(C)n2)c1 41010476 SOTJGZUAVDRLNT-UHFFFAOYSA-N 264.350 2.456 10 20 CECD CC(C)[C@H]1OCCC[C@H]1CNC(=O)c1cccc(O)c1O 193128168 QBNRMKAMMVJUBS-XHDPSFHLSA-N 293.363 2.279 10 20 CECD CO[C@]1(C)C[C@H](NC(=O)Cc2ccc(N)cc2)C1(C)C 237271085 QPEAZPVFBJYTRP-XJKSGUPXSA-N 276.380 2.131 10 20 CECD Oc1ccc(Cl)c(F)c1CNCC12CC(CO1)C2 527792081 YKMSNAOAZVEMJT-UHFFFAOYSA-N 271.719 2.453 10 20 CECD CCN(CCOCCOC)c1ccc(OC)c(OC)c1 267436460 GHSXOIZABSZMJQ-UHFFFAOYSA-N 283.368 2.193 10 20 CECD Cc1cnccc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 274724040 AWCAVEXNZHJDIH-LLVKDONJSA-N 286.331 2.162 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](C)CCN(C)C)c1 273363271 AUFQVJNPHHBURH-VXGBXAGGSA-N 294.395 2.170 10 20 CECD CCN(CC)c1ccc(CNCCC(=O)O)cc1F 283757739 ADNSLSODKXTJOJ-UHFFFAOYSA-N 268.332 2.236 10 20 CECD COc1ccc(O)c(CN(C)CCCn2ccnc2)c1 809753303 PXLDMNCZJGVHNQ-UHFFFAOYSA-N 275.352 2.119 10 20 CECD CCc1cc(NC(=O)c2cc(O)cs2)nn1C 817771412 YVGNNVZEGJYIJO-UHFFFAOYSA-N 251.311 2.002 10 20 CECD CSC[C@H](O)CNc1ccccc1OCC(F)F 819459990 DBKWRXPKXYMEHM-SECBINFHSA-N 277.336 2.466 10 20 CECD CC[C@@H](NC1CNC1)c1cc(Br)ccc1O 817956182 SSDCPZQZZHAIOO-LLVKDONJSA-N 285.185 2.167 10 20 CECD COc1ccc(O)c([C@H](C)NCCCNC2CC2)c1 817984057 MIENOLUGSGLTKP-NSHDSACASA-N 264.369 2.194 10 20 CECD Cc1cc(CN2CCC[C@]2(C)CO)ccc1N(C)C 815093033 ZTBQAWFDQRBNHQ-MRXNPFEDSA-N 262.397 2.408 10 20 CECD CC[C@@H](N)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 826019831 LDEXJOJQDMQTPY-OAHLLOKOSA-N 277.412 2.229 10 20 CECD COc1cccc(O)c1CNC[C@@H](C)Cn1ccnc1C 729681230 KKHQJVPSAKZPGK-GFCCVEGCSA-N 289.379 2.332 10 20 CECD CN(C)c1ccc(CNCc2ccc(C(=O)O)o2)cc1F 737376412 VRKHKZNGECGEBE-UHFFFAOYSA-N 292.310 2.473 10 20 CECD CN(Cc1cc(Cl)ccc1O)C1(CO)CCC1 827903476 IDTWKWURRMFNHG-UHFFFAOYSA-N 255.745 2.392 10 20 CECD CCn1ccnc1[C@H](C)NCc1cc2c(cc1O)OCO2 825005850 UBZJMNQWFLQUJI-JTQLQIEISA-N 289.335 2.188 10 20 CECD Cc1csc(N(C)C(=O)c2cc(O)cs2)n1 734865109 MOMVJNSAKOTYIO-UHFFFAOYSA-N 254.336 2.495 10 20 CECD CC(C)(NC(=O)c1cc(O)cs1)C1CCOCC1 834678709 ITDGJWOKLYHIMG-UHFFFAOYSA-N 269.366 2.389 10 20 CECD CCN(CC)c1ccc(CNC2CC(N)C2)cc1F 906511225 ZJCFUKIEBFENAH-UHFFFAOYSA-N 265.376 2.251 10 20 CECD O=C(CCN[C@@H]1CCc2cccc(O)c21)Nc1ccccn1 834541260 SKZKOLNPMVMLJR-CYBMUJFWSA-N 297.358 2.393 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C(=O)O)C(C)C 911324069 RDXFMLOILWSQNL-AWEZNQCLSA-N 293.363 2.488 10 20 CECD CC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@H](O)C(C)C 840525345 NGEPOQHAPCOULO-PRWLWDESSA-N 293.363 2.023 10 20 CECD CC(=O)c1cc(F)cc(CN(CC(=O)O)CC(C)C)c1O 846263879 IGXVJULBCHNISB-UHFFFAOYSA-N 297.326 2.277 10 20 CECD COc1cccc(O)c1CNCCC(=O)OC(C)(C)C 742372537 PFALPNYPYKHYNH-UHFFFAOYSA-N 281.352 2.222 10 20 CECD NCCCc1nc(-c2ccc(O)c(O)c2)cs1 843290288 PIHFSDZOCRZTBD-UHFFFAOYSA-N 250.323 2.113 10 20 CECD O=C(Nc1ccn(CC(F)F)n1)c1cc(O)cs1 748859341 JUWKVQYEXKTPEK-UHFFFAOYSA-N 273.264 2.168 10 20 CECD c1cc2c(cc1CNCCOC[C@H]1CCCO1)CCCO2 921744576 FFHDXURRKJTDBB-MRXNPFEDSA-N 291.391 2.297 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H](C)COCC2CC2)c1 858588751 OGKMEKLFZPDBEM-GFCCVEGCSA-N 292.379 2.315 10 20 CECD CN(CC1=CCSC1)C(=O)/C=C\c1ccc(O)c(O)c1 856370577 XIKDQSJYQUMHNV-HYXAFXHYSA-N 291.372 2.243 10 20 CECD COC(=O)CCCCN1CCOc2cc(N(C)C)ccc21 859217120 LAFDEZDJVLGYHQ-UHFFFAOYSA-N 292.379 2.295 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H]2CCC[C@@]2(N)C1 857226262 JKNSISBCRXUEKZ-NVXWUHKLSA-N 273.424 2.374 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](C)C(=O)OC(C)(C)C)c1 862754754 JAMGZQGAFCWALN-LLVKDONJSA-N 293.363 2.295 10 20 CECD CCO[C@H](CC)C(=O)NCc1cc(C)ccc1O 862759121 WQCSPOMCZVCAOD-CYBMUJFWSA-N 251.326 2.132 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC1CC=CC1 862630864 PWPUTQBVDKLHDG-SOFGYWHQSA-N 259.305 2.193 10 20 CECD COC(=O)c1cnc(SCc2nccnc2C)s1 865369294 QHXAWITWEFBIMK-UHFFFAOYSA-N 281.362 2.320 10 20 CECD CC[C@@]1(O)CCCN(Cc2cc(F)cc(C(C)=O)c2O)C1 879310657 LFUIRTKCYUZDAC-MRXNPFEDSA-N 295.354 2.471 10 20 CECD Cc1ccc(CN[C@@H]2CCCC(F)(F)[C@H]2O)c(O)c1 877589701 JQNBEBZRZKWXAR-YPMHNXCESA-N 271.307 2.339 10 20 CECD Cc1cccc(O)c1CN1C[C@@H](C)O[C@@]2(CCOC2)C1 877492243 HSNKSEXXZBNMHX-CJNGLKHVSA-N 277.364 2.080 10 20 CECD COC(=O)c1ccc(CNCc2ccc(C)cc2O)o1 877526622 KYCXKTXCJGMAGN-UHFFFAOYSA-N 275.304 2.370 10 20 CECD C[C@H]1C[C@@H](NCCOCCN(C)C)c2c(O)ccc(F)c21 774375632 DETWSCQTBCWJOE-WCQYABFASA-N 296.386 2.247 10 20 CECD Cc1cccc(O)c1CNC[C@@](C)(O)c1ccco1 877071630 AXHJYDFWUINTSM-OAHLLOKOSA-N 261.321 2.291 10 20 CECD CC(C)(C)n1cc(CNCc2ccc3c(c2)CCO3)nn1 790954916 CIPKZCSNFQETRL-UHFFFAOYSA-N 286.379 2.258 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1ccc(Br)cc1O 701015872 SCZRKDKGCQIXEU-RKDXNWHRSA-N 288.185 2.404 10 20 CECD COc1ccc(O)c([C@H](C)NCCC(C)(C)O)c1 271818698 NLLUBSFCRRTFNZ-JTQLQIEISA-N 253.342 2.212 10 20 CECD OC[C@@H]1CSCCN1Cc1ccc(N2CCCC2)cc1 1336753909 BBDUZNNUQWRSRW-MRXNPFEDSA-N 292.448 2.197 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCCCCN1)c1ccccc1O 1336994181 WMNRRWODXWKJIF-OLZOCXBDSA-N 291.395 2.285 10 20 CECD CSCCCN(C)c1nnc(-c2sccc2O)n1C 1262854847 YAPZTPRVBWPMPH-UHFFFAOYSA-N 298.437 2.439 10 20 CECD CCN(CC)c1ccc(CN=c2nc[nH]n2CC)cc1 1347796718 FLYBLZFTBAQXPU-UHFFFAOYSA-N 273.384 2.178 10 20 CECD CC(C)[C@@H](N[C@H](C)c1cc(F)cc(F)c1O)C(=O)O 1609942969 AEDKFOMEBIDXPI-RDDDGLTNSA-N 273.279 2.430 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C(=O)O)[C@H]2C)cc1C 1610475663 HXOWKLBLBGJSLA-DGCLKSJQSA-N 263.337 2.304 10 20 CECD CN(C)c1cc(F)c(CNC2CC(C)(C(=O)O)C2)cc1F 1777037751 CIXGJCDNFJKZJQ-UHFFFAOYSA-N 298.333 2.374 10 20 CECD CN(C)c1ccc(CN2CCSC[C@@H](C(=O)O)C2)cc1 901890386 IDTINYVLPNWNQD-ZDUSSCGKSA-N 294.420 2.002 10 20 CECD C[C@H](C(=O)NC(C)(C)C)N(C)Cc1ccc(N)cc1 35360570 FJZHZLACDPXHID-LLVKDONJSA-N 263.385 2.004 10 20 CECD C[C@H](N[C@H](CCO)C(F)(F)F)c1cc(F)ccc1O 886801140 IHXATXAAHRIXGV-WRWORJQWSA-N 281.249 2.495 10 20 CECD Oc1ccc(Cl)cc1CN1CCO[C@@H]([C@H]2CCCO2)C1 245724962 DRFJROCLRRZGKU-HUUCEWRRSA-N 297.782 2.425 10 20 CECD CO[C@@H](C)CC(=O)NCCCSc1nccs1 114375111 FNZNTBFYYWACKU-VIFPVBQESA-N 274.411 2.167 10 20 CECD CCO[C@H](C)C(=O)NCc1ccc(N2CCCC2)cc1 65514401 SSMGPHSWJLTGKE-CYBMUJFWSA-N 276.380 2.328 10 20 CECD CC[C@H](C)[C@@](C)(O)CNCc1cccc(OC)c1O 304044774 JKLPAYVSQKIDCC-NHYWBVRUSA-N 267.369 2.288 10 20 CECD Cc1csc(NC(=O)c2cccc(O)c2O)n1 126234717 OXHHCFQTUDYAKW-UHFFFAOYSA-N 250.279 2.115 10 20 CECD CCOC(=O)[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 179981392 IISKKMNJWMIFSX-LLVKDONJSA-N 281.327 2.306 10 20 CECD CCn1ccc(C(=O)NCc2cccc(O)c2O)c1C 1348048022 RQBRQRRLIIVMBD-UHFFFAOYSA-N 274.320 2.158 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2CCOC2)c1 37738140 FYEHUCFLVKLYDN-MNOVXSKESA-N 251.326 2.088 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)Cc1ccn(C)c1 121303840 LAGKHYIYMUSTFJ-UHFFFAOYSA-N 299.418 2.494 10 20 CECD COc1ccc(O)c(CN2CCC3(CC2)C[C@@H]3C(=O)O)c1 405316682 AVIHUWHCMSZEGW-CYBMUJFWSA-N 291.347 2.088 10 20 CECD C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@H](C)CO1 193104411 AMWKXVAJTABMIR-OLZOCXBDSA-N 291.395 2.071 10 20 CECD Oc1c(F)cccc1CN[C@@H]1CCCCC[C@H]1O 135656341 DIVCUGFHLFUZIP-CHWSQXEVSA-N 253.317 2.315 10 20 CECD C[C@]1(CNCc2ccc(N3CCOCC3)cc2)CCCO1 94798387 MKAXGPHYMOMBJE-QGZVFWFLSA-N 290.407 2.182 10 20 CECD Cc1c(CNC(=O)c2csnn2)n(C)c2ccccc12 352130353 YOEFVRZMDGNMGG-UHFFFAOYSA-N 286.360 2.268 10 20 CECD Cc1nc(CC(=O)NCc2ccccc2O)c(C)s1 268976655 PAKDSAMHRWYHDV-UHFFFAOYSA-N 276.361 2.324 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCC(C)C)c1O 278636890 HJGGYCCVNKDWTR-UHFFFAOYSA-N 254.286 2.055 10 20 CECD C[C@@H](Cn1ccnc1)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273363763 DNZCJGQNOGYLKJ-WDEREUQCSA-N 290.323 2.236 10 20 CECD CCNC(=O)[C@H](C)N[C@@H](C)c1cc(Cl)ccc1O 273407103 ORFPYTFZRLAYES-IUCAKERBSA-N 270.760 2.221 10 20 CECD CCNC(=O)C[C@H]1CCCCN1Cc1ccccc1O 285216169 RMQJKMISFOPILS-CQSZACIVSA-N 276.380 2.273 10 20 CECD Nc1ccc(NC(=O)[C@@H]2CCC[C@H](C(=O)O)C2)cc1 388880106 HENODYRPCRXEFD-ZJUUUORDSA-N 262.309 2.098 10 20 CECD CO[C@@](C)(C(=O)NCc1ccc(N(C)C)cc1C)C1CC1 812512061 QMWBMRZPMNOHEZ-QGZVFWFLSA-N 290.407 2.492 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CC(CC(F)F)C1 819731739 SCYBZPNMOBPBGF-RQOWECAXSA-N 283.274 2.225 10 20 CECD COC[C@]1(CO)CCN(Cc2cc(Cl)c(C)cc2O)C1 826096739 BEXRGHHAYUNINY-OAHLLOKOSA-N 299.798 2.185 10 20 CECD CC[C@@H](C)N1CCN(C(=O)c2cc(O)cs2)CC1 839786067 BENZDKIDVIBOCX-SNVBAGLBSA-N 268.382 2.010 10 20 CECD Fc1cc(CNCC(F)F)ccc1N1CCOCC1 839089995 COBIDGQAOBDCLE-UHFFFAOYSA-N 274.286 2.017 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1cc(C)n(C)n1 840897181 KUTRMJTWRXPZPT-UHFFFAOYSA-N 272.396 2.393 10 20 CECD Cc1cc(O)c([C@@H]2NC(=O)CN2CC(C)C)cc1Cl 849183704 VVMVBSSHWVGQKZ-CQSZACIVSA-N 282.771 2.440 10 20 CECD Cn1cncc1CCC(=O)NCc1cc(Cl)ccc1O 846474622 XJADGXWRMPQZMV-UHFFFAOYSA-N 293.754 2.028 10 20 CECD CN[C@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 843344612 NQMQWXHPXANEMQ-LBPRGKRZSA-N 282.771 2.042 10 20 CECD COC[C@H](CCO)N[C@H](C)c1ccc(Cl)cc1O 841756234 WGLNTGOCVXSTQT-KOLCDFICSA-N 273.760 2.094 10 20 CECD CC[C@](C)(O)CNCc1cc(F)c(N(C)C)cc1F 858131353 SDHFBMUXQXDAES-AWEZNQCLSA-N 272.339 2.281 10 20 CECD COc1ccc(N(C)CCN(C)c2ccc(C)nn2)cc1 853711490 DUSJSAXORWTPMO-UHFFFAOYSA-N 286.379 2.366 10 20 CECD CC(C)NC(=O)CCN[C@@H](C)c1cc(F)cc(F)c1O 756396431 NFLIQCNOFDQZML-VIFPVBQESA-N 286.322 2.236 10 20 CECD CCN(C)c1ccc(CN(C)Cc2nnc(C)o2)cc1 852471211 GOWSGZFJMPBWIU-UHFFFAOYSA-N 274.368 2.466 10 20 CECD CN(C)c1ccc(CNc2ncnc3nccnc23)cc1 752629788 HXQBUZCZPUGWDT-UHFFFAOYSA-N 280.335 2.098 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCCCO1)c1ccccc1O 868360828 ZTRLSQHZRIBPLW-NEPJUHHUSA-N 278.352 2.322 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCCS1 935948595 PMBCLGDAXNNMDV-LLVKDONJSA-N 286.393 2.390 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(C(=O)CC)CC1 935946164 ZMDSTOVTFACKMR-UHFFFAOYSA-N 296.363 2.253 10 20 CECD CCOc1ccc(CN2CC[S@](=O)[C@H](C)[C@H]2C)c(O)c1 769465537 HCWIHTXLNDEAIQ-HTGLOVNISA-N 297.420 2.132 10 20 CECD Cc1cccc(O)c1CNCCC(=O)NCc1ccccc1 876991749 UALHAPVRGRHGTJ-UHFFFAOYSA-N 298.386 2.497 10 20 CECD COC(=O)CN(Cc1ccc(C)cc1O)C(C)C 876605011 HDENNFKLXPNDHS-UHFFFAOYSA-N 251.326 2.084 10 20 CECD CCn1cc(CN(C)Cc2cc(OC)ccc2O)cn1 775699470 DXQWPVIPJMICGQ-UHFFFAOYSA-N 275.352 2.249 10 20 CECD COc1ccc(N2CCC(Nc3nnc(C)o3)CC2)cc1 779708822 YMZGFFZDXIMLTL-UHFFFAOYSA-N 288.351 2.468 10 20 CECD Cc1cc(Cn2cc(-c3ccnn3C)nn2)ccc1N(C)C 881378204 ILZFTAXWJJSJMT-UHFFFAOYSA-N 296.378 2.101 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)NCCc2ccc(N)cc2)C1 884028607 LOQFIPRNRODDAE-IAQYHMDHSA-N 298.390 2.017 10 20 CECD CC(=O)[C@@H]1C[C@H](C(=O)NCc2ccccc2O)C1(C)C 780930030 APVARCGWYBHUQS-QWHCGFSZSA-N 275.348 2.260 10 20 CECD CO[C@H]1CN(Cc2ccc(N3CCCCC3)cc2)CCO1 895969576 NZDZYJNGWCNPDK-QGZVFWFLSA-N 290.407 2.482 10 20 CECD CC1(CNCc2ccc(Br)cc2O)COC1 701061740 ZCBVXHIBWXXLBB-UHFFFAOYSA-N 286.169 2.281 10 20 CECD CC[C@H](C)CC(=O)NCCc1ccc(O)c(O)c1 189544790 YVNBYDKUSURHOE-JTQLQIEISA-N 251.326 2.193 10 20 CECD Cc1noc(C)c1CCC(=O)NCc1ccccc1O 706303219 OCZXWPNMBSCRTF-UHFFFAOYSA-N 274.320 2.246 10 20 CECD COc1ccc(CNCC2(C)CC2)c(O)c1OC 1333693715 NFVGWCBUDYEIET-UHFFFAOYSA-N 251.326 2.299 10 20 CECD CSC[C@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 1262163681 BUJBRXSWTCQSBH-QMMMGPOBSA-N 293.747 2.091 10 20 CECD CN(C(=O)c1cccnc1-n1cccn1)c1ccc(N)cc1 1578391612 FALYQULKBZSFAX-UHFFFAOYSA-N 293.330 2.126 10 20 CECD CC[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 1595281507 POLUIEBGNXAGSU-GWCFXTLKSA-N 250.342 2.266 10 20 CECD CCOc1cccc(CN(C2CC2)[C@H](C)C(=O)O)c1O 1592862996 MRVGQXBJBADZSS-SNVBAGLBSA-N 279.336 2.228 10 20 CECD CC(C)[C@@](C)(O)CN[C@H](C)c1cc(C(=O)O)ccc1O 1593239053 AKDAPIVIEGWYIC-BMIGLBTASA-N 281.352 2.148 10 20 CECD CC[C@H](N[C@H]1CC12CC2)c1cccc(-c2nn[nH]n2)c1O 1590467770 TZPWMCIHWUBLFE-RYUDHWBXSA-N 285.351 2.166 10 20 CECD CCN(C)c1ccc(CN2C[C@@H](C)[C@H](C(=O)O)C2)cc1 1596194934 YKMKEYPXMWTNEC-IUODEOHRSA-N 276.380 2.295 10 20 CECD COCC1CCN(Cc2cc(OC)c(OC)cc2O)CC1 160187183 ITYOZZZDYNDBAJ-UHFFFAOYSA-N 295.379 2.268 10 20 CECD CCc1ocnc1C(=O)N[C@H](C)c1ccccc1O 827937244 PPDCXJQCYWBWPW-SECBINFHSA-N 260.293 2.434 10 20 CECD Cc1cccc(O)c1CN[C@@H](C)c1nnc2n1CCC2 877165758 LQVQEOBUNMYWHZ-NSHDSACASA-N 272.352 2.089 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2ccccc2O)CC1 37138457 NOIQPXYOKXAHRW-LLVKDONJSA-N 262.353 2.054 10 20 CECD COc1cccc(CNCCc2cccc(C)n2)c1O 280305648 BOHXLSWOIIAZBQ-UHFFFAOYSA-N 272.348 2.437 10 20 CECD O=C(O)[C@@H]1CCCCN1Cc1cc(F)cc(F)c1O 708215124 HSAOCTSJIJEYMV-NSHDSACASA-N 271.263 2.110 10 20 CECD CS(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 3076788 JAXKPWSBJCIWDY-UHFFFAOYSA-N 256.110 2.071 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCCC2)cc1F 58515018 HYNUUOYBYNMYRZ-UHFFFAOYSA-N 265.332 2.197 10 20 CECD C[C@@H](N[C@H](C)c1ccccc1O)C(=O)NCc1ccco1 1262018068 VFGOABNRQIVWAX-VXGBXAGGSA-N 288.347 2.341 10 20 CECD CC[C@H](NC(=O)N(C)Cc1ccccc1O)[C@H]1CCCO1 128717047 ZIHIEQOQVSJYPP-DZGCQCFKSA-N 292.379 2.491 10 20 CECD Cc1cccc(CN2CCC(CN(C)C)CC2)c1O 124532545 VVHUDMYVCCJIFK-UHFFFAOYSA-N 262.397 2.474 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cc(Cl)ccc2O)C1 93813697 UEGBENAQPXNLES-AWEZNQCLSA-N 283.755 2.431 10 20 CECD CN(CCC(N)=O)Cc1cc(Cl)cc(Cl)c1O 289236753 DJBCRMHBPNHQFE-UHFFFAOYSA-N 277.151 2.006 10 20 CECD Cc1cc(C(=O)NC[C@H](C)CO)c(C)n1-c1ccccc1 268924792 WYKVSLDONNKEHX-LBPRGKRZSA-N 286.375 2.452 10 20 CECD C[C@@H](NC[C@@H]1COCCN1)c1ccc2ccccc2c1O 530221801 DJTSRTULJGBMSG-TZMCWYRMSA-N 286.375 2.184 10 20 CECD CO[C@@H](C)CCNCc1ccc(N(C)C)c(F)c1 264948788 JUKBUXOQIZPPRL-NSHDSACASA-N 254.349 2.406 10 20 CECD CCn1cc[nH]c(=NCc2c(C)c3ccccc3n2C)c1=O 359827344 CCAPGJVIACQVMD-UHFFFAOYSA-N 296.374 2.097 10 20 CECD COCC(C)(C)CNCc1cc([N+](=O)[O-])ccc1O 276921466 KXJRZIRIJDVABY-UHFFFAOYSA-N 268.313 2.063 10 20 CECD CC[C@H](NCc1cc(OC)c(OC)cc1O)C(C)(C)O 293731406 UWGRYJPWUFKTQL-AWEZNQCLSA-N 283.368 2.049 10 20 CECD COC[C@@H](CCO)N[C@H](C)c1c(C)cc(C)cc1O 293653565 ISOPEZIACHNJDO-CHWSQXEVSA-N 267.369 2.057 10 20 CECD COc1cc(O)c(CN[C@@H](C)CC(C)(C)O)cc1OC 294923287 BBJDPFWFMVWRQH-JTQLQIEISA-N 283.368 2.049 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 298792278 ZAMRMPLSTLFVHA-JKSUJKDBSA-N 288.391 2.328 10 20 CECD Oc1c(F)cc(Br)cc1CN1CCOCC1 715702610 MEROGVAZKAOTGB-UHFFFAOYSA-N 290.132 2.126 10 20 CECD Cc1cc(CN[C@H](CO)C(C)C)ccc1N(C)C 815085816 DFKCUHOBELJERY-CQSZACIVSA-N 250.386 2.168 10 20 CECD Cn1cnnc1CNCc1cc(-c2ccccc2)ccc1O 725847133 DTCXXUBNBAPHBK-UHFFFAOYSA-N 294.358 2.478 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCN[C@@H]2C)cc1 827341002 OXNQCOYIZFFXRP-CZUORRHYSA-N 289.423 2.147 10 20 CECD CC(=O)N1CCN(Cc2cc(Cl)c(C)cc2O)[C@@H](C)C1 824831669 WJHGNJQSRQKGQX-NSHDSACASA-N 296.798 2.407 10 20 CECD COc1cc(O)c(CN[C@H](C)C2CC2)cc1OC 824683650 TUCJAXINFUHNCW-SECBINFHSA-N 251.326 2.298 10 20 CECD CCC(C)(C)OCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 837519685 CQYHNQHDFDHWMF-LLVKDONJSA-N 295.379 2.350 10 20 CECD Cc1ccc(O)c(CN[C@@H]2Cc3ccccc3[C@H]2N)c1 904462588 XAMARYXLIIDORX-NVXWUHKLSA-N 268.360 2.415 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@@H]2C(=O)O)cc1F 901485737 SFQOGXBMUNDDTM-WCQYABFASA-N 280.343 2.235 10 20 CECD CCCC[C@@H](CN)NCc1ccc(OCC)cc1O 841028374 CJRQXIAWJKNRRW-ZDUSSCGKSA-N 266.385 2.398 10 20 CECD CCCCOCCOCCNC(=O)c1cc(O)cs1 743801018 RMKJHFSHAWQZEI-UHFFFAOYSA-N 287.381 2.017 10 20 CECD CCC1(CNC(=O)NCc2cc(Cl)ccc2O)COC1 845240207 SXYQCRMTORAGPB-UHFFFAOYSA-N 298.770 2.271 10 20 CECD C[C@@H](NCCCN1CCOCC1)c1ccc(Cl)cc1O 841744757 SQTRHKHKYKAFNP-GFCCVEGCSA-N 298.814 2.419 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cc2nncn2c(C)n1 840264098 PBEWVYLKJSYOBB-UHFFFAOYSA-N 296.378 2.419 10 20 CECD Cc1cc(N(C)C)ccc1CNCCSCCCO 840932544 RWENCRSXAIYYFA-UHFFFAOYSA-N 282.453 2.266 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2cccc(CC)c2O)C1 848903156 NONVRGRCDABQDB-CQSZACIVSA-N 292.379 2.275 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCC(=O)C1 843757734 DPWIVUFLDNQVBJ-CYBMUJFWSA-N 274.364 2.080 10 20 CECD CC(C)C1(C(=O)NCc2ccc(N(C)C)cc2)COC1 929402671 CTTJVQQQVOJXAO-UHFFFAOYSA-N 276.380 2.041 10 20 CECD CCc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)n[nH]1 756572118 IYBOEXSTJQWRQZ-VIFPVBQESA-N 290.323 2.437 10 20 CECD CN(C)c1cc(F)c(CNC[C@H](O)C2CCC2)cc1F 858174530 TUTYTVGQBKQFOE-HNNXBMFYSA-N 284.350 2.281 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@](C)(CC)OC 935945921 PSVHNAUSZZCFTG-HNNXBMFYSA-N 286.368 2.309 10 20 CECD CN(Cc1cc2c(cc1O)CCCC2)[C@@H]1CCOC1 768450111 HWYQOKFCECHZGV-OAHLLOKOSA-N 261.365 2.492 10 20 CECD Cc1cccc([C@@H](O)CNC(=O)c2cc(O)cs2)c1 768310671 LPCUKHAEYLZFQZ-LBPRGKRZSA-N 277.345 2.226 10 20 CECD C[C@H]1COCCN1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773621782 PLYATYYSXNQOTL-QWHCGFSZSA-N 291.395 2.244 10 20 CECD C[C@H](O)[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1116511793 BMMANIVACGVAGE-HOCLYGCPSA-N 274.408 2.490 10 20 CECD CCCn1cc(C(=O)N(C)c2ccc(N)cc2)cn1 877076945 XSDQCBJIWRPDBR-UHFFFAOYSA-N 258.325 2.152 10 20 CECD C[C@H]1CN(C)[C@H](C)CN1Cc1ccc(N(C)C)cc1 775986253 QOUNBRDGGGNPSG-KGLIPLIRSA-N 261.413 2.277 10 20 CECD CCOC(=O)c1cnc(Sc2nccs2)cn1 777732441 MSUQTOKREGMBNP-UHFFFAOYSA-N 267.335 2.261 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H]2CCO)cc1 773848989 RCDLVPUWRYFOIU-MRXNPFEDSA-N 262.397 2.490 10 20 CECD CCN(C)c1ccc(CN2CC[S@](=O)C[C@H](C)C2)cc1 773889520 WNXFRKSTYPLHRQ-VLIAUNLRSA-N 294.464 2.343 10 20 CECD Oc1ccc(F)cc1CN1CCC(O[C@H]2CCOC2)CC1 779026842 ZLAFLZUOCKVFAM-HNNXBMFYSA-N 295.354 2.301 10 20 CECD C[C@H](Cc1ccco1)NC(=O)/C=C/c1ccc(O)c(O)c1 779502363 YPRRPDFEFIBGMW-OKPNEXGHSA-N 287.315 2.451 10 20 CECD COc1cccc(O)c1CN[C@H](CO)Cc1ccccc1 782544699 PELOPESCIIYASX-AWEZNQCLSA-N 287.359 2.094 10 20 CECD COc1cc(C)cc(CN[C@H](C)[C@@H](C)OC)c1O 894796307 ZSVRAGJLHUOGCA-GHMZBOCLSA-N 253.342 2.222 10 20 CECD CC[C@@H](C)[C@@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423487 XNSPQZBEFGHCGO-BXUZGUMPSA-N 264.369 2.342 10 20 CECD CC[C@@H](NCCOCCN(C)C)c1ccc(F)cc1O 796962298 TZSMDGNLTFXBTR-CQSZACIVSA-N 284.375 2.150 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@](C)(O)C(C)C)c1 185433865 FUOUVSUCZGVEPM-XHDPSFHLSA-N 267.369 2.458 10 20 CECD OCCN(Cc1c(O)ccc(Cl)c1F)CC1CC1 792167553 WBOCBKBJSFUSRA-UHFFFAOYSA-N 273.735 2.389 10 20 CECD Cn1cc(C[C@@H]2CCN(Cc3ccc(N)cc3)C2)cn1 1336284903 DNWWVJLFWPBZLO-AWEZNQCLSA-N 270.380 2.067 10 20 CECD C[C@H]1CCC[C@@H](OCC(=O)NCc2cccc(O)c2O)C1 1521851625 NTDONHXUNSYHEC-WCQYABFASA-N 293.363 2.309 10 20 CECD COc1ccc(CN[C@](C)(C(=O)O)C2CC2)cc1C 1607258203 CPLCTSNPFFGFPI-HNNXBMFYSA-N 263.337 2.347 10 20 CECD C[C@H](NCCC(=O)NC(C)(C)C)c1ccc(F)cc1O 228337756 XXYBJEQHKRLEQA-JTQLQIEISA-N 282.359 2.487 10 20 CECD CCC[C@@H](O)CCN[C@H](C)c1cc(C(=O)O)ccc1O 1595607522 LPEYXKRXACFNTJ-ZYHUDNBSSA-N 281.352 2.292 10 20 CECD CCN(C)c1ccc(CN[C@H](C)C(=O)O)c(C)c1 1776856607 MTYYLQYUYVCSDQ-LLVKDONJSA-N 250.342 2.014 10 20 CECD CCN1CCc2cc(CN[C@H](C(=O)O)[C@@H]3C[C@@H]3C)ccc21 1776884723 NCBHKPJNJZOTLV-PEYYIBSZSA-N 288.391 2.268 10 20 CECD NC(=O)CC1CCN(Cc2cc(Cl)ccc2O)CC1 159768335 KQJZHIOJEOKKKK-UHFFFAOYSA-N 282.771 2.133 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1ccc(N(C)C)cc1 37997051 PHWWZUNIASMDIN-CYBMUJFWSA-N 277.412 2.147 10 20 CECD C[C@@H]1C[C@@H](CNCc2cc3c(cc2O)OCO3)[C@@H](C)O1 686514810 KGCPZTNYTHZTFE-MXWKQRLJSA-N 279.336 2.024 10 20 CECD COc1cc(Cl)cc(CN2CCN[C@H](C)[C@@H]2C)c1O 379436604 NIWQTQJGRBGFBX-ZJUUUORDSA-N 284.787 2.236 10 20 CECD CCO[C@@H](C)C(=O)NCc1ccc(N2CCCC2)cc1 66484522 SSMGPHSWJLTGKE-ZDUSSCGKSA-N 276.380 2.328 10 20 CECD C[C@H]1CSCCN1Cc1ccc(N2CCOCC2)cc1 179663266 RSAHLVXYDFOGSD-AWEZNQCLSA-N 292.448 2.461 10 20 CECD Cn1cc(CNCc2c(O)cccc2Cl)cn1 83552140 NNULZRUCVHLXIY-UHFFFAOYSA-N 251.717 2.069 10 20 CECD Cc1cccc(CN2CCC[C@H]2c2ncon2)c1O 362045257 LOUCYLGMSALRCB-LBPRGKRZSA-N 259.309 2.421 10 20 CECD CCNC(=O)C1(CN[C@H](C)c2ccccc2O)CCC1 277382261 XSMHOHADKGLQCN-GFCCVEGCSA-N 276.380 2.349 10 20 CECD Cn1cc2c(n1)CCC[C@@H]2NCc1cccc(F)c1O 283183511 ZWWQBRBJJXHGQI-ZDUSSCGKSA-N 275.327 2.432 10 20 CECD Cc1cc(C)c([C@@H](C)NCC(=O)NCC(F)F)c(O)c1 285418674 YCDORDXBTHSEAE-SNVBAGLBSA-N 286.322 2.041 10 20 CECD CC[C@@H](N[C@@H](CO)c1cnn(C)c1)c1ccc(C)cc1O 280245548 WGHBTXGVDRNHLL-CABCVRRESA-N 289.379 2.208 10 20 CECD COCC1(NC(=O)NCc2ccc(N(C)C)cc2)CCC1 285309439 SDAGWDJNQSFTKF-UHFFFAOYSA-N 291.395 2.121 10 20 CECD CCOC1(C(=O)NCc2cccc(OC)c2O)CCCC1 286781280 ORYZRUPWASEYGT-UHFFFAOYSA-N 293.363 2.366 10 20 CECD COc1ccc(O)c(CN[C@H](C2CC2)C(C)(C)CO)c1 290986793 UQSJAAGHSHVJSR-OAHLLOKOSA-N 279.380 2.288 10 20 CECD C[C@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc(O)cs1 807776952 JILBXJLCAOGLTH-CMPLNLGQSA-N 280.393 2.153 10 20 CECD COC[C@]1(CN[C@H](C)c2ccc(N(C)C)cc2)CCCN1 817974208 JKIWGHGFFOIEOQ-RHSMWYFYSA-N 291.439 2.172 10 20 CECD COCC1(COC(=O)c2cc(O)cs2)CCC1 812585578 RKFZCHXUMHZLHJ-UHFFFAOYSA-N 256.323 2.427 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(C)CCNCC2)c1 817964786 IOWPVLHGTBVKTE-GFCCVEGCSA-N 278.396 2.441 10 20 CECD COC[C@@H](C)NC[C@H]1CCN(c2ccc(OC)cc2)C1 818116075 GGDODXCIWWKDJX-ZIAGYGMSSA-N 278.396 2.146 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H](C)C[C@H](C)N)C2)cc1 818616590 YNCQGKNJBATKKH-SOUVJXGZSA-N 291.439 2.237 10 20 CECD CO[C@@H]1CCC[C@@H](NC[C@H](N)c2ccc(N(C)C)cc2)C1 817943275 TWELOXKFWTWTJZ-OIISXLGYSA-N 291.439 2.300 10 20 CECD C[C@@H](NC(=O)CCC(C)(C)[N+](=O)[O-])c1ccccc1O 827952167 IKYWWNHEBJUZRL-SNVBAGLBSA-N 280.324 2.405 10 20 CECD COCCNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 727642343 JBZXNZPZYYUEPF-UHFFFAOYSA-N 293.367 2.321 10 20 CECD OC[C@H](C1CC1)[C@@H](NCc1cc(F)ccc1O)C1CC1 824846438 SCGIWWTUMNMUOO-ZBFHGGJFSA-N 279.355 2.418 10 20 CECD CS(C)(=O)=Nc1ccc(NC(=O)C2=S=CC=C2)cc1 820359565 XXHOVLWIPATRPO-UHFFFAOYSA-N 294.401 2.262 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cscn2)c1 728979463 VGFSVAMGIWCVEG-MRVPVSSYSA-N 278.333 2.348 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1 824837068 DJEJGNLAOXZXHM-MWDXBVQZSA-N 270.376 2.138 10 20 CECD Cc1cc(NCc2ccc(N(C)C)cc2)c(=O)n(C)c1 902258396 VASBFMUMZBYSHC-UHFFFAOYSA-N 271.364 2.372 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ccc(C(=O)O)nn1 738402463 UZHKABJRRYAUFJ-UHFFFAOYSA-N 286.335 2.161 10 20 CECD CCn1nnc(C)c1/C=C1/C(=O)N(C)c2ccc(C)cc21 834441603 OLFRCPWPLTUXNE-UKTHLTGXSA-N 282.347 2.432 10 20 CECD CC1CCC(N(C)C(=O)C(=O)Nc2ccc(N)cc2)CC1 841010061 XPKNOYSKORVLMU-UHFFFAOYSA-N 289.379 2.244 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)NCCc1ccc(N)cc1 841916054 WVORSGBLYROVKD-HUUCEWRRSA-N 291.395 2.068 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](C)N[C@@H](C)C1 843048999 CTZRWDODUUJBFC-KBPBESRZSA-N 261.413 2.243 10 20 CECD C[C@H]1C[C@H](NCc2cc(Cl)ccc2O)CCN1 841061853 OARFNGNAQRTRJH-JOYOIKCWSA-N 254.761 2.276 10 20 CECD C[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)CO1 842773543 ADBQDIBPCZIKAP-YUMQZZPRSA-N 259.708 2.452 10 20 CECD CN(C)CCN(C(=O)/C=C\c1cnn(C)c1)c1ccccc1 746278653 PCUGKKHMUXMSDG-KTKRTIGZSA-N 298.390 2.028 10 20 CECD CCc1cccc(CN2CC[C@H](C)C[C@@H]2C(N)=O)c1O 848904264 OSBXTBHFYIUPQA-SMDDNHRTSA-N 276.380 2.040 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 858588232 XNBBJGTUWVJCSB-KKZNHRDASA-N 296.342 2.078 10 20 CECD COc1ccc(N(C)Cc2cnc(C)nc2)c(OC)c1 752113992 SOYAZLDADDPJMY-UHFFFAOYSA-N 273.336 2.439 10 20 CECD CCOc1cc(NCCc2ccc(O)c(O)c2)nc(C)n1 853408920 BPIGKQWXCWIOAN-UHFFFAOYSA-N 289.335 2.250 10 20 CECD CCC(=O)N1CC[C@@H](NCc2ccc3c(c2)CCCO3)C1 921848436 MLZUPUQYMYRVFJ-OAHLLOKOSA-N 288.391 2.112 10 20 CECD CC(C)(C)c1nnc(COC(=O)c2cccc(O)c2O)o1 758560422 KSQWEZHUOUVCPD-UHFFFAOYSA-N 292.291 2.135 10 20 CECD Cc1cccc(O)c1CNCc1ccccc1CO 876967227 DLGQQCROEHQCSM-UHFFFAOYSA-N 257.333 2.483 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](OC)C(C)C)c1 771416033 CEQSXDHCUOUVOJ-HZMBPMFUSA-N 281.352 2.249 10 20 CECD CCOc1ccc(CN(C)C[C@H]2CCC[C@H]2O)c(O)c1 770291259 FRMVLVNITDECOV-IUODEOHRSA-N 279.380 2.384 10 20 CECD COc1cccc(CN2CC[C@H](C)C[C@@H]2[C@@H](C)O)c1O 785988843 PLKQVJOIMRGUDQ-OUCADQQQSA-N 279.380 2.382 10 20 CECD C[C@]1(CO)CCCN1Cc1cccc(Cl)c1O 789558305 WEUSHSXRUIHFDF-CYBMUJFWSA-N 255.745 2.392 10 20 CECD Cc1cnc(C(=O)NCc2ccc(O)c(O)c2)c(C)c1 780983528 DWPZVOVYMQGEFO-UHFFFAOYSA-N 272.304 2.040 10 20 CECD CCO[C@H]1C[C@H](O)C12CCN(Cc1ccc(N)cc1)CC2 1120370802 FTOLZAXHNBPLGE-HOTGVXAUSA-N 290.407 2.021 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)[C@@H]([C@@H](C)O)C1 785987789 IMVHDZDISARFTL-NQBHXWOUSA-N 293.363 2.102 10 20 CECD COc1cc(C)cc(CNCc2cccc(CO)c2)c1O 894237790 IGMRYKRBBNLIIQ-UHFFFAOYSA-N 287.359 2.491 10 20 CECD CCn1cnc2c1CCN(Cc1cc(F)cc(F)c1O)C2 897333994 ZOHLYBPSBIWXKA-UHFFFAOYSA-N 293.317 2.445 10 20 CECD O=C(COC(=O)c1cc(O)cs1)Cc1ccccc1 785316226 MBHGTMOWYKYTDT-UHFFFAOYSA-N 276.313 2.422 10 20 CECD Cc1nnc([C@@H](C)OC(=O)c2ccc(C)c(O)c2O)s1 783344270 KYEFTLHTAIFGPP-SSDOTTSWSA-N 294.332 2.484 10 20 CECD CCCn1ccc(CNC(=O)c2cccc(O)c2O)c1 897540359 QAQQDDUKKANEEV-UHFFFAOYSA-N 274.320 2.239 10 20 CECD COc1cccnc1CNCc1cc(C)cc(OC)c1O 894938524 BQSRGIKQTMVGCJ-UHFFFAOYSA-N 288.347 2.403 10 20 CECD CC[C@@H](CCO)CNCc1cc(C)cc(OC)c1O 894351731 GGROGUINHCPVJE-LBPRGKRZSA-N 267.369 2.207 10 20 CECD COc1ccc(CN[C@H](C)CN(C)C(C)C)c(O)c1OC 894549922 TZGQHMYFXDDGLF-GFCCVEGCSA-N 296.411 2.228 10 20 CECD CS[C@H](CO)[C@@H](C)NCc1cc(Cl)ccc1O 219079298 PXKDMIKATLSBNK-PRHODGIISA-N 275.801 2.248 10 20 CECD C[S@](=O)C1(CNCc2cc(F)cc(F)c2O)CCC1 708393992 NFJDNLOSHDAWHO-IBGZPJMESA-N 289.347 2.061 10 20 CECD C[C@@H]1COCCCN1Cc1cc(F)cc(F)c1O 708424114 WVAHQJXSAAFHHP-SECBINFHSA-N 257.280 2.281 10 20 CECD C[C@H]1C[C@@H](C)CN(S(=O)(=O)Nc2ccc(O)cc2)C1 776743889 BFSYOGAPDDRUEU-PHIMTYICSA-N 284.381 2.027 10 20 CECD C[C@H](CCC(=O)O)CNCc1ccc2c(c1)CCO2 1326324160 UJFFPBDIYIWJNI-LLVKDONJSA-N 263.337 2.212 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2cc(C)cc(OC)c2O)C1 1334317692 DUFRCCFRJLJATA-YPMHNXCESA-N 293.363 2.141 10 20 CECD Nc1ccc(CN2CCC([C@@H](O)C(F)(F)F)CC2)cc1 1336284937 DZSDFYYWDDIZHB-CYBMUJFWSA-N 288.313 2.404 10 20 CECD CO[C@H]1CCN(Cc2cc(Cl)ccc2O)[C@@H](C(=O)O)C1 1610238128 TZVRKBJJFBBDQZ-NWDGAFQWSA-N 299.754 2.110 10 20 CECD Cc1ccn2ncnc2c1NC(=O)N(C)c1ccc(N)cc1 1579810624 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65841600 LIUNPPWBXPFFBD-CQSZACIVSA-N 264.369 2.136 10 20 CECD COc1ccc(N(CCO)Cc2ccco2)cc1F 177796095 WUBQIMJIMDUGRN-UHFFFAOYSA-N 265.284 2.426 10 20 CECD C[C@H]1CN(Cc2cc(Br)ccc2O)[C@H](C)CN1 300438271 UPOAQIGUTSYDOS-VHSXEESVSA-N 299.212 2.337 10 20 CECD C[C@@H](CCc1cccn1C)NC(=O)c1cccc(O)c1O 187138686 FAYSRYQJTHMXKK-NSHDSACASA-N 288.347 2.187 10 20 CECD COc1cccc(CN(C)Cc2ncc(Cl)n2C)c1O 181148846 GPNPOKNJSUQTKA-UHFFFAOYSA-N 295.770 2.420 10 20 CECD C[C@@](O)(CNCc1cc(F)ccc1O)c1ccco1 180823048 ZZEGWMRDDXKXJN-CQSZACIVSA-N 265.284 2.122 10 20 CECD CC[C@H](C)N(CC(=O)O)Cc1cc(F)cc(C(C)=O)c1O 236963201 GSIGYUVRMOWUKP-VIFPVBQESA-N 297.326 2.419 10 20 CECD CCC[C@@](C)(O)CNC(=O)NCc1ccc(N(C)C)cc1 264846480 KCWDJGPXKQHSCZ-MRXNPFEDSA-N 293.411 2.103 10 20 CECD CCN(Cc1ncnn1CC)c1ccc(OC)cc1 278558683 VGWXLWHUBCNUFP-UHFFFAOYSA-N 260.341 2.333 10 20 CECD COC(=O)C1(CNCc2c(O)cccc2Cl)CC1 275276511 MJGLWTJXEPCHRU-UHFFFAOYSA-N 269.728 2.088 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(F)F 284237351 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CO[C@@H]1COCC[C@H]1CN[C@@H](C)c1ccc(N(C)C)cc1 834881017 JONYWMNGCZLFMP-JLJPHGGASA-N 292.423 2.455 10 20 CECD Cc1c[nH]cc1C(=O)NCc1ccc(N(C)C)c(F)c1 746866389 KYNAFCQNHTYCDV-UHFFFAOYSA-N 275.327 2.458 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC1CCOCC1 844900113 JRMJRCZZAMNZSU-UHFFFAOYSA-N 284.743 2.024 10 20 CECD Cc1cc(O)c(CN(C)C2CC(N)C2)c(Cl)c1 843124590 CVFCAEHKCBBKEQ-UHFFFAOYSA-N 254.761 2.276 10 20 CECD Cc1cc(N(C)C)ccc1CNCCC[C@@H](C)O 840940606 HUONDMQGFVZJPV-CYBMUJFWSA-N 250.386 2.312 10 20 CECD CCOc1ccc(O)c(CNCCCCCCN)c1 843126827 JMEKPWXJKCLWRH-UHFFFAOYSA-N 266.385 2.400 10 20 CECD CCc1cccc(CN(C)Cc2cnn(C)c2)c1O 848880008 LARNWDAGHQYENA-UHFFFAOYSA-N 259.353 2.320 10 20 CECD CCOCc1cc(CNC(C)(C)C(=O)O)ccc1OC 841800551 GSKUTZIIPHFVLY-UHFFFAOYSA-N 281.352 2.185 10 20 CECD COc1cccc(CNC(=O)Nc2cc(C)ns2)c1O 749113376 GCCVDFGIWRMVIK-UHFFFAOYSA-N 293.348 2.487 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1OCCc2ccccc21 750425002 XFNMNRCYIFUXTB-MRXNPFEDSA-N 283.327 2.322 10 20 CECD CN(C)c1ccc(CNC[C@@H](O)c2ccccn2)cc1F 853099541 XCKWNMUSYFFZDP-MRXNPFEDSA-N 289.354 2.110 10 20 CECD C[C@@]1(CNC(=O)c2cc(O)cs2)CCO[C@H]1C1CC1 768737518 QTOHSJDQSMVROJ-JSGCOSHPSA-N 281.377 2.389 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(C)cc2O)[C@@H]1C 877466972 UTBPCVCZWGPUJW-YPMHNXCESA-N 263.337 2.084 10 20 CECD CCn1nccc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773286372 WYLHARVGENXYOX-LBPRGKRZSA-N 286.379 2.460 10 20 CECD CC(C)[C@H](N[C@H](C)c1ccc(F)cc1O)C(=O)O 62748315 MYFNFACYXWIMPA-PELKAZGASA-N 255.289 2.291 10 20 CECD CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccc(N)cc1)CC2 1120370804 FTOLZAXHNBPLGE-JKSUJKDBSA-N 290.407 2.021 10 20 CECD CCCN(Cc1ccccc1O)C[C@H](O)COCC 76074344 TXXHTBMHLSSVMC-AWEZNQCLSA-N 267.369 2.002 10 20 CECD Oc1c(F)cc(F)cc1CN1CC(OC(F)F)C1 894978336 FRZFGWCKVALXNX-UHFFFAOYSA-N 265.206 2.094 10 20 CECD CC[C@H](C)CC[C@H](O)CC(=O)NCc1ccc(O)c(O)c1 793689055 IWZZZSHSIWIUEL-AAEUAGOBSA-N 295.379 2.291 10 20 CECD CCOC(=O)C1(CNC(=O)c2cc(O)cs2)CCCC1 792516267 INHKOOUIPLIJMT-UHFFFAOYSA-N 297.376 2.307 10 20 CECD CN(C)CCCNCc1ccc(Br)cc1O 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VDUXSSSDDWVTPZ-AOOOYVTPSA-N 264.325 2.006 10 20 CECD COc1ccc([C@H]2NC(=O)CN2Cc2ccccc2)c(O)c1 112369181 PEFRPFKSJZOCOH-KRWDZBQOSA-N 298.342 2.031 10 20 CECD CN(C)c1ccc(CNc2ncnc3[nH]ncc23)cc1F 69714270 TYOXTGLKTPTVOY-UHFFFAOYSA-N 286.314 2.170 10 20 CECD COc1cccc(CNC(=O)CC[C@@H]2CC[C@H](C)O2)c1O 175928818 IXXXBYKQFYVSPH-AAEUAGOBSA-N 293.363 2.365 10 20 CECD CCc1nc(CN[C@H](C)c2cc(OC)ccc2O)no1 182367589 OYLSWIAPRMVJON-SECBINFHSA-N 277.324 2.197 10 20 CECD CCC[C@@](C)(O)C(=O)NCc1ccc2c(c1)CCCN2C 124531259 MMUJRFMRFZHBNT-QGZVFWFLSA-N 290.407 2.236 10 20 CECD CN(Cc1ccccc1O)C(=O)COc1ccccc1C=O 120281920 SGGPVJUWOZBTMD-UHFFFAOYSA-N 299.326 2.242 10 20 CECD Cc1ccc(C(=O)NCc2nc(C)c(C)s2)c(O)c1O 182534907 QJAJOQLJLXONMR-UHFFFAOYSA-N 292.360 2.410 10 20 CECD Cc1ccc(C(=O)Nc2cccnc2C)c(O)c1O 182540026 AUFXAFYNOIMVET-UHFFFAOYSA-N 258.277 2.362 10 20 CECD CC[C@@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 130487241 IMAOZKZQMDTPFO-MRXNPFEDSA-N 289.423 2.276 10 20 CECD C[C@@H](CO)N[C@@H](C)c1cc(Br)ccc1O 134925616 PBUYEHVRCDLXQT-YUMQZZPRSA-N 274.158 2.186 10 20 CECD COCCN(Cc1ccc(N(C)C)cc1)CC(F)F 92965752 ZVERKNUWXPKQKW-UHFFFAOYSA-N 272.339 2.466 10 20 CECD Cc1ccc(O)c(CN(CC(N)=O)Cc2ccccc2)c1 93358616 IUGLTPXZWJMQSY-UHFFFAOYSA-N 284.359 2.188 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@H]1CCc2cccc(O)c21 295826689 DRWLZKHQSCXZQI-YPMHNXCESA-N 276.380 2.274 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)C[S@](C)=O)c(O)c1C 273470136 RVMIBZZQFYSYDF-MYFIVHGGSA-N 269.410 2.427 10 20 CECD C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)CCO1 271422482 ZSLGNTLBOAWIBT-YPMHNXCESA-N 278.352 2.101 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273591066 PDQCXYPAWPWMOW-RBZYPMLTSA-N 282.340 2.358 10 20 CECD CCOc1cccc(CN(C)C[C@@H]2CCC[C@H]2O)c1O 271265884 LWXZFXDKTSYYTR-GXTWGEPZSA-N 279.380 2.384 10 20 CECD CCOc1ccc(O)c(CNCc2nnc(CC)s2)c1 289826096 NXSWOPKWHVDLND-UHFFFAOYSA-N 293.392 2.495 10 20 CECD N[C@@H]1CC=C(C(=O)N2CCN(C3CC3)c3ccccc32)C1 638284737 CNIZYRJIJBBXMX-CYBMUJFWSA-N 283.375 2.050 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@H]1CCCO1 295138147 ZCYASHHLLVSYIG-SECBINFHSA-N 259.708 2.453 10 20 CECD Cc1ccc(O)c(CN2CC(OC(=O)NC(C)C)C2)c1 297394361 KVYQGZNQYXHRSR-UHFFFAOYSA-N 278.352 2.019 10 20 CECD C[C@H](N[C@H]1CCCN(CCCO)C1)c1cc(F)ccc1O 297368734 QJWOIDKDPUYRDD-JSGCOSHPSA-N 296.386 2.029 10 20 CECD Cc1nc(C(=O)NCc2ccc(N(C)C)cc2)c(C)o1 292587997 ZZPJIDUBXQIKFW-UHFFFAOYSA-N 273.336 2.287 10 20 CECD CC1(C)CCC[C@]1(O)CNCc1cc2c(cc1O)OCO2 293104973 YAFAUHFZHXLKAU-INIZCTEOSA-N 293.363 2.152 10 20 CECD CCCNC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 298722667 OXFKKELPVBPUIY-UHFFFAOYSA-N 289.423 2.243 10 20 CECD C[C@H](N[C@@H]1COC[C@H]1O)c1cc(Cl)c(Cl)cc1O 296048838 UYTKFSKIBQWVCK-ISROVCFRSA-N 292.162 2.109 10 20 CECD Cc1cnn([C@@H]2CCN(C(=O)c3cc(O)cs3)C2)c1 812380007 CFYCJKWOUUPNLA-SNVBAGLBSA-N 277.349 2.046 10 20 CECD Cc1c(CNc2cc(=O)n(C)cn2)n(C)c2ccccc12 656182422 IRBWNGXGPBFFTA-UHFFFAOYSA-N 282.347 2.193 10 20 CECD CCc1cccc(CN[C@@H]2CCC[C@@H]2C(=O)OC)c1O 827843234 BFDWUVRHCHMLBZ-UONOGXRCSA-N 277.364 2.386 10 20 CECD COc1cccc(O)c1CN1CC(CC(F)F)C1 822520834 PWZNLTWZTZZHDX-UHFFFAOYSA-N 257.280 2.488 10 20 CECD Cc1cc(O)c(CNC2(CCO)CCOCC2)cc1Cl 825037454 CDBMEMWVIDFWAB-UHFFFAOYSA-N 299.798 2.375 10 20 CECD CC(C)[C@@H](N[C@@H]1CCc2cccc(O)c21)c1nncn1C 903066482 VKOVODOKTCWHEX-IUODEOHRSA-N 286.379 2.495 10 20 CECD CN(C[Si](C)(C)C)C(=O)c1cccc(O)c1O 911726667 KINHJWIOKRPEKA-UHFFFAOYSA-N 253.374 2.047 10 20 CECD CCc1nc(C)c(C(=O)NCc2ccc(O)cc2O)s1 910955238 PSANKXOCMYEESD-UHFFFAOYSA-N 292.360 2.355 10 20 CECD CC(C)(CNCc1cc2c(cc1O)OCO2)OCC1CC1 840960390 KKJYBAYYFAEQBV-UHFFFAOYSA-N 293.363 2.416 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@@H](C)C[S@](C)=O 840940081 VEMLYRNYDOYCSN-DJJJIMSYSA-N 282.453 2.260 10 20 CECD Nc1ccc(CCNCc2cccc3c2OCO3)cc1 841036449 NVZNHVAFQZXQPY-UHFFFAOYSA-N 270.332 2.330 10 20 CECD CCCn1cc(NC(=O)NCCc2ccc(N)cc2)cn1 841127267 LDKOTFGBCFCESY-UHFFFAOYSA-N 287.367 2.240 10 20 CECD CC[C@@](C)(CNCc1ccc(N(C)C)cc1)C(=O)O 1326506438 TXDZWHKXQNVWTG-HNNXBMFYSA-N 264.369 2.343 10 20 CECD CCN(CC)CCN[C@@H](C)c1cccc(OC)c1O 846135717 FTGLIRMDFONSNP-LBPRGKRZSA-N 266.385 2.393 10 20 CECD C[C@H](N[C@H]1CCc2c(nnn2C)C1)c1ccc(N(C)C)cc1 848563994 GKWZWYMDUCOYIS-JSGCOSHPSA-N 299.422 2.089 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N[C@H]1CCSC1 845011357 DUBHRDXPPCVQNM-JTQLQIEISA-N 286.784 2.350 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CC(C)(C)CN)c1O 843355236 NQLFNGGLRICIMP-UHFFFAOYSA-N 282.359 2.151 10 20 CECD Cc1cc(C)c([C@H](C)NCCO[C@@H]2CCOC2)c(O)c1 927081306 OKJBVEKZYQSUDJ-UONOGXRCSA-N 279.380 2.465 10 20 CECD COc1ccc2c(c1)CCCN2CC[C@H]1CCNC1 842471652 OWFVGRSDHKONET-CYBMUJFWSA-N 260.381 2.447 10 20 CECD Cc1cc(CN2C[C@@H]3CCC[C@@]3(N)C2)ccc1N(C)C 923398926 OSHCPQQPELHNPU-DOTOQJQBSA-N 273.424 2.374 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)CC(F)F)cc1C 758614005 FSZBHACWTQMGFJ-LLVKDONJSA-N 259.296 2.115 10 20 CECD Cn1cc([C@@H]2N(C(=O)Cc3ccc(N)cc3)CC2(C)C)cn1 852873470 VYUGKCUBSXXZKX-INIZCTEOSA-N 298.390 2.155 10 20 CECD Cc1ccc(C(=O)Nc2cccc3c2COC3=O)c(O)c1O 752867339 PORGMRJWOPGTAN-UHFFFAOYSA-N 299.282 2.329 10 20 CECD Nc1ccc(Cc2noc(Cn3cc(C4CC4)cn3)n2)cc1 854133783 JYEFROUCEFIROZ-UHFFFAOYSA-N 295.346 2.365 10 20 CECD CSCCNC(=S)NCc1ccc(N(C)C)cc1 752732373 GOYYYMJRSDYFBU-UHFFFAOYSA-N 283.466 2.080 10 20 CECD CC[C@H]1CC[C@@H](C(=O)NCc2cc(C)ccc2O)O1 862758135 PXDRVVBPQNCBMF-JSGCOSHPSA-N 263.337 2.274 10 20 CECD Oc1cccc(Cl)c1CNCCNc1cnccn1 760699834 ALJZWJWHARERCH-UHFFFAOYSA-N 278.743 2.037 10 20 CECD OCc1ccc(CCNCc2cc(F)cc(F)c2O)cc1 883083819 ZRCVHSOKGUOCHR-UHFFFAOYSA-N 293.313 2.495 10 20 CECD Cc1cncnc1NCc1ccc(N2CCN(C)CC2)cc1 882880027 YLTLDSPGRJDEJF-UHFFFAOYSA-N 297.406 2.149 10 20 CECD CCOCc1cc(CNC[C@@H]2CC(C)=NO2)ccc1OC 895309518 BUTHOTJFQJOZLH-HNNXBMFYSA-N 292.379 2.486 10 20 CECD CCn1ncnc1CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 794841097 LNGFZUFVGOMJAU-KOLCDFICSA-N 290.342 2.481 10 20 CECD COC1CC(NC[C@H](c2ccc(N(C)C)cc2)N(C)C)C1 898449461 GIGJEPROWFGOCF-BDVYOWHSSA-N 291.439 2.122 10 20 CECD CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc(O)cs1 791058214 BRXJZHZVYPFAHJ-GFCCVEGCSA-N 282.409 2.304 10 20 CECD CC[C@@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(=O)OC 790913733 SHJUFGSVEFVHDX-RISCZKNCSA-N 292.379 2.129 10 20 CECD CCCCNC(=O)NCc1ccc(OC)cc1O 792761635 FDYCMRDIBIGRRK-UHFFFAOYSA-N 252.314 2.000 10 20 CECD C[C@H](O)CCN(Cc1ccccc1O)C[C@H]1CCCO1 798195249 DMIRFVZAVIGFBK-DZGCQCFKSA-N 279.380 2.144 10 20 CECD COC(=O)c1cnc(SCCCc2cncn2C)s1 1328047782 ZHTUUHVGMITAGA-UHFFFAOYSA-N 297.405 2.388 10 20 CECD NCC[C@H](NCc1ccc(N2CCCC2)cc1)C(F)F 1325626486 QROUSMXTLCPLDU-AWEZNQCLSA-N 283.366 2.359 10 20 CECD O=C(C1=CCCNCC1)N1C[C@@H]2CCCN2c2ccccc21 1340044021 FBQBPUTYPKHDEZ-HNNXBMFYSA-N 297.402 2.312 10 20 CECD CN[C@@H](C)CCNCc1cccc(Br)c1O 1348517001 ZBVQUMFGNIGBJY-VIFPVBQESA-N 287.201 2.242 10 20 CECD COc1cc(Cl)cc(CN2[C@H](C)CC[C@@H]2C(=O)O)c1O 1604719803 PJXPWTSYQDYAQL-LDYMZIIASA-N 299.754 2.492 10 20 CECD O=C(O)c1cc(NCc2ccc3cccnc3c2O)ncn1 1777667607 WQUFPDPZPFQURL-UHFFFAOYSA-N 296.286 2.041 10 20 CECD CN(C)c1ccc(CN[C@@H](CC(C)(F)F)C(=O)O)cc1 1777039537 CGDSZPSUWQXWPA-LBPRGKRZSA-N 286.322 2.341 10 20 CECD COc1cccc(CN(C)CC2CCN(C)CC2)c1O 134006854 AMFIXFNUUIPICH-UHFFFAOYSA-N 278.396 2.174 10 20 CECD COc1ccc(O)c(CN(C)CC2CCN(C)CC2)c1 134004600 SPMZJSOPVXHKEQ-UHFFFAOYSA-N 278.396 2.174 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCCO1 161147001 GHNNYZWUAADGMW-OAHLLOKOSA-N 276.380 2.280 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CC[C@H](CO)CC2)c1 153134732 JMTZGAJMTPDQLX-XBXGTLAGSA-N 279.380 2.432 10 20 CECD C[C@@H](NCCC(=O)N1CCCC1)c1ccccc1O 20127211 DOCBVYKKYKLXAI-GFCCVEGCSA-N 262.353 2.055 10 20 CECD COCCN(CC(C)C)C(=O)Nc1ccc(N)cc1 42370879 VGJPUBVFQAGHJU-UHFFFAOYSA-N 265.357 2.405 10 20 CECD CC[C@H](CO)N(C)Cc1cc(Cl)cc(C(C)=O)c1O 293876434 FISWPQCVGVDEKM-GFCCVEGCSA-N 285.771 2.451 10 20 CECD C[C@@H](NCc1ncc[nH]1)c1ccc(N2CCOCC2)cc1 67694978 JCWOKMJJBSBXOA-CYBMUJFWSA-N 286.379 2.097 10 20 CECD CC(C)(C)CCS(=O)(=O)NCc1ccccc1O 218973390 FDQVCXLTJMUEMO-UHFFFAOYSA-N 271.382 2.248 10 20 CECD CC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H]1CCCO1 181262972 OSEQOLKFARLUPO-XIACAKRESA-N 291.347 2.185 10 20 CECD C[C@@H](N)[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 220210723 PQRUVNYRNFZSGE-GHMZBOCLSA-N 252.333 2.091 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@@H](N)C1 236732846 KXJHTACQCRRAHQ-TZMCWYRMSA-N 276.380 2.258 10 20 CECD C[C@@H](NCc1ccc(C(N)=O)cc1)c1ccccc1O 179874074 IALLMQMISAYQPR-LLVKDONJSA-N 270.332 2.342 10 20 CECD C[C@H](NC[C@@H]1CN2CCC[C@H]2CO1)c1ccc(F)cc1O 252548371 MMTTXRKKFWXDJA-FPMFFAJLSA-N 294.370 2.045 10 20 CECD CN(C)c1ccc(CN2CC[C@@](O)(C3CC3)C2)cc1F 369676694 RRFLYMWBFQQLFG-INIZCTEOSA-N 278.371 2.239 10 20 CECD CN(C)c1ccc(CN(CC2OCCO2)C2CC2)cc1 272094155 MLAYQCYHWBDQDO-UHFFFAOYSA-N 276.380 2.090 10 20 CECD CC(C)C[C@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CCO1 279800893 JSRXZQFCXUNGMN-RYUDHWBXSA-N 293.363 2.421 10 20 CECD CC[C@H](C)[C@H](O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273591064 PDQCXYPAWPWMOW-PKFCDNJMSA-N 282.340 2.358 10 20 CECD OC[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 271834969 RRNZVPPHPUBCJH-SNVBAGLBSA-N 255.745 2.250 10 20 CECD Cc1cc(C)c([C@@H](C)N[C@H](C)C(=O)NCCF)c(O)c1 285366512 VUMKVGLTAOAZOP-VXGBXAGGSA-N 282.359 2.134 10 20 CECD CCC[C@@]1(CO)CCN(Cc2cc(OC)ccc2O)C1 290235471 UAFWONBHTZRDPL-MRXNPFEDSA-N 279.380 2.385 10 20 CECD COC(=O)C(C)(C)NCc1ccc(N(C)C)c(C)c1 815035578 DPCFQPJRJRWUQJ-UHFFFAOYSA-N 264.369 2.102 10 20 CECD Cc1cc(CN2CC[C@H](C)[S@@](=O)CC2)ccc1N(C)C 815103734 XRLJRZJFQAOQAS-XOBRGWDASA-N 294.464 2.404 10 20 CECD C[C@H](CC(=O)N[C@H](C)c1ccccc1O)c1cnn(C)c1 827952509 VWZMZFQCXGUORO-VXGBXAGGSA-N 287.363 2.497 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2CCOCC2)c1 728985103 WCLVQAGONZBPGS-SNVBAGLBSA-N 279.336 2.005 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCCC(=O)O)c1 820845756 AYLJYWAMQIJQHZ-SNVBAGLBSA-N 267.325 2.306 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCCN2C(C)C)c1 827167263 OXOQGQOUPUXTGX-CQSZACIVSA-N 276.380 2.190 10 20 CECD C[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)c2nccn21 825017911 ZVHGVAUKFHEACN-BXKDBHETSA-N 288.307 2.293 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@](C)(O)C(F)F 905123402 XLTILLVXUDLBDH-CQSZACIVSA-N 272.339 2.167 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1C[C@H]2CC[C@H]1O2 837586631 FITHIZAWUPPDGV-JRZJEATHSA-N 290.315 2.222 10 20 CECD CN(C)c1ccc(CNC(C)(C)CCC(=O)O)cc1 901662423 PWUVRJBLFZLFGQ-UHFFFAOYSA-N 264.369 2.486 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN[C@@H]1CCNC1 841044620 FSWWMIVXBYNODF-SECBINFHSA-N 261.152 2.151 10 20 CECD CC(C)(F)CCN1C(=O)CN(Cc2ccccc2O)C1=O 849362190 NYYMDXIKHCHYLW-UHFFFAOYSA-N 294.326 2.295 10 20 CECD CC1(CNCc2cc(F)ccc2O)CCNCC1 841056146 CWUILGYREPZQKL-UHFFFAOYSA-N 252.333 2.011 10 20 CECD CCOC(=O)c1ccc(CNCCc2ccc(N)cc2)o1 841037091 YGWAIGIDOCBOGM-UHFFFAOYSA-N 288.347 2.371 10 20 CECD CN(C)c1cc(NC(=O)c2cc(O)cs2)ccn1 748509722 HIOAWECTWZGVGC-UHFFFAOYSA-N 263.322 2.167 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1Cc2cccc(O)c2C1 758549164 ZTMXKCQCZFMKAR-CYBMUJFWSA-N 298.342 2.064 10 20 CECD COc1cc(CN[C@H](C)CC(N)=O)c(O)c(C(C)(C)C)c1 850197077 KCKDASMERDFHMZ-SNVBAGLBSA-N 294.395 2.052 10 20 CECD CCCN1CC[C@@H](N[C@@H](C)c2cc([N+](=O)[O-])ccc2O)C1 850557326 WGKTYVATGCYTNC-NWDGAFQWSA-N 293.367 2.435 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2SCCS2)c1 761967384 MJYGZCFPMYLFLC-MRVPVSSYSA-N 299.417 2.384 10 20 CECD CCCn1cc(CNCc2ccc(N(C)C)c(F)c2)nn1 865437303 GMWHMVMOBVTQBX-UHFFFAOYSA-N 291.374 2.183 10 20 CECD COc1cc(CN2CCC[C@H]2C[C@H](C)O)c(O)cc1C 768461488 DFKIPLPUGCKTSH-JSGCOSHPSA-N 279.380 2.445 10 20 CECD Cc1ccc(CNCCC(=O)NCc2ccccc2)c(O)c1 876991111 HKOHNEXIVFNWBG-UHFFFAOYSA-N 298.386 2.497 10 20 CECD CC(C)[C@H]1CCN1C(=O)/C=C/c1ccc(O)c(O)c1 779545280 RKHRNESKQAIIPM-FVOPLDGLSA-N 261.321 2.368 10 20 CECD C[C@H](NC(=O)/C=C\c1cnn(C)c1)c1ccc(N(C)C)cc1 772999814 MQZNKDSOBLOXPV-PRFOUVDFSA-N 298.390 2.377 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@H]1CNCCCO1 1118122139 PUSYVMWWCQJUSB-MCIONIFRSA-N 290.407 2.217 10 20 CECD C[C@@H](NCCCn1ccnc1)c1c(O)cccc1F 886487527 HZCVJRVJVCXZGF-LLVKDONJSA-N 263.316 2.469 10 20 CECD C[C@@H](N[C@H]1CCCN(CCCO)C1)c1c(O)cccc1F 886615409 FTAVUXBOCIECKW-OLZOCXBDSA-N 296.386 2.029 10 20 CECD CC1(C)CO[C@H](CCC(=O)NCc2cccc(O)c2O)C1 1123888819 LSOXZUYEUIKWEC-GFCCVEGCSA-N 293.363 2.309 10 20 CECD CC[C@@](C)(O)Cc1cn(Cc2ccc(N(C)C)cc2)nn1 881272454 VRZVLWDPUFSTJI-MRXNPFEDSA-N 288.395 2.096 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C(=O)OC)[C@H]2C)c1 787421156 NYSXTZHEWFAARV-RISCZKNCSA-N 293.363 2.174 10 20 CECD COc1cccc(CNCc2nc(C(F)F)no2)c1O 895727845 UWUCAJQRLUWUBC-UHFFFAOYSA-N 285.250 2.011 10 20 CECD CC[C@@]1(CO)CCCN1Cc1cc(C)cc(OC)c1O 894532946 LKVJZWPQBJNAGJ-INIZCTEOSA-N 279.380 2.446 10 20 CECD Oc1cc(Br)ccc1CNCCOCCF 702616014 UKKZFRRTJDIBLW-UHFFFAOYSA-N 292.148 2.230 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCCCS2)c(O)c1 794381278 NZANDZHEUYSYLY-CYBMUJFWSA-N 281.377 2.303 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCN3CCC[C@@H]3C2)c1 83551953 FFWANYUIQZTHRI-HUUCEWRRSA-N 260.381 2.417 10 20 CECD CC[C@@H]1C[C@H](C(=O)NCc2ccc(N)cc2)CCO1 1356228323 POOIDAJHVYLEGX-TZMCWYRMSA-N 262.353 2.090 10 20 CECD C[C@H](N[C@H]1CCCC[C@H]1CN)c1cc(C(=O)O)ccc1O 1609778123 MWRNWHYHSAQTKD-JKOKRWQUSA-N 292.379 2.259 10 20 CECD C[C@H](N[C@@H]1CC[C@@H](C)C1)c1cccc(-c2nn[nH]n2)c1O 1603879101 BGPSWMFOVUVTSH-OUAUKWLOSA-N 287.367 2.412 10 20 CECD CC[C@H](C)[C@@H](CC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1776953636 RRVDJVQAVMSOLM-JOYOIKCWSA-N 296.323 2.279 10 20 CECD COc1cccc(CNCc2ccc(C(=O)O)cc2O)c1 1777380110 QRHUNAZDIYGHBC-UHFFFAOYSA-N 287.315 2.389 10 20 CECD COc1ccc(N2CCC(NCCCN(C)C)CC2)cc1 151930119 QAWNLPLZQNPBPR-UHFFFAOYSA-N 291.439 2.205 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCO2)[C@H]1CCCNC1 904353024 GKVSTLKBTVXNAT-CJNGLKHVSA-N 274.408 2.489 10 20 CECD O[C@H]1CCCC[C@@H]1NCc1ccc2c(c1)CCCO2 921738839 UYRUQMARJCADHV-GJZGRUSLSA-N 261.365 2.405 10 20 CECD CC(C)[C@H](NCc1ccc2c(c1)CCCO2)C(=O)O 900029250 NJNATDOQNJRNAU-AWEZNQCLSA-N 263.337 2.210 10 20 CECD COc1ccnc(N2CCN(Cc3ccccc3O)CC2)c1 179570101 YBOACYYPLBSFEW-UHFFFAOYSA-N 299.374 2.118 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N(CC(F)F)C1CC1 180761275 KJKAHZWIUFGXMV-QHHAFSJGSA-N 283.274 2.367 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccnn2C(C)C)c1 125918602 QPJMNORFDADDBB-UHFFFAOYSA-N 289.335 2.108 10 20 CECD C[C@@H]1CC[C@@H](CCC(=O)NCCc2ccc(O)c(O)c2)O1 122190262 JWIIVBXOXQORSD-YPMHNXCESA-N 293.363 2.104 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H](O)COCC(C)C)c1 185116935 JRIJOKSETXZEFT-UONOGXRCSA-N 281.396 2.385 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(N(C)C)ccn1 195495742 RAQDYGSNLDKDSY-UHFFFAOYSA-N 285.347 2.125 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(F)cn1 183550769 CTSUPNKHGIITGT-UHFFFAOYSA-N 260.268 2.199 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1ncc[nH]1 279214844 OFFWSCODSIBCAL-UHFFFAOYSA-N 286.379 2.067 10 20 CECD Cc1ccc([C@@H](C)NCCNC(=O)C2CC2)c(O)c1C 273386963 JSQKHBDSUITMIA-GFCCVEGCSA-N 276.380 2.186 10 20 CECD CCOCC(C)(C)NCc1ccc(N2CCOCC2)cc1 379113680 KVGKYUMVNMDNAS-UHFFFAOYSA-N 292.423 2.428 10 20 CECD Cc1cc(C)c([C@H](C)NCc2nnc3n2CCC3)c(O)c1 283846041 AZSVDYXVPVZADX-LBPRGKRZSA-N 286.379 2.398 10 20 CECD NC(=O)C[C@@H]1CCN(Cc2c(O)ccc3ccccc23)C1 377193061 OLQPKPJLHHQPBI-LBPRGKRZSA-N 284.359 2.243 10 20 CECD Cc1ccc(O)c(CNc2ccnc(C(=O)N(C)C)c2)c1 285303086 UVAOVRYHVUKHSC-UHFFFAOYSA-N 285.347 2.410 10 20 CECD COc1cccc(CNC(=O)c2cc(C)cc(C)n2)c1O 801173504 VPYJHWMMZZRZCZ-UHFFFAOYSA-N 286.331 2.343 10 20 CECD O=C(NCc1ccccc1O)NCc1cnn2ccccc12 805780742 OMODTURAJRWQGC-UHFFFAOYSA-N 296.330 2.039 10 20 CECD NC[C@@H]1CCCC[C@@H]1N[C@@H]1CCc2cccc(O)c21 817959510 GTXDJKTUGNJDAL-MELADBBJSA-N 260.381 2.487 10 20 CECD CC[C@H](NC[C@H](N)C1CC1)c1ccc(F)cc1O 817964550 CHXNDYQYBPDYRH-STQMWFEESA-N 252.333 2.309 10 20 CECD CCCn1nccc1C(=O)N[C@H](C)c1ccccc1O 827957022 QYEMGBPYNRIDKP-LLVKDONJSA-N 273.336 2.490 10 20 CECD CCCONC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 828313694 WNMGOGXNWVGXFM-NSHDSACASA-N 265.357 2.454 10 20 CECD O=C(NCCc1cccs1)c1cc(O)cs1 731861569 GDDURDACMSEWIE-UHFFFAOYSA-N 253.348 2.488 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)C1 827812192 FNIIMGQLJLJWOA-ZKCHVHJHSA-N 287.718 2.226 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnco1 839919479 HJJKIDDWURSKBN-GFCCVEGCSA-N 287.363 2.410 10 20 CECD NC[C@H]1CCCN(Cc2cccc(Br)c2O)C1 843047497 PZVMNTMZORIINX-SNVBAGLBSA-N 299.212 2.325 10 20 CECD CCn1nnc(C)c1CN[C@@H](C)c1cc(OC)ccc1O 845971791 NCBJRMHOYQJPLD-JTQLQIEISA-N 290.367 2.171 10 20 CECD CN(CC1CCCCC1)C(=O)C(=O)Nc1ccc(N)cc1 841014148 LGCQHUQUSWIUBM-UHFFFAOYSA-N 289.379 2.246 10 20 CECD COc1cccc([C@H](C)NCCc2nccnc2C)c1O 846168616 BKYXQKUKLUVHKX-NSHDSACASA-N 287.363 2.393 10 20 CECD C[C@H]1CCC[C@H](C)N(C(=O)C(=O)Nc2ccc(N)cc2)C1 841049489 SJUCQLAVXSQSBB-RYUDHWBXSA-N 289.379 2.244 10 20 CECD CC[C@H](C)OCC(=O)NCc1cc(Cl)ccc1O 846474726 AXYOAFMDJXRCNT-VIFPVBQESA-N 271.744 2.477 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCNCC1 846677097 MWOOVNUFDKCFGR-OAHLLOKOSA-N 289.423 2.101 10 20 CECD COc1ccc(N(C)CCN(C)c2ncccn2)cc1 845666639 IDKDMBHOQPJGHY-UHFFFAOYSA-N 272.352 2.058 10 20 CECD Cc1ncc(CNC[C@@H](N)c2ccc(N(C)C)cc2)s1 841042497 KVELKTKLGQVXLY-OAHLLOKOSA-N 290.436 2.307 10 20 CECD Oc1c(Cl)cccc1CN[C@@H]1CC12CCNCC2 841079325 MDBHVIXMOZKUOL-GFCCVEGCSA-N 266.772 2.277 10 20 CECD COCc1nc(CNCc2ccccc2O)cs1 696128189 UQXXAZZHHQCQIP-UHFFFAOYSA-N 264.350 2.285 10 20 CECD CC[C@@](C)(OC)C(=O)N[C@H](C)c1ccccc1O 827946667 NWNVKFYNQPRHFA-QMTHXVAHSA-N 251.326 2.385 10 20 CECD CCN(CC)CCOCCNCc1cccc(C)c1O 757945868 IUBZBCSRADOPIU-UHFFFAOYSA-N 280.412 2.149 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnc3n2CCCC3)c1 862757419 TUIZPPZIJXRXSB-UHFFFAOYSA-N 285.347 2.163 10 20 CECD COc1cccc(O)c1CNC[C@H](O)c1ccc(F)cc1 767717739 NFXVEQUPSBBGQW-HNNXBMFYSA-N 291.322 2.363 10 20 CECD Cc1ccc(CN(C)[C@@H](C)C(=O)OC(C)C)c(O)c1 876779506 HMYDQGZCVKMMNU-LBPRGKRZSA-N 265.353 2.473 10 20 CECD CCOC(=O)[C@@H](NCc1cccc(OCC)c1O)C1CC1 1116755459 JDAIMCPSKKJZHG-AWEZNQCLSA-N 293.363 2.222 10 20 CECD Nc1ccc(CN2CCC([C@H]3CCCNC3)CC2)cc1 1120269613 VVLJOJRQOXIRHT-INIZCTEOSA-N 273.424 2.480 10 20 CECD C[C@H](N[C@H](C)[C@@H](C)N1CCOCC1)c1c(O)cccc1F 886524042 BMDXNBJHICEKST-FRRDWIJNSA-N 296.386 2.291 10 20 CECD COC[C@H](NCc1cc(Cl)ccc1O)[C@@H]1CCCO1 788535243 LDYMXEWHRVILTE-JSGCOSHPSA-N 285.771 2.329 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CO[C@@H](C)C2)c1 784441398 FUXJKQBZSWNRJR-DCAQKATOSA-N 279.336 2.003 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOC2(CCC2)C1 894049617 HXVQNXQGVOBSSU-UHFFFAOYSA-N 269.291 2.425 10 20 CECD COc1cc(C)cc(CN[C@H]2CCc3c[nH]nc3C2)c1O 894330761 SUAZFWJRHRXUMU-ZDUSSCGKSA-N 287.363 2.079 10 20 CECD CCn1nc(C)c(C(=O)NCc2ccccc2O)c1C 269155605 RKGNBFUCDKNABA-UHFFFAOYSA-N 273.336 2.155 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@H]1CCCOC1 793512307 BTUCGAXKIBYNHA-CQSZACIVSA-N 290.407 2.494 10 20 CECD CC[C@H](C)NC(=S)NCc1ccc(OC)cc1O 795031540 KEKBIVRWJXVYNC-VIFPVBQESA-N 268.382 2.163 10 20 CECD COc1ccc(CNc2ncnc(N)c2Cl)c(O)c1 795292643 ZOWRZWCUQDQKRK-UHFFFAOYSA-N 280.715 2.039 10 20 CECD Cc1cnc(NCCc2ccc(O)c(O)c2)nc1C 764157751 XWDLFRZQAWGTLA-UHFFFAOYSA-N 259.309 2.159 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@]2(C)CC(C)=NO2)c1 1338905076 OLDVTRXLLKTVKJ-ZUZCIYMTSA-N 292.335 2.133 10 20 CECD C[C@@H](CNC(=O)NCc1ccc(N)cc1)c1nccs1 1336975523 PUCXJUPTTLKKAP-JTQLQIEISA-N 290.392 2.328 10 20 CECD O=C(O)c1cnc(S[C@H]2CCN(C3CCC3)C2=O)s1 1602537620 XMXVDWHTQPQQTJ-QMMMGPOBSA-N 298.389 2.087 10 20 CECD Cc1ccc(CN2C[C@@H](C)[C@H](CC(=O)O)C2)c(O)c1 1600416342 XQZFNHSRMKCRSE-DGCLKSJQSA-N 263.337 2.243 10 20 CECD Cc1cc(Cl)cc(CN2CCOC[C@@H]2CC(=O)O)c1O 1600218930 HBFYZGOJWDNLNB-LBPRGKRZSA-N 299.754 2.030 10 20 CECD COc1ccc(O)c(CN[C@@H]2C[C@@H](OC)C2(C)C)c1 224894872 AOKZKBWVCCZFKB-ZIAGYGMSSA-N 265.353 2.304 10 20 CECD O=C(/C=C/[C@H]1CCCNC1)N1CCc2cc(F)ccc21 1580491950 WNKSFTJNBNGZHX-MJRJWQSSSA-N 274.339 2.271 10 20 CECD N[C@@H](C(=O)NCc1ccc(O)cc1O)C1CCCCCC1 1580114164 ZPADLCNQZLGNGQ-OAHLLOKOSA-N 292.379 2.012 10 20 CECD CCOc1ccc(N(C)CC(=O)NCC2CC2)cc1 150734682 KCRFNLAUWJWEBP-UHFFFAOYSA-N 262.353 2.048 10 20 CECD OCCN(Cc1cc2c(cc1O)OCO2)C1CCCCC1 155126024 ASTMDIQEBPBKQV-UHFFFAOYSA-N 293.363 2.248 10 20 CECD CC(C)(C)[C@H](CN)NCc1ccc2c(c1)CCCO2 904358323 LFBSDQOFSGFXSN-HNNXBMFYSA-N 262.397 2.475 10 20 CECD Cc1n[nH]cc1CNCc1ccc2c(c1)CCCO2 921528994 XCUWKDPIDLURBO-UHFFFAOYSA-N 257.337 2.333 10 20 CECD CCO[C@@H]1CCCN(C(=O)Nc2ccc(N)cc2)C1 42425640 YGWNVWAPDHRZSG-CYBMUJFWSA-N 263.341 2.302 10 20 CECD CCN(CC)c1ccc(CNC[C@@]2(O)CCSC2)cc1 267098038 WFCFZCHDTREBIS-INIZCTEOSA-N 294.464 2.490 10 20 CECD Cc1nccn1CCN[C@H](C)c1ccc(F)cc1O 273468008 FEZIRDBPSLDXGN-SNVBAGLBSA-N 263.316 2.387 10 20 CECD CO[C@@H]1[C@H]2C[C@@H]3CN(Cc4cc(F)ccc4O)[C@@H]1[C@H]3C2 289777721 RNLBQEWWDFBERV-TXBJDVRTSA-N 277.339 2.387 10 20 CECD C[S@](=O)C1(CNCc2cc(Cl)ccc2O)CCC1 393695158 BAEYSIBTJQXXIX-SFHVURJKSA-N 287.812 2.436 10 20 CECD COc1ccc(CN[C@H]2CS[C@H](C)C2)c(O)c1 397975958 OSLICDPMZHBWNY-MWLCHTKSSA-N 253.367 2.384 10 20 CECD CCCCCNC(=O)CN(C)c1ccc(OC)c(OC)c1 64517385 ZNDWCJFYCJZLRH-UHFFFAOYSA-N 294.395 2.446 10 20 CECD OC[C@@H](Cc1ccccc1)NCc1ccc2c(c1)CCO2 63218891 ASHVQJGFCRPIAP-QGZVFWFLSA-N 283.371 2.315 10 20 CECD C[C@H](Nc1cnn(CCO)c1)c1ccc(N(C)C)cc1 305865614 YOULPINMOGFUAR-LBPRGKRZSA-N 274.368 2.115 10 20 CECD CCC(=O)N1CCCN(Cc2cc(C)c(C)cc2O)CC1 128729190 QPIICEUQEZVPJC-UHFFFAOYSA-N 290.407 2.453 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccon2)c1 183629269 NWYUNUHBVICAHR-MRVPVSSYSA-N 277.280 2.272 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ccc(N)cc2)cc1 40825843 LJVZQYRQIZZENG-UHFFFAOYSA-N 283.375 2.194 10 20 CECD CC(C)COC[C@H](O)CN[C@@H](C)c1cc(F)ccc1O 185117676 AKEQERDXOCAVPQ-WCQYABFASA-N 285.359 2.215 10 20 CECD COc1cc(Cl)cc(CN(C)CC[C@H](C)O)c1O 184695373 YMBGXPPMFAXEGL-VIFPVBQESA-N 273.760 2.257 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Nc2ccon2)c1 183629252 NWYUNUHBVICAHR-QMMMGPOBSA-N 277.280 2.272 10 20 CECD C[C@@H](CCS(C)(=O)=O)N[C@H](C)c1ccc(N(C)C)cc1 127213795 JZPYTDKGJSYDGW-QWHCGFSZSA-N 298.452 2.226 10 20 CECD CN(Cc1ccccc1O)C(=O)CCC(=O)OC(C)(C)C 192434100 CNNDULOOAFOUDG-UHFFFAOYSA-N 293.363 2.473 10 20 CECD CC1(C)[C@H]2OCC[C@H]2[C@H]1NC(=O)NCc1ccccc1O 266027127 VMWKHNOTWBCKSK-YUTCNCBUSA-N 290.363 2.005 10 20 CECD Cc1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)ccn1 447517955 BAQHYBGDSGYKLM-UHFFFAOYSA-N 297.358 2.495 10 20 CECD CC[C@H](COC)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273562303 ILIAFNMTWQSXGL-VHSXEESVSA-N 268.313 2.376 10 20 CECD C[C@H](CCCO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273556390 HAQPFBWMSDMTEO-NXEZZACHSA-N 268.313 2.112 10 20 CECD C[C@@H](CO)CNCc1ccc(N(C)C)cc1C(F)(F)F 279536896 AAXBBEUMWGNQTM-SNVBAGLBSA-N 290.329 2.489 10 20 CECD Cc1cc([C@@H]2CCCN2C(=O)c2cccc(O)c2O)no1 373744462 DCWUKVQUEGFWBY-LBPRGKRZSA-N 288.303 2.372 10 20 CECD Cc1cc(CN2CCC[C@]23CCOC3=O)ccc1N(C)C 294523972 JHMKHCXDUSOBSF-QGZVFWFLSA-N 288.391 2.343 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1OC1CCCC1 819170713 MTNAKJGGUQCTHO-UHFFFAOYSA-N 290.319 2.031 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)C=C(C)C 819694939 QAMLVVUWZJJFLK-UHFFFAOYSA-N 291.347 2.250 10 20 CECD C[C@@H]1C[C@@H](NCCc2ccc(N)cc2)CN1C1CC1 817955934 LTIUMFAXFLNWCA-IUODEOHRSA-N 259.397 2.026 10 20 CECD CSC[C@H](CCO)NCc1cc(Cl)c(F)cc1O 816552291 HVYAELSHKHLYJI-VIFPVBQESA-N 293.791 2.388 10 20 CECD CCOCc1cc(CN[C@H](CC)[C@@H](C)O)ccc1OC 824921471 MHLUECNHJJYKNO-IUODEOHRSA-N 281.396 2.481 10 20 CECD C[C@@H](NC(=O)COC(F)(F)F)c1ccccc1O 828539893 VNXOYQSRTPVTRA-SSDOTTSWSA-N 263.215 2.106 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 903299188 HIGAPYSIQGGLOT-LEJCRSTHSA-N 295.354 2.473 10 20 CECD CCCN(CC(=O)NC)Cc1cc(Cl)c(C)cc1O 824606399 RSDUQGAKDMHAOA-UHFFFAOYSA-N 284.787 2.312 10 20 CECD C/C(=C(\F)C(=O)NCCc1ccc(O)c(O)c1)C1CC1 901121854 KXMJJHLWSFDQEL-NTEUORMPSA-N 279.311 2.410 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)CC2CCCC2)cc1 832292167 BWAIITGBPCDUJI-MRXNPFEDSA-N 289.423 2.449 10 20 CECD Cc1ccc(O)c(CNCC(C)(C)C2(O)CCOCC2)c1 841891195 VVGKDQCBRRBPPO-UHFFFAOYSA-N 293.407 2.358 10 20 CECD N[C@@H]1Cc2ccccc2N(Cc2cccc(F)c2O)C1 841107066 USLXXAPJMMVVBX-CYBMUJFWSA-N 272.323 2.421 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)c2nccc(N)n2)c1 846844819 PXTYUHVOILHRTJ-NXEZZACHSA-N 288.351 2.185 10 20 CECD CCOc1ccc(CN2CC[C@@H](N)C[C@H]2C)c(O)c1 846699698 VVZUCDTVXGHNJA-DGCLKSJQSA-N 264.369 2.103 10 20 CECD O=C(c1cc(O)cs1)N1CCC(c2ccncn2)CC1 854931158 RKQVFBPJZCKRTA-UHFFFAOYSA-N 289.360 2.264 10 20 CECD CCN(C[C@H]1CCC(=O)O1)c1ccc(OC)c(OC)c1 851828046 MSSRDAFGAILFIA-GFCCVEGCSA-N 279.336 2.236 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2cc(C)cc(OC)c2O)C1 754735847 DTEIRLOEXPBPNP-AWEZNQCLSA-N 292.423 2.483 10 20 CECD CN(Cc1cccn1C)C(=O)/C=C\c1ccc(O)c(O)c1 779486856 VQJNRGXPCHTJMV-VURMDHGXSA-N 286.331 2.108 10 20 CECD C[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)C1CC1 779498755 JRXJKDXPBJEFAQ-WXGCRTCVSA-N 261.321 2.273 10 20 CECD CN(c1nnc(-c2sccc2O)n1C)[C@@H]1CCSC1 1121274126 MCOMQCWYSDEOQV-MRVPVSSYSA-N 296.421 2.191 10 20 CECD CCOC(=O)C1(CNCc2cc(F)cc(F)c2O)CC1 894479439 IPMHXSMEICDZAV-UHFFFAOYSA-N 285.290 2.103 10 20 CECD C[C@@H]1CC[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 781617090 ACSMKLQXRWAKLX-STBQQDIQSA-N 261.321 2.416 10 20 CECD COc1ccc(CN[C@@H]2CSC[C@H]2C)c(O)c1OC 894411924 BTTSEUYOFIBFJL-MWLCHTKSSA-N 283.393 2.251 10 20 CECD COc1cccc(CN2C[C@H](C)OC(C)(C)C2)c1O 133114057 PHUDOVWOSOFASB-NSHDSACASA-N 265.353 2.400 10 20 CECD C[C@@H](NC(=O)N[C@@H](CN)C1CCCC1)c1ccccc1O 892091712 LTOSACNARJMZGM-RISCZKNCSA-N 291.395 2.270 10 20 CECD COc1ccc(CNC[C@@H]2CC[C@H](C)O2)c(O)c1OC 894817470 QUTWODGHTLYCHW-JQWIXIFHSA-N 281.352 2.067 10 20 CECD CC[C@@H](NCc1ccc(OC)c(OC)c1O)[C@@H]1CCCO1 893256420 RQWIINUSCNZLHK-OLZOCXBDSA-N 295.379 2.457 10 20 CECD CSC[C@](C)(O)CNCc1cc(Cl)ccc1O 217866525 CPEQPRFNWGTKQK-GFCCVEGCSA-N 275.801 2.249 10 20 CECD COc1ccc(CN[C@@H]2CCO[C@@H](C)C2)c(O)c1 219899748 UJAROCKDYRFAOD-CMPLNLGQSA-N 251.326 2.058 10 20 CECD C[C@H]1CCC[C@@H](C)N1C(=O)CN(C)c1ccc(N)cc1 702069617 OHRLTUXCTGUJKA-BETUJISGSA-N 275.396 2.495 10 20 CECD CCc1occc1C(=O)OCC(=O)c1ccc(O)c(O)c1 797487698 RMLKAHMDJFTRSW-UHFFFAOYSA-N 290.271 2.293 10 20 CECD COc1ccc(CNC(=O)c2c[nH]c3ncccc23)c(O)c1 794389278 KCSASKCGHAGFCQ-UHFFFAOYSA-N 297.314 2.207 10 20 CECD CC[C@@H](NC[C@@]1(OC)CCOC1)c1ccc(F)cc1O 796939471 CLOHVDJGKHUQDY-HIFRSBDPSA-N 283.343 2.378 10 20 CECD COc1cccc(CN[C@@H]2C[C@H](C)O[C@H](C)C2)c1O 724624621 JCHOIVCGEIQKMH-PJXYFTJBSA-N 265.353 2.446 10 20 CECD COCC[C@H](CO)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 798940876 OJLCNYZNCMQNON-FOGDFJRCSA-N 283.343 2.067 10 20 CECD COC(=O)c1csc(CN(C)Cc2ccccc2O)n1 1249475150 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GGOXCDBGQOAJTK-JTQLQIEISA-N 277.324 2.115 10 20 CECD C[C@@H](NCCC1(C)OCCO1)c1ccccc1O 183906541 JXMPCFPYVLRORM-LLVKDONJSA-N 251.326 2.196 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)CC[C@H]1N 252501445 CGBVNTLKENAFBZ-JOYOIKCWSA-N 254.761 2.215 10 20 CECD COc1ccc(CNCCN2CCOC(C)(C)C2)cc1C 264396431 UNXHSPVJDJGOLT-UHFFFAOYSA-N 292.423 2.204 10 20 CECD CCCOc1ccc(CN2C[C@@H](O)[C@@H](CC)C2)c(O)c1 271279554 LTBPWZQOCBBGRX-BLLLJJGKSA-N 279.380 2.384 10 20 CECD Cc1cccc(CNCCCN2CCCO[C@H](C)C2)c1O 277577983 TUJPWHJOAUFURD-OAHLLOKOSA-N 292.423 2.291 10 20 CECD Cc1cccc(CN2CCOC[C@@H]2[C@H]2CCCC2=O)c1O 375472595 WZIBSEGEINBOLY-HUUCEWRRSA-N 289.375 2.271 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CNCc2ccccc21 387939194 CVFUOCIPHFVCQU-INIZCTEOSA-N 296.370 2.238 10 20 CECD CC(C)[C@@H](C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 297744391 DGRFOMRHCGCJNE-CQSZACIVSA-N 291.439 2.345 10 20 CECD C[C@H](N[C@H]1CC[C@@H](CO)C1)c1cc([N+](=O)[O-])ccc1O 296475513 NYXYUQHNQGNQHQ-AXFHLTTASA-N 280.324 2.112 10 20 CECD COC(=O)[C@@H]1[C@H]2CN(Cc3c(O)ccc(Cl)c3F)C[C@H]21 814173629 UDIPKJMMHZOGKZ-JDICNCQASA-N 299.729 2.036 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCCC[C@H]2N)c1O 818431122 GFZDTFNZJSVJNC-VXGBXAGGSA-N 284.787 2.414 10 20 CECD CC[S@](=O)CCNCc1ccc2ccccc2c1O 816551077 NYXKAWCGTISYKZ-IBGZPJMESA-N 277.389 2.404 10 20 CECD Cc1ccc(C(=O)OCc2nccn2C(F)F)c(O)c1O 727003793 GOQBBHODSJEMAF-UHFFFAOYSA-N 298.245 2.355 10 20 CECD O=C(/C=C/c1cncc(F)c1)N1C[C@H](CO)c2ccccc21 493491164 JCFIZIXDAZIHOU-URWSZGRFSA-N 298.317 2.357 10 20 CECD Cc1cc(O)c(CN2CC[C@@](C)(C(=O)O)C2)cc1C 832900348 ZBNLDOSHDOCLRP-OAHLLOKOSA-N 263.337 2.306 10 20 CECD C[C@@H](NC[C@H]1CCCN1CCCO)c1cc(F)ccc1O 834850763 OYOJBXJYAGGTKU-TZMCWYRMSA-N 296.386 2.029 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC(C)(C)C(C)(C)O 838719127 IZAPSFLUOALMFI-UHFFFAOYSA-N 294.395 2.331 10 20 CECD CCOC[C@@H](O)CN(Cc1ccc(N(C)C)cc1)C(C)C 733609802 LSRHWUZZXSBYPZ-KRWDZBQOSA-N 294.439 2.360 10 20 CECD CNc1nc(C)ccc1C(=O)NCc1cc(C)ccc1O 913000783 VJKWIDLSZLQQIH-UHFFFAOYSA-N 285.347 2.376 10 20 CECD CNC(=O)C[C@H](C)N[C@@H](C)c1ccc(Cl)cc1O 841752540 BGLJSQAZIPRVQS-IUCAKERBSA-N 270.760 2.221 10 20 CECD CCN(CCSC)Cc1cc2c(cc1O)OC[C@H]2O 842647537 ZOBGZBABPGVJCX-CYBMUJFWSA-N 283.393 2.003 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@H]2OC(C)(C)C)c(O)c1 846950970 SJWFFNQWBCFTAP-TZMCWYRMSA-N 293.363 2.221 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)[C@H]2CCOC2)c1O 846149452 ZNKHVWLRJSUZQI-SRVKXCTJSA-N 265.353 2.476 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1 841298581 QWFNFUWFACRITP-MGPQQGTHSA-N 287.363 2.348 10 20 CECD NCC[C@H](NCc1c(O)cccc1Cl)C(F)(F)F 841089894 BPSFNHBKEWAROA-JTQLQIEISA-N 282.693 2.415 10 20 CECD C[C@@H]1CCCN(C(=O)c2cc(O)cs2)[C@H]1CCO 855541186 NPXTWESGSLRUIB-KOLCDFICSA-N 269.366 2.077 10 20 CECD C[C@@H]1C[C@@H](NCC2(CO)CC2)c2c(O)ccc(F)c21 756638147 RSXCFCWHAIGNDF-MWLCHTKSSA-N 265.328 2.442 10 20 CECD Cc1cc(CN(C)c2ccc3c(c2)OCO3)nn1C 756654393 SHAFOMVIOIZCGM-UHFFFAOYSA-N 259.309 2.094 10 20 CECD Cc1cc(C(=O)NCc2cc(Cl)ccc2O)n(C)n1 857547903 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CNTQNXJIEVVYLE-LLVKDONJSA-N 295.379 2.409 10 20 CECD CCC(=O)N1CCCN(Cc2cc(F)cc(F)c2O)CC1 893967146 JFPCGKHFGGTTJI-UHFFFAOYSA-N 298.333 2.115 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC2(CCO2)CC1 894671501 QASGVHWEHXVVGZ-UHFFFAOYSA-N 269.291 2.425 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCOCC(F)F 189785303 SMNMFIACPDUDEM-UHFFFAOYSA-N 286.322 2.233 10 20 CECD CN1CCC(NCc2c(O)cccc2Br)CC1 706852109 PUNWVTTWKIQUEP-UHFFFAOYSA-N 299.212 2.339 10 20 CECD CCCS(=O)(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 775833534 CXPYZKOLYYDBTR-ZDUSSCGKSA-N 298.452 2.228 10 20 CECD CNCCCN(C)Cc1ccc(N2CCCC2)cc1 1326075387 NIABFAOJBPYVQP-UHFFFAOYSA-N 261.413 2.328 10 20 CECD OC[C@@]12C[C@@H]1CN(Cc1ccc(N3CCCC3)cc1)C2 1320882613 YNWYWXQVTVOZFW-WBVHZDCISA-N 272.392 2.101 10 20 CECD Nc1ccc(CN2CCCC[C@@H]2[C@H]2CCCN2)cc1 1345160110 QYUMEEQPZYNTAE-HZPDHXFCSA-N 259.397 2.375 10 20 CECD CN1CCN(c2ccc(CN3C[C@@H]4C[C@H]4C3)cc2F)CC1 1348389793 WREPWADFZSECDP-GJZGRUSLSA-N 289.398 2.029 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2cc(Br)ccc2O)C1 220339405 ONKDRIXWLBFGHK-ZJUUUORDSA-N 299.212 2.324 10 20 CECD Cc1cc(O)c(CNC2(CC(=O)O)CC2)cc1Cl 1607698544 AKSYLHFKDCCJTE-UHFFFAOYSA-N 269.728 2.451 10 20 CECD CC1(C(=O)NCc2cccc(O)c2O)C[C@@H]2C[C@H]2C1 1548791495 FGHGMCJUHNEJRW-QWRGUYRKSA-N 261.321 2.150 10 20 CECD CCOc1cccc(CNCCC[C@H](C)CO)c1O 230159856 XSICSHWPOXDXNU-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CCc1cccc(CN[C@@H]2CCC[C@@H]2C(=O)O)c1O 1597586575 IVGQKUDBFHDFNM-QWHCGFSZSA-N 263.337 2.298 10 20 CECD COc1cccc(CNCc2cc(C(=O)O)oc2C)c1O 1599673627 HAEJRTQLIOHKMQ-UHFFFAOYSA-N 291.303 2.290 10 20 CECD CC(C)C[C@@H](CO)N[C@@H](C)c1cc(C(=O)O)ccc1O 1591436117 FHCXYSNXUMXWJC-JQWIXIFHSA-N 281.352 2.148 10 20 CECD C[C@H](C(=O)O)[C@H]1CCCN1Cc1ccc(N(C)C)cc1 1776224910 VBDQQURIBTYKBN-SWLSCSKDSA-N 276.380 2.438 10 20 CECD CC[C@@H](CC(=O)O)NCc1cc(F)cc(F)c1O 1776952264 BHOAJYPRCVINHF-VIFPVBQESA-N 259.252 2.013 10 20 CECD CN(C)c1cc(F)c(CN[C@H](C(=O)O)C2(C)CC2)cc1F 1777038094 WKHWZGWKXKXHIQ-CYBMUJFWSA-N 298.333 2.374 10 20 CECD Cc1cc(C(=O)NCc2ccc(O)c(O)c2)ccc1F 158934195 XRWOGJIKYMJFKC-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CCc1cccc(CN2CCO[C@H](CF)C2)c1O 848917533 ULSQLKCGPSDDSK-CYBMUJFWSA-N 253.317 2.125 10 20 CECD Cc1ccc(CNC[C@](C)(O)C(F)(F)F)c(O)c1 877121395 SJYAPXYNMUMGLR-NSHDSACASA-N 263.259 2.104 10 20 CECD O=S(=O)(Cc1ccccc1)NCc1ccccc1O 134912176 OEQKOXIILROYAA-UHFFFAOYSA-N 277.345 2.012 10 20 CECD CC[C@@H]1CN(C(=O)c2cccc(O)c2O)[C@H](CC)CO1 403780305 ADPAIQHCSRKLNT-GHMZBOCLSA-N 279.336 2.127 10 20 CECD Cc1cccc(O)c1CNCCNC(=O)OC(C)(C)C 877147220 RLRHDZKZZJLJCH-UHFFFAOYSA-N 280.368 2.315 10 20 CECD COc1ccc(O)c(CNC(=O)c2occc2C)c1 114543178 LYCLWMRDSGQNFR-UHFFFAOYSA-N 261.277 2.232 10 20 CECD O=C(N[C@@H](CCO)C1CCCCC1)c1cccc(O)c1O 187207364 JSLVEGQQVHCZLV-ZDUSSCGKSA-N 293.363 2.159 10 20 CECD CN(C)c1ccc(CNC(=O)COC(C)(C)C)cc1F 182657908 LZPVLRAUUNVHEF-UHFFFAOYSA-N 282.359 2.323 10 20 CECD COc1cccc(CN[C@H]2CC[C@H](CO)CC2)c1O 153153755 FSFQZGVACBIKQX-BJHJDKERSA-N 265.353 2.042 10 20 CECD Cc1cccc(NC(=O)NCCc2ccc(O)c(O)c2)n1 122585779 SONVNOMWGRHRLB-UHFFFAOYSA-N 287.319 2.165 10 20 CECD C[C@@H](Cc1ccco1)NCc1cc2c(cc1O)OCO2 42879913 PAONOWQDUZHWKD-JTQLQIEISA-N 275.304 2.435 10 20 CECD CCCOc1ccc(CN2CC[C@H](C)[C@@H]2CO)c(O)c1 191176026 FCOCOZNFWWDETI-WFASDCNBSA-N 279.380 2.384 10 20 CECD CCCOc1ccc(CN(C)CCOC)c(O)c1 133464175 QZUGEJFHASEUGN-UHFFFAOYSA-N 253.342 2.259 10 20 CECD C[C@H](NC[C@@H](C)O)c1cc(Br)c(F)cc1O 134899488 NRRYCENOMWBXJN-RQJHMYQMSA-N 292.148 2.325 10 20 CECD Cc1cc(O)c(CN2CCS(=O)(=O)CC[C@@H]2C)cc1C 191344315 RSROAFSJDSOXCG-ZDUSSCGKSA-N 297.420 2.018 10 20 CECD OC[C@H]1CCCN1Cc1cc(Br)ccc1O 92470666 OWNNCONXFZRQBE-LLVKDONJSA-N 286.169 2.111 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](OC)C2CC2)c1 293602203 DMUSMZHDSNKPMH-MEBBXXQBSA-N 265.353 2.476 10 20 CECD CNC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 247841900 QICBNMPNWQFSQN-UHFFFAOYSA-N 258.321 2.462 10 20 CECD CCCOc1ncc[nH]c1=NCc1ccc(OC)cc1O 527996101 OFYDNXJFUDAOIL-UHFFFAOYSA-N 289.335 2.014 10 20 CECD CCN(C)c1ccc([C@H](C)NCCCS(C)(=O)=O)cc1 268927611 RXIWMPRTUZKZAU-ZDUSSCGKSA-N 298.452 2.228 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCCSC1 267251585 BPHADKWTFVBVNF-GFCCVEGCSA-N 280.393 2.429 10 20 CECD CC[C@H](NCc1nnc2n1CCC2)c1ccc(F)cc1O 285509238 DGRNFUABQMQTJY-LBPRGKRZSA-N 290.342 2.310 10 20 CECD COC(=O)[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1C 373494277 BRFZYTAPPXQXJG-BXKDBHETSA-N 283.755 2.287 10 20 CECD COCc1cnc(NC(=O)c2ccc(C)c(O)c2O)s1 804305284 LNGVXSTYWWPELE-UHFFFAOYSA-N 294.332 2.261 10 20 CECD C[C@H]1C[C@H](NC[C@@H]2C[C@H](F)CN2)c2c(O)ccc(F)c21 817977066 ZXVCZBRIISPTSD-GMOBBJLQSA-N 282.334 2.369 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=S)NC2CCC2)c1 814197333 XGMYBXXJRJJBRX-SECBINFHSA-N 280.393 2.478 10 20 CECD C[C@H]1OCC[C@]1(O)CNCc1ccc2ccccc2c1O 816593869 HEYKCSKSDSIXEY-PXAZEXFGSA-N 287.359 2.175 10 20 CECD CCOC(=O)c1ccc(C(=O)NCc2ccccc2O)cc1 810274814 DOFLOVXWOVTKPR-UHFFFAOYSA-N 299.326 2.499 10 20 CECD COC[C@@H](C)[C@H](C)C(=O)N(C)Cc1ccccc1O 812475675 WRJGKEVRGWQAMH-NEPJUHHUSA-N 265.353 2.269 10 20 CECD CCN(Cc1cccc(Br)c1O)[C@@H](C)CO 816653622 BAOGWINIAHCJJE-VIFPVBQESA-N 288.185 2.357 10 20 CECD Cc1cc(CN2CC[C@@H](C)C[C@H]2C(N)=O)ccc1N(C)C 815095169 AMUJVLPQKGKLMP-WBMJQRKESA-N 289.423 2.147 10 20 CECD CC(C)OC(=O)[C@H](C)NCc1ccc(N(C)C)cc1 825117623 IHYNKUNRNPTPOB-LBPRGKRZSA-N 264.369 2.182 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(F)c1O)[C@H](C)O 824920868 ADRZYUWHBNIKJF-WRWORJQWSA-N 261.724 2.434 10 20 CECD CCOc1ccc(CN[C@@H](CC(C)C)C(=O)O)c(O)c1 820386942 BYVWHLRUJYODNP-ZDUSSCGKSA-N 281.352 2.380 10 20 CECD O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1cc(O)cs1 732273242 OCIXDOSCQOCHPD-NSHDSACASA-N 293.348 2.082 10 20 CECD CCOCc1cc(CN[C@@H](C)[C@@H](C)C(=O)O)ccc1OC 901448774 MTPSANCVQYIDAK-NEPJUHHUSA-N 295.379 2.431 10 20 CECD CN(C)c1ccc(/C=C/CNCC2(C(=O)O)CC2)cc1 901509664 YZYFGHJXLPUHTR-ONEGZZNKSA-N 274.364 2.220 10 20 CECD CC[C@@H](N[C@@H](C)CC(=O)NC)c1ccc(C)cc1O 834898661 ATVNGDOAAKENNX-WCQYABFASA-N 264.369 2.266 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)NOC1CCC1 836319822 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1118241612 IIEKZMVKWIPSDN-VIFPVBQESA-N 273.716 2.007 10 20 CECD COc1cccc(CN(C)C[C@H]2CCCCO2)c1O 132605686 QLURWXKZCXQAMH-CYBMUJFWSA-N 265.353 2.402 10 20 CECD C[C@H]1CC[C@@H](Cn2cc(COc3ccc(N)cc3)nn2)O1 881393070 HJCJWOPAWAOUML-NHYWBVRUSA-N 288.351 2.007 10 20 CECD C[C@H](NC(=O)c1c(F)ccc(O)c1O)c1ccccn1 789938969 KCLNILOSGRFRQC-QMMMGPOBSA-N 276.267 2.123 10 20 CECD OC[C@]12C[C@H]1CN(Cc1ccc(N3CCCCC3)cc1)C2 783745888 WXPUTUNYBDOFDU-FUHWJXTLSA-N 286.419 2.491 10 20 CECD COc1ccc(CNC/C=C/Cl)c(O)c1OC 898424080 BNYZASRZXMONOC-ZZXKWVIFSA-N 257.717 2.252 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CC[C@H](CN)CC1 892450041 PBTIVKYMIPUHHA-MQMHXKEQSA-N 291.395 2.051 10 20 CECD COc1ccc(CN2C[C@@H]3[C@@H](C2)C3(F)F)c(O)c1OC 895185429 MGHPJZUIFLNQPG-NXEZZACHSA-N 285.290 2.106 10 20 CECD C[C@@H]1CSC[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 796603964 CGYUULNTBFGKJP-BXUZGUMPSA-N 293.436 2.303 10 20 CECD COc1cccc(O)c1CNCC1(O)CCCCC1 726605602 GEHPWVYDLYYTPQ-UHFFFAOYSA-N 265.353 2.186 10 20 CECD CCOc1cccc(CN[C@H]2CCN(C)[C@H](C)C2)c1O 90721532 VWYUFMJQRUEVLT-OCCSQVGLSA-N 278.396 2.363 10 20 CECD NCCCOC1CCN(Cc2cc(Cl)ccc2O)CC1 94070670 DLPCVVGMQUKMDL-UHFFFAOYSA-N 298.814 2.375 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 1328400771 WQDUAMBGXXZWMJ-HKUMRIAESA-N 277.364 2.252 10 20 CECD C=CC(=O)NCc1ccc(N(CC)CC)c(F)c1 1336724142 OLJHMHHZVPXCEV-UHFFFAOYSA-N 250.317 2.474 10 20 CECD C[C@H](NCc1ncccc1F)c1cc(C(=O)O)ccc1O 1609777220 ACDJAINETSKNQE-VIFPVBQESA-N 290.294 2.475 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](O)CC(C)C)c1 223739147 ZRXQBSABUWECFH-NEPJUHHUSA-N 267.369 2.458 10 20 CECD O=C(O)c1ccnc(NCc2ccc(N3CC=CC3)cc2)n1 1602483455 PQNMYFITBREPIE-UHFFFAOYSA-N 296.330 2.163 10 20 CECD CC[C@@H](NCC[C@H](C)F)c1cccc(-c2nn[nH]n2)c1O 1590468146 SWPSFSPKHGHQLP-JOYOIKCWSA-N 293.346 2.361 10 20 CECD CCOc1cccc(CN[C@H](C)Cn2cccn2)c1O 37155470 LBTXUTDYONWZAA-GFCCVEGCSA-N 275.352 2.166 10 20 CECD CN(C)c1ccc(CNCCC(C)(C)CO)cc1 294907253 XTLLKRPFXJYAGL-UHFFFAOYSA-N 250.386 2.251 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC2(C)OCCO2)c1 183893728 QWBWRLPZPYHCFV-LLVKDONJSA-N 281.352 2.205 10 20 CECD CCc1cccc(CN2CCN(CC)[C@@H](C)C2)c1O 709290793 PDPJWUZYTYCWSI-ZDUSSCGKSA-N 262.397 2.481 10 20 CECD C[C@@H](CC(=O)NCc1ccc(N(C)C)cc1)n1cccn1 20991100 LCABGBAYWCLLCK-ZDUSSCGKSA-N 286.379 2.217 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cc[nH]c(=O)c2)cc1 177949560 HAMNLAQJVGACMJ-UHFFFAOYSA-N 299.374 2.151 10 20 CECD O=C(NC1CC1)[C@H]1CCCN1Cc1cccc(Cl)c1O 179726631 NYWSJKUWHNEKEG-CYBMUJFWSA-N 294.782 2.289 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCCC(=O)NC 180163042 JEGWGAUCGOYRTR-UHFFFAOYSA-N 292.379 2.047 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1cccc(OCC)c1O 182325442 KZBUSIYOMWOKQT-INIZCTEOSA-N 292.379 2.412 10 20 CECD CCOc1cccc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)c1O 313741018 CABODUFKWLMYNB-WCQYABFASA-N 293.363 2.334 10 20 CECD O=C(NCc1ccccc1O)c1cccc2c1OCCO2 133747381 LTJNXKLELCQDNT-UHFFFAOYSA-N 285.299 2.093 10 20 CECD CCN(CC)c1ccc(CN(C)CCC(=O)NC)cc1 193839837 UUEPVEVYWZZJCJ-UHFFFAOYSA-N 277.412 2.101 10 20 CECD COc1cc(CN2CCO[C@H](C)[C@H]2C)c(O)cc1C 245547935 WVGSFMPIPJROTK-VXGBXAGGSA-N 265.353 2.318 10 20 CECD Cc1cccc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c1O 271867443 RLWTXIMDOHMRCH-IUUKEHGRSA-N 267.394 2.042 10 20 CECD CC/C=C(\C)C(=O)NCc1ccc(N2CCOCC2)cc1 299433744 QYRODDDSHSMCCE-LNKIKWGQSA-N 288.391 2.496 10 20 CECD CC(=O)C(=O)COC(=O)c1oc2ccccc2c1C 808483038 CSLNLTKFRDDIQI-UHFFFAOYSA-N 260.245 2.056 10 20 CECD CNC(=O)CCN(Cc1ccc(N(C)C)cc1)C(C)C 299191208 DRHXVDDXWKNJKM-UHFFFAOYSA-N 277.412 2.099 10 20 CECD CC(C)(C)c1ncc(/C=C2\SC(=S)NC2=O)cn1 806565594 PLRKSEWOEGYAOJ-YWEYNIOJSA-N 279.390 2.263 10 20 CECD CCN(CC(=O)NCC1CC1)c1ccc(OC)cc1 299340060 DTWCGWULVIYRLZ-UHFFFAOYSA-N 262.353 2.048 10 20 CECD C[C@@]1(CN[C@H]2CCc3cccc(O)c32)CCCNC1 817966445 NZWKBZQDYSCCAP-XJKSGUPXSA-N 260.381 2.359 10 20 CECD CCn1ncnc1CNCc1ccc2ccccc2c1O 816596936 XRLQAFISEJSGBS-UHFFFAOYSA-N 282.347 2.447 10 20 CECD CC[C@](C)(NCc1ccc(N(C)C)c(C)c1)C(=O)OC 815080351 AFZVVJCZBDWAIS-INIZCTEOSA-N 278.396 2.492 10 20 CECD COc1ccc(N2CCC(NCCNC3CC3)CC2)cc1 817952268 DEVQUFCFAIKNEX-UHFFFAOYSA-N 289.423 2.006 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CCOC[C@H]2OC)c1 824709457 QIWKLTSJDAZDOW-MQIPJXDCSA-N 295.379 2.103 10 20 CECD COc1cc(O)c(CNCCC[C@H]2CCOC2)cc1OC 825144803 RJPZDSMJJBAVGP-LBPRGKRZSA-N 295.379 2.316 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CC1(F)F 825873501 KZCCVTJHCAMSLU-LBPRGKRZSA-N 268.307 2.332 10 20 CECD CC[C@@H](NCCN1CCCOCC1)c1ccc(F)cc1O 903226545 HDIRNTGVGSUHMJ-OAHLLOKOSA-N 296.386 2.294 10 20 CECD CNC(=O)C[C@H](C)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 834900547 QRZIYUUBQPGPIZ-ATZCPNFKSA-N 280.343 2.194 10 20 CECD C[C@H](NC(=O)NOCC1CC1)c1ccc(N(C)C)cc1 838612888 USYPILNWXCEOCK-NSHDSACASA-N 277.368 2.454 10 20 CECD CN1CCCc2cc(CNC(=O)C[C@@H]3CCOC3)ccc21 739536780 PPHIKNAVZFOSEU-AWEZNQCLSA-N 288.391 2.112 10 20 CECD CCOc1ccc(CN[C@@H]2CO[C@H](C)C2)c(O)c1 842776765 ZRIBUOZRXZLGSO-PWSUYJOCSA-N 251.326 2.058 10 20 CECD CCOCc1cc(CNC[C@@H](N)C2CC2)ccc1OC 841050096 OQTBWLFWGXCCRC-OAHLLOKOSA-N 278.396 2.059 10 20 CECD Cc1cc(N(C)C)ccc1CNCCOC[C@H]1CCCO1 840933726 IFSFVIGCNJSSHC-QGZVFWFLSA-N 292.423 2.346 10 20 CECD CCCN1C[C@@H](CNCc2cccc(CC)c2O)CC1=O 848918312 VTMCWFFVNSLHRS-CYBMUJFWSA-N 290.407 2.303 10 20 CECD Cc1noc2ncc(C(=O)NCc3ccccc3O)cc12 748345720 ITZLXQGFQBZEJA-UHFFFAOYSA-N 283.287 2.167 10 20 CECD C[C@@H](CCCN)NCc1cc(Cl)cc(F)c1O 841079980 MLHRTMCFBLYDAY-QMMMGPOBSA-N 260.740 2.402 10 20 CECD CC/C=C(\C)C(=O)N(CC(=O)O)Cc1ccccc1O 911485683 JZCPXMPOOTWSCH-IZZDOVSWSA-N 277.320 2.162 10 20 CECD CN1CCCc2cc(CNC(=O)CCC(C)(C)N)ccc21 844177204 BIMBMOXNSUXNRI-UHFFFAOYSA-N 289.423 2.203 10 20 CECD CN(C)c1ccc(CNC(=O)C2(CC(=O)O)CCC2)cc1 843339366 MYDZAUGIXMUZHH-UHFFFAOYSA-N 290.363 2.014 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H](C)C(=O)O 848585387 LJCDIMURNHLOCH-LLVKDONJSA-N 294.351 2.035 10 20 CECD C[C@H](NCCCN1CCOCC1)c1ccc(Cl)cc1O 841744760 SQTRHKHKYKAFNP-LBPRGKRZSA-N 298.814 2.419 10 20 CECD Cc1ccc([C@H](C)NCc2ccc(C(N)=O)nc2)c(O)c1 756641937 ZNEPYUXKWYJQLR-NSHDSACASA-N 285.347 2.045 10 20 CECD CN(C)c1cc(F)c(CNC[C@@H](O)C(F)(F)F)cc1F 858106422 ISEHHGYGLVBVOG-LLVKDONJSA-N 298.255 2.044 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCSC2)c1 762536344 NBEXSUSCTSJYHQ-ZJUUUORDSA-N 281.377 2.331 10 20 CECD CCCOc1ccc(CN[C@@H](C)CC(=O)NC)cc1C 873129294 KIYHZAKLNVBJLF-ZDUSSCGKSA-N 278.396 2.398 10 20 CECD C[C@H](NC(=O)Nc1ccncn1)c1ccc(N(C)C)cc1 770769189 VADKLAGHDKGFTI-NSHDSACASA-N 285.351 2.425 10 20 CECD Cc1cccc(O)c1CN[C@H]1CN(C2CC2)C[C@H]1C 877094187 IAGQRVDSDZSGDE-DOMZBBRYSA-N 260.381 2.273 10 20 CECD C[C@@H](Cc1cnccn1)NCc1cc(F)cc(F)c1O 882938104 YVHRASVARUUWCL-VIFPVBQESA-N 279.290 2.181 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2ccc3c(c2)CCCO3)C1 895470989 GBSSVPSOYYNBHD-HDJSIYSDSA-N 275.348 2.053 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCCC[C@@H]2O)c1O 894914207 LIHLIEUGQOVSNN-OCCSQVGLSA-N 279.380 2.350 10 20 CECD COCCC1(NCc2cc(OC)ccc2O)CCC1 793329620 PRZGKSOGZCPJMG-UHFFFAOYSA-N 265.353 2.450 10 20 CECD COCC1(NCc2cccc(Br)c2O)CC1 390406319 BMVJZEVUNYFBSD-UHFFFAOYSA-N 286.169 2.423 10 20 CECD COc1cc(CNCc2ccc3c(c2)CCO3)ccn1 58062519 LSTFQVSYERGGKD-UHFFFAOYSA-N 270.332 2.315 10 20 CECD CC(C)(C)OCCCNCc1cc2c(cc1O)OCO2 710023883 PBXPHERMZOVWFC-UHFFFAOYSA-N 281.352 2.416 10 20 CECD C[C@@H]1C(=O)CC[C@H]1CC(=O)NCc1ccc(N(C)C)cc1 792846856 CBXGPIKMEZRCHX-JSGCOSHPSA-N 288.391 2.374 10 20 CECD COc1cccc(CNC[C@@H]2C[C@@H](C)O[C@@H]2C)c1O 686510848 IESWMSOBPVMVEN-WZRBSPASSA-N 265.353 2.304 10 20 CECD CC(F)(F)C1(C(=O)NCCc2ccc(N)cc2)CC1 692803473 JGYXVZQLAYRHFK-UHFFFAOYSA-N 268.307 2.363 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](F)CC 1353713283 KQHGEFOMQXRCFC-LBPRGKRZSA-N 297.326 2.032 10 20 CECD C[C@@H]1CCC[C@@H](OCC(=O)NCc2cccc(O)c2O)C1 1521851624 NTDONHXUNSYHEC-DGCLKSJQSA-N 293.363 2.309 10 20 CECD CCN(C)c1ccc(CN[C@@](C)(CCF)C(=O)O)cc1 1605410921 PPVOZEGSHBUDDA-HNNXBMFYSA-N 282.359 2.435 10 20 CECD CN(Cc1ccc(N)cc1)[C@@H](CO)CC(C)(C)C 1578489934 WZAFYBJNYPKDAZ-CQSZACIVSA-N 250.386 2.498 10 20 CECD COc1ccc(CNCc2cnn(C)c2C)cc1C 229807436 XLMYRCMNXYYPSF-UHFFFAOYSA-N 259.353 2.335 10 20 CECD C[C@H](NCCCCF)c1cc(C(=O)O)ccc1O 1593265393 SFMUKJBVQYJFAG-VIFPVBQESA-N 255.289 2.491 10 20 CECD C[C@@H](NC(=O)[C@H]1CC[C@@H](C(=O)O)C1)c1ccccc1O 1594206415 CKAFMGBZPBOWJG-OUAUKWLOSA-N 277.320 2.070 10 20 CECD CN1CCCc2cc(CNC(=O)C(F)(F)F)ccc21 169812759 ZHGPLXPOYHSDEP-UHFFFAOYSA-N 272.270 2.248 10 20 CECD C[C@H](NC[C@@H]1CCCO1)c1ccc(N2CCOCC2)cc1 153050085 PFFSGGUUADISCA-YOEHRIQHSA-N 290.407 2.353 10 20 CECD COCCO[C@H]1CCCN(Cc2cccc(C)c2O)C1 802652218 ASJVPESJPQYLCM-HNNXBMFYSA-N 279.380 2.328 10 20 CECD Nc1ccc(CC(=O)NC[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 1122427782 DJSGYYLLIQEVJV-IHRRRGAJSA-N 256.349 2.140 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)Cn2ccnc2)c1 37157733 IKGIKPQDVNQYCH-RYUDHWBXSA-N 275.352 2.337 10 20 CECD CCOc1cccc(CNC(C)(C)CN(C)C)c1O 308609860 STRCECIMYXMUNV-UHFFFAOYSA-N 266.385 2.221 10 20 CECD CC(C)CS(=O)(=O)N[C@H](C)c1ccccc1O 867834669 UPVUNRSXLTYEIS-SNVBAGLBSA-N 257.355 2.029 10 20 CECD Cc1oc(C(=O)O)cc1COc1ccc(F)nc1 1600832442 QNBHSHDIBRDSMK-UHFFFAOYSA-N 251.213 2.399 10 20 CECD CNC(=O)CCN(C)Cc1cc(Cl)cc(Cl)c1O 179410558 KBIQEYSZMLUBCD-UHFFFAOYSA-N 291.178 2.267 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2nccc(OC)n2)c1 301195368 NGHVYVLETAUDEM-SECBINFHSA-N 275.308 2.373 10 20 CECD COc1ccc(O)c(CN[C@H](CCO)c2ccco2)c1 187528968 JNXVMRIKPNXQSY-CYBMUJFWSA-N 277.320 2.207 10 20 CECD Oc1ccccc1CN1CCN(Cc2ccncc2)CC1 184714001 JQFBPNUXYDUKST-UHFFFAOYSA-N 283.375 2.105 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](C)C(N)=O)c1C 73019270 LVPDMCIFJUWCKI-LBPRGKRZSA-N 299.374 2.006 10 20 CECD O=C(CSc1nccs1)Nc1nccs1 47239423 OHVGGJKKICCFOZ-UHFFFAOYSA-N 257.365 2.330 10 20 CECD CC1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCCO1 368015605 ANQIATWNNVVDSU-FNORWQNLSA-N 291.347 2.139 10 20 CECD Oc1ccccc1CNC[C@H](O)CCc1ccccc1 273069848 GWJINWCYBFBCAB-MRXNPFEDSA-N 271.360 2.476 10 20 CECD Cc1ccc(O)c(CN[C@H]2CCc3c[nH]nc3C2)c1 378109232 JUAAANWDKYWSRX-ZDUSSCGKSA-N 257.337 2.071 10 20 CECD COCCN1CC[C@H](N[C@@H](C)c2c(C)cc(C)cc2O)C1 284206262 SLLXVSRWVLYHJM-GJZGRUSLSA-N 292.423 2.380 10 20 CECD O=C(CC1CC1)NCc1ccc(N2CCOCC2)c(F)c1 298847665 HECDRAHXGPFYMK-UHFFFAOYSA-N 292.354 2.079 10 20 CECD C[C@H](N[C@@H]1CCN[C@H](C)C1)c1cc(F)cc(F)c1O 817972657 ZHJVJGDTMADSBO-WCABBAIRSA-N 270.323 2.462 10 20 CECD CC(C)(C)n1cc(C(=O)C(=O)Nc2ccc(N)cc2)cn1 818556063 NMPOTGFONBZDSG-UHFFFAOYSA-N 286.335 2.042 10 20 CECD CC[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(F)F 824510763 ZRMRWQJSHUZJSD-VIFPVBQESA-N 260.240 2.434 10 20 CECD CC[C@H](CO)N(C)Cc1cccc(Br)c1O 824533163 BLPVZQYJMDYGPS-SNVBAGLBSA-N 288.185 2.357 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C)no2)c1 728985671 ZQLLRHOWJOUUIO-SECBINFHSA-N 276.292 2.188 10 20 CECD CN(Cc1cnc[nH]1)Cc1cccc(Cl)c1O 826768518 BHTRZFUVJCYZSS-UHFFFAOYSA-N 251.717 2.401 10 20 CECD C[C@@H](NC(=O)c1c2c(nn1C)CCCC2)c1ccccc1O 827941167 OIVFKXSSBDYFSN-LLVKDONJSA-N 299.374 2.496 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C1(CO)CCC1 827903244 GRORKDWGUWNCAF-UHFFFAOYSA-N 262.397 2.408 10 20 CECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)Cc1ccc(N)cc1 829805402 SVJBUEWWVITTGL-INIZCTEOSA-N 296.374 2.104 10 20 CECD C[C@@H](NC1CCN(C(=O)O)CC1)c1ccccc1O 827727221 HFDDPYLQSUQZGH-SNVBAGLBSA-N 264.325 2.185 10 20 CECD CCc1nocc1/C=C1\SC(=S)N(CC)C1=O 834398976 WDEAFXUZBKFNIG-UITAMQMPSA-N 268.363 2.458 10 20 CECD CCOc1cccc(CN[C@@H]2CCC[C@@H](N)C2)c1O 841055213 MALFFMGZSUQANF-CHWSQXEVSA-N 264.369 2.150 10 20 CECD C[C@@H]1C[C@@H](CN(C)c2ccc3c(c2)OCO3)CCN1 841012027 WTDOSXYOOSPKES-NEPJUHHUSA-N 262.353 2.240 10 20 CECD CC(C)N[C@@H]1CCCN(C(=O)Nc2ccc(N)cc2)C1 841299657 HKYOMQNUDRFSNB-CQSZACIVSA-N 276.384 2.263 10 20 CECD CC[C@H](C)CC[C@H](O)CC(=O)NCc1ccc(O)cc1O 910945986 GYDZTWHZAAUPJE-FZMZJTMJSA-N 295.379 2.291 10 20 CECD C[C@H]1C[C@@H](NCc2cc(Cl)ccc2O)CCN1 841061852 OARFNGNAQRTRJH-CABZTGNLSA-N 254.761 2.276 10 20 CECD CCc1cccc(CNCCN2CCOCC2(C)C)c1O 848901373 YMRKLOQPFNTKGF-UHFFFAOYSA-N 292.423 2.155 10 20 CECD CN(C)c1ccc(CNC[C@@]2(C)CCCNC2)cc1 841058334 VTWGBWQZFKMPAP-INIZCTEOSA-N 261.413 2.232 10 20 CECD CCc1cccc(CN2CCn3cncc3C2)c1O 848913117 OTDHWZPZXDUZQS-UHFFFAOYSA-N 257.337 2.167 10 20 CECD C[C@H](NCCN1CCC1)c1cc(F)cc(F)c1O 756769190 OSQAOKNGCPTWMR-VIFPVBQESA-N 256.296 2.027 10 20 CECD C[C@@H](NCC(=O)NC1CCCC1)c1cc(F)ccc1O 756705495 KJFOYWRPGSOOPR-SNVBAGLBSA-N 280.343 2.241 10 20 CECD CCOc1cccc(CN2C[C@H]3CCC[C@]3(N)C2)c1O 857226153 GARGZGROZNAPFC-CJNGLKHVSA-N 276.380 2.104 10 20 CECD COc1cccc(CNC(=O)NCC2CC(C)C2)c1O 856957807 HSEOAPMNGCPXKS-UHFFFAOYSA-N 278.352 2.246 10 20 CECD C[C@H](NCCN(C)CC(F)F)c1ccccc1O 858597622 SGMANHPNAROBAW-JTQLQIEISA-N 258.312 2.240 10 20 CECD COc1cc(C)cc(CNC(C)(C)c2noc(C)n2)c1O 754727156 QEWFOZUXUPOZHH-UHFFFAOYSA-N 291.351 2.426 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H]1CCC(=O)O1 851722884 SCWASBDVGZLFDU-CYBMUJFWSA-N 261.321 2.153 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CC1(O)CCCC1 935948276 KUHFUINBMFPNNP-UHFFFAOYSA-N 298.379 2.189 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)[C@H](C)C2)c1 764265803 SZMKQPQFEVJREU-MNOVXSKESA-N 291.347 2.022 10 20 CECD Cc1ccc(O)c(CNC(=O)c2c(C)nn(C)c2Cl)c1 862759466 GBMOVTYSYCUMGZ-UHFFFAOYSA-N 293.754 2.326 10 20 CECD CCCOc1ccc(CNC[C@]2(O)CCO[C@@H]2C)cc1C 873116447 FTXJFEQLRZMUBR-RHSMWYFYSA-N 293.407 2.413 10 20 CECD Cc1cccc(O)c1CN1C[C@@H](C)O[C@]2(CCOC2)C1 877492244 HSNKSEXXZBNMHX-CZUORRHYSA-N 277.364 2.080 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CC[C@@H]1N 1118241672 KBEZQXQIVTVVFD-PBHICJAKSA-N 273.424 2.456 10 20 CECD Cc1ccc(CN2CCO[C@H](COC(C)C)C2)c(O)c1 877402262 AWCSHTLJROJSHS-HNNXBMFYSA-N 279.380 2.326 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCCO1)c1ccc(N(C)C)cc1 774018179 RINJIGCLTFQTIC-DOMZBBRYSA-N 291.395 2.292 10 20 CECD Cc1noc(C(C)(C)NCc2cc(F)cc(F)c2O)n1 883113658 ZPZBZWNJXRBQJE-UHFFFAOYSA-N 283.278 2.387 10 20 CECD CC(C)CN1CCN(Cc2cc(F)ccc2O)[C@H](C)C1=O 779202580 OSCXDWQXRDJQRP-GFCCVEGCSA-N 294.370 2.220 10 20 CECD COc1ccc(CN2C[C@@H](C)OC[C@H]2C)c(O)c1OC 891669260 AYMPPWBRQYMKEY-GHMZBOCLSA-N 281.352 2.019 10 20 CECD COc1ccc(CNCc2cc(C)cc(OC)c2O)cn1 894165518 MFKGGRYHXSYYJU-UHFFFAOYSA-N 288.347 2.403 10 20 CECD C/C=C/C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891247710 UMGMOJLKGICFPP-LFAOLKIESA-N 275.396 2.048 10 20 CECD c1cc2c(cc1CN[C@H]1CCCC13OCCO3)CCO2 715636767 VCJAXBKDHJVLIU-HNNXBMFYSA-N 275.348 2.007 10 20 CECD Cn1nc([C@H]2CCCO2)cc1NC(=O)c1cc(O)cs1 791013069 RYGJUTWKUDCKED-SNVBAGLBSA-N 293.348 2.291 10 20 CECD CC1(C)CN(Cc2cc(Cl)ccc2O)C[C@H]1O 790938544 WZKNTPIQJSPKRH-GFCCVEGCSA-N 255.745 2.248 10 20 CECD CN1C[C@H]2CN(Cc3ccc(N4CCCC4)cc3)C[C@H]2C1 1204321150 HGSJJZLBXSRKDI-CALCHBBNSA-N 285.435 2.280 10 20 CECD C[C@H]1CSC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 796396560 SMUTZHJHACFWFP-GZMMTYOYSA-N 268.338 2.142 10 20 CECD COc1ccc(CNC(=O)Nc2cccc(F)n2)c(O)c1 797646171 RYQCBRKHTFFEBQ-UHFFFAOYSA-N 291.282 2.257 10 20 CECD COc1cccc(O)c1CN(C)CCCN1CCCC1 798958493 ZESOPGAYQIKLAC-UHFFFAOYSA-N 278.396 2.319 10 20 CECD C[C@@H](NCCCCS(C)(=O)=O)c1cc(F)ccc1O 818350959 NUDJRLHRUVZRGF-SNVBAGLBSA-N 289.372 2.007 10 20 CECD C[C@H](CCC(=O)O)CNCc1ccc(N(C)C)cc1 1321113641 MSKQYAFICGKDPD-GFCCVEGCSA-N 264.369 2.343 10 20 CECD CC(C)c1ncc(C(=O)NCc2ccccc2O)[nH]1 1339415633 FETYKMFXAVQYJI-UHFFFAOYSA-N 259.309 2.169 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCCCCN1)c1ccccc1O 1336994179 WMNRRWODXWKJIF-CHWSQXEVSA-N 291.395 2.285 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)C(=O)NCc1ccco1 1262018067 VFGOABNRQIVWAX-NEPJUHHUSA-N 288.347 2.341 10 20 CECD Cc1ccc(CN(C)[C@@H](COC(C)C)C(=O)O)c(O)c1 1600409526 BSMWBMVCNRJFSW-ZDUSSCGKSA-N 281.352 2.011 10 20 CECD CCCC[C@H](NCc1ccc(OC)c(OC)c1O)C(=O)O 1605244638 AXYIHLUCEPWTDA-NSHDSACASA-N 297.351 2.142 10 20 CECD C[C@H](CN1CCCCC1)NCc1cc(F)ccc1O 226584444 NAPLMFIRRMCRLE-GFCCVEGCSA-N 266.360 2.495 10 20 CECD COc1ccc(O)c(CN2CCO[C@H]3CCC[C@H]32)c1 228144048 UMEWJXSQKGUFIU-HIFRSBDPSA-N 263.337 2.154 10 20 CECD COc1cc(C)cc(CN(C)CCCC(=O)O)c1O 1594054430 HNDOHCDQWNHHSP-UHFFFAOYSA-N 267.325 2.006 10 20 CECD C[C@H](NC(=O)N(C)Cc1ccccc1O)C1CCOCC1 151141137 ZEYWOBMYFBFIMO-LBPRGKRZSA-N 292.379 2.349 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@]1(C)CCCCO1 837467563 IKEMLYOLPDPADC-HNNXBMFYSA-N 263.337 2.310 10 20 CECD C[C@@H](N[C@H](C)c1ccccc1O)C(=O)NC(C)(C)C 135719374 XDACWZXBIDJVTG-GHMZBOCLSA-N 264.369 2.346 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H]1CCc2cccc(O)c21 297794721 QBMMJPIAADOBRT-XHVZSJERSA-N 267.394 2.082 10 20 CECD Nc1ccc(CNC(=O)CC[C@H]2CCCCO2)cc1 69384351 HJTCUHFQBCVEAQ-CQSZACIVSA-N 262.353 2.234 10 20 CECD CCc1cccc(CNCC(C)(C)C(=O)OC)c1O 691435481 FKJNIHNXXNPWMK-UHFFFAOYSA-N 265.353 2.243 10 20 CECD CC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@@H](C)O 395246903 ARFWSYLZKTVYAV-BREBYQMCSA-N 253.342 2.211 10 20 CECD CCCn1nc(C)c(/C=C2\SC(=S)NC2=O)c1C 178028354 BXECAXUGUHUGBJ-POHAHGRESA-N 281.406 2.399 10 20 CECD Oc1ccc(Br)cc1CNCCn1ccnc1 227434644 MLZMIOUVMWDNSL-UHFFFAOYSA-N 296.168 2.141 10 20 CECD COc1ccc(O)c(CNCc2cccc(OC)c2O)c1 114505785 QXRVTOKNJUHYRG-UHFFFAOYSA-N 289.331 2.405 10 20 CECD CN(CCOC[C@@H]1CCCO1)c1ccc2c(c1)OCO2 121273424 OUZPTAFJLJPTTL-ZDUSSCGKSA-N 279.336 2.047 10 20 CECD C[C@H]1CCCCN1CCCNC(=O)c1cccc(O)c1O 126209094 CCBAXFVCWISDJD-LBPRGKRZSA-N 292.379 2.092 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1cc(Cl)ccc1O 185467009 OLPUSRFJLRVBQW-QMTHXVAHSA-N 287.787 2.484 10 20 CECD CN(Cc1ccccc1O)C[C@](C)(O)C(F)(F)F 281888822 DQZMVSFDZDYUDU-NSHDSACASA-N 263.259 2.137 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1ccon1 175030475 BTMOWHIZEAIPOY-UHFFFAOYSA-N 259.309 2.140 10 20 CECD Cc1oc(CNCc2ccccc2O)cc1C(=O)O 235974150 YPQJLCZEBGFHBO-UHFFFAOYSA-N 261.277 2.282 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@@H](COC)C2)cc1 93529518 YZMXQQUZDWIXIY-QGZVFWFLSA-N 292.423 2.380 10 20 CECD C[C@H](N(C)Cc1ccc(N(C)C)cc1)C(C)(C)O 295189587 QWAKBVYIFULKSH-LBPRGKRZSA-N 250.386 2.344 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H]2CCCOC2)c1 273412862 QEVIAIVYXAHOBR-NEPJUHHUSA-N 293.363 2.256 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](n3cncn3)C2)cc1C 368798227 DXGDGBTWRHLTRI-CQSZACIVSA-N 272.352 2.048 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cncnc1 273598296 FDGGFGPTCBJWPY-UHFFFAOYSA-N 284.363 2.205 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cccc(F)c2O)C[C@@H]1C 276517629 UTQDNMYZXSXJQU-CMPLNLGQSA-N 281.327 2.162 10 20 CECD CCOC(=O)[C@](C)(O)CN(C)c1ccc(OC(C)C)cc1 277253029 QKHILXSFJXDCJS-MRXNPFEDSA-N 295.379 2.224 10 20 CECD COc1ccc2c(c1)CCCCN2CC(=O)N(C)C1CC1 270887997 ONRYYESHGBROFZ-UHFFFAOYSA-N 288.391 2.459 10 20 CECD CCc1[nH]ccc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 285683708 BLLWUIXEPWSEHR-JTQLQIEISA-N 288.347 2.349 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H]2CCS(=O)(=O)C2)c(O)c1 285264153 QNKXFPNULKXHIP-QWHCGFSZSA-N 297.420 2.094 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCN2C)c1ccc(=O)[nH]n1 286250988 UJPWIQDUCREOCB-LBPRGKRZSA-N 298.390 2.003 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)C[C@@H](O)C1CC1 809752981 YPCNARFXRBFGFG-GFCCVEGCSA-N 273.735 2.387 10 20 CECD CCNC(=O)CN(CC)Cc1ccc(N(C)C)c(C)c1 293529166 PHHFPRBBFLSXQI-UHFFFAOYSA-N 277.412 2.019 10 20 CECD CN(C)c1ccc(CN2CCOCC23CC3)cc1F 802658443 BAQURKWYDXBSRH-UHFFFAOYSA-N 264.344 2.257 10 20 CECD COC[C@@H](NC[C@H](N)c1ccc(N(C)C)cc1)C(C)C 817939520 CAGXBVGVFQIDDP-JKSUJKDBSA-N 279.428 2.013 10 20 CECD CCOc1ccc(CN[C@@H](CC)[C@@H](C)O)c(O)c1 824921746 PQVHBLCLROEXSJ-MFKMUULPSA-N 253.342 2.040 10 20 CECD CC1(C)CCCN1CCNCc1cc2c(cc1O)OCO2 825327511 SQPXTUKPRGEZAJ-UHFFFAOYSA-N 292.379 2.085 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCc1cc[nH]n1 731281131 UYVVFMVCAAFCQI-UHFFFAOYSA-N 288.351 2.237 10 20 CECD CN(C)c1ccc(CNC2(CC(=O)O)CCC2)cc1F 901707025 MPQBDGQSCVRVMI-UHFFFAOYSA-N 280.343 2.379 10 20 CECD Cc1noc([C@H](C)OC(=O)c2cc(O)cs2)n1 732354264 IQSRCBWELIPSDE-YFKPBYRVSA-N 254.267 2.063 10 20 CECD CN(C)[C@H](CNC(=O)c1cc(O)cs1)c1ccco1 731864485 XXAOFMAJZROVLH-SNVBAGLBSA-N 280.349 2.079 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CCCO2)c1O 846138936 XZDBSUMIARXOAK-WDEREUQCSA-N 251.326 2.230 10 20 CECD CN(C)c1ccc(CN2CC[C@H]3NCC[C@H]3C2)cc1F 843128903 YYBLETVZXCMMJT-DZGCQCFKSA-N 277.387 2.076 10 20 CECD CSCC1(CC(=O)NCc2ccc(N)cc2)CC1 846298810 RAKUFIGHCGQIHQ-UHFFFAOYSA-N 264.394 2.418 10 20 CECD CO[C@@H](CC(=O)Nc1ccc(N)cc1)C(F)(F)F 846662629 VORBJNJOENPLCL-VIFPVBQESA-N 262.231 2.175 10 20 CECD CC(C)(C)n1cc(COC(=O)c2cc(O)cs2)nn1 849728049 LRJJAEVKHQUHEX-UHFFFAOYSA-N 281.337 2.157 10 20 CECD C[C@H]1[C@H](CO)CCCN1Cc1cc(F)ccc1O 840978547 OIMYYEWHCWHKJV-QWRGUYRKSA-N 253.317 2.124 10 20 CECD CCOCCC(=O)NCc1cc(Cl)ccc1O 846471779 AMYMNFJHINMBOW-UHFFFAOYSA-N 257.717 2.088 10 20 CECD CC(C)CCO[C@@H](C)C(=O)NCc1ccccc1O 748347116 VPZBEUMQYRXDSF-LBPRGKRZSA-N 265.353 2.460 10 20 CECD CCC(C)(C)N[C@H](C)C(=O)NCc1cc(OC)ccc1O 753984554 BNDFIGPDWIBAFS-LLVKDONJSA-N 294.395 2.184 10 20 CECD Cc1ccc([C@@H](C)C(=O)NCCc2ccc(O)c(O)c2)o1 762275707 YEKBBDIZZLTFIT-LLVKDONJSA-N 289.331 2.462 10 20 CECD O=C1CN(Cc2ccccc2O)CCN1c1ccccc1 765693317 LKXCATSZVDVIDC-UHFFFAOYSA-N 282.343 2.241 10 20 CECD C[C@H](O)CCN(C)Cc1cc(F)c(N(C)C)cc1F 862246636 LSQGBFMRPWCNEF-JTQLQIEISA-N 272.339 2.234 10 20 CECD CN(C)c1ccc(/C=C2/SC(=O)NC2=O)cc1F 874928945 YIQNKEBVQRVHBT-UXBLZVDNSA-N 266.297 2.216 10 20 CECD CC(=O)NCC[C@H]1CCCN(Cc2ccc(C)cc2O)C1 877530328 SHHJZONRMVCSGY-OAHLLOKOSA-N 290.407 2.439 10 20 CECD CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@@H](C)[S@]1=O 877519691 ZLLGIPMCTITWMW-VLXJIEOASA-N 281.421 2.432 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCn3ccnc3C2)c1 779064241 HPJYTHKFDUHKRK-VXGBXAGGSA-N 287.363 2.263 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCCCO 771522113 YIIMHYXZAXJANK-UHFFFAOYSA-N 265.353 2.293 10 20 CECD CCN(C)c1ccc(CN2CCN(C(=O)OC)CC2)cc1 773731234 SOOWTHJWRZSOLC-UHFFFAOYSA-N 291.395 2.027 10 20 CECD C[C@@H](NCC(=O)NC1CCCC1)c1ccccc1O 775137395 UDGBMEDYBFVUQI-LLVKDONJSA-N 262.353 2.102 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)NCc1cc(F)cc(F)c1O 882941026 GGZIDBBMDNDDGN-BDAKNGLRSA-N 286.322 2.063 10 20 CECD Nc1ccc(/C=C2\SC(N3CCCCC3)=NC2=O)cn1 899341638 GCFKJTPLQYIZAE-FLIBITNWSA-N 288.376 2.120 10 20 CECD COc1cc(C)cc(CNCc2cccnc2OC)c1O 894171033 BOEGATWPFAZHBS-UHFFFAOYSA-N 288.347 2.403 10 20 CECD Oc1ncccc1CNCc1ccc2c(c1)CCO2 714954087 LODCJVJTNKQYSD-UHFFFAOYSA-N 256.305 2.012 10 20 CECD CCc1cccc(CN[C@H]2CCC[C@H]2C(=O)O)c1O 1603975145 IVGQKUDBFHDFNM-OLZOCXBDSA-N 263.337 2.298 10 20 CECD CO[C@H]1CCN(Cc2cccc(Cl)c2O)[C@@H](C(=O)O)C1 1606757245 PKFLNZRFGJUZJX-CMPLNLGQSA-N 299.754 2.110 10 20 CECD Cc1occc1CNC[C@@H](N)c1ccc(N(C)C)cc1 1579930761 CGKFAYDAIJQORI-MRXNPFEDSA-N 273.380 2.444 10 20 CECD 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COc1cccc(O)c1CN(C)C1C[C@@H]2CC[C@H](C1)N2C 809704638 DMWNTAXJIHGJPL-PBWFPOADSA-N 290.407 2.458 10 20 CECD CCOC1(C(=O)NCc2ccc(OC)cc2O)CCCC1 803292761 WJMKZJFNYKAMQP-UHFFFAOYSA-N 293.363 2.366 10 20 CECD CCCN[C@@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 294775275 NGVGSNFSKKFPIP-ZDUSSCGKSA-N 277.412 2.099 10 20 CECD CC(=O)C(=O)COC(=O)Cc1c(C)nc2ccccc2c1C 808486152 IEYUPORMSBRILQ-UHFFFAOYSA-N 299.326 2.095 10 20 CECD COC[C@H](O)CNCc1ccc(N2CCC(C)CC2)cc1 819039817 UHLJNLCPEKARSH-QGZVFWFLSA-N 292.423 2.020 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1C1CCCCC1 819166675 ZZVMRKPPHBHQKK-UHFFFAOYSA-N 288.347 2.489 10 20 CECD CC[C@@H](O)CN[C@H](C)Cc1ccc(N(C)C)cc1C 819376760 IUELXBBVTYSHHS-CZUORRHYSA-N 264.413 2.353 10 20 CECD C[C@H](CS(C)(=O)=O)NCc1ccc2ccccc2c1O 816549837 ZTNRDGKXQUPSMW-LLVKDONJSA-N 293.388 2.068 10 20 CECD CNCCCN[C@@H](C)c1cc(Br)ccc1O 817942238 ZNIKTJJQLMUKNZ-VIFPVBQESA-N 287.201 2.415 10 20 CECD COc1ccc(CN[C@H]2CCN(C(C)(C)C)C2=O)cc1C 818112284 ZIOZWANPCQFKQB-AWEZNQCLSA-N 290.407 2.493 10 20 CECD CCCONC(=O)NCc1ccc(N2CC=CC2)cc1 828278772 WOICCAWOXGPHAH-UHFFFAOYSA-N 275.352 2.204 10 20 CECD CCn1ccnc1[C@@H](C)NCc1cc([N+](=O)[O-])ccc1O 825004977 AMGYSVYNIMUHAB-SNVBAGLBSA-N 290.323 2.368 10 20 CECD CN(Cc1cc(Cl)ccc1O)C1(CO)CCOCC1 827908857 RDWFSBGHTVDWHK-UHFFFAOYSA-N 285.771 2.019 10 20 CECD CC[C@@H](O)[C@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 822576082 GVNYERCJOFANGA-BLLLJJGKSA-N 290.407 2.092 10 20 CECD C[C@H]1[C@@H](CO)CCCN1Cc1ccc(N(C)C)cc1 839672808 HOXTWIPCUQONJA-DZGCQCFKSA-N 262.397 2.345 10 20 CECD O=C1[C@@H](NCc2cc(Cl)ccc2O)C[C@@H]2CCCCN12 835074288 RIRYXUHCRIWKOR-STQMWFEESA-N 294.782 2.289 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CS[C@H](C)C2)c(O)c1O 840511267 XKDYDZZQBWSQOO-BDAKNGLRSA-N 267.350 2.030 10 20 CECD C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)CS1 840415831 IPWFSNJIPSAACB-CMPLNLGQSA-N 280.393 2.428 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1ccc(N(C)C)c(F)c1 840956886 GJTVXIPGFXCYRE-AWEZNQCLSA-N 294.370 2.323 10 20 CECD CCOc1cccc(CN[C@H](C)C[C@H](C)N)c1O 843129642 RBGYRMFNYGOBER-WDEREUQCSA-N 252.358 2.006 10 20 CECD CCc1cccc(CN2CCC[C@H]2C(=O)NC2CC2)c1O 848880622 GMUHZANFMLWFCG-HNNXBMFYSA-N 288.391 2.198 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](O)C(C)C 840553993 BCBXSCLMKXHILW-CJNGLKHVSA-N 292.423 2.125 10 20 CECD O=C(Cc1cc[nH]n1)NCc1ccc(N2CCCCC2)cc1 743324500 DKFAPYQEGYTBQX-UHFFFAOYSA-N 298.390 2.259 10 20 CECD C[C@@H]1NCCN(Cc2cccc(Br)c2O)[C@H]1C 843056855 AZMBWBPQWOXUGE-UWVGGRQHSA-N 299.212 2.337 10 20 CECD Cc1ccc(O)c(CNCCC(C)(C)S(C)(=O)=O)c1 840960156 FJZXWHMTSQHGBZ-UHFFFAOYSA-N 285.409 2.004 10 20 CECD COC[C@H]1CCN(Cc2cc(C)cc(OC)c2O)C1 754741799 NOEDZYAIIPWXEW-LBPRGKRZSA-N 265.353 2.178 10 20 CECD CCSC1(CNC(=O)c2cc(O)cs2)CC1 856064598 DUBXPHOMBFTQIG-UHFFFAOYSA-N 257.380 2.469 10 20 CECD COc1ccc(O)c([C@H](C)NC2COC(C)(C)OC2)c1 757698398 QPQPBVAJYXIHJQ-JTQLQIEISA-N 281.352 2.203 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CCC[C@@]3(N)C2)cc1 857230131 ODJANBKOLXDTOA-GDBMZVCRSA-N 259.397 2.066 10 20 CECD CCOC[C@@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850565761 HWJBYUPBSXTPSZ-CQSZACIVSA-N 292.423 2.162 10 20 CECD CCN(CCC(=O)OC)Cc1cc(OC)c(C)cc1O 768449665 XUYHMSQVUCULFC-UHFFFAOYSA-N 281.352 2.094 10 20 CECD CCCN(c1ccc(CN)cc1)[C@@H]1CCCNC(=O)C1 877479703 WHNKCMRRUBRRBH-OAHLLOKOSA-N 275.396 2.030 10 20 CECD Cc1cccc(O)c1CNC1CCN(c2cccnn2)CC1 877477108 XPELACDCQXLEEH-UHFFFAOYSA-N 298.390 2.249 10 20 CECD C[C@H](C[C@H]1CCOC1)NC(=O)/C=C\c1ccc(O)c(O)c1 779527992 FGGKZOKDLNFGLR-KJGKVODESA-N 291.347 2.042 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](O)[C@H](C)C2)cc1 773846873 LHIPTTUFKYKLHX-CZUORRHYSA-N 262.397 2.345 10 20 CECD CC[C@H](NCc1cc(F)cc(F)c1O)[C@H](O)C(F)(F)F 883079088 JRBRJZFYEYWYRB-ONGXEEELSA-N 299.239 2.462 10 20 CECD CCCCNC(=O)[C@@H]1CCCN(Cc2ccc(N)cc2)C1 1120262828 FEIVSFVYAFOGGO-OAHLLOKOSA-N 289.423 2.397 10 20 CECD CCOC[C@@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898450366 QMRPDDLFGSVJRP-PBHICJAKSA-N 293.455 2.370 10 20 CECD C[C@@H]1C[C@@H](NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CO1 898447920 NFCAIXKGMCTFRW-FRFSOERESA-N 291.439 2.122 10 20 CECD CC[C@@H](NCCCn1cncn1)c1ccc(F)cc1O 796875314 XZOWPMJBXDTXOT-CYBMUJFWSA-N 278.331 2.254 10 20 CECD COc1ccc(CNC(=O)c2ccn(C(C)C)n2)c(O)c1 794377031 KQBUALJCSBFHLS-UHFFFAOYSA-N 289.335 2.108 10 20 CECD CO[C@@H](C(=O)NCc1ccc(N(C)C)cc1C)C1CC1 791593806 MAJFJUYPIRNGJN-OAHLLOKOSA-N 276.380 2.102 10 20 CECD CC[C@H](NCCN1CCC1)c1ccc(F)cc1O 796838903 FCJPYDZPXZTFER-ZDUSSCGKSA-N 252.333 2.278 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1ccc2c(c1)CCO2 193982298 DCPCDKOYBCOYDF-UHFFFAOYSA-N 291.328 2.128 10 20 CECD COC[C@H](O)CN[C@@H](C)c1ccc2ccccc2c1O 71270401 GHCGHRNHUBLDCS-WCQYABFASA-N 275.348 2.203 10 20 CECD CC(C)Oc1ccc(N(C)C[C@@H]2CN(C)C(=O)O2)cc1 1324488501 MDGUPHQKMQDXPC-CQSZACIVSA-N 278.352 2.361 10 20 CECD COc1ccc(CNC(=O)[C@H](C)n2cccc2)c(O)c1 1325005281 ZNFDPENSJHOOOY-NSHDSACASA-N 274.320 2.080 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](C(=O)O)C2(C)C)cc1 1777039444 SMJLMPJXEWWCBS-AWEZNQCLSA-N 276.380 2.438 10 20 CECD CC(C)[C@@H](CO)CN[C@H](C)c1cc(C(=O)O)ccc1O 1604332945 MVJWDKPCBLOXPB-ZYHUDNBSSA-N 281.352 2.006 10 20 CECD Cc1nsc(Sc2nccs2)c1-c1nn[nH]n1 1609466550 WVBKPDBCQXSTOM-UHFFFAOYSA-N 282.379 2.239 10 20 CECD CCCC[C@H](NCc1ccc(OC)c(C)c1)[C@H](O)C(=O)O 1776774486 CKDWPTBAJGLSGO-ZFWWWQNUSA-N 295.379 2.098 10 20 CECD CN(C)c1ccc(CN2C[C@H](C(=O)O)CC(F)(F)C2)cc1 1777039409 XTHRZVWDZSWPSD-GFCCVEGCSA-N 298.333 2.294 10 20 CECD CN1CCc2cc([C@@H](CN)N3CCCCC3)ccc21 34936242 GSYGCKALSIRLQO-MRXNPFEDSA-N 259.397 2.165 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)Cn2ccnc2)c1 37157737 IKGIKPQDVNQYCH-NWDGAFQWSA-N 275.352 2.337 10 20 CECD C[C@H](NCC1([S@@](C)=O)CCC1)c1cc(F)ccc1O 281024376 MNUVIQSEAHVYII-APBUJDDRSA-N 285.384 2.483 10 20 CECD FC1(F)CC(NCc2ccc(N3CCOCC3)cc2)C1 700110372 ZKTCDJJFWCBJJL-UHFFFAOYSA-N 282.334 2.411 10 20 CECD CON1CCC(N[C@@H](C)c2ccc(C)cc2O)CC1 692096073 AGVAFZQALOMCCO-LBPRGKRZSA-N 264.369 2.377 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](O)C[C@H]2C)c1O 384957721 RCWKPYKVBCRYOH-PRHODGIISA-N 283.755 2.203 10 20 CECD COc1cccc(CNC(=O)C(=O)c2ccc(C)cc2)c1O 105650892 TTYXAEBKXPJFRL-UHFFFAOYSA-N 299.326 2.208 10 20 CECD COc1ccc(CNCC2(OC)CCCC2)c(O)c1OC 1262372184 JRUBRLFMVMNCJZ-UHFFFAOYSA-N 295.379 2.458 10 20 CECD CCOc1ccc(N(C)CC[C@@H]2CCOC2=O)cc1 120688410 RORWXYKUROQGPI-GFCCVEGCSA-N 263.337 2.475 10 20 CECD CN(C)c1ccc(CN2CCCC3(C2)OCCO3)cc1 182077438 DPZQXPAWUTZIAQ-UHFFFAOYSA-N 276.380 2.092 10 20 CECD C[C@H]1C[C@H](CN)CN1Cc1cc(Cl)ccc1O 216020717 MLSJHRBHVAZBOQ-VHSXEESVSA-N 254.761 2.215 10 20 CECD CCS[C@@H](C(=O)NCc1ccc(O)c(O)c1)C(C)C 182523802 VWTZDYIFYZJHRC-CYBMUJFWSA-N 283.393 2.492 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C[C@@H](O)C(F)(F)F 183923267 ONLWRPGSPXQYFC-CYBMUJFWSA-N 290.329 2.498 10 20 CECD COc1cccc(CNC(=O)c2csnc2C)c1O 182264140 VRVRUKSOEOFALU-UHFFFAOYSA-N 278.333 2.096 10 20 CECD Cc1cc(C)c(O)c(CN2CCN(c3ncccn3)CC2)c1 125558569 YIVPRFUDJOEDIO-UHFFFAOYSA-N 298.390 2.121 10 20 CECD CNC(=O)CC1CCN(Cc2c(O)cccc2Cl)CC1 129606073 RHBPXLVXXQHBFP-UHFFFAOYSA-N 296.798 2.394 10 20 CECD COc1cccc(CNC[C@H]2CCCCO2)c1O 42812121 BRRZWYXEGNDLFC-GFCCVEGCSA-N 251.326 2.060 10 20 CECD COC(=O)CCCC(=O)NCc1ccc(N(C)C)cc1C 131218546 FISOWYHUPOAFDN-UHFFFAOYSA-N 292.379 2.021 10 20 CECD C[C@@H](O)CN[C@H](C)c1ccc(N2CCOCC2)cc1Cl 131145234 MCAAHHGIKMRZHN-VXGBXAGGSA-N 298.814 2.208 10 20 CECD OC[C@@H]1CCCN1Cc1cc(Br)ccc1O 92455543 OWNNCONXFZRQBE-NSHDSACASA-N 286.169 2.111 10 20 CECD CC(C)c1cc(C(=O)NCc2ccccc2O)nn1C 266949041 SZLMMOKZSUQMHM-UHFFFAOYSA-N 273.336 2.179 10 20 CECD CCOc1ccc(O)c(CNCC[C@H](C)OC)c1 263844103 ZGYNEWUOZHLULQ-NSHDSACASA-N 253.342 2.306 10 20 CECD OCCC1(CNCc2cc3c(cc2O)OCO3)CCCC1 266634157 QTVVQAMQFPORAX-UHFFFAOYSA-N 293.363 2.153 10 20 CECD CCOCCOCCN(C)Cc1cc(OCC)ccc1O 276112275 AFHRIVLHHBHDDF-UHFFFAOYSA-N 297.395 2.276 10 20 CECD Cc1cccc(CN[C@@H]2CCO[C@]3(CCOC3)C2)c1O 378459978 UZWFNWGBVYKCEK-GDBMZVCRSA-N 277.364 2.128 10 20 CECD CCCN(CCN1CCCC1)C(=O)c1cccc(O)c1O 287174734 HBTGRHCHGARTDF-UHFFFAOYSA-N 292.379 2.046 10 20 CECD CCOc1ccc(O)c(CN2CCN(CC)C[C@@H]2C)c1 289577973 JVQBDGBTSMGZLS-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD COc1cccc(CN2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@H]4OC)c1O 289623723 LRCUXTOILSZUGZ-SCYMPEOESA-N 289.375 2.256 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2CC1 295687932 UIKXSKPDIYDLPZ-IMIFBBOLSA-N 285.343 2.382 10 20 CECD C[C@H](CN[C@H](C)c1cc([N+](=O)[O-])ccc1O)CN(C)C 293604068 IYYJJECKPPCFQC-GHMZBOCLSA-N 281.356 2.149 10 20 CECD CO[C@@H](CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 293751401 QIPOABRERJQPKX-XPTSAGLGSA-N 280.324 2.376 10 20 CECD CC[C@H](N)CN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 817980726 WQAGZPJWMHTIJS-OCCSQVGLSA-N 295.402 2.050 10 20 CECD O=C(N[C@@H]1C[C@H]1C1CCC1)c1c(F)ccc(O)c1O 822413591 GAUHQZRQBQKXHX-WCBMZHEXSA-N 265.284 2.155 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2CCCC2)c1 734006325 RNCCLOKXLMWCND-UHFFFAOYSA-N 278.352 2.390 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC[C@H]1C[C@H]2CC[C@H]1O2 837586629 FITHIZAWUPPDGV-AHHFEDHVSA-N 290.315 2.222 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C(=O)O 833630330 RONPZFSGTHBFRZ-JQWIXIFHSA-N 280.343 2.044 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 837012479 ISZNDQXNTMFCPX-NHTZVMBPSA-N 291.347 2.041 10 20 CECD Cc1ccc(CNC[C@H](N)c2ccc(N(C)C)cc2)cn1 841041787 CDETVEOJHDYLAB-KRWDZBQOSA-N 284.407 2.246 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](N)C[C@H]2C)c1O 846707861 ZRNNCBRWFJIJLB-RNCFNFMXSA-N 280.343 2.046 10 20 CECD C[C@H]1CCC(=O)CN1C(=O)NCc1ccc(N(C)C)cc1 913926474 DMOYLMQBKHCRKH-LBPRGKRZSA-N 289.379 2.016 10 20 CECD CSCC[C@@H](C)NC(=O)NCCc1ccc(N)cc1 841829123 NNYRTAMLRHYSMB-LLVKDONJSA-N 281.425 2.252 10 20 CECD CCn1ccc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)n1 843832183 UKMTWLRVFDWYSN-JTQLQIEISA-N 289.335 2.108 10 20 CECD C[C@H](N[C@H]1CCCCNC1=O)c1ccc(Cl)cc1O 841743564 AYNQOOHFGFRZDN-CABZTGNLSA-N 282.771 2.365 10 20 CECD C[S@@](=O)c1cccc(NC(=O)c2cc(O)cs2)c1 748355507 RDKDLQBABJTLDQ-GOSISDBHSA-N 281.358 2.443 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](N)C[C@@H]2C)c1 846698514 IHEOOZHPALTUAG-AAEUAGOBSA-N 264.369 2.103 10 20 CECD CCCN(Cc1cccc(OC)c1O)[C@@H]1CCN(C)C1 843423071 VGTYMSCCMLGVKU-CQSZACIVSA-N 278.396 2.317 10 20 CECD CCOc1ccc(CN[C@H](C)[C@H]2CCCNC2)c(O)c1 841033069 KABMCBQLZKZCAK-OLZOCXBDSA-N 278.396 2.269 10 20 CECD Cc1ccoc1CC(=O)NCCc1ccc(N)cc1 851631947 IBNCCFQRUZCXDN-UHFFFAOYSA-N 258.321 2.072 10 20 CECD COC(=O)NC1CCN(Cc2cc(C)cc(C)c2O)CC1 853626242 QOWZHWVLQSEOLR-UHFFFAOYSA-N 292.379 2.329 10 20 CECD COC[C@](C)(O)CN[C@H](C)c1cc(Cl)ccc1O 756576479 NMHGRFZBHKLJLI-NOZJJQNGSA-N 273.760 2.094 10 20 CECD COCc1ccc(CNCCc2ccc(N)cc2)o1 863642148 SQEVLVUWDWXCNS-UHFFFAOYSA-N 260.337 2.341 10 20 CECD COc1nc(C)cc(NCc2cccc(OC)c2O)n1 760516066 RFFVHAFDXLFYSM-UHFFFAOYSA-N 275.308 2.120 10 20 CECD Cc1ccc(CN(C)CC2CCN(C)CC2)c(O)c1 876690389 KBFFTWLMPSBGIA-UHFFFAOYSA-N 262.397 2.474 10 20 CECD CCCOc1ccc(CN[C@@H](C)C(=O)NCC)cc1C 873007853 HTTWKRRCIMXOPG-ZDUSSCGKSA-N 278.396 2.398 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@]12CCOC2)c1ccc(N(C)C)cc1 773007377 HZGDCIJAYDMSSY-NUTKFTJISA-N 288.391 2.356 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](N)CCC(C)C)c1 876878736 JTGSRCXDJOOZKG-RISCZKNCSA-N 294.395 2.342 10 20 CECD CCN(C)c1ccc(Cn2cc(-c3cc[nH]n3)nn2)cc1 881314716 BUJBIYIMDMGZHB-UHFFFAOYSA-N 282.351 2.173 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccncc2)cc1 1122538816 IAGHZIGCMPJBLC-LSDHHAIUSA-N 267.332 2.084 10 20 CECD CCN(CC)c1ccc(CNC2(C(=O)O)CC2)cc1F 789898486 VOPWMFWDZJEKNA-UHFFFAOYSA-N 280.343 2.379 10 20 CECD COc1cc(C)cc(CN[C@]2(C)CCCOC2)c1O 894416000 OWYQSTXYBSTGQP-OAHLLOKOSA-N 265.353 2.368 10 20 CECD CC1=NO[C@@H](CNCc2cc(Cl)cc(F)c2O)C1 895306934 LDPQULFQBNAARS-SNVBAGLBSA-N 272.707 2.439 10 20 CECD COc1cc(O)c(CNC/C=C/Cl)cc1OC 898434296 VCUNLUKKQFMHQU-ONEGZZNKSA-N 257.717 2.252 10 20 CECD COc1ccc(CN[C@H](C)CCCCO)c(O)c1OC 894691446 ZWQGKHOTFYSGOP-LLVKDONJSA-N 283.368 2.050 10 20 CECD COc1cc(C)cc(CNCC2(CO)CCCC2)c1O 894480724 RGROQFXSOHYKAZ-UHFFFAOYSA-N 279.380 2.352 10 20 CECD CCN1CC[C@H](CNCc2cc(C)cc(OC)c2O)C1 894190131 JSBFTBRDTITEQY-CYBMUJFWSA-N 278.396 2.141 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN3CCC[C@H]3C2)c1O 894188223 SHZFOFNGEQCMEV-GJZGRUSLSA-N 290.407 2.426 10 20 CECD COc1ccc(CNC(=O)C[C@@H](C)C2CC2)c(O)c1 794381050 IUZVPCRZZVEURD-SNVBAGLBSA-N 263.337 2.453 10 20 CECD C[C@H](NC[C@@H]1CC[C@H](O)C1)c1ccc(F)cc1O 189307739 UCGPYFQZAAQSGT-UMNHJUIQSA-N 253.317 2.343 10 20 CECD Oc1c(F)cc(F)cc1CN1[C@H]2CC[C@H]1COC2 708444584 SDRFPLGVMSPDDB-QWRGUYRKSA-N 255.264 2.034 10 20 CECD COC(=O)c1ccnc(O)c1NCc1cc(C)ccc1O 798188715 GUSFDSCYARWWFW-UHFFFAOYSA-N 288.303 2.200 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2C[C@H]2c2ccncc2)cc1 1353005838 YUSMVURMALYJAT-JKSUJKDBSA-N 281.359 2.126 10 20 CECD CC(=O)NCC1CCN(Cc2cc(C)ccc2O)CC1 219488350 AUDQWVGRXCEPRM-UHFFFAOYSA-N 276.380 2.049 10 20 CECD C[C@@H](NCCOC1CCC1)c1cc(C(=O)O)ccc1O 1604342950 NWZHDLVNKRAEGX-SNVBAGLBSA-N 279.336 2.310 10 20 CECD CN1CCC(C)(CNC(=O)Nc2ccc(N)cc2)CC1 226356279 ZRQBDSSAZCPNMV-UHFFFAOYSA-N 276.384 2.122 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)c2nncn2C)c1O 228673260 NJRSQKXXMQNAHR-QMMMGPOBSA-N 296.758 2.034 10 20 CECD Cc1ccccc1[C@H](CO)NCc1ccc(N)cc1 1579790420 URNFPTUVTQXLAL-INIZCTEOSA-N 256.349 2.400 10 20 CECD CCN(C)C(=O)CN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 229588080 UAVYJSXNLYXWRT-NWDGAFQWSA-N 276.380 2.317 10 20 CECD COc1cc(Cl)cc(CN(C2CC2)[C@H](C)C(=O)O)c1O 1594058873 MFMKGXFIXNRCMZ-MRVPVSSYSA-N 299.754 2.492 10 20 CECD COc1cccc(CN2CCC[C@@](C)(OC)C2)c1O 230300016 WTJLJSYQTNFWQI-OAHLLOKOSA-N 265.353 2.402 10 20 CECD CC[C@H](NC1C[C@@H]2C[C@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1590466770 OIVLIRJGJLPGCH-BHDSKKPTSA-N 299.378 2.412 10 20 CECD CN(C)c1ccc(CN2CC(F)(F)C[C@]2(C)C(=O)O)cc1 1777039374 MBWRZPYIEYMRCS-CQSZACIVSA-N 298.333 2.437 10 20 CECD CCN(C)c1ccc(CNC2CC(C(=O)O)C2)c(C)c1 1776856983 ZSZHOSNOORAJBK-UHFFFAOYSA-N 276.380 2.404 10 20 CECD COc1cccc(CNC(=O)Nc2nocc2C)c1O 158868047 XUJIYWJZEBVSCU-UHFFFAOYSA-N 277.280 2.019 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C)[C@@H]2CCOC2)c1O 163076228 QPLCXMDQVCOHQC-GXSJLCMTSA-N 281.327 2.249 10 20 CECD CC[C@@H](O)CCNCc1cc(Br)ccc1O 166139535 RWCUWWVGLOAACP-LLVKDONJSA-N 288.185 2.405 10 20 CECD COc1ccc(CNCc2c(Cl)c(C)nn2C)c(O)c1 894185461 OJFYBLABOMHEGK-UHFFFAOYSA-N 295.770 2.386 10 20 CECD Cc1ccc(C(=O)N2CCn3cccc3[C@@H]2C)c(O)c1O 177668799 SBPIMUFUZGAASP-NSHDSACASA-N 286.331 2.425 10 20 CECD CCOc1ccc(O)c(CNCC(C)(C)OC)c1 174594454 NWLZINNYQWGLAV-UHFFFAOYSA-N 253.342 2.306 10 20 CECD O=C(O)[C@@H]1[C@@H]2CCC[C@H]2CN1Cc1ccccc1O 300006435 WMYDXHOLOBUQMB-SUHUHFCYSA-N 261.321 2.077 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1ccc(N(C)C)cc1 179886930 SYGFQBHQVINKRO-HNNXBMFYSA-N 276.380 2.280 10 20 CECD COc1cc(O)c(CN2CCOC[C@H]2C2CC2)cc1OC 180426126 GLEREGQWIDJGBU-ZDUSSCGKSA-N 293.363 2.020 10 20 CECD Cn1c(-c2ccccc2)cnc1SCCOCCO 78700384 BZLAESMIINZTHL-UHFFFAOYSA-N 278.377 2.188 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2nccs2)cc1 79404712 VPWDRJHGBQXGOI-UHFFFAOYSA-N 290.392 2.209 10 20 CECD CCOC1CC(NCc2ccc(OC)cc2O)C1 218987821 FAYPAXHVRRKSNX-UHFFFAOYSA-N 251.326 2.058 10 20 CECD O=C(C=C1CCC1)NCc1ccc(N2CCOCC2)cc1 87169972 NZFPZVSEYXHEQM-UHFFFAOYSA-N 286.375 2.250 10 20 CECD CCN(Cc1cnn(C)c1)Cc1cccc(OC)c1O 92438025 UQYLONNFPNAYNK-UHFFFAOYSA-N 275.352 2.156 10 20 CECD CCN(CCO)Cc1ccc(N2CCC(OC)CC2)cc1 267128226 CQBOOAQXTDOJBZ-UHFFFAOYSA-N 292.423 2.116 10 20 CECD CCc1nocc1CNCc1cccc(OC)c1O 816610721 VXBUXXCOXDTEOB-UHFFFAOYSA-N 262.309 2.241 10 20 CECD COc1cc(O)c(CN2CCC[C@@](C)(O)CC2)cc1OC 279685608 PFYXHYNKQKMYMU-MRXNPFEDSA-N 295.379 2.146 10 20 CECD CC[C@@H](NCc1cc(OC)ccc1O)[C@H](O)C(F)(F)F 271876158 ZLKYJIRESIGLRT-PWSUYJOCSA-N 293.285 2.192 10 20 CECD C[C@@H]1[C@@H](C)[S@@](=O)CCN1Cc1ccc(N(C)C)cc1 271196725 OAABMCWMIRXIPT-VPZZIHKRSA-N 280.437 2.094 10 20 CECD CCC[C@H](CNCc1ccc(N2CCOCC2)cc1)OC 378848785 UQKRUJGYSDVWKE-QGZVFWFLSA-N 292.423 2.428 10 20 CECD CN(CCO)Cc1cc(-c2ccccc2)ccc1O 271030348 XZCLJWDJTDZYPN-UHFFFAOYSA-N 257.333 2.483 10 20 CECD CN(C)c1ccc(CNc2nnc(C(C)(C)O)o2)cc1F 276480355 RYYXNECURZNSDI-UHFFFAOYSA-N 294.330 2.114 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)S(=O)(=O)[C@H](C)C2)cc1C 290388843 BMZGMDCUXVUCDM-BETUJISGSA-N 297.420 2.016 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H](O)c2cnn(C)c2)c(O)c1 294841732 RXRYWQUENNHJCK-SWLSCSKDSA-N 289.379 2.127 10 20 CECD OC[C@H]1CCCN1Cc1cc(Cl)c(F)cc1O 295061490 ZXNCJOYLRDQRKX-SECBINFHSA-N 259.708 2.141 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCCNCC2)c1 817969015 PJNLQUAAIFCMHR-NWDGAFQWSA-N 264.369 2.194 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@@H](N)Cc1ccccc1 827205798 UFKAUQAQCVEYHI-INIZCTEOSA-N 298.386 2.311 10 20 CECD Cc1ncsc1/C=C\C(=O)N1CCOc2ncccc21 492716184 MIZKFPYIYPAKPV-PLNGDYQASA-N 287.344 2.285 10 20 CECD O=C(COC(=O)c1cc(O)cs1)Nc1ccccc1 731909254 DWFOQLIWKFGQOU-UHFFFAOYSA-N 277.301 2.249 10 20 CECD CCOc1ccc(CN[C@H]2CCN(C)[C@H](C)C2)c(O)c1 742374629 AQWZPBLGNVLUPS-OCCSQVGLSA-N 278.396 2.363 10 20 CECD CCOc1ccc(CN2CCC[C@H](CCN)C2)c(O)c1 843112657 KWZXPBOXMGIWGZ-CYBMUJFWSA-N 278.396 2.352 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)c1ncn(C)n1 840939290 MPAFADJQXQXURI-GFCCVEGCSA-N 273.384 2.040 10 20 CECD COc1cccc([C@H](C)NC[C@@H](C)CN(C)C)c1O 846170242 MVPDPCQLGCXWCC-NEPJUHHUSA-N 266.385 2.249 10 20 CECD CCn1ccc(C(=O)NCc2ccc(N(C)C)c(F)c2)n1 843538282 CIUBGOWSKQLCLX-UHFFFAOYSA-N 290.342 2.038 10 20 CECD C[C@H](C(=O)NC(C)(C)C)N1CCCc2cc(CN)ccc21 843349726 JVJFYJQLLSENES-GFCCVEGCSA-N 289.423 2.201 10 20 CECD CCCN(Cc1cccc(F)c1O)[C@@H]1CCNC1 843051624 AHIIHKCSQYMGTG-GFCCVEGCSA-N 252.333 2.105 10 20 CECD CCN(CC)[C@@H]1CCN(C(=O)c2cc(O)cs2)C1 743784789 MDFGJWDNFNFBSK-SNVBAGLBSA-N 268.382 2.010 10 20 CECD COc1cc(O)c(CN(C)CC[C@H](N)C(C)C)cc1OC 843056760 ZIDVFBBBPFKHMW-ZDUSSCGKSA-N 296.411 2.215 10 20 CECD COc1cccc(CNC(=O)NC[C@@H]2CC2(C)C)c1O 745816840 PCMLWJHHURCWFA-NSHDSACASA-N 278.352 2.246 10 20 CECD CCCC[C@@H](CN)NCc1cc(OC)ccc1O 841030825 ZVKPSUZCBLHHRQ-LBPRGKRZSA-N 252.358 2.008 10 20 CECD CN(Cc1ccccc1O)C(=S)NCC1CC1 849255536 RVPYJRIOWKKMQN-UHFFFAOYSA-N 250.367 2.109 10 20 CECD CC(C)(F)CCNC(=O)c1c(F)ccc(O)c1O 857318228 LTCUKVUDUKDLIT-UHFFFAOYSA-N 259.252 2.105 10 20 CECD COc1ccc(CNC[C@H]2CCCCN2C(C)=O)cc1C 1024835727 OZZBSRPGGXJUJS-MRXNPFEDSA-N 290.407 2.494 10 20 CECD COc1cccc([C@H](C)NCc2ncccn2)c1O 850551670 IUPGECMDAKHNRD-JTQLQIEISA-N 259.309 2.042 10 20 CECD CNS(=O)(=O)CCSc1ncc(C(C)(C)C)s1 857221504 CVDOEANHFOAOHI-UHFFFAOYSA-N 294.467 2.082 10 20 CECD COc1cc(CN2CCO[C@@H]3CCC[C@@H]32)c(O)cc1C 863305111 UOISLCPZBSNLKP-DZGCQCFKSA-N 277.364 2.463 10 20 CECD C[C@@H](NC(=O)NOC/C=C/Cl)c1ccccc1O 868633186 YPWVJONGEIBGFJ-ILFKPUCNSA-N 270.716 2.437 10 20 CECD Oc1cc2c(cc1CN1CCc3ccccc3C1)[C@H](O)CO2 768437754 FXOCUWCPZVTGIE-QGZVFWFLSA-N 297.354 2.376 10 20 CECD COC(=O)c1cnc(SC[C@H]2CCO[C@@H]2C)s1 865368914 GKBCAUAUBAIFRN-HTQZYQBOSA-N 273.379 2.447 10 20 CECD C[C@H](CCO)N(C)Cc1cc(F)c(N(C)C)cc1F 862403187 WZBUVDQFIJQLIZ-SNVBAGLBSA-N 272.339 2.234 10 20 CECD C[C@@H]1CC(NC(=O)c2cc(O)cs2)C[C@@H](C)O1 768575536 LJTRVYDHIZZORX-HTQZYQBOSA-N 255.339 2.140 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2ccccc2O)C[C@@H]1C 877666807 OBUDPJSUPKIBEY-NHYWBVRUSA-N 263.337 2.023 10 20 CECD C[C@@H](NCCC1(C)OCCO1)c1c(O)cccc1F 886590413 UWQDMTDPPKJPOI-SNVBAGLBSA-N 269.316 2.335 10 20 CECD COc1cccc(O)c1CNCCN1CCC(C)(C)C1 898035506 SHJSCVABPSPXLY-UHFFFAOYSA-N 278.396 2.222 10 20 CECD Cc1ccc(CN(C)C(=O)c2ccc(C)c(O)c2O)nc1 789866245 AXCVNMHUDYWVBJ-UHFFFAOYSA-N 286.331 2.382 10 20 CECD COc1ccc(CN2CCC[C@@H](CO)[C@H]2C)c(O)c1OC 894941074 YQQWYHKTMDFPPF-YPMHNXCESA-N 295.379 2.002 10 20 CECD COCC1(NCc2c(O)cccc2Br)CC1 706863308 CMARWWSEYKBVTK-UHFFFAOYSA-N 286.169 2.423 10 20 CECD Oc1cccc(Br)c1CNC[C@H]1C[C@@H](O)C1 720977805 PVEPTKKMSDHWTM-DTORHVGOSA-N 286.169 2.015 10 20 CECD Oc1cccc(Br)c1CN1CC2(CCOC2)C1 1140098836 OHCPLEFRXXLJPW-UHFFFAOYSA-N 298.180 2.377 10 20 CECD C[C@@H](CCO)CNCc1ccc(Br)cc1O 691454910 NCKABJTUPNEMMF-VIFPVBQESA-N 288.185 2.263 10 20 CECD C[C@H]1CCN(CCNCc2cccc(Cl)c2O)C1 777483249 KEZLKWRIGUYUQH-NSHDSACASA-N 268.788 2.477 10 20 CECD Nc1ccc(CN2CCC(c3cn[nH]c3)CC2)cc1 1352791207 VZHICTVYGODKPG-UHFFFAOYSA-N 256.353 2.372 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC[C@H](C(=O)O)C1 1600236307 RWZNYGPJLSVTPV-JSGCOSHPSA-N 276.380 2.404 10 20 CECD Cc1nc(CN(C)c2ccc(OCC(=O)O)cc2)c(C)o1 1600700676 WKUMPOKDXUFPAD-UHFFFAOYSA-N 290.319 2.391 10 20 CECD C[C@@H](NCCN1CCC[C@H]1C)c1cc(C(=O)O)ccc1O 1609780461 SAAKFPRZSMQSSB-VXGBXAGGSA-N 292.379 2.225 10 20 CECD CCOc1cccc(CN[C@@H]2CCN(C)[C@@H](C)C2)c1O 227376193 VWYUFMJQRUEVLT-GXTWGEPZSA-N 278.396 2.363 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H]2CNC[C@@]2(C)C1 1579617640 RJUMWLODTFZYPM-WBVHZDCISA-N 273.424 2.102 10 20 CECD CCCN(CC(=O)O)Cc1cccc(Cl)c1O 1589669712 WBPONNQUCCZXEQ-UHFFFAOYSA-N 257.717 2.342 10 20 CECD Nc1ccc(NC(=O)c2ccc3nonc3c2)cc1 1580449361 JHJUJIWBOWQLTF-UHFFFAOYSA-N 254.249 2.057 10 20 CECD COc1cccc([C@H](C)NC[C@H](C(=O)O)C(C)C)c1O 1594123167 CJUQUEBIACPTEP-JQWIXIFHSA-N 281.352 2.408 10 20 CECD CC(C)CCn1cc(C(=O)Nc2ccc(N)cc2)nn1 160342368 GSZGMPGMXOOEDR-UHFFFAOYSA-N 273.340 2.159 10 20 CECD COc1cc(Cl)cc(CNCc2cncn2C)c1O 291545325 LRCYAFFQPOUMAI-UHFFFAOYSA-N 281.743 2.078 10 20 CECD C[C@H]1CCCN(Cc2cc(F)ccc2O)[C@H]1CCN 404516894 SXKKIGBRJHYPRT-FZMZJTMJSA-N 266.360 2.481 10 20 CECD CNC(=O)/C(=C/c1cc(F)c(OC)c(F)c1)N=[N+]=[N-] 2048536897 JZIPOOSMGYSIHT-UITAMQMPSA-N 268.223 2.371 10 20 CECD Cc1ccc(C(=O)Nc2ccccc2O)c(O)c1O 177664651 YRGTWSYYQXODRL-UHFFFAOYSA-N 259.261 2.364 10 20 CECD C[C@@H]1CCCN1C(=O)NCc1ccc(N(C)C)cc1 173321498 ZGPMDONJUJMXKY-GFCCVEGCSA-N 261.369 2.447 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1CCNCC1 38086708 SDFBFMGQYBZLPN-UHFFFAOYSA-N 261.152 2.104 10 20 CECD C[C@H](CCN(C)C)NCc1cccc(Cl)c1O 124755913 SYLXHFHRYHNUMS-SNVBAGLBSA-N 256.777 2.475 10 20 CECD CCO[C@@H]1C[C@@](CO)(NCc2cc(F)ccc2O)C1(C)C 188906101 YNZBOCBONNPOPV-ZBFHGGJFSA-N 297.370 2.187 10 20 CECD C/C=C/C[C@H](CO)N[C@H](C)c1cc(OC)ccc1O 186520306 YTLTYINZTHCIDD-GKUNOOHESA-N 265.353 2.379 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)Cn1cccn1 138466222 VZSDYMGRIBYLCB-CQSZACIVSA-N 272.396 2.436 10 20 CECD Oc1ccc(F)cc1CN1CCN(c2ccccn2)CC1 139744598 XUKFFTPDMPYLRU-UHFFFAOYSA-N 287.338 2.249 10 20 CECD CCCN(CC(=O)N(C)C)Cc1ccc(N(C)C)c(F)c1 130647967 BNKZZPBZNSBCKB-UHFFFAOYSA-N 295.402 2.192 10 20 CECD C[C@@H](N[C@H]1CCOC1)c1ccc(N2CCOCC2)c(F)c1 90774592 RLHRUGSUIDSOHS-OCCSQVGLSA-N 294.370 2.102 10 20 CECD CC(=O)N1CC[C@H](CN(C)Cc2ccc(N(C)C)cc2)C1 92100197 VKHLXZPSNJYIIC-MRXNPFEDSA-N 289.423 2.053 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCCS2)cc1 266510747 BKDUGYXFEBUHSW-CYBMUJFWSA-N 264.394 2.264 10 20 CECD C[C@]1(CNC(=O)NCc2ccccc2O)CCCS1 268207993 JMJXBNACMIJDTP-CQSZACIVSA-N 280.393 2.477 10 20 CECD CC[C@H]1CC[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)O1 268131737 MLZHCGQSZPNKGC-WFASDCNBSA-N 294.370 2.466 10 20 CECD O=C(NCc1ccccc1O)NOCCC(F)(F)F 275051610 OVEKWICLHAWFBK-UHFFFAOYSA-N 278.230 2.075 10 20 CECD CO[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 371685285 KRGRKJBMGFUYTQ-IYNGYCSASA-N 291.347 2.139 10 20 CECD C[C@@H]1CN(C2CCOCC2)CCN1Cc1ccccc1O 278666492 MZWQTSNCRQSSEE-CQSZACIVSA-N 290.407 2.077 10 20 CECD COc1cccc(CN(C)C2C[C@@H]3CC[C@H](C2)N3C)c1O 289258225 FNELPXICAFQNOW-YIONKMFJSA-N 290.407 2.458 10 20 CECD Cc1ccc([C@@H](N)C(=O)NCc2ccc(N(C)C)cc2)cc1 280810369 VRGOONWPYFXWCX-QGZVFWFLSA-N 297.402 2.377 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cncs1 288551733 MKGSEEAYSNTXMG-UHFFFAOYSA-N 275.377 2.481 10 20 CECD CN1CCC[C@@]2(CCN(Cc3ccccc3O)C2)C1 293617491 KMHMZXZMJLCGBO-MRXNPFEDSA-N 260.381 2.310 10 20 CECD CCN(C[C@H](C)OC)C(=O)NCc1ccc(N(C)C)cc1 291973750 SLKARAMHDTVRRN-ZDUSSCGKSA-N 293.411 2.319 10 20 CECD C[C@@H](CN(C)C)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 807141090 QDZLLFHODXZFKY-STQMWFEESA-N 292.427 2.063 10 20 CECD COC[C@@]1(CN[C@H](C)c2ccc(C)c(C)c2O)CCCN1 817974469 MMWJLMHATRSFCC-PBHICJAKSA-N 292.423 2.428 10 20 CECD OC1(CNCc2ccc(N3CC=CC3)cc2)CCCC1 819094771 LUYRPMDUVRHJEC-UHFFFAOYSA-N 272.392 2.458 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@](C)(O)C1CC1 840933918 KCYIOORQMWGWJT-INIZCTEOSA-N 262.397 2.312 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCc2cccc(Cl)c2O)C1 843040766 XWQFIHYJQSIETF-SCZZXKLOSA-N 269.728 2.389 10 20 CECD CCN1CC[C@H](NCCc2ccc(N)cc2)[C@@H](C)C1 841035384 NJKNHNHOAULTKW-BBRMVZONSA-N 261.413 2.131 10 20 CECD CC[C@](C)(CO)NCc1ccc(N(C)C)cc1C 840938071 ZGEXLRMSSCEOHC-OAHLLOKOSA-N 250.386 2.312 10 20 CECD Cc1[nH]nc2ncc(NC(=O)c3cc(O)cs3)cc12 748297768 VYPDUUSOBSXLPU-UHFFFAOYSA-N 274.305 2.286 10 20 CECD C[C@H]1CCC[C@H](N(C)C(=O)C(=O)Nc2ccc(N)cc2)C1 841015746 LITBAEKUGQHGFE-FZMZJTMJSA-N 289.379 2.244 10 20 CECD Cc1ccc(O)c(CNC(=O)NCC(C)(F)F)c1 858490866 RDAHKKKQAPYCHZ-UHFFFAOYSA-N 258.268 2.155 10 20 CECD CC1(C)C[C@]1(C)NC(=O)NCCc1ccc(N)cc1 851662857 MAAVERSHHDVTKC-HNNXBMFYSA-N 261.369 2.299 10 20 CECD COc1cc(C)cc(CN2CCN(C3CCC3)CC2)c1O 754726032 JZGBSPJUAQGZEN-UHFFFAOYSA-N 290.407 2.379 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](O)c1ccccn1 853100591 IWFXFIUAUHUAQS-KRWDZBQOSA-N 285.391 2.279 10 20 CECD CC[C@H](CO)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756344289 SXLLIYFCAQYRFV-NGZCFLSTSA-N 253.317 2.440 10 20 CECD CC(C)[C@H](O)CN[C@H](C)c1cc(F)cc(F)c1O 756586859 VPHHSCAFYPDUOQ-PRHODGIISA-N 259.296 2.338 10 20 CECD Cc1noc(C)c1[C@@H](C)C(=O)NCc1ccc(O)c(O)c1 768914784 JRNYOABBXJIKLS-MRVPVSSYSA-N 290.319 2.123 10 20 CECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)C1CC1 35136422 PAZKINUCWWKWSG-CYBMUJFWSA-N 260.381 2.411 10 20 CECD Cc1ccc(O)c(CN(C)CC(=O)NCc2ccco2)c1 768195044 JSTWXZZMJHSDOR-UHFFFAOYSA-N 288.347 2.042 10 20 CECD Cc1nn(C)cc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773014951 OCQKJUWSDBZIKB-LLVKDONJSA-N 286.379 2.286 10 20 CECD Cc1ncc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)[nH]1 773020756 VKVMCIUWRYOLLA-JTQLQIEISA-N 272.352 2.275 10 20 CECD C[C@H](N[C@H](C)Cc1cnccn1)c1ccccc1O 783506572 YMDXVPKJKNECDE-NEPJUHHUSA-N 257.337 2.464 10 20 CECD CC[C@@H](NC[C@H](C)S(C)(=O)=O)c1ccc(C)cc1O 794819665 XBGHBDVXSJFHAL-WCQYABFASA-N 285.409 2.174 10 20 CECD Cc1cc(CNCc2cc(F)cc(F)c2O)n(C)n1 708517439 OZVAFSTVPYDJGV-UHFFFAOYSA-N 267.279 2.002 10 20 CECD CCCN(Cc1ccccc1O)Cc1ncnn1CC 193364961 HXFHGVUDVFOHSC-UHFFFAOYSA-N 274.368 2.416 10 20 CECD C[C@H](Cn1cccn1)N[C@H](C)c1cc(F)ccc1O 94617556 OTZZSGFVYDPKCF-GHMZBOCLSA-N 263.316 2.467 10 20 CECD CC[C@H](NC(=O)c1ccc(C)c(O)c1O)C(F)F 1325277981 KOJUCSJQPUQFBU-QMMMGPOBSA-N 259.252 2.180 10 20 CECD CC1(C)CN(C(=O)C2CC2)CCN1Cc1ccc(N)cc1 1334775149 UEEFDWGUESRRPY-UHFFFAOYSA-N 287.407 2.102 10 20 CECD O=C(O)c1cnc(SCCO[C@@H]2CC2(F)F)s1 1602536685 DPLGCKVXWKQOEQ-ZCFIWIBFSA-N 281.305 2.358 10 20 CECD CCC(CC)(C(=O)O)C(=O)N1Cc2cccc(O)c2C1 1603522847 BPUPJMQHNSCQJH-UHFFFAOYSA-N 277.320 2.125 10 20 CECD C[C@H](N[C@@H]1CSC[C@@H]1C)c1cc(C(=O)O)ccc1O 1604328381 DGZURPYZBBDNOI-HOTUBEGUSA-N 281.377 2.493 10 20 CECD CN1CCC(CCNCc2cc(F)ccc2O)CC1 226607487 GAALCXMRYOCSRU-UHFFFAOYSA-N 266.360 2.353 10 20 CECD COC[C@H](CNCc1ccc(N2CCCC2)cc1)OC 227704314 VZDWTOWUTXWYPF-INIZCTEOSA-N 278.396 2.038 10 20 CECD O=C(O)[C@H](C(=O)N1Cc2cccc(O)c2C1)C1CCCC1 1594832904 MJSXFJRPCHEJER-AWEZNQCLSA-N 289.331 2.125 10 20 CECD O=C1NC(=S)S/C1=C/c1cc(F)cc(F)c1 158625671 CTWNVHVBULQZGU-FPYGCLRLSA-N 257.286 2.454 10 20 CECD NC(=O)CN(Cc1cccc(Cl)c1O)C1CCCC1 124531052 WSKJMTSERRHVJG-UHFFFAOYSA-N 282.771 2.276 10 20 CECD CC1(C)CNCC[C@@H]1NCc1ccc2c(c1)CCO2 841073155 RCOHOXAJTXBQEF-HNNXBMFYSA-N 260.381 2.099 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCC[C@]1(C)N 827205399 MINDJSGTBYRCKT-BBRMVZONSA-N 276.380 2.258 10 20 CECD COc1ccc(O)c(CN[C@H]2CCN3CCC[C@H]3C2)c1 250379528 KPYGUAVDDCEKSU-KBPBESRZSA-N 276.380 2.117 10 20 CECD CN(C)c1ccc(CNC(=O)CCCCCCN)cc1 40825859 GMIRGBFEEHFFQT-UHFFFAOYSA-N 277.412 2.278 10 20 CECD C[C@@H](CC(N)=O)N[C@@H](C)c1ccc2ccccc2c1O 168829583 AJWOOUTWBJPOIL-QWRGUYRKSA-N 272.348 2.460 10 20 CECD CC(C)(CN1CCCC1)NCc1cc(F)ccc1O 308627786 JDRPSJKMZDIXCS-UHFFFAOYSA-N 266.360 2.495 10 20 CECD C[C@H](NCc1csnn1)c1ccc(N(C)C)cc1 398248939 UYNNSACMBKRDST-JTQLQIEISA-N 262.382 2.455 10 20 CECD Cc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)n(C)n1 58769469 BREHVMJUISJICS-UHFFFAOYSA-N 298.390 2.041 10 20 CECD Cc1csc(N2CCN(Cc3ccccc3O)CC2)n1 179557166 WYEFDQZNIHGIRG-UHFFFAOYSA-N 289.404 2.479 10 20 CECD CCOC(=O)c1cnc(Sc2nccn2C)s1 310249593 FQEACLFIEQWQHG-UHFFFAOYSA-N 269.351 2.205 10 20 CECD CCCOc1ccc(CN[C@]2(C)CCOC2)c(O)c1 120150601 YHPZWCMYYGFZAB-OAHLLOKOSA-N 265.353 2.450 10 20 CECD CCOCCO[C@H]1CCN(Cc2cccc(C)c2O)C1 180769430 HTVFEYOITNRWLS-HNNXBMFYSA-N 279.380 2.328 10 20 CECD CCN(Cc1cccc(C)c1O)[C@H](C)CS(=O)(=O)CC 180249632 NAZUSUXJEXJHEJ-CYBMUJFWSA-N 299.436 2.346 10 20 CECD Cc1ccc(O)c(CNc2cccc(-n3cnnn3)c2)c1 71407372 LJJNRNLRNBKCFH-UHFFFAOYSA-N 281.319 2.288 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)on2)c1 77614112 WRMAMTSNQALCEJ-VIFPVBQESA-N 276.292 2.188 10 20 CECD COC[C@H](NC(=O)c1ccc(C)c(O)c1O)c1ccco1 182545870 ZYEZLFNACOYPHI-NSHDSACASA-N 291.303 2.117 10 20 CECD C[C@H](CCNC(=O)c1cccc(O)c1O)N1CCCCC1 193161597 TYPWODWUFYWFIS-GFCCVEGCSA-N 292.379 2.092 10 20 CECD C[C@H](N[C@H]1CCc2c[nH]nc2C1)c1cc(F)ccc1O 359956883 FZFTVIOIWVGDDL-CABZTGNLSA-N 275.327 2.463 10 20 CECD Cc1ccc(O)c(CNCC2(O)CCN(C(C)C)CC2)c1 268422572 MGKMMOORVJLMED-UHFFFAOYSA-N 292.423 2.026 10 20 CECD Cc1ccc([C@@H](C)N[C@H]2CCCCNC2=O)c(O)c1C 273411836 PVMRHEGWJAZVOF-OCCSQVGLSA-N 276.380 2.328 10 20 CECD COCCN(C)CCN[C@@H](C)c1ccc(C)c(C)c1O 273597420 QZJGNQSJUFTJCV-AWEZNQCLSA-N 280.412 2.238 10 20 CECD CCOC1CC2(CCN(C(=O)c3cccc(O)c3O)C2)C1 376429842 VGGHGQDPNOKVQP-UHFFFAOYSA-N 291.347 2.129 10 20 CECD COc1ccc(N2CCCN(C[C@H](O)C(C)C)CC2)cc1 374093270 IEUXLFALACLCOV-KRWDZBQOSA-N 292.423 2.224 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCC2(C)C)c1 806811316 UOUREFCJZODMFJ-CYBMUJFWSA-N 278.352 2.389 10 20 CECD CO[C@H]1COC[C@@H]1N[C@H](C)c1ccc(C)c(C)c1O 290104584 IFDXOJKMGPXKFG-XBFCOCLRSA-N 265.353 2.073 10 20 CECD CCc1cc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)n[nH]1 728977614 BFSRFKZREONWNJ-VIFPVBQESA-N 289.335 2.177 10 20 CECD C/C=C\C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 828519747 ZUFDHIQZZVXWNX-ARJAWSKDSA-N 297.738 2.123 10 20 CECD COc1nccc(CNCCCSc2nccs2)n1 823937625 DXPHFJSYAZMVLX-UHFFFAOYSA-N 296.421 2.214 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1cccc(Cl)c1O 824703121 VWLRGYZBWVJEHI-PWSUYJOCSA-N 283.755 2.477 10 20 CECD CC[C@@H](CO)N(C)Cc1cc(Cl)cc(F)c1O 824533258 CJUHTTYBNWHVIU-JTQLQIEISA-N 261.724 2.387 10 20 CECD O=C(/C=C\c1cccnc1)N1C[C@@H](O)Cc2ccccc21 493257753 GSGHQHUGLHDQIJ-LZNQSLFOSA-N 280.327 2.045 10 20 CECD Cc1cc(O)c(CNCCC(=O)NC(C)C)cc1Cl 825096780 INAISUMWDSYQOI-UHFFFAOYSA-N 284.787 2.358 10 20 CECD CC(C)C[C@@H](CNC(=O)c1cc(O)cs1)N(C)C 827487986 BGCWNXVPYXHNRB-JTQLQIEISA-N 270.398 2.160 10 20 CECD Oc1ccc(Cl)c(F)c1CN1C[C@@H]2CCNC[C@@H]2C1 904420186 FUUAHHBDTVVBOZ-VHSXEESVSA-N 284.762 2.226 10 20 CECD COc1ncccc1NC(=O)/C=C\c1ccc(O)c(O)c1 588405917 CSGCYISGERUNQL-ALCCZGGFSA-N 286.287 2.153 10 20 CECD CC(C)(O)C1CN(Cc2c(O)ccc(Cl)c2F)C1 839139477 GXJFMLSNQOWSFQ-UHFFFAOYSA-N 273.735 2.387 10 20 CECD COc1ccc(O)c(CNC(=S)NC(C)(C)C)c1 733907509 XIJIIVODJWTIJI-UHFFFAOYSA-N 268.382 2.163 10 20 CECD CN[C@@H](CC(C)(C)C)C(=O)NCc1ccc(OC)cc1O 832178833 XRBHBFYCXJATRX-ZDUSSCGKSA-N 294.395 2.041 10 20 CECD C[C@@H](O)CN(Cc1ccc(N(C)C)c(F)c1)C1CC1 848928456 DUQJCIBEVUSGHG-LLVKDONJSA-N 266.360 2.237 10 20 CECD CCc1cccc(CNCCC(C)(C)S(C)(=O)=O)c1O 848917603 XGFNCSRMQNOMKQ-UHFFFAOYSA-N 299.436 2.258 10 20 CECD CNC[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 843045247 SNGYTCRIZDQYJS-LLVKDONJSA-N 268.788 2.477 10 20 CECD CCCN(Cc1ccccc1O)c1cc(C(=O)O)ncn1 910354590 FLXICPDWTSVAAW-UHFFFAOYSA-N 287.319 2.297 10 20 CECD Oc1ccc(F)cc1CNCCC[C@@H]1CCCN1 841071748 ALEYFPLJYDCIQN-CYBMUJFWSA-N 252.333 2.153 10 20 CECD Cc1cccc2c1CCN2C(=O)/C=C\c1cnn(C)c1 746388231 XGXHXAACLITHSQ-SREVYHEPSA-N 267.332 2.331 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1N 843120378 IBGXYIUXEYLFEZ-RHSMWYFYSA-N 273.424 2.456 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1C(=O)c1cc(O)cs1 754906984 KLBQBMCWFOTLKB-DTWKUNHWSA-N 255.339 2.093 10 20 CECD CNC(=O)C(C)(C)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756782063 MCNPKYNMZFZRJU-GXSJLCMTSA-N 294.370 2.441 10 20 CECD COC[C@](C)(O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756577223 QWVCETGBTNQRQR-BPYAMOTFSA-N 283.343 2.067 10 20 CECD CCOc1cccc(/C=C2/SC(=S)N(C)C2=O)n1 763105292 BLUZBVLOFMOSIU-VQHVLOKHSA-N 280.374 2.311 10 20 CECD O=C(c1cc(O)cs1)N1CCCC[C@H]1c1ncon1 764510079 AIOPOFCYZBCXPP-VIFPVBQESA-N 279.321 2.204 10 20 CECD C[C@H]1CC[C@@H](C)N1CC(=O)N(C)Cc1ccccc1O 769281466 DJJBKWJCIIGVAH-BETUJISGSA-N 276.380 2.223 10 20 CECD CCCN1CCN(Cc2cc(F)ccc2O)C(C)(C)C1=O 779217045 OEJDKXVTLFRROR-UHFFFAOYSA-N 294.370 2.364 10 20 CECD CN(C(=O)[C@@H]1CCCC[C@]1(C)N)c1ccc(N)cc1 877077720 RYYSTDNWEAJENN-ZFWWWQNUSA-N 261.369 2.139 10 20 CECD CCOc1ccc(CN[C@H]2C[C@@H](O)C2(C)C)c(O)c1 778193265 VIBCJJKGGSQXTB-UONOGXRCSA-N 265.353 2.040 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@H](O)C2(C)C)c(O)c1 778193264 VIBCJJKGGSQXTB-KGLIPLIRSA-N 265.353 2.040 10 20 CECD O=C(c1cccc2c1CCN2)N1CCCc2ccnc(O)c21 1122285136 RQKBDFCAMUIVJF-UHFFFAOYSA-N 295.342 2.348 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cc(F)cc(F)c2O)C1 894075592 GDMQPEJWORSCBO-AWEZNQCLSA-N 285.290 2.055 10 20 CECD C/C=C\C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891247709 UMGMOJLKGICFPP-IDTUSYRASA-N 275.396 2.048 10 20 CECD COc1cccc(CN2CC[C@@H]3OCCC[C@@H]3C2)c1O 93506641 KORRKFBCILBXLX-OCCSQVGLSA-N 277.364 2.402 10 20 CECD CO[C@@H](C)[C@H](C)NCc1ccc(N2CCOCC2)cc1 189114562 UMJTUVBNOWDGMA-KBPBESRZSA-N 278.396 2.036 10 20 CECD C[C@@H](NCc1cc(Cl)ccc1O)C1(CO)CC1 696098792 HKZMQIZSASRLOU-SECBINFHSA-N 255.745 2.296 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CC[C@H]1CCOC1 783676371 DFWJNGWJQUGKKV-ZDUSSCGKSA-N 276.380 2.378 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@H]1CO[C@@H](C)C1 1326784046 PYGDCPFLRSJVNF-GXTWGEPZSA-N 291.395 2.038 10 20 CECD CCC[C@@]1(CO)CCCN1C(=O)NCc1ccc(N)cc1 1337070360 OAJUPOZVLYNMMF-INIZCTEOSA-N 291.395 2.105 10 20 CECD COc1cc(C)cc(CN[C@H]2CC[C@H](OC)C2)c1O 1332708732 VIBOWLWYONBDFS-STQMWFEESA-N 265.353 2.366 10 20 CECD Cn1cncc1C1CCN(C(=O)c2cc(O)cs2)CC1 1348852846 FPFGKYPRNUCOOP-UHFFFAOYSA-N 291.376 2.207 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1C=CCCC1 1345639491 UPYGULHQJUPZMG-CYBMUJFWSA-N 286.331 2.265 10 20 CECD C[C@@H](NCCC(=O)NC(C)(C)C)c1cc(F)ccc1O 228336947 NZVINXXYFDAJTC-SNVBAGLBSA-N 282.359 2.487 10 20 CECD O=C(O)C1(CN[C@@H]2CCc3cccc(O)c32)CCC1 1594879989 KOBCOJJFDVIYOQ-LLVKDONJSA-N 261.321 2.224 10 20 CECD CCOC[C@@H](NCc1ccc(N(C)CC)cc1C)C(=O)O 1776905802 KDSHAGVGKXSMTM-OAHLLOKOSA-N 294.395 2.030 10 20 CECD C[C@H](C[C@H](O)c1ccccc1)NC(=O)Cc1ccc(N)cc1 161509300 WGOQFHACODEKOH-DYVFJYSZSA-N 298.386 2.440 10 20 CECD COC[C@@H]1CCCN1Cc1cc(OC)c(OC)cc1O 160357206 FLYHMRUXDIWSQJ-LBPRGKRZSA-N 281.352 2.020 10 20 CECD Cc1cc(=O)nc(/C=C\c2ccc(N(C)C)cc2)[nH]1 204633650 KOKXFRAJKSVBRQ-TWGQIWQCSA-N 255.321 2.315 10 20 CECD OC1(COc2ccc(N3CCCC3)cc2)CCOCC1 155261073 JODFDPRORAQSEX-UHFFFAOYSA-N 277.364 2.207 10 20 CECD COc1ccc(O)c(CN2CC[C@H](OC)[C@H](C)C2)c1 824815326 LYHUPKZVHGFKQI-ABAIWWIYSA-N 265.353 2.258 10 20 CECD COCC[C@H](C)n1cc(COc2ccc(N)cc2)nn1 881321883 QDZBOSPOLCKHPQ-NSHDSACASA-N 276.340 2.037 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@H](C)c1ccccc1O 38013799 WBNQLECLHJQAIT-VXGBXAGGSA-N 264.369 2.348 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCCS(C)(=O)=O 38047273 NORQHIQQVBWVBM-NEPJUHHUSA-N 297.420 2.273 10 20 CECD CN(Cc1ccccc1O)C(=O)CC[C@@H]1CCCNC1 43589398 RPCJOPFNNVRATQ-ZDUSSCGKSA-N 276.380 2.130 10 20 CECD COc1cccc(CN2CC[C@H](OC)C[C@H]2C)c1O 282397146 RJHXGEFLWXVUKS-YPMHNXCESA-N 265.353 2.400 10 20 CECD COc1ccc(O)c([C@H](C)NCCc2cn[nH]c2)c1 289701024 IPLAKRFRJVFLFU-JTQLQIEISA-N 261.325 2.017 10 20 CECD COc1ccc(O)c(CN[C@@H]2C[C@@H](OC)C23CCC3)c1 713481309 SPWMOAGPEKDHKW-HUUCEWRRSA-N 277.364 2.448 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)C(C)(C)O)c1O 393962387 VKHRYVSKOJEFBZ-QMMMGPOBSA-N 273.760 2.303 10 20 CECD CC[C@@H](NCC(C)(C)C(N)=O)c1ccc(N(C)C)cc1 183205600 BGQGPAXHSKACEQ-CQSZACIVSA-N 277.412 2.305 10 20 CECD COCc1noc(CN(C)c2ccc(OC)c(F)c2)n1 182455416 ASGOODZPAGUICA-UHFFFAOYSA-N 281.287 2.000 10 20 CECD Cc1ccc([C@H](C)NCCN2CCOCC2(C)C)c(O)c1 185333966 SGNCDYRIPROOTM-AWEZNQCLSA-N 292.423 2.462 10 20 CECD OCCCCCCNCc1ccc(N2CCOCC2)cc1 224953932 RKERYQLTVIHFGM-UHFFFAOYSA-N 292.423 2.166 10 20 CECD C[C@H](CC(=O)Nc1ccc(N)cc1)C1CCNCC1 237467912 OQIOVXTZGCHWGL-LLVKDONJSA-N 261.369 2.233 10 20 CECD C[C@H](NC[C@@H](O)C(F)(F)F)c1ccc(F)cc1O 230659206 XWBVSPFEPCMBIF-QUBYGPBYSA-N 267.222 2.105 10 20 CECD CN(C)C(=O)O[C@@H]1CCCN(Cc2ccccc2O)C1 294704746 DFBUJLIGWAOLKI-CYBMUJFWSA-N 278.352 2.055 10 20 CECD O=C(O)[C@H]1CN(C(=O)/C=C\c2cccnc2)c2ccccc21 255059343 LKOPIAIRGNWYIE-DANTVBBOSA-N 294.310 2.310 10 20 CECD Cc1ccc([C@H](C)NCCCOCCO)c(O)c1C 273491301 WQZCEBZEVRKMQH-ZDUSSCGKSA-N 267.369 2.059 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)c(O)c1 273529599 WANXKJKSXCRVFW-CHWSQXEVSA-N 276.380 2.361 10 20 CECD CCOc1cccc(CN(C)CCCCCO)c1O 279345551 FPKFAKUTASTQEA-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CC[C@@H](N[C@@H](CO)CCOC)c1ccc(C)cc1O 281764882 WOSIHVKHGAQDNI-TZMCWYRMSA-N 267.369 2.139 10 20 CECD Oc1cccc2c1[C@H](NCc1nc(C3CC3)n[nH]1)CC2 296583783 UNVYEMDRTSMJFX-LLVKDONJSA-N 270.336 2.165 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCc2cnnn2C)c1O 808719116 RZVCTACBFOHFJE-VIFPVBQESA-N 280.759 2.333 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1ccc(OCCC)cc1O 298795592 SRMYJZZJOYCPMC-INIZCTEOSA-N 292.379 2.412 10 20 CECD Cc1cc(CN(CCCO)C2CC2)ccc1N(C)C 815050984 HWCNIFCSSDUSSM-UHFFFAOYSA-N 262.397 2.408 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC[C@@H](CC)O1 819761490 RWANCBURSXDRHB-YPMHNXCESA-N 298.379 2.452 10 20 CECD O=C(/C=C/c1ccc(Cl)nc1)N1CCCc2n[nH]cc21 493086192 DORCEPNQXGTQRY-GQCTYLIASA-N 288.738 2.451 10 20 CECD COc1cccc(CNC(=O)CCCC(=O)C2CC2)c1O 825702983 HQGUBEFVZJGGCO-UHFFFAOYSA-N 291.347 2.166 10 20 CECD CN(Cc1ccccc1O)C(=O)C1(C(=O)C2CC2)CC1 825481965 ZBIHSVSRDIPKJH-UHFFFAOYSA-N 273.332 2.110 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]23)c1 825841130 ZZLMLDLKTNVENX-MJVIPROJSA-N 275.348 2.453 10 20 CECD CC[C@@H](NCCCON)c1cccc(Cl)c1O 902414823 DBGZKAJGBRFTOO-LLVKDONJSA-N 258.749 2.367 10 20 CECD CCOCCCN(Cc1ccccc1O)C[C@@H](C)C(=O)O 901677478 KHJSBYXYGAAUIX-CYBMUJFWSA-N 295.379 2.342 10 20 CECD CNC(=O)C[C@@H](C)N[C@H](C)c1cc(Cl)ccc1O 834900104 MDYKYEVSJSDNQG-RKDXNWHRSA-N 270.760 2.221 10 20 CECD CC[C@@H](CO)N(C)Cc1ccc(N(C)C)c(C)c1 830352360 LTHPLUDMKMUTRT-AWEZNQCLSA-N 250.386 2.264 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC[C@@H]1N 843053027 XXVOGGGRBZAOAD-KCJUWKMLSA-N 299.758 2.123 10 20 CECD COC(=O)c1ccc(C(=O)NCc2ccccc2O)cc1 748354202 GZKQZVHLMUQGGL-UHFFFAOYSA-N 285.299 2.109 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)C1=COCC1 769562862 RTGVWZCLXYCQIX-UHFFFAOYSA-N 273.332 2.191 10 20 CECD CCC(O)(CC)CN(C)Cc1cc2c(cc1O)OCO2 862539668 POXKSHRUGDUAHS-UHFFFAOYSA-N 281.352 2.104 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CC=CC1 1119151820 HUZSFLITVOKDHR-UHFFFAOYSA-N 269.348 2.144 10 20 CECD C[C@H](NC(=O)NCCCF)c1ccc(N(C)C)cc1 773395088 ATGXPIHAAFVBRP-NSHDSACASA-N 267.348 2.472 10 20 CECD COc1cc(C)cc(CNCC2(O)CCCC2)c1O 1119445212 IEBBIFZPUBMKSU-UHFFFAOYSA-N 265.353 2.104 10 20 CECD O=C(C[C@@H](O)c1cccc(F)c1)NCc1ccccc1O 772805295 WWCIUQJMOUZNBA-OAHLLOKOSA-N 289.306 2.271 10 20 CECD Oc1c(F)cc(F)cc1CNCC1(O)CCCCC1 708503916 RSEDTXOSEXGILV-UHFFFAOYSA-N 271.307 2.455 10 20 CECD COc1ccc(CNC[C@@H]2C[C@H](C)N(C(C)=O)C2)cc1C 980276911 YSSRCMMPMXLMMD-BBRMVZONSA-N 290.407 2.350 10 20 CECD Cc1nc(C)c(C(=O)N(C)Cc2ccccc2O)[nH]1 1329494727 GIPSMRWIKOUWRT-UHFFFAOYSA-N 259.309 2.004 10 20 CECD CN(C(=O)[C@H](N)C1CCCCC1)c1ccc(N)cc1 1333353480 WWCOJUDSDSWGPM-CQSZACIVSA-N 261.369 2.139 10 20 CECD CC(C)C(=O)NC[C@H]1CCCN(Cc2ccc(N)cc2)C1 1335286385 YKRXBFORRVARIS-OAHLLOKOSA-N 289.423 2.253 10 20 CECD Nc1ccc(CNC(=O)NCCSC(F)(F)F)cc1 1346203673 LRWOTKFBAXEWED-UHFFFAOYSA-N 293.314 2.321 10 20 CECD CN(C)c1ccc(CN(c2ccnc(N)n2)C2CC2)cc1 1354079186 LKNUYPSZKNZIAW-UHFFFAOYSA-N 283.379 2.294 10 20 CECD CCN1CCC(N(C)Cc2cc(F)ccc2O)CC1 226562089 HJJARPRMWBZYOR-UHFFFAOYSA-N 266.360 2.447 10 20 CECD Oc1c(CNC[C@@H]2[C@H]3CNC[C@H]32)ccc2ccccc12 1580885889 QWBCJVQWTRBBJD-PHZGNYQRSA-N 268.360 2.100 10 20 CECD CC[C@H](NCc1nncn1CC)c1ccccc1O 230971666 DTZRYHRZUNSZHG-LBPRGKRZSA-N 260.341 2.245 10 20 CECD CCOCCOCCN[C@H](C)c1ccc(F)cc1O 927087290 LNXQLZNEGNQOLQ-LLVKDONJSA-N 271.332 2.235 10 20 CECD CCOc1cccc(CN[C@H]2C[C@@H](O)C2(C)C)c1O 128267985 YSWJFDPQFQHZAC-QWHCGFSZSA-N 265.353 2.040 10 20 CECD C[C@H](N[C@@H](CO)CC(F)(F)F)c1ccc(F)cc1O 717773069 GAQSLKIVNCPPCF-IONNQARKSA-N 281.249 2.495 10 20 CECD Oc1cccc2c1[C@@H](NCCc1cnccn1)CC2 390066239 RSYXKKSTCWWAQW-ZDUSSCGKSA-N 255.321 2.002 10 20 CECD CCOC(=O)N1CCCN(Cc2ccccc2O)CC1 179565652 ZIHMAGIURNALTB-UHFFFAOYSA-N 278.352 2.056 10 20 CECD COc1ccc(CCNC(=O)c2cccc(O)c2O)cc1 126205514 WDIATTAZKDKATE-UHFFFAOYSA-N 287.315 2.079 10 20 CECD C[C@@H](CN[C@@H](C)c1cc(F)ccc1O)CN1CCOCC1 185505617 KGOWRUVTZNMLLX-STQMWFEESA-N 296.386 2.150 10 20 CECD C[C@H]1SCC[C@@H]1NCc1cc2c(cc1O)OCO2 381036921 UUDQIDPWVNUDRK-SCZZXKLOSA-N 267.350 2.105 10 20 CECD CCNC(=O)[C@H](C)N[C@@H](CC)c1ccc(N(C)C)cc1 268709160 FUEDKQBBZUJGPD-WFASDCNBSA-N 277.412 2.318 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](O)C2CCOCC2)c(O)c1C 273530781 WEKUWDGFIOACTD-XJKSGUPXSA-N 293.407 2.447 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)C[S@@](C)=O)c(O)c1C 273470131 RVMIBZZQFYSYDF-KWFDTGPKSA-N 269.410 2.427 10 20 CECD CN(C)c1ccc(CN[C@H]2CCO[C@@]3(CCOC3)C2)cc1 374271982 PPICKJXBDVJUQQ-RDJZCZTQSA-N 290.407 2.180 10 20 CECD CN(C)C(=O)OC[C@H]1CCCCN1Cc1ccccc1O 289537969 HYCCRLLPAJSZLG-CQSZACIVSA-N 292.379 2.445 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)c(F)c1O)C(=O)N1CCCC1 281497439 GOQKINUQSVALRK-ZJUUUORDSA-N 298.333 2.332 10 20 CECD Cc1cccc(CN2CC[C@@H](n3cccn3)C2)c1O 291192793 GUUSFKLOIHIOBM-CQSZACIVSA-N 257.337 2.344 10 20 CECD COc1ccc(CN[C@@H](C)COC(C)C)c(O)c1 800524120 APFKSVHVWVNSBC-NSHDSACASA-N 253.342 2.304 10 20 CECD C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1cc(O)cs1 819922957 QFWOEMSIXIKARO-JTQLQIEISA-N 282.409 2.256 10 20 CECD Cc1cc(CN[C@H]2CCCC[C@H]2C(N)=O)ccc1N(C)C 815089359 DARCBXKLVLQAAC-CABCVRRESA-N 289.423 2.195 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(CC(N)=O)CC2)c1 817586430 OHURZPNDUHJIPN-LLVKDONJSA-N 262.353 2.007 10 20 CECD CC[C@@H](O)CNC1CCN(c2ccc(OC)cc2)CC1 817586235 MTPLBZIPVWFGDR-OAHLLOKOSA-N 278.396 2.025 10 20 CECD CC1(S(=O)(=O)NCc2ccc(N3CCCC3)cc2)CC1 829957634 UMHPWKIBCVNSJW-UHFFFAOYSA-N 294.420 2.259 10 20 CECD CN(C(=O)/C=C\c1ccc(O)c(O)c1)c1cccnc1 588406539 UMPVLXQCWHBIQU-ALCCZGGFSA-N 270.288 2.169 10 20 CECD CCCCN1CCC(NC(=O)c2cc(O)cs2)CC1 731871468 MCFGPAPINZRXDG-UHFFFAOYSA-N 282.409 2.448 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H]1CC[C@H](O)C1 840942202 VMQDFZVGCXSLPN-BBRMVZONSA-N 262.397 2.312 10 20 CECD CCc1cccc(CN2CC[S@](=O)C[C@H](C)C2)c1O 848907303 LDFJJORYLUQPLV-BLVKFPJESA-N 281.421 2.155 10 20 CECD CCc1cccc(CN2CCC3(CC2)CNC(=O)C3)c1O 848886484 GHRQHNDMXHHUBY-UHFFFAOYSA-N 288.391 2.057 10 20 CECD Cc1cc(N(C)C)ccc1CNC1(CCO)CCOCC1 840932913 YNVNWFSFVMLZQZ-UHFFFAOYSA-N 292.423 2.082 10 20 CECD CCO[C@H](C)C(=O)N(C)CCN(C)c1ccc(OC)cc1 844853123 SRHCXQUIULLAHP-CYBMUJFWSA-N 294.395 2.015 10 20 CECD CC(C)C[C@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841056654 HRDBQJGQJSOORL-GFCCVEGCSA-N 289.379 2.102 10 20 CECD COc1ccc(N(C)CCN(C)c2ncc(F)cn2)cc1 845672795 NXNARFMZOUHHDH-UHFFFAOYSA-N 290.342 2.197 10 20 CECD CC(C)CNC(=N)NCc1cc(Cl)ccc1O 849048100 CATGKFOLOIHELH-UHFFFAOYSA-N 255.749 2.316 10 20 CECD COc1cccc([C@H](C)N[C@H](CO)CC(F)(F)F)c1O 846157900 PFOWYRPGLCWBLQ-IUCAKERBSA-N 293.285 2.365 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@H]3CNC[C@H]3C2)cc1F 843342788 ONWQFGIGBYGQFR-RRFJBIMHSA-N 291.414 2.369 10 20 CECD COc1cc(O)c(CN[C@@H]2CCCC[C@@H]2CN)cc1OC 841028525 ASFFIYTUAGYKFB-DGCLKSJQSA-N 294.395 2.017 10 20 CECD CC[C@@H](NCc1cc(OC)c(OC)cc1O)[C@@H](O)C(C)C 840967403 MNXRKSHVFJWBCE-WBMJQRKESA-N 297.395 2.295 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1C[C@@H]2C=C[C@H]1CC2 845834404 UNTNLXWEWMXKPN-KWCYVHTRSA-N 287.359 2.359 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](N)C[C@@H]2C)c1 846698519 IHEOOZHPALTUAG-WCQYABFASA-N 264.369 2.103 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2cccc(Br)c2O)C1 843057243 HLDLCABARLOYOP-UWVGGRQHSA-N 299.212 2.324 10 20 CECD CC1(C)NCC[C@@H]1NCc1cccc(Br)c1O 841088370 ZJNZWLVBBJPFMD-NSHDSACASA-N 299.212 2.385 10 20 CECD C[C@@H]1CC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)[C@H](C)C1 841038309 UQMTXVHGHNVUIA-GYSYKLTISA-N 289.379 2.148 10 20 CECD Cc1nonc1[C@H](C)NCc1ccc2c(c1)CCO2 924901324 RWWOJQDQSCGIAW-VIFPVBQESA-N 259.309 2.164 10 20 CECD C[C@H](NCCNc1cnccn1)c1cc(F)cc(F)c1O 756644943 DGXKRKIEENXHAD-VIFPVBQESA-N 294.305 2.223 10 20 CECD COC[C@H](C)[C@H](C)C(=O)NCc1cc(C)ccc1O 862755908 NBGZUAUKYGTAOG-RYUDHWBXSA-N 265.353 2.235 10 20 CECD CCOCc1cc(CNC2CSC2)ccc1OC 877635534 VGNMSVXNNONFIY-UHFFFAOYSA-N 267.394 2.437 10 20 CECD C[C@H](NC(=O)C[C@](C)(O)C1CC1)c1ccc(N(C)C)cc1 775404174 LWEJIVCSRIRKHI-SJCJKPOMSA-N 290.407 2.481 10 20 CECD CC[C@H](N[C@H](C)COCCOC)c1ccccc1O 775527218 PCOVTIFEBZXSBY-OCCSQVGLSA-N 267.369 2.484 10 20 CECD COc1ccc(CN[C@H](C)[C@@H]2CCN(C(C)=O)C2)cc1C 1047655613 AVYBKTVIAWWULQ-CZUORRHYSA-N 290.407 2.350 10 20 CECD COc1cccc([C@H](C)N[C@H](CCO)C(F)(F)F)c1O 886803700 MFFQJJNFKSHLPG-GZMMTYOYSA-N 293.285 2.365 10 20 CECD O=C(NCCCSc1nccs1)N1C[C@H]2C[C@H]2C1 888565525 MSYLSQLYTUIVSG-AOOOYVTPSA-N 283.422 2.287 10 20 CECD CC1(C)[C@H]2CN(C(=O)NCc3ccc(N)cc3)C[C@H]21 1120591695 GDXDTXHZFAKHPV-BETUJISGSA-N 259.353 2.066 10 20 CECD Oc1ccc([C@@H]2CCNc3c2ccc(O)c3O)cc1O 97758775 SJLVXVFXUUXDJP-VIFPVBQESA-N 273.288 2.457 10 20 CECD Cc1cc(CN2CCCc3cc(CN)ccc32)nn1C 700813729 OSBVWGBVARLCAN-UHFFFAOYSA-N 270.380 2.140 10 20 CECD C[S@@](=O)C1(CNCc2cc(F)cc(F)c2O)CCC1 708393994 NFJDNLOSHDAWHO-LJQANCHMSA-N 289.347 2.061 10 20 CECD CCc1cccc(CN2CC[C@@]3(CCN(C)C3)C2)c1O 692089525 FTAPIPORTMTMBZ-QGZVFWFLSA-N 274.408 2.482 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 1334937420 RQEZRTWEWXDNLC-IJLUTSLNSA-N 292.379 2.247 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCC[C@H](O)C2)c1O 1331992901 FXQPYQAPNQIJNQ-OCCSQVGLSA-N 279.380 2.350 10 20 CECD CC(C)[C@H](CC(=O)O)NCc1cc(F)cc(F)c1O 1331982598 LJMDFRUJXIRSBZ-NSHDSACASA-N 273.279 2.259 10 20 CECD CCc1nn(C)c(CC)c1CNCc1ccc(N)cc1 1262488273 WRKQCGHYZCHBPZ-UHFFFAOYSA-N 272.396 2.417 10 20 CECD CCc1cccnc1C(=O)NCc1ccc(N)cc1 1578281319 WFPUYUUAHRHTOM-UHFFFAOYSA-N 255.321 2.156 10 20 CECD CCN(CCC(=O)O)Cc1c(C)cc(OC)cc1O 1596314885 NYMOCGBHZVUVGU-UHFFFAOYSA-N 267.325 2.006 10 20 CECD C[C@H]1CC[C@](NCc2ccc(N(C)C)cc2)(C(=O)O)C1 1776628239 IXAUCYVBUAVJHA-BLLLJJGKSA-N 276.380 2.486 10 20 CECD COc1ccc(N2CCN(CCOC(C)C)CC2)cc1 66863786 VYALRMJQLLGMJM-UHFFFAOYSA-N 278.396 2.242 10 20 CECD Nc1ccc(CCNC(=O)NC2CCCCC2)cc1 40675733 HUQIWBGZOBQBKV-UHFFFAOYSA-N 261.369 2.443 10 20 CECD COc1ccc(CN[C@@H](C)c2n[nH]c(C)n2)cc1C 392428239 ZFSLQNAAEDVNPF-JTQLQIEISA-N 260.341 2.281 10 20 CECD COCCC(C)(C)NCc1cc(OC)ccc1O 397925048 QNXBLKVJPLNHJH-UHFFFAOYSA-N 253.342 2.306 10 20 CECD CN(C)c1ccc(CN[C@@H](CCO)C(F)(F)F)cc1 852079895 INYWMZBFSPWPDZ-LBPRGKRZSA-N 276.302 2.156 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]2CN2CCCC2)c1 179878321 CZFYYTNLMOZXJM-HNNXBMFYSA-N 290.407 2.461 10 20 CECD C[C@H](Nc1cnccn1)c1ccc(N2CCOCC2)cc1 301133652 YUMVUJHTPBAETN-ZDUSSCGKSA-N 284.363 2.486 10 20 CECD CCOCc1nnc(NCc2ccc(N(C)C)cc2)o1 181843703 ZQHKMJCKRATQCH-UHFFFAOYSA-N 276.340 2.284 10 20 CECD CCOc1cc(N[C@@H](C)Cc2ccc(O)c(O)c2)ncn1 185696285 OGVKARIVBJOGOB-JTQLQIEISA-N 289.335 2.330 10 20 CECD COc1ccccc1NC(=O)c1cccc(O)c1O 126199512 OYVYLZFJNWDSOA-UHFFFAOYSA-N 259.261 2.359 10 20 CECD COc1ccc(N(C)CCn2ccc([N+](=O)[O-])n2)cc1F 121767056 SDXHDZDBFIFROL-UHFFFAOYSA-N 294.286 2.075 10 20 CECD CN1CCC(NCc2cc(Cl)ccc2O)CC1 37267113 QRZDMZZRNPNJPL-UHFFFAOYSA-N 254.761 2.229 10 20 CECD C[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@H](C)S1 70381537 QXDVVJIDNWOPHF-QWRGUYRKSA-N 264.394 2.164 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CCCCO2)cc1 183795539 WJOAODNQMAHPSQ-OAHLLOKOSA-N 293.363 2.244 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1CCC(O)CC1 194046253 KUVYDFCFNNRWCC-UHFFFAOYSA-N 290.407 2.262 10 20 CECD Cc1cc(Br)cc(CN2CC[C@H](O)C2)c1O 132491796 VQMBDDVXDIFWDC-NSHDSACASA-N 286.169 2.030 10 20 CECD C[C@@H](O)CCN(C)Cc1cc(Br)ccc1O 93481040 UZPBSELSAHZXSI-SECBINFHSA-N 288.185 2.357 10 20 CECD CN(C(=O)c1c[nH]nc1-c1cnn(C)c1)c1ccc(F)cc1 436060130 MTJRFQUBEMEOOI-UHFFFAOYSA-N 299.309 2.226 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CCC(N)=O)C2)cc1 92659881 GVENZOCDWRQCRX-CQSZACIVSA-N 289.423 2.230 10 20 CECD Cc1cccc(CN2CC[C@@H](Cc3cnn(C)c3)C2)c1O 362044176 HGJHLSUCRQCOLY-AWEZNQCLSA-N 285.391 2.499 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@]2(C)CCCOC2)cc1 272594237 CYZFZHOIOAFWML-INIZCTEOSA-N 276.380 2.186 10 20 CECD C[C@H]1CN(CCCNCc2cc(F)ccc2O)CCCO1 277646514 YUSNJEXUKGOGHP-ZDUSSCGKSA-N 296.386 2.122 10 20 CECD COC[C@H](CO)N[C@H](C)c1cc(Cl)c(Cl)cc1O 280843150 AVECLDBKZNXJKE-SFYZADRCSA-N 294.178 2.357 10 20 CECD CC[C@H](NC[C@@](C)(O)COC)c1cccc(Cl)c1O 806140702 ZOSPYCBZKMWRLU-GXTWGEPZSA-N 287.787 2.484 10 20 CECD Cc1cc(CN(CC(N)=O)CC(C)C)ccc1N(C)C 293671246 ZLTFMGBAFHHOAO-UHFFFAOYSA-N 277.412 2.004 10 20 CECD CC(=O)C1(C(=O)NCc2ccc(N(C)C)cc2C)CC1 815629769 MUZZKDIHEJBCCG-UHFFFAOYSA-N 274.364 2.046 10 20 CECD C[C@H](N)CCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 817953862 VKVUAVCSXLWIKM-ATZCPNFKSA-N 252.333 2.407 10 20 CECD O=C(NCc1ccc(O)cc1O)C1CC2(CCC2)C1 827701517 GISMBGWCLJCUIN-UHFFFAOYSA-N 261.321 2.294 10 20 CECD Cc1nc(CN(C)Cc2c(O)cccc2Cl)no1 827892299 VLWGOLAFFIYWFG-UHFFFAOYSA-N 267.716 2.369 10 20 CECD CCOc1ccc(O)c(CN(C)Cc2nnc(C)o2)c1 827039290 NCPWPNDZWMPGOL-UHFFFAOYSA-N 277.324 2.114 10 20 CECD C[C@@H](NC[C@H]1CCN1C)c1cc(F)cc(F)c1O 903319428 ZFEUBZNZJCAFFE-PSASIEDQSA-N 256.296 2.025 10 20 CECD CN(Cc1cc(Cl)c(F)cc1O)C1(CO)CC1 827903054 AGWCBFIRYFYVFF-UHFFFAOYSA-N 259.708 2.141 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C[C@H]1COCCO1 827140092 HRGZVZMZLOMLEG-VIFPVBQESA-N 289.734 2.032 10 20 CECD O=C(O)[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 821511169 CSTPOTOWAOLHDL-SSDOTTSWSA-N 273.691 2.091 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)CC(=O)O 829497130 WWYHRARGHYWDOZ-LLVKDONJSA-N 279.336 2.242 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H](c2ncc[nH]2)C1 732285066 PLOIYHZBTGHMMB-VIFPVBQESA-N 277.349 2.197 10 20 CECD C[C@@H]1CC[C@H](CNC(=O)c2c(F)ccc(O)c2O)C1 831005842 QRKWDQYGCXLNRR-BDAKNGLRSA-N 267.300 2.403 10 20 CECD C[C@@H](C[C@@H](C)N)NCc1cc(Cl)cc(F)c1O 843129056 LYMHNQONIDBXFC-SFYZADRCSA-N 260.740 2.400 10 20 CECD CC[C@H](O)[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1C 900732009 HSDZUBFLCBPOBF-DOMZBBRYSA-N 278.396 2.084 10 20 CECD C[C@@H](NC(=O)C1(N(C)C)CC1)c1ccc(N(C)C)cc1 832431576 RCVJJSHJUKOSIP-GFCCVEGCSA-N 275.396 2.024 10 20 CECD C[C@@H](CCCN)NCc1cc(Cl)cc([N+](=O)[O-])c1O 841078370 BSCKTNZYWBFEES-QMMMGPOBSA-N 287.747 2.171 10 20 CECD CCOC(=O)[C@H](CC)C(=O)NCc1cc(Cl)ccc1O 846475353 CRLBWHPSAUIUIY-LLVKDONJSA-N 299.754 2.251 10 20 CECD Cc1cc(O)c(CN[C@@H](C)[C@@H]2CCCNC2)cc1C 841032398 BSNODWGIPIUBBH-UONOGXRCSA-N 262.397 2.487 10 20 CECD Cc1occc1CNC(=O)NCCc1ccc(N)cc1 841727488 SCMOXCLSPQWSRV-UHFFFAOYSA-N 273.336 2.212 10 20 CECD COCCN(C)CCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756528720 OZNJGXDDDMKMQN-AAEUAGOBSA-N 296.386 2.247 10 20 CECD CON(C)C(=O)[C@H](C)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 858580194 XNBBJGTUWVJCSB-WCABBAIRSA-N 296.342 2.078 10 20 CECD CN(CC[C@@H]1COC(C)(C)O1)c1ccc2c(c1)OCO2 851867713 JVDYLWJQWOZHFZ-GFCCVEGCSA-N 279.336 2.393 10 20 CECD O=C(NC[C@H]1CCCCS1)c1cc(O)cs1 753476396 LHGNTBCVSGSSKO-SECBINFHSA-N 257.380 2.469 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1cc(C)c(C)cc1O 759174524 VKBROIZFLQIAMQ-GOEBONIOSA-N 279.380 2.293 10 20 CECD COc1ccc2c(c1)CCCCN2CCN1CCOC1=O 766270756 SLDJKYYDDDASQI-UHFFFAOYSA-N 290.363 2.290 10 20 CECD C[C@H](CNCc1cc(F)c(N(C)C)cc1F)CC(=O)O 864513239 XQZHPRYNKHEMBH-VIFPVBQESA-N 286.322 2.231 10 20 CECD C[C@]1(CNC(=O)c2cc(O)cs2)CCCC[C@@H]1O 762549664 NLZJRTBTKKHOFW-WCQYABFASA-N 269.366 2.125 10 20 CECD COc1ccc(N(C)C[C@]2(OC)CCOC2)cc1F 877181161 IRWFXTQXGQHKNZ-CQSZACIVSA-N 269.316 2.076 10 20 CECD COc1ccc(CNCc2cocn2)cc1Cn1cccn1 873048102 PCMQMZYORSDJQM-UHFFFAOYSA-N 298.346 2.218 10 20 CECD Cc1cccc(O)c1CN[C@H]1CC(=O)N(C(C)(C)C)C1 877081611 DIGLQDWTIRWIKC-LBPRGKRZSA-N 276.380 2.190 10 20 CECD Cc1cccc(O)c1CNC[C@]1(N(C)C)CCSC1 877074420 JKTCMFNEGHIBJN-OAHLLOKOSA-N 280.437 2.228 10 20 CECD C[C@@H](NC(=O)c1ccc(N)cc1)c1ccccc1O 1579414419 ACELDKISDVFMBD-SNVBAGLBSA-N 256.305 2.465 10 20 CECD O=C(CCC(F)(F)F)OCC(=O)c1ccc(O)c(O)c1 783913758 DYDMHDFRXTWUOR-UHFFFAOYSA-N 292.209 2.166 10 20 CECD C[C@H](O)CN(C)Cc1cc(Br)cc(F)c1O 894449855 FBYMMCRNXDMPGB-ZETCQYMHSA-N 292.148 2.106 10 20 CECD CN1CCN(c2ccc(CNC(=O)C3=CCCC3)cc2)CC1 893608113 PDZHMSVODVWGAM-UHFFFAOYSA-N 299.418 2.165 10 20 CECD CN(C)c1ccc([C@@H](CNC(=O)CCCF)N(C)C)cc1 891245730 IDPBBTDASALZKB-OAHLLOKOSA-N 295.402 2.221 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)CCS(C)(=O)=O)c1 185790508 IUADWTQVBIBVQW-RYUDHWBXSA-N 285.409 2.174 10 20 CECD Oc1cccc(Br)c1CN1CCCOCC1 707134465 GLQSVDUQNSDLLZ-UHFFFAOYSA-N 286.169 2.377 10 20 CECD O=C(N[C@H](C(=O)O)c1ccccc1F)c1cc(O)cs1 1601399744 OPYSSGLGKWIQLC-NSHDSACASA-N 295.291 2.149 10 20 CECD O=C(O)c1cnc(SCC(=O)C2(Cl)CC2)s1 1602536902 GDBZJWPPTIFZGP-UHFFFAOYSA-N 277.754 2.274 10 20 CECD Oc1ccc(F)cc1CNC[C@H]1CCC[C@H](O)C1 226611458 OUUIPSQCGNKDSD-GWCFXTLKSA-N 253.317 2.172 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C(F)(F)F 115490800 RPPZMONZZRTKHF-UHFFFAOYSA-N 260.259 2.240 10 20 CECD NCC1CCN(Cc2cc(Cl)c(F)cc2O)CC1 1574276261 AWBLNRIBHCGWLL-UHFFFAOYSA-N 272.751 2.355 10 20 CECD COc1cc(C)c(CN2CC[C@H](C)[C@H](C(=O)O)C2)c(O)c1 1574181546 BZGMUSMHFGIGOO-IINYFYTJSA-N 293.363 2.252 10 20 CECD Nc1ccc(CNC(=O)c2csc(C=O)c2)cc1 1580445705 QPKHZAIRLYEDTC-UHFFFAOYSA-N 260.318 2.073 10 20 CECD C[C@@H](Sc1ncc(C(=O)O)s1)C(=O)NC(C)(C)C 1593679237 GYIZFJPQEOZMET-ZCFIWIBFSA-N 288.394 2.237 10 20 CECD CN(C)c1ccc(CN2C[C@H]3C[C@@H](C2)[C@H](C(=O)O)C3)cc1 1777039347 FHUMSMMOVQCFJI-OFQRWUPVSA-N 288.391 2.295 10 20 CECD C[C@@]1(C(=O)O)CC[C@@H](NCc2cc(F)cc(F)c2O)C1 1776501995 XUHVEIDWCZNWIN-QMTHXVAHSA-N 285.290 2.403 10 20 CECD CN1CC=C(CNCc2c(O)cccc2Cl)CC1 271821326 NAMBYUVRTDITOY-UHFFFAOYSA-N 266.772 2.397 10 20 CECD Oc1c(Br)cccc1CNCC12CC(CO1)C2 527787084 GCOASQLXSZJEAJ-UHFFFAOYSA-N 298.180 2.423 10 20 CECD CCOc1cccc(CN[C@]2(CC)CCOC2)c1O 378775919 NBCDICAQZYQENQ-OAHLLOKOSA-N 265.353 2.450 10 20 CECD OC[C@H](CC1CC1)NCc1cccc(Cl)c1O 776252038 KWSKEDHJBIKRBO-NSHDSACASA-N 255.745 2.296 10 20 CECD CC(=O)N1CCC(CNCc2c(O)cccc2Cl)CC1 113338193 LGHDCZXBJFELTL-UHFFFAOYSA-N 296.798 2.394 10 20 CECD CC[C@@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183475083 QHKJBYSKLSFAPZ-ZJUUUORDSA-N 251.326 2.191 10 20 CECD COc1cccc(CN(C)CCc2ccccn2)c1O 120822383 MRZIXDIVUIYJRY-UHFFFAOYSA-N 272.348 2.470 10 20 CECD C/C=C/C=C/C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186374524 XGNZDDBORRHENE-XXZAKMSKSA-N 261.321 2.277 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2ccc(N(C)C)cc2)C1 185786706 QPKQEROSNSIBIO-CQSZACIVSA-N 291.395 2.073 10 20 CECD C[C@H](N)CC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 40855918 GDEYAADNOLYSIS-AWEZNQCLSA-N 289.423 2.373 10 20 CECD Cc1cc(NC(=O)N(C)Cc2ccccc2O)n(C)n1 48870444 QQJJYWSNQMAZHG-UHFFFAOYSA-N 274.324 2.098 10 20 CECD CCC[C@@](C)(NCc1ccc2c(c1)CCO2)C(=O)O 86732319 CLIGYMMWEDCGQL-OAHLLOKOSA-N 263.337 2.355 10 20 CECD CC(C)c1nnc(Sc2ncc([N+](=O)[O-])s2)n1C 195512613 SJCHRMAMJACEDB-UHFFFAOYSA-N 285.354 2.454 10 20 CECD CCOCC(=O)NCc1ccc(N(CC)CC)cc1 193742939 JMHPIEXLVSNIHE-UHFFFAOYSA-N 264.369 2.186 10 20 CECD C[C@H](NCC(C)(C)N1CCOCC1)c1cc(F)ccc1O 94616809 BADDUXIZSVINCI-LBPRGKRZSA-N 296.386 2.293 10 20 CECD Cc1c(CNC(=O)c2cnn(C)c2)n(C)c2ccccc12 352112419 TUVVUHUXLCUCTA-UHFFFAOYSA-N 282.347 2.150 10 20 CECD CSC[C@@](C)(O)CNCc1cc(C)c(C)cc1O 266168139 QCUSGXOKOLPNNU-AWEZNQCLSA-N 269.410 2.213 10 20 CECD Cc1cc(CN2CCC(C)(O)CC2)ccc1N(C)C 292771028 JRVMHBWLRHJHIB-UHFFFAOYSA-N 262.397 2.408 10 20 CECD Oc1ccccc1CN1CC(O)(c2ccccc2)C1 291533698 KNBRONYNZNKXLH-UHFFFAOYSA-N 255.317 2.096 10 20 CECD COCCN(C)Cc1cc(Br)cc(F)c1O 715702546 LUTKXMUZGKJXOS-UHFFFAOYSA-N 292.148 2.372 10 20 CECD C[C@@H](NC[C@@H]1CCCCN1)c1cc([N+](=O)[O-])ccc1O 817950027 QHEMOVVKBSBLIT-MNOVXSKESA-N 279.340 2.093 10 20 CECD CON1CCC(NCc2cc(Cl)c(F)cc2O)CC1 817418312 KGWZPMCMIMOXOZ-UHFFFAOYSA-N 288.750 2.300 10 20 CECD C[C@H](OC(=O)c1cc(O)cs1)C(=O)NC1CCCCC1 731912602 UPRAFYKZVQXJIQ-VIFPVBQESA-N 297.376 2.448 10 20 CECD CC[C@H](CN1CCOCC1)N[C@@H](C)c1ccc(C)cc1O 903342996 LVQTXLRGEYTREO-LSDHHAIUSA-N 292.423 2.462 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)C2(C)CCC2)cc1 832265909 BGZZNRSYDXDMHN-AWEZNQCLSA-N 275.396 2.059 10 20 CECD CCC(C)(C)OCCNC(=O)NCc1ccccc1O 836689025 DSIOQTVHODSRDG-UHFFFAOYSA-N 280.368 2.397 10 20 CECD CC[C@H](CO)N(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 838560462 XHLLNHBAPUWUMU-TZMCWYRMSA-N 293.411 2.226 10 20 CECD C[C@H](NCc1nnn(C(C)(C)C)n1)c1cc(F)ccc1O 848561235 RWASKKAHKRKZBJ-VIFPVBQESA-N 293.346 2.124 10 20 CECD C[C@@H]1C[C@@H](C)CN(C(=O)NCCc2ccc(N)cc2)C1 841961726 GUFRMLBDFYTWAX-CHWSQXEVSA-N 275.396 2.499 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N(C)C 840557636 SEUZFHNDHCATAN-GFCCVEGCSA-N 263.385 2.263 10 20 CECD CCOc1cccc(CNCCCNC2CC2)c1O 841093865 VGRYVMGAFHECOY-UHFFFAOYSA-N 264.369 2.023 10 20 CECD CCc1cccc(CN(C)[C@@H](CO)COC(C)C)c1O 848911501 GGCWJAOMAFKGKO-HNNXBMFYSA-N 281.396 2.172 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)[C@@H](C)CN1 843119948 QBYKJINNIZLXOJ-IUCAKERBSA-N 272.751 2.367 10 20 CECD COCCOCCN(C)Cc1ccc(N(C)C)cc1C 840945909 AJWBLUCBBVXYLJ-UHFFFAOYSA-N 280.412 2.156 10 20 CECD COc1cc(O)c(CN(C)CC[C@@H](N)C(C)C)cc1OC 843056759 ZIDVFBBBPFKHMW-CYBMUJFWSA-N 296.411 2.215 10 20 CECD C[C@@H]1CN(C(=O)Nc2ccc(N)cc2)C[C@@H](C2CC2)O1 841294357 ACNLJNLJEGNVGU-YGRLFVJLSA-N 275.352 2.300 10 20 CECD CCOc1ccc(CN2CC[C@]3(CCCN3)C2)c(O)c1 841105667 WTGWWLOZLIJGFX-MRXNPFEDSA-N 276.380 2.119 10 20 CECD Cc1ccc([C@H](C)NCCCn2cncn2)c(O)c1C 756829146 CWANXEXFHXVVHZ-ZDUSSCGKSA-N 274.368 2.341 10 20 CECD COC(=O)c1cccc(CNC(=O)c2cc(O)cs2)c1 758333388 GTKFVVGXGCKHTI-UHFFFAOYSA-N 291.328 2.170 10 20 CECD CCOC[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 44689076 NOQXCZSXLZUKSU-MNOVXSKESA-N 253.342 2.476 10 20 CECD CCOc1ccc(CN(CC)CCC(=O)OC)c(O)c1 768991814 FWDRTLASWKLGMS-UHFFFAOYSA-N 281.352 2.176 10 20 CECD Cc1ccc(O)c(CNC(=O)c2noc3c2CCCC3)c1 862758668 GOACWDGXOUQGNG-UHFFFAOYSA-N 286.331 2.497 10 20 CECD NC(=O)[C@H]1CCCCN1Cc1cc(Cl)cc(F)c1O 775643196 OJYOCJPEUSTAEQ-LLVKDONJSA-N 286.734 2.025 10 20 CECD CC1=NO[C@H](CNC(=O)NCc2cc(Cl)ccc2O)C1 875958660 HVQWMSHBQUQMIM-NSHDSACASA-N 297.742 2.010 10 20 CECD C[C@@H](C[S@](C)=O)N(C)Cc1cc(Cl)cc(F)c1O 776521222 MTEGTTYOVKBNKL-ASCAZGACSA-N 293.791 2.384 10 20 CECD C[C@@H](NCCCc1cncn1C)c1ccccc1O 879649597 XBWNKWZCGWPVLS-GFCCVEGCSA-N 259.353 2.409 10 20 CECD CC(C)N(C)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 775409332 FMWLVVHFCZNKPN-CYBMUJFWSA-N 277.412 2.270 10 20 CECD CCN(C)c1ccc(CN2CCC(O)(COC)CC2)cc1 773790393 JCBURWFBPPJDPT-UHFFFAOYSA-N 292.423 2.116 10 20 CECD CC[C@H](C[C@@H](C)CO)NC(=O)/C=C\c1ccc(O)c(O)c1 779534181 OIBREBGJYSGXBY-HHQZKXIDSA-N 293.363 2.024 10 20 CECD CN1C(=O)C2(CCCC2)N[C@@H]1c1cc(F)cc(F)c1O 887328482 ZQYGSGDCRBRCQY-LBPRGKRZSA-N 282.290 2.043 10 20 CECD Cc1ccc(CN2CC[C@@H](c3n[nH]c(C)n3)C2)c(O)c1 895012664 TYIUITFQUGJPHO-CYBMUJFWSA-N 272.352 2.117 10 20 CECD COc1ccc(CNCCc2cccnc2)c(O)c1OC 892538349 MYEUMUNPYSCSML-UHFFFAOYSA-N 288.347 2.137 10 20 CECD COc1ccc(CN2CC(CC(F)F)C2)c(O)c1OC 895011141 ATQFMRFMLHMIEM-UHFFFAOYSA-N 287.306 2.496 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@H](C)c1cc(F)ccc1O 188494608 VNCAPQCYUJVBIB-ZJUUUORDSA-N 268.332 2.049 10 20 CECD CC(C)c1nocc1C(=O)NCc1ccc(N)cc1 1343567334 PJBGOHPDWLYLIQ-UHFFFAOYSA-N 259.309 2.310 10 20 CECD Nc1ccc(NC(=O)[C@H]2CC[C@H](C(=O)O)CC2)cc1 1608273757 YYLMUSLRXCQDTR-MGCOHNPYSA-N 262.309 2.098 10 20 CECD CCc1cccc(CN(CC(=O)O)CC2CC2)c1O 1603975151 JGAKKDCEDCPJQB-UHFFFAOYSA-N 263.337 2.251 10 20 CECD CC(C)OC(=O)CC[C@H](C)NC(=O)Cc1ccc(N)cc1 1575940988 GGZVOIQEFGHXIA-LBPRGKRZSA-N 292.379 2.048 10 20 CECD COc1cc(C)cc(CNCCCCCC(=O)O)c1O 1599392918 WHTKCTRJJYKNBQ-UHFFFAOYSA-N 281.352 2.444 10 20 CECD CCN(C)c1ccc(CN[C@H](CCOC)C(=O)O)c(C)c1 1776856148 PEWSIFPKYRCYPF-OAHLLOKOSA-N 294.395 2.030 10 20 CECD CN(C)c1ccc(NCc2cc3c(cc2O)OCO3)nc1 150914223 CRQPZQBSVUDJMN-UHFFFAOYSA-N 287.319 2.194 10 20 CECD CC(C)c1cc(NC(=O)c2cccc(O)c2O)[nH]n1 126648623 GJKLBNGMUWVZBU-UHFFFAOYSA-N 261.281 2.197 10 20 CECD C[C@@H]1CN(C)CC[C@H]1N(C)Cc1cc(F)cc(F)c1O 894783210 QTWZINOWQXANEW-QMTHXVAHSA-N 284.350 2.442 10 20 CECD CCOC(=O)N1CCN(Cc2c(O)cccc2Cl)CC1 158398477 GPVSFXMBUDWYGF-UHFFFAOYSA-N 298.770 2.320 10 20 CECD COc1ccc(CNCc2ccc3c(c2)CCO3)cn1 37362896 JEVYDNXPFKFMDS-UHFFFAOYSA-N 270.332 2.315 10 20 CECD CC[C@H](C)NC(=O)CCN[C@@H](C)c1ccccc1O 38013798 WBNQLECLHJQAIT-RYUDHWBXSA-N 264.369 2.348 10 20 CECD COCc1ccc(C(=O)NCc2ccccc2O)cc1 72051910 FEMVMBHATAOQFX-UHFFFAOYSA-N 271.316 2.469 10 20 CECD CC[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)OC 311569653 QPULSWHFCBJIAK-FZMZJTMJSA-N 264.369 2.355 10 20 CECD CON1CCC(N[C@H](C)c2ccccc2O)CC1 709288816 YXMNNTYIMUOIRZ-LLVKDONJSA-N 250.342 2.069 10 20 CECD CCOC(=O)[C@@H]1CCCN(Cc2ccccc2O)C1 4590263 QUFAWTYLYGFDOF-CYBMUJFWSA-N 263.337 2.167 10 20 CECD O=C(NCCCSc1nccs1)N1CCC1 177853869 QUONRHIJKPYCNO-UHFFFAOYSA-N 257.384 2.041 10 20 CECD CS[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1C 115279875 PXRMIUOCEWRJLL-NSHDSACASA-N 266.410 2.429 10 20 CECD Cc1c(CN(C)Cc2ccc(N(C)C)cc2)cnn1C 119907367 DGXNJYCHCYYMSV-UHFFFAOYSA-N 272.396 2.427 10 20 CECD Cc1ccc(O)c(NC(=O)c2cccc(O)c2O)c1 186998138 IDCOUIODQCJDHX-UHFFFAOYSA-N 259.261 2.364 10 20 CECD CCOC(C)(C)CNCc1cc(OC)c(OC)cc1O 188865390 WISDJFOPBROEKN-UHFFFAOYSA-N 283.368 2.314 10 20 CECD CSC[C@@H](CCO)N[C@H](C)c1cc(C)ccc1O 185530199 GEJYENDEVSNJJN-VXGBXAGGSA-N 269.410 2.465 10 20 CECD Cc1ccc(O)c([C@H](C)NCCNC(=O)c2ccco2)c1 184916973 DMOKPKRHAQSFHD-LBPRGKRZSA-N 288.347 2.374 10 20 CECD CCn1nncc1CN[C@H](C)c1c(C)cc(C)cc1O 527917233 RXKWUEBQHBYBIP-GFCCVEGCSA-N 274.368 2.471 10 20 CECD CN(C)C(=O)O[C@H]1CCN(Cc2c(O)cccc2Cl)C1 295210062 ZZFSUIKCCKPVAF-JTQLQIEISA-N 298.770 2.318 10 20 CECD CC(C)(C)OC(=O)NCCN[C@@H]1CCc2cccc(O)c21 297877896 UXLOFONYQVQFSF-GFCCVEGCSA-N 292.379 2.494 10 20 CECD CC(C)[C@@H](CCO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273603079 SJBRZPPNLJBGGG-GXFFZTMASA-N 282.340 2.358 10 20 CECD CC[C@@H](NCCCS(C)(=O)=O)c1ccc(F)cc1O 285935702 FMQZIJTWAYLEAS-GFCCVEGCSA-N 289.372 2.007 10 20 CECD CC[C@@H](N[C@H](CO)c1cnn(C)c1)c1ccc(F)cc1O 285957146 FIZMGABQIJXNLV-ZIAGYGMSSA-N 293.342 2.039 10 20 CECD CC[C@@H]1CN(Cc2cc(F)ccc2O)C[C@@H](C)[S@@]1=O 289678372 NVPUNPQTVMJWEV-FTNGCUSPSA-N 285.384 2.263 10 20 CECD CCNC(=O)[C@@H](NCc1cccc(Cl)c1O)C(C)C 293680465 PRCUQGNRUFMRPM-LBPRGKRZSA-N 284.787 2.296 10 20 CECD CCCCN(CC(N)=O)Cc1ccc(N(C)C)c(C)c1 293640661 XNMDHHMBLBPDRX-UHFFFAOYSA-N 277.412 2.148 10 20 CECD CCc1[nH]ccc1C(=O)NCc1ccc(OC)cc1O 803291778 BEKAXYNHNIZNPJ-UHFFFAOYSA-N 274.320 2.221 10 20 CECD CC(C)C[C@@H](CN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 817957582 DDQWFTPKSLZWIR-MNOVXSKESA-N 281.356 2.324 10 20 CECD CN(Cc1nc(C2CC2)nn1C)c1ccc2c(c1)OCO2 828098217 IRIBIRKXIJFNHO-UHFFFAOYSA-N 286.335 2.058 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCCC[C@]2(C)N)cc1 825973931 TUVLFSZMPNLRNX-WBVHZDCISA-N 289.423 2.276 10 20 CECD OC[C@@H]1CCC[C@@H]1NCc1c(O)ccc(Cl)c1F 825188852 QIGYQAZAARWQOT-KWQFWETISA-N 273.735 2.435 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)C1(CO)CC1 826991242 XGCXEVDCOVXETG-CYBMUJFWSA-N 262.397 2.312 10 20 CECD CC(C)(C)[C@@H](CC(=O)O)NCc1ccccc1O 905790427 SQGLWIDVZVGLFF-GFCCVEGCSA-N 251.326 2.371 10 20 CECD Cc1cc(C(=O)O[C@@H](C)C(=O)O)c(C)n1-c1ccccn1 738216940 UWOAJGJCLKRRKT-NSHDSACASA-N 288.303 2.119 10 20 CECD CCN(CCCC(=O)OC)c1ccc(OC)c(OC)c1 735309345 DODBDZGUEJYZSP-UHFFFAOYSA-N 281.352 2.483 10 20 CECD COC(=O)CN(C)Cc1cc(OC)cc(C(C)(C)C)c1O 732526047 YGYSOMUNOSCHLY-UHFFFAOYSA-N 295.379 2.303 10 20 CECD O=C(Cc1cccnc1)NCCCSc1nccs1 735471671 VGAZDTZSNLOKIZ-UHFFFAOYSA-N 293.417 2.379 10 20 CECD Cc1cc(C)n2nc(Sc3nccs3)nc2n1 914862372 FAOIXLMOAJYKBG-UHFFFAOYSA-N 263.351 2.349 10 20 CECD Cc1cc(O)c(CNC[C@H](C(=O)O)C(C)C)cc1C 848639793 LOMMFSLWZRVXLY-ZDUSSCGKSA-N 265.353 2.455 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H](C)N 841988444 RKQCFIQVLSTTJX-ZDUSSCGKSA-N 292.427 2.020 10 20 CECD COc1ccc(O)c(CNc2ccc(OCCN)cc2)c1 841053995 FHFMVXDADCFDMD-UHFFFAOYSA-N 288.347 2.350 10 20 CECD CCc1cccc(CN(C)C[C@H]2CCN(C(C)=O)C2)c1O 848890847 UPMRXSWEDVTOPT-CQSZACIVSA-N 290.407 2.255 10 20 CECD CC[C@@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 846074162 VWWYEMVHNMTFSA-SWLSCSKDSA-N 288.391 2.444 10 20 CECD CCOc1ccc(O)c(CNC2(C)CCNCC2)c1 841065044 LNMNFUBYTPUCCC-UHFFFAOYSA-N 264.369 2.023 10 20 CECD CCOc1ccc(O)c(CN[C@@H](CO)CC2CC2)c1 754835045 RQZHNHVOQWIECA-CYBMUJFWSA-N 265.353 2.042 10 20 CECD O=C(Cc1cncs1)NCc1cc(Cl)ccc1O 857548050 BIVNOOUYCZUVBR-UHFFFAOYSA-N 282.752 2.361 10 20 CECD C[C@H](N[C@H](C)CC(N)=O)c1cc2c(cc1O)CCCC2 756660142 JDPJQQDRMMYDFO-MNOVXSKESA-N 276.380 2.186 10 20 CECD C[C@@H]1C[C@H](O)CN1Cc1c(O)cccc1Br 862339378 RMUWHPROXCMYSU-BDAKNGLRSA-N 286.169 2.110 10 20 CECD CC[C@@H](NCC[C@H](O)COC)c1cc(Cl)ccc1O 775526557 RXOAFLGXKSPJOM-WCQYABFASA-N 287.787 2.484 10 20 CECD Cn1cc([C@@H]2CSCCN2Cc2ccc(N)cc2)cn1 1120371340 WAAJHSQQJDPWQP-HNNXBMFYSA-N 288.420 2.292 10 20 CECD CCn1cc(/C=C2/C(=O)N(C)c3ccc(C)cc32)nn1 899377579 AZDJMCZMCRHPLD-MDWZMJQESA-N 268.320 2.123 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1 86802692 MRGOAPGPYFKOCO-CYBMUJFWSA-N 250.342 2.048 10 20 CECD CCOc1ccc(CN[C@@H](C)C(=O)OCC(C)C)c(O)c1 789578128 ZREHZYAJUGUBIJ-LBPRGKRZSA-N 295.379 2.468 10 20 CECD C[C@H]1c2nncn2CCN1Cc1cc(Cl)ccc1O 792186037 FVUBGDPXKDVLLW-VIFPVBQESA-N 278.743 2.214 10 20 CECD CCC[C@H](CNC(=O)Cc1ccc(N)cc1)OCC 705341488 WAGYOAQRJMCJNY-CQSZACIVSA-N 264.369 2.133 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCC[C@H]2CN)cc1 89140413 FYWWFQBIXFDRBJ-GOEBONIOSA-N 261.413 2.360 10 20 CECD C[C@@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(F)F 1161304078 NVIQAXLKEWBTOY-ZCFIWIBFSA-N 270.239 2.232 10 20 CECD Cn1nccc1NC(=O)c1ccc(C2=S=CC=C2)s1 1320136778 HVHFMNQWARPWSR-UHFFFAOYSA-N 289.385 2.360 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)c1nccs1 1324649209 IXQBIUORJSKKOE-UHFFFAOYSA-N 285.372 2.449 10 20 CECD CC(C)[C@]1(C)C[C@H]1C(=O)NCc1cccc(O)c1O 1520508491 CSSWIXNVNPRGPE-NHYWBVRUSA-N 263.337 2.396 10 20 CECD O=C(O)[C@@H]1[C@@H]2CCC[C@@H]2CN1Cc1ccc(F)c(F)c1O 1601756915 KHRSMNKTHOIWAQ-JQEORGNBSA-N 297.301 2.356 10 20 CECD CCOc1ccc(CN2CC[C@@H](C)C[C@H]2C(=O)O)c(O)c1 1605690675 MZMVZILMRCFVOS-RISCZKNCSA-N 293.363 2.476 10 20 CECD C[C@H](N[C@@H]1CC[C@H]1C)c1cccc(-c2nn[nH]n2)c1O 1589955090 KBHPKQGPHYJBKS-VDDIYKPWSA-N 273.340 2.021 10 20 CECD CN(C)c1ccc(CNc2cccc(CC(=O)O)n2)cc1 1598320446 GAHLDIZODWDOKF-UHFFFAOYSA-N 285.347 2.387 10 20 CECD CCN(C)c1ccc(CN2CCC(F)(F)[C@H]2C(=O)O)cc1 1776855947 YHQLDCRIGZVVMD-CYBMUJFWSA-N 298.333 2.437 10 20 CECD Cc1cccc(O)c1CN1CC[S@@](=O)C(C)(C)CC1 877570582 PSPGMTXOKLEQKF-LJQANCHMSA-N 281.421 2.434 10 20 CECD CO[C@H](CNCc1cc(C)ccc1O)C1CCOCC1 877652875 OPRQJQQPRAWILG-MRXNPFEDSA-N 279.380 2.232 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](C)NC[C@H]2C)c1O 252881636 ZZQLNTRERNIURH-NXEZZACHSA-N 284.787 2.236 10 20 CECD COc1ccc(O)c(CN[C@H](C)c2cnn(C)c2C)c1 37167363 JJVSCNYOURTIAN-SNVBAGLBSA-N 275.352 2.294 10 20 CECD COCC1(NCc2cc(OC)ccc2O)CCC1 285153947 PCLUXPKWIGMSTD-UHFFFAOYSA-N 251.326 2.060 10 20 CECD C[C@@H]1CSC[C@@H]1NCc1ccc(N2CCOCC2)cc1 285470132 KMOWRLJADIOCAK-CJNGLKHVSA-N 292.448 2.364 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1cc(Cl)ccc1O 185467045 OLPUSRFJLRVBQW-YGRLFVJLSA-N 287.787 2.484 10 20 CECD O=C(NCCOc1cccc(F)c1)c1cccc(O)c1O 186923314 GYKFHSZUQUVNTJ-UHFFFAOYSA-N 291.278 2.046 10 20 CECD CCN(CC)CCN(CCOC)Cc1cc(F)ccc1O 180079176 FMHOPMGRSZPHBN-UHFFFAOYSA-N 298.402 2.322 10 20 CECD Cc1cncc(CNC(=O)/C=C/c2ccc(O)c(O)c2)c1 181270920 OBLAIIXPOHLPRG-HWKANZROSA-N 284.315 2.131 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)cc1O)[C@@H](C)N1CCOCC1 185375839 NIPUSZWDPYICIS-YNEHKIRRSA-N 296.386 2.291 10 20 CECD CO[C@@H]1CCC[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 134164099 TWXCITUMZQAFLN-HUUCEWRRSA-N 291.395 2.119 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(CN)o1 237085842 YGVRWVGNBLNGGV-UHFFFAOYSA-N 287.363 2.043 10 20 CECD CSc1ccccc1C(=O)N1CC[S@](=O)[C@@H](C)[C@@H]1C 265493007 ILSLUNIBBRVORK-ADWYPQAOSA-N 297.445 2.390 10 20 CECD CC(=O)C1(C(=O)NCc2ccc3c(c2)CCCN3C)CC1 292958915 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VWTDKYSCOXNKMW-MLGOLLRUSA-N 276.380 2.328 10 20 CECD CN(Cc1cc(O)nc(C2CC2)n1)c1ccc2c(c1)OCO2 838899997 DDDWGRGJDVVDNC-UHFFFAOYSA-N 299.330 2.425 10 20 CECD O=C1CCC[C@H]1[C@@H]1CCCN1C(=O)c1cc(O)cs1 831433364 FXIAAIXJNBOVSY-QWRGUYRKSA-N 279.361 2.428 10 20 CECD O=C(NC[C@@H](O)c1cccc(F)c1)c1cc(O)cs1 731871405 JSRXNCYDHPSZHV-LLVKDONJSA-N 281.308 2.056 10 20 CECD C[C@@H](NC(=O)O[C@H]1CCOC1)c1ccc(N(C)C)cc1 914390978 ALJKPXQQVPYXKI-RISCZKNCSA-N 278.352 2.329 10 20 CECD COc1cccc([C@@H](C)NCCC[C@@H](C)CO)c1O 846158353 WUZCLKQHHBOMIC-VXGBXAGGSA-N 267.369 2.460 10 20 CECD COCCCCC(=O)NCc1cc(Cl)ccc1O 846472088 GTEBTEYTNLUOKJ-UHFFFAOYSA-N 271.744 2.479 10 20 CECD COc1cccc([C@H](C)NCC[C@@H](C)OC)c1O 846143643 FKXQNPBCDNNDFM-MNOVXSKESA-N 253.342 2.476 10 20 CECD COC1([C@H](C)NC(=O)/C=C/c2ccc(O)c(O)c2)CCC1 840530689 AIIOOVOZWQMKOA-ZRQQLDRUSA-N 291.347 2.185 10 20 CECD C[C@H](N)C[C@H](C)NCc1cc(Br)ccc1O 843130091 WQZBNPNPYYFOEL-IUCAKERBSA-N 287.201 2.370 10 20 CECD CCc1cccc(CN2CCN(C)C(=O)C2(C)C)c1O 848888455 ULPBSTWLFBKTHA-UHFFFAOYSA-N 276.380 2.007 10 20 CECD CC(C)(F)CCNC(=O)/C=C/c1ccc(O)c(O)c1 855746089 RDLCHDPRJFICGH-GQCTYLIASA-N 267.300 2.365 10 20 CECD CN(CCN[C@H]1CCc2cccc(O)c21)CC(F)F 858597212 WWHCTDFYJQOOMW-NSHDSACASA-N 270.323 2.166 10 20 CECD C[C@@H](NCc1ccon1)c1cc([N+](=O)[O-])ccc1O 756638997 XVDJZDHVQNNPNR-MRVPVSSYSA-N 263.253 2.139 10 20 CECD CS[C@H](CO)[C@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 756595147 UFDDTDFUNUJNAQ-YVZVNANGSA-N 291.363 2.433 10 20 CECD CCc1cc(CNC(=O)NCc2cc(C)ccc2O)on1 858245741 WUPSPFSNZJWYDS-UHFFFAOYSA-N 289.335 2.250 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@H]1CCC[C@@H]1O 865736614 LNNGMUSAFBJUMU-ONGXEEELSA-N 259.708 2.188 10 20 CECD Oc1ccc(F)cc1CN[C@H]1Cc2cccc(O)c2C1 763482289 YJIHFSDWIZIKHC-ZDUSSCGKSA-N 273.307 2.494 10 20 CECD FC(F)Oc1ccc2c(c1)CCCN2CC1OCCO1 777606526 MKIHBXJWZNZCTM-UHFFFAOYSA-N 285.290 2.414 10 20 CECD CCN(C)c1ccc(CN2CCNC(=O)[C@@H]2C(C)C)cc1 773758587 XANLEEOWLKVXSE-INIZCTEOSA-N 289.423 2.099 10 20 CECD COCC[C@]1(NCc2cc(Cl)ccc2O)CCOC1 775035256 YEYRZCALURZOOR-AWEZNQCLSA-N 285.771 2.331 10 20 CECD O=C(CCCC(F)(F)F)NCc1ccc(O)c(O)c1 778916588 MJBXCVQOGGENQA-UHFFFAOYSA-N 277.242 2.447 10 20 CECD CCN1C[C@H](CN[C@@H](C)c2c(O)cccc2F)CC1=O 886633465 WKTZTILKWIJWIK-QWRGUYRKSA-N 280.343 2.050 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCCCCCO 790742514 IESDIMFSONYOHR-UHFFFAOYSA-N 293.411 2.023 10 20 CECD Oc1cc2c(cc1CNCc1cnn3ccccc13)OCO2 796480120 IZZNWOXJSCJRIX-UHFFFAOYSA-N 297.314 2.058 10 20 CECD CC[C@H](N[C@@H](C)[C@@H]1CN(C)CCO1)c1ccc(C)cc1O 794819436 WQBKLVZLNWDXLY-QRTARXTBSA-N 292.423 2.460 10 20 CECD CC(C)C[C@H](CO)NCc1cc(F)cc(F)c1O 708455238 VSFJWSZXHXBDPS-LLVKDONJSA-N 259.296 2.167 10 20 CECD C[C@@H](Cc1cnn(C)c1)NCc1ccc2c(c1)CCO2 768404076 USQNUELOECQGPQ-LBPRGKRZSA-N 271.364 2.076 10 20 CECD COCC[C@@H](C)NCc1ccc(N2CCOCC2)cc1 101597623 FVQHUKCTKHKYBL-CQSZACIVSA-N 278.396 2.038 10 20 CECD Cc1cccc(CN2CCC3(CC2)C[C@H]3C(=O)O)c1O 1607851093 YBZIKSZOIDBMBU-ZDUSSCGKSA-N 275.348 2.387 10 20 CECD C[C@H](N[C@@H]1C[C@@H](O)C12CCC2)c1cc(C(=O)O)ccc1O 1593217844 DAIYBPDQQNXAHF-CUOATXAZSA-N 291.347 2.045 10 20 CECD CC(C)N(C)C[C@H](C)N[C@@H](C)c1cc(C(=O)O)ccc1O 1593352695 FWGGCKZWRHXWMT-RYUDHWBXSA-N 294.395 2.470 10 20 CECD CC(C)c1ccc(O)c(CN[C@@H](C(=O)O)C2CC2)c1 1591973586 BTCSZVVGVFPFHI-CQSZACIVSA-N 263.337 2.468 10 20 CECD C[C@H]1CC[C@@](NCc2ccc3c(c2)CCO3)(C(=O)O)C1 1776629589 OZVWTYBQISJRGN-ZBEGNZNMSA-N 275.348 2.355 10 20 CECD CCN1CCCc2cc(CNCC3(C(=O)O)CC3)ccc21 1776875584 SIWOQANLSJFLOD-UHFFFAOYSA-N 288.391 2.414 10 20 CECD Cc1nc(C)c(C(=O)NCc2ccc(O)c(O)c2)s1 159043074 VOYRPDBTRNJBEZ-UHFFFAOYSA-N 278.333 2.101 10 20 CECD CCCNC(=O)CCNCc1ccc2c(c1)CCCO2 921574454 WOLQJHQOYFLYPC-UHFFFAOYSA-N 276.380 2.018 10 20 CECD CCC[C@]1(NCc2cccc(OC)c2O)CCOC1 285429770 HIAKHWPWIRDNGV-HNNXBMFYSA-N 265.353 2.450 10 20 CECD COc1ccc(O)c(CN2CC(F)(F)C(F)(F)C2)c1 313324260 JBULOKCDSUUUAQ-UHFFFAOYSA-N 279.233 2.487 10 20 CECD Cc1nnc(CNCc2c(O)cccc2Cl)s1 391839242 LPXSMMXBACWZFQ-UHFFFAOYSA-N 269.757 2.495 10 20 CECD C[C@@H](NCCCO[C@H]1CCOC1)c1ccccc1O 179888279 UQXQFSRBVAZHAM-OLZOCXBDSA-N 265.353 2.238 10 20 CECD COc1cccc(CNc2ccc([N+](=O)[O-])cn2)c1O 66812674 JBWYCYLFSARPKL-UHFFFAOYSA-N 275.264 2.316 10 20 CECD COc1cccc(CN2CCSC[C@@H]2C)c1O 179664500 PXHNGYDIGCVDOW-JTQLQIEISA-N 253.367 2.338 10 20 CECD COc1ccc(NC(=O)c2cccc(O)c2O)cc1 126234488 IXKGYRFTEKOSMA-UHFFFAOYSA-N 259.261 2.359 10 20 CECD CC(C)OC(=O)[C@H](C)N(C)Cc1cc(F)ccc1O 180226799 YFSOWALBJXJPGW-JTQLQIEISA-N 269.316 2.303 10 20 CECD NCC1CCN(Cc2cc(Br)ccc2O)CC1 219451239 UCWKUOJWFIFRTE-UHFFFAOYSA-N 299.212 2.325 10 20 CECD C[C@H](N[C@H](C)c1nnnn1C1CC1)c1cc(F)ccc1O 189122076 IKJIZPZXDPTBFA-DTWKUNHWSA-N 291.330 2.265 10 20 CECD C[C@H]1CN(C(=O)c2cccc(O)c2O)C[C@H](C)S1 126430468 WMUXAFHDIHAHSI-IUCAKERBSA-N 267.350 2.064 10 20 CECD NC(=O)[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 157148925 ZAPPRWWUAOZYCG-SSDOTTSWSA-N 289.162 2.006 10 20 CECD COCCC1(C(=O)NCc2ccc(N(C)C)cc2C)CC1 133678878 OPCMMAWOFVNTNL-UHFFFAOYSA-N 290.407 2.494 10 20 CECD CC[C@](C)(O)CN[C@@H](C)c1cc(OC)ccc1O 87013362 VHUVSCCVBZKAMQ-HZMBPMFUSA-N 253.342 2.212 10 20 CECD COC(=O)Cc1cccc(NCc2cccc(C)c2O)n1 191625940 YEDZQRXIQVJNKN-UHFFFAOYSA-N 286.331 2.423 10 20 CECD CO[C@H]1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 267973875 QHCNAUICQWOTBB-AWEZNQCLSA-N 299.374 2.350 10 20 CECD COc1cccc(CNCc2cnn(C(C)C)c2)c1O 265035925 HFXPZYWCPLNYPT-UHFFFAOYSA-N 275.352 2.468 10 20 CECD C[C@H]1CCC[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272476618 QGAFXYYMGZUUPG-YPRPKKHFSA-N 261.321 2.416 10 20 CECD Cc1n[nH]cc1CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273538221 XRJZJYKIGPGOME-SECBINFHSA-N 276.296 2.183 10 20 CECD COc1coc(CN(C)c2ccc3c(c2)OCO3)cc1=O 270362990 RZZLFYRMCSZBLU-UHFFFAOYSA-N 289.287 2.014 10 20 CECD COc1cccc(CNC[C@@H]2COC3(CCCC3)O2)c1O 271380868 DJKHFBDQHBCCFZ-CYBMUJFWSA-N 293.363 2.176 10 20 CECD CN(C)c1ccc(CNCC2([S@@](C)=O)CCC2)cc1F 280521595 BBKWCVUCOXBBHC-HXUWFJFHSA-N 298.427 2.283 10 20 CECD CN(C)c1ccc(CN2CCC(F)(F)[C@@H](CO)C2)cc1 291227287 KAXOFKFKYQVQID-CYBMUJFWSA-N 284.350 2.202 10 20 CECD C[C@H](NC[C@H]1CC[C@@H](CO)O1)c1cc(Cl)ccc1O 294061493 HECYWSHUASRZHS-WCQGTBRESA-N 285.771 2.236 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCc1nnc(C)n1C 393200532 YELDAMOQZOLNEQ-ZYHUDNBSSA-N 286.379 2.476 10 20 CECD C[C@@H](CN)N[C@H](C)c1ccc(Br)cc1O 817970181 NLPVHLNKXCOHLC-JGVFFNPUSA-N 273.174 2.153 10 20 CECD CCOc1ccc(CN[C@@H](C)C(C)(C)O)c(O)c1 734841573 UFHZSOZJEREIDK-JTQLQIEISA-N 253.342 2.040 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1cnc[nH]1 901054453 XNCLWNAHRXXUJC-UHFFFAOYSA-N 273.336 2.097 10 20 CECD Cc1cn(C)nc1C(=O)NCCCSc1nccs1 839680936 LVHRLQYRTFTBQC-UHFFFAOYSA-N 296.421 2.097 10 20 CECD Cc1ccc(C(=O)N2CCC[C@H](C(C)(C)O)C2)c(O)c1O 832472236 IXNWIHHBOKOAEA-NSHDSACASA-N 293.363 2.029 10 20 CECD C[C@@H](N[C@H]1CCCCNC1=O)c1ccc(Cl)cc1O 841743570 AYNQOOHFGFRZDN-SKDRFNHKSA-N 282.771 2.365 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NS(=O)(=O)C1CC1 841568624 DBMBRGRQTRGYEC-GFCCVEGCSA-N 296.436 2.074 10 20 CECD Oc1c(F)cccc1CN1CCC[C@H]([C@H]2CCNC2)C1 843125439 WNVLESYWUYWOOI-STQMWFEESA-N 278.371 2.353 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](CCN)C2)c1 843113549 WTILHECBWYNEDG-CYBMUJFWSA-N 278.396 2.352 10 20 CECD CN1CCN(c2ccc(/C=C\c3cnccn3)cc2)CC1 849246294 QXGGETJQAWIRDD-DJWKRKHSSA-N 280.375 2.399 10 20 CECD CCCCN1CC(=O)N[C@H]1c1ccc(OCC)cc1O 917505760 FHDHGLMNHKMBRE-OAHLLOKOSA-N 278.352 2.021 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](c2cccnc2)C1 844145756 DHNZJZZYUBWGLD-LLVKDONJSA-N 274.345 2.478 10 20 CECD C[C@H](NCc1cn[nH]c1)c1ccc(N2CCOCC2)cc1 749915596 MZASWDACBZIZMY-ZDUSSCGKSA-N 286.379 2.097 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC(=O)N(C(C)C)C1 840934161 MXRCVXYPQFVLKO-OAHLLOKOSA-N 289.423 2.160 10 20 CECD CC[C@H](CSC)NC(=O)NCCc1ccc(N)cc1 841866783 JJSVCYJCGPVNPL-CYBMUJFWSA-N 281.425 2.252 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@@H](C)N1 843049201 JDWNVFMQFWRKHM-RKDXNWHRSA-N 272.751 2.367 10 20 CECD Nc1ccc(CCNC(=O)NCCC2CCC2)cc1 841858252 OVYPAPCRAFSQJR-UHFFFAOYSA-N 261.369 2.301 10 20 CECD CCOc1ccc(CNCC(C)(C)OC)c(O)c1 742380349 MGQMCGOXRJTPRR-UHFFFAOYSA-N 253.342 2.306 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C)[C@H](CN)C2)c1 841100813 KPQKJDHVXKXCBT-TZMCWYRMSA-N 278.396 2.208 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@]2(C)CCO[C@H]2C)c1O 755155660 CNMGZAOMDRAXLP-BONVTDFDSA-N 281.327 2.391 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C(=O)N(C)OC)cc1 858318725 QBPYZACOWRCCQI-ZDUSSCGKSA-N 293.411 2.031 10 20 CECD C[C@H](NC[C@@H](O)CN(C)C)c1ccc2ccccc2c1O 756557841 WQQGIXCHHBKDPL-GXTWGEPZSA-N 288.391 2.119 10 20 CECD COC[C@@H](C)CC(=O)N[C@@H](C)c1cc(OC)ccc1O 755784276 FFZDDJJPTNHFSL-QWRGUYRKSA-N 281.352 2.251 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccnn2C(F)F)cc1 854271577 LZGUMRXPFZIKKS-UHFFFAOYSA-N 294.305 2.274 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C3CC3)[nH]n2)c1 862759554 HGMIISUVMWZTDS-UHFFFAOYSA-N 271.320 2.231 10 20 CECD Cc1ccc2c(c1)CCN2C(=O)/C=C/c1cn(C)cn1 935230101 QBOVZBWIOHABTR-GQCTYLIASA-N 267.332 2.331 10 20 CECD Cc1cc(C(=O)NC2(CO)CCC2)c(C)n1-c1ccccn1 767891991 WUSYAGUFTBUQFL-UHFFFAOYSA-N 299.374 2.134 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCC(CO)CC2)c(O)c1 1116585333 XOKPAXCCYNIZQM-CQSZACIVSA-N 292.423 2.056 10 20 CECD COc1cccc(O)c1CNC[C@@H](O)c1ccc(F)cc1 767723303 NFXVEQUPSBBGQW-OAHLLOKOSA-N 291.322 2.363 10 20 CECD C[C@@H](N[C@@H]1C[C@H]2CCCC[C@@H]2NC1=O)c1ccccc1O 879648830 BIDHWXKDJJIONL-RJZRQDKASA-N 288.391 2.490 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1ccc(C)cc1O 876763446 GSBVULDISKLLIE-CYBMUJFWSA-N 263.337 2.228 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)[C@H](O)C(F)(F)F 877693760 QCMZRABCHJXNDP-MFKMUULPSA-N 290.329 2.462 10 20 CECD Cc1ccnc(N2CCN(Cc3ccccc3O)CC2)c1 778999522 GMTCUPVICTWAAP-UHFFFAOYSA-N 283.375 2.418 10 20 CECD O=C(Nc1cc(CC2CC2)[nH]n1)c1c(F)ccc(O)c1O 881446623 JKEDUYBIQGTGNU-UHFFFAOYSA-N 291.282 2.165 10 20 CECD COc1ccc(CNC/C=C\C2CC2)c(O)c1OC 1120056492 BPHMSRBWLCXREX-ARJAWSKDSA-N 263.337 2.465 10 20 CECD C[C@@H](NCc1nnnn1-c1ccccc1)c1ccccc1O 775137816 YTAPKFPLBXIXMX-GFCCVEGCSA-N 295.346 2.219 10 20 CECD COc1cccc(O)c1CNc1ccc(CC(N)=O)cc1 770409247 ZQZFGUAHMYTNOW-UHFFFAOYSA-N 286.331 2.041 10 20 CECD C[C@H](NCC1(N(C)C)CC1)c1c(O)cccc1F 886627102 SSMDITUFJROYRK-JTQLQIEISA-N 252.333 2.276 10 20 CECD COC(=O)[C@H](NCc1cc(Cl)ccc1O)C1CC1 789573820 PXNPMRZSODWFNK-GFCCVEGCSA-N 269.728 2.087 10 20 CECD COc1ccc(CNC(=S)NCC(C)C)c(O)c1 795032942 ZFLLTNJQUKSBJG-UHFFFAOYSA-N 268.382 2.021 10 20 CECD CCN(CC)C(=O)CN1CCCc2cc(OC)ccc21 797721182 ZZAKOBSRYASWKB-UHFFFAOYSA-N 276.380 2.316 10 20 CECD Cc1nonc1CNCc1ccc(N2CCCC2)cc1 1329660879 TUIZGUSENLXVIY-UHFFFAOYSA-N 272.352 2.268 10 20 CECD CCC[C@@H](CC)NC(=O)C(=O)N(C)Cc1ccccc1O 1345531306 CMOVCCSTJGSLRB-CYBMUJFWSA-N 292.379 2.046 10 20 CECD COc1cccc(CNC[C@H](O)c2ccsc2)c1O 219090419 CKOZIGHQGYVDFR-LBPRGKRZSA-N 279.361 2.286 10 20 CECD CCCN(c1ccc(CN)cc1)[C@H](C)[C@H]1C[C@H]1C(=O)O 1605320800 PSGIDBDYPPUPJL-KCPJHIHWSA-N 276.380 2.471 10 20 CECD CC(C)(CCNCc1cc(F)c(F)cc1O)C(=O)O 1590687439 LDUUJISSLNUGKM-UHFFFAOYSA-N 273.279 2.261 10 20 CECD CCc1cccc(CN[C@@H](C[C@@H]2CCCO2)C(=O)O)c1O 1597586817 LJFKFDNNBJKFBT-KBPBESRZSA-N 293.363 2.067 10 20 CECD C[C@]1(C(=O)O)CC[C@H](NCc2cc([N+](=O)[O-])ccc2O)C1 1776501933 TWJWAQWUKKRTQJ-HZMBPMFUSA-N 294.307 2.033 10 20 CECD COc1cccc(CN2CC[C@H]3[C@@H](CCCN3C)C2)c1O 156094553 ZRYRIZJAVFJRRV-ZFWWWQNUSA-N 290.407 2.317 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1ccc(CO)o1 154922501 NLVUZRGVTPUQEN-UHFFFAOYSA-N 288.347 2.237 10 20 CECD CN(Cc1ccccc1O)Cc1noc2c1COCC2 929977847 XHDUINUVLRZRDS-UHFFFAOYSA-N 274.320 2.085 10 20 CECD COc1cccc(CN(C)C[C@H]2CCCOC2)c1O 156030999 TXLXWHXZJCRTMV-GFCCVEGCSA-N 265.353 2.259 10 20 CECD C[C@H](NCc1ccccc1O)c1nnc2ccccn12 36968880 XFTWUHJHRMEWQF-NSHDSACASA-N 268.320 2.286 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CCN)C2)cc1 70169391 WOVIGAMHFHAMII-CQSZACIVSA-N 261.413 2.313 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CO[C@@H](C)C2)c1 402305794 KFDIEAYTLJVPEN-GARJFASQSA-N 251.326 2.229 10 20 CECD CC[C@@H](C)CN(C)CC(=O)NCc1ccc(N(C)C)cc1 171948769 IWUZUWUVAKVEAX-CQSZACIVSA-N 291.439 2.347 10 20 CECD CCc1ncoc1C(=O)NCc1ccc(N(C)C)cc1 1262674498 BBGZLTBAWMVBON-UHFFFAOYSA-N 273.336 2.233 10 20 CECD CC(C)NC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 68463011 SNKPEUDSAJKVGK-ZDUSSCGKSA-N 291.395 2.292 10 20 CECD CCC[C@@H]1CN(Cc2ccccc2O)CCN1CCOC 179585242 YPSBLIMUXPSBOX-MRXNPFEDSA-N 292.423 2.325 10 20 CECD C[C@H]1CN(Cc2cc(Br)ccc2O)CC[C@H]1N 300417048 IZVLXPOCYRRLKS-JOYOIKCWSA-N 299.212 2.324 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)CN2CCCC2=O)c1 37782157 VZEANOFGAXEAJX-NEPJUHHUSA-N 292.379 2.062 10 20 CECD COCCCOCCN(C)Cc1cccc(C)c1O 181523984 ABVWLXFUFBRUHR-UHFFFAOYSA-N 267.369 2.186 10 20 CECD C[C@H](N[C@@H]1CCc2[nH]ncc2C1)c1cc(F)ccc1O 186115701 SMNYHSQUKUCIBW-JOYOIKCWSA-N 275.327 2.463 10 20 CECD CC[C@@]1(CO)CCCN(Cc2cc3c(cc2O)OCO3)C1 190216844 LBJYJOMRLBCRIX-MRXNPFEDSA-N 293.363 2.105 10 20 CECD CCCN(CCS(=O)(=O)C(C)C)Cc1ccccc1O 178235268 APJCSXUNWVHXRB-UHFFFAOYSA-N 299.436 2.427 10 20 CECD CCNC(=O)C1(CNCc2c(O)cccc2Cl)CCC1 277547743 ZVMZZOXGBNTPJZ-UHFFFAOYSA-N 296.798 2.442 10 20 CECD CC[C@@](C)(O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273602644 SGCGEKZLDLIHHH-TVQRCGJNSA-N 268.313 2.112 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H]2CCCO2)c1 273426109 UEBSIJBKOUSANV-PWSUYJOCSA-N 279.336 2.008 10 20 CECD Oc1ccc(F)cc1CNC[C@H](O)Cc1ccccc1 289764702 KEPHMJALRATBGV-OAHLLOKOSA-N 275.323 2.225 10 20 CECD COCC[C@@H](NC(=O)c1cccc(O)c1O)c1ccco1 280033986 YJRDRUKMSZIBAO-LLVKDONJSA-N 291.303 2.198 10 20 CECD CC[C@H](NC(=O)NCc1ccc(N(C)C)cc1)C(C)(C)O 296588318 NIPPNWOVHLVTMC-AWEZNQCLSA-N 293.411 2.101 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC(=O)NCC1CC1 393003165 ZWJYPJCIKBSNSG-WCQYABFASA-N 288.391 2.365 10 20 CECD CCN(C)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819589765 GYRPVIYVNIKION-CYBMUJFWSA-N 291.395 2.183 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2CC[C@H]2O)cc1 819683021 KQQYYWVJLZVNIA-HZPDHXFCSA-N 284.359 2.347 10 20 CECD CCNCCN[C@H](C)c1ccc(Br)cc1O 817951975 MBZVARDEHAAEEN-SECBINFHSA-N 287.201 2.415 10 20 CECD C[C@H]1C[C@H](N[C@@H]2CC[C@H]2O)c2c(O)ccc(F)c21 818357986 MKQIJUMPITXDPI-CDEVMZEPSA-N 251.301 2.193 10 20 CECD CC(=O)c1ccc(C(=O)NCc2ccccc2O)cc1O 816911979 GBPLIDKHZKLMHM-UHFFFAOYSA-N 285.299 2.230 10 20 CECD C[C@H](N[C@H](C)CN)c1cc(Br)ccc1O 817966233 JJEIALHNBHFEFZ-SFYZADRCSA-N 273.174 2.153 10 20 CECD COc1cc(O)c(CN[C@@H]2CCC[C@H]2OC)cc1OC 824903392 FYSKWAGFZDUHLZ-DGCLKSJQSA-N 281.352 2.067 10 20 CECD COc1ccc(O)c(CN(C)Cc2nnc(C)s2)c1 827806660 UWRYJRSTQSYJJH-UHFFFAOYSA-N 279.365 2.193 10 20 CECD O=C1Nc2ccccc2/C1=C/c1c[nH]c(C(=O)O)c1 833357952 LBVLYWJIPZDZCX-YHYXMXQVSA-N 254.245 2.206 10 20 CECD COc1cc(C)nc(NCc2cccc(OC)c2O)n1 735487623 QNVCRZGVIZTUDU-UHFFFAOYSA-N 275.308 2.120 10 20 CECD O=C(O)CCC1CCN(C(=O)c2cc(O)cs2)CC1 833224230 COEVKOQYFPYHOQ-UHFFFAOYSA-N 283.349 2.171 10 20 CECD COc1ccc(CNC2(CO)CCSCC2)cc1C 839177458 LBKUDYNZBBMNKS-UHFFFAOYSA-N 281.421 2.351 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1ccc(OCC)cc1O 917505759 FHDHGLMNHKMBRE-HNNXBMFYSA-N 278.352 2.021 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2CCCSC2)cc1 841850235 GAEXFCVERPNXMR-CYBMUJFWSA-N 279.409 2.006 10 20 CECD Cc1cc(O)c(CN2CCO[C@H](CF)C2)cc1C 840171062 FISKPDDZGGVHLP-CYBMUJFWSA-N 253.317 2.179 10 20 CECD CCOc1cccc(CN[C@@H]2CCNCC2(C)C)c1O 841072050 FEBKMYSSWVUXBR-CQSZACIVSA-N 278.396 2.269 10 20 CECD CCC(CC)(C(=O)O)C(=O)Nc1ccc(N)cc1 849364010 BBFCXPXYXHEKAV-UHFFFAOYSA-N 250.298 2.098 10 20 CECD CN(CCCCF)c1ccc(OCC(=O)O)cc1 846279587 GZSWWCKXWFERIA-UHFFFAOYSA-N 255.289 2.336 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1[C@@H]1CCCOC1 844147706 YPJIPTSYJZUWQN-ZYHUDNBSSA-N 281.377 2.485 10 20 CECD Oc1cc2c(cc1CN1CCO[C@H](CF)C1)CCC2 840171664 NUANISJVXAQQSO-CQSZACIVSA-N 265.328 2.051 10 20 CECD Cc1ccc([C@H](C)NC[C@H](C)S(C)(=O)=O)c(O)c1C 756770260 VHQWWBUATGECTC-JQWIXIFHSA-N 285.409 2.093 10 20 CECD CN1CCC(CNCc2cc(F)c(N(C)C)cc2F)CC1 858127902 UDQWJSLVABDXNG-UHFFFAOYSA-N 297.393 2.462 10 20 CECD Cc1cc(OCC(=O)NCc2cc(Cl)ccc2O)no1 857547537 JCGBUHOGKOWDCE-UHFFFAOYSA-N 296.710 2.037 10 20 CECD C[C@@H]1C[C@H](NCCC(=O)N(C)C)c2c(O)ccc(F)c21 756517981 RTYPBTQUGIEZLX-KOLCDFICSA-N 280.343 2.148 10 20 CECD Cc1cc(CNC(=O)N[C@H](C)c2ccccc2O)on1 868188964 UELJIYCEWRJNIQ-SNVBAGLBSA-N 275.308 2.249 10 20 CECD CCOc1ccc(CNC2(COC)CC2)c(O)c1 765264181 RFZCYQNXGZLTAD-UHFFFAOYSA-N 251.326 2.060 10 20 CECD CC[C@@]1(C)NC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 761357987 FQBMJYJOVJVELE-QGZVFWFLSA-N 299.374 2.283 10 20 CECD COc1cc(CN2CCOC[C@H](C)C2)c(O)cc1C 768466028 VROSHAPABZTZKJ-LLVKDONJSA-N 265.353 2.178 10 20 CECD C[C@H]1COCCN1CCN[C@H](C)c1ccc(N(C)C)cc1 765728640 NOFQTORRCMGKMH-LSDHHAIUSA-N 291.439 2.124 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CC23CCC3)c1 873267908 LYJFMJVBTRCVCK-CYBMUJFWSA-N 260.337 2.442 10 20 CECD COC1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCC1 773001596 VNMWNOCONWFSJH-GFCCVEGCSA-N 276.380 2.499 10 20 CECD C[C@H](NC[C@H]1CC2(CCNCC2)CO1)c1ccccc1O 873293114 XZHPTTMJNWCRHS-UONOGXRCSA-N 290.407 2.202 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1c(O)cccc1F 886549505 IYSHNLZKNTXOHG-MNOVXSKESA-N 271.332 2.233 10 20 CECD CCCCN(CCO)Cc1ccc(OC)c(OC)c1O 891458091 JTGDCJWUQBTRQW-UHFFFAOYSA-N 283.368 2.004 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCn3ccnc3C2)c1O 894494314 NMQPNUMPWLQHFB-CYBMUJFWSA-N 287.363 2.010 10 20 CECD COc1cc(C)cc(CN[C@@H](CO)CC2CCC2)c1O 894616736 HXKDJGZIDGNKQJ-CQSZACIVSA-N 279.380 2.350 10 20 CECD C[C@@H](CCNCc1ccc(N(C)C)c(F)c1)N(C)C 895298167 SMUDKILWIREEKE-LBPRGKRZSA-N 267.392 2.322 10 20 CECD CC(C)NCCCNC(=O)N[C@H](C)c1ccccc1O 891988692 SKRKWTKTMTZPHG-GFCCVEGCSA-N 279.384 2.141 10 20 CECD COC[C@H](N[C@H](C)c1cc(OC)ccc1O)C1CC1 186153596 GGCFXJWWWFQYMX-YGRLFVJLSA-N 265.353 2.476 10 20 CECD COc1ccc(CNC(=O)/C=C/c2ccc[nH]2)c(O)c1 794380792 CURXNNHNRPUGMI-FNORWQNLSA-N 272.304 2.059 10 20 CECD CSCC1CCN(C(=O)c2cccc(O)c2O)CC1 719313486 QQFLQFBWNWEQMX-UHFFFAOYSA-N 281.377 2.313 10 20 CECD O=C(c1cccc(O)c1O)N(Cc1ccoc1)C1CC1 723738158 ZZDKUTIJNBCDAV-UHFFFAOYSA-N 273.288 2.496 10 20 CECD CCn1c(C)cc(C(=O)NCc2cccc(O)c2O)c1C 1350300620 VKWJMRIGAFIEDJ-UHFFFAOYSA-N 288.347 2.466 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](CC(=O)O)C2CC2)c1O 1603103652 UUKMMUCYWPWDEH-ZDUSSCGKSA-N 295.310 2.077 10 20 CECD CN(C)c1ccc(CNC2CC(CC(=O)O)C2)cc1F 1606055986 RQZVJHNAEOJTPL-UHFFFAOYSA-N 280.343 2.235 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccc(F)c(F)c1 158967751 RGPHKPIOINFKOP-UHFFFAOYSA-N 279.242 2.306 10 20 CECD COc1ccc(CNCC2=CCN(C)CC2)cc1C 271851386 TVEVOEYMTDEZAN-UHFFFAOYSA-N 260.381 2.355 10 20 CECD CN(C)C(=O)c1cc(NCc2ccccc2O)ccn1 163769523 FQIHSCHFOUONCF-UHFFFAOYSA-N 271.320 2.101 10 20 CECD O=C(NC[C@H]1C[C@H]2C=C[C@H]1CC2)c1cccc(O)c1O 402765547 LLANVZWZXZGGAK-SDDRHHMPSA-N 273.332 2.430 10 20 CECD CN(C)c1ccc(CNC[C@@H](O)c2ccco2)cc1 78878424 KWJCDVGCOOARKT-CQSZACIVSA-N 260.337 2.169 10 20 CECD CCc1cccc(CN2CCN(C(C)C)CC2)c1O 709289176 IJNNCROIFCSUFO-UHFFFAOYSA-N 262.397 2.481 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCC(N)=O)c1 173019476 YDTJYDMSZSTZFN-UHFFFAOYSA-N 299.374 2.008 10 20 CECD CCCN(Cc1ccccc1O)c1ncnc2[nH]ncc12 301755830 KSWXFCZVNZJVBJ-UHFFFAOYSA-N 283.335 2.475 10 20 CECD CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cc(OC)ccc1O 180697502 QLPBGIJCLVPZIF-CABCVRRESA-N 290.407 2.459 10 20 CECD O=S1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 132804774 LQUWLNFYRNHTJV-UHFFFAOYSA-N 294.203 2.263 10 20 CECD CCOc1cc(NCc2cc(OC)ccc2O)ncn1 124708185 LIWKIMHKDLYUFV-UHFFFAOYSA-N 275.308 2.202 10 20 CECD Oc1cccc(Cl)c1CNCCN1CCCC1 83551495 DNAQXVXVKHKLIM-UHFFFAOYSA-N 254.761 2.231 10 20 CECD CCOc1cccc(CN[C@@H]2CC[C@H](C(=O)OC)C2)c1O 193496882 UMKPFOIZTFPYSL-WCQYABFASA-N 293.363 2.222 10 20 CECD COc1cc(C(=O)NCc2ccccc2O)ccc1O 82286348 RTLVGZRALJXJBD-UHFFFAOYSA-N 273.288 2.036 10 20 CECD Cn1ccc(CNCc2ccc(N3CCOCC3)cc2)c1 267038563 CDPLPRHSJILMRX-UHFFFAOYSA-N 285.391 2.152 10 20 CECD C[C@H](NC(=O)NCc1ccccc1O)[C@H]1CCCCO1 272006232 PDNKSRQXGYXRTB-SMDDNHRTSA-N 278.352 2.149 10 20 CECD Cc1ccc([C@H](C)NCC2(C(N)=O)CCCC2)c(O)c1 273604681 SVNMSCMTQZCGNC-LBPRGKRZSA-N 276.380 2.397 10 20 CECD COc1ccc(O)c(CN(C)[C@@H](CO)C(C)(C)C)c1 271802397 LBUZCQUAQQZJDJ-AWEZNQCLSA-N 267.369 2.240 10 20 CECD CN(CC1(O)CCCCCC1)C(=O)c1cccc(O)c1O 280560483 UWUBDWBAQKIOLT-UHFFFAOYSA-N 293.363 2.255 10 20 CECD CCc1cccc2c1N(C(=O)c1ccoc1CC(N)=O)CC2 552089076 UHGQHRGSOCZQPY-UHFFFAOYSA-N 298.342 2.073 10 20 CECD CC[C@@H](NCC1CNC1)c1cc(Cl)ccc1O 817965652 SSSSFBXIAVCFFB-GFCCVEGCSA-N 254.761 2.306 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)[C@H](O)c1ccccc1 811539569 RDKDMQOZLMTXJV-ZANVPECISA-N 277.345 2.306 10 20 CECD CN(C)c1ccc(OCCOC[C@@H]2CCCO2)cc1 810000898 QLRSGVJKZPINIA-HNNXBMFYSA-N 265.353 2.327 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@H]2CCNC2)c1O 817945232 XOXIXDMJNCOJSJ-ONGXEEELSA-N 254.761 2.367 10 20 CECD Cc1cccc(CN2CCC3(CC2)OCCCO3)c1O 816645763 IDQHNFFNWQFZGV-UHFFFAOYSA-N 277.364 2.430 10 20 CECD CN(C)c1ccc(N(C)C(=O)/C=C\c2cnn(C)c2)cc1 728840785 WGVVFPXSOSOKBQ-YHYXMXQVSA-N 284.363 2.162 10 20 CECD CO[C@@H]1COCC[C@@H]1CNCc1cc(Cl)c(C)cc1O 826049758 ZDNOVWBMEJUTRP-IAQYHMDHSA-N 299.798 2.495 10 20 CECD CCn1ccnc1[C@@H](C)NC(=O)c1cc(O)cs1 839785836 LAJDBDOXVDZLPV-MRVPVSSYSA-N 265.338 2.161 10 20 CECD CC(=O)CCCCCNC(=O)c1ccc(C)c(O)c1O 909096143 HTBNQGURTMNYQL-UHFFFAOYSA-N 279.336 2.285 10 20 CECD CC(C)[C@H]1N(C(=O)C(=O)Nc2ccc(N)cc2)CC1(C)C 841133618 FQVOJHZHFMCAGH-CYBMUJFWSA-N 289.379 2.100 10 20 CECD CC[C@@H](C[C@@H](C)CO)NCc1cc([N+](=O)[O-])ccc1O 743500351 XZRLHXGUFNIEQD-PWSUYJOCSA-N 282.340 2.187 10 20 CECD CCC[C@H](C)S(=O)(=O)NCc1ccccc1O 845865283 AIJLFKLJGLFCSP-JTQLQIEISA-N 257.355 2.000 10 20 CECD CCN[C@H](C)CNCc1c(O)ccc(Cl)c1F 841064843 VHGDICGXWYJLHD-MRVPVSSYSA-N 260.740 2.272 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H]([C@@H](C)N)C2)c1 843051476 JEGYIHUOXRWQDR-OLZOCXBDSA-N 278.396 2.350 10 20 CECD C[C@]1(NC(=O)Nc2ccc(N)cc2)CCO[C@@H]1C1CC1 841295570 BLTIKVFVMHCVSZ-HIFRSBDPSA-N 275.352 2.348 10 20 CECD CC(C)[C@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)O 840995630 ZRLVOLVNPVWHQM-YVACAVLKSA-N 276.380 2.465 10 20 CECD C[C@H]1C[C@@H](NCc2cc(Br)ccc2O)CCN1 841062822 YBAQWEMDUFOMEY-CABZTGNLSA-N 299.212 2.385 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@@H](N)C1(C)C 876767149 CFQCTILSIRQLNS-LSDHHAIUSA-N 289.423 2.051 10 20 CECD Cc1cccc(O)c1CN1CC[C@H](Cc2cnn(C)c2)C1 876797715 UEBYDECSZPGTGB-CQSZACIVSA-N 285.391 2.499 10 20 CECD CN(C)c1cc(F)c(CNC2CSC2)cc1F 877633567 BGYQEPBYQHMXLL-UHFFFAOYSA-N 258.337 2.236 10 20 CECD CC[C@H](NCc1ccc(C(N)=O)nc1)c1ccccc1O 775513889 VXLYLEAONOMSOW-ZDUSSCGKSA-N 285.347 2.127 10 20 CECD CCN(Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H]1CCNC1 886856224 KVSRKFHQXGEMEW-CYBMUJFWSA-N 296.798 2.432 10 20 CECD CCOc1ccc(CNc2nnc(C(C)(C)O)o2)c(O)c1 789882306 YVRMADIOXLKDHM-UHFFFAOYSA-N 293.323 2.013 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H](O)C[C@H]2C)cc1 788270934 XHBFETXFRURZQS-CJNGLKHVSA-N 262.397 2.488 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H]3COC[C@@H]32)c1O 894986628 ZDQCQYWWZLWBQP-OCCSQVGLSA-N 277.364 2.320 10 20 CECD CCCN1CC[C@H](NCc2cc(C)cc(OC)c2O)C1 895326819 HGKIPAUYLYPQBE-AWEZNQCLSA-N 278.396 2.283 10 20 CECD COc1cc(C)cc(CNC[C@H](O)c2ccco2)c1O 894164264 BTZIHHGCVVKENV-LBPRGKRZSA-N 277.320 2.125 10 20 CECD CCC(N)(CC)CNC(=O)N[C@H](C)c1ccccc1O 892036710 NJVFTCOOOYZLLJ-LLVKDONJSA-N 279.384 2.270 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CCO)C2CC2)c1 756740591 SAPXDQBSRZZMIR-IINYFYTJSA-N 265.353 2.212 10 20 CECD Oc1cccc(Cl)c1CN1CCO[C@@H]([C@H]2CCCO2)C1 770304370 MLNIWOYNVCCFIS-HUUCEWRRSA-N 297.782 2.425 10 20 CECD CN(Cc1ccccc1O)c1ncnc2c1CCC2 760261861 GNBPWRJZLPDTLB-UHFFFAOYSA-N 255.321 2.307 10 20 CECD C[C@H](CC(=O)NCCc1ccc(O)c(O)c1)C1CC1 762275198 OANFFWMZKLMKPA-SNVBAGLBSA-N 263.337 2.193 10 20 CECD O=C(O)[C@@H]1CCCN1Cc1ccc(N2CCCC2)cc1 1602173776 LRUJQVAKNPZYJJ-HNNXBMFYSA-N 274.364 2.336 10 20 CECD O=C(O)[C@@H](CC1CCC1)NCc1ccc2c(c1)CCO2 1777573225 YVQKSVFKCYFOAF-CQSZACIVSA-N 275.348 2.355 10 20 CECD CCO[C@@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)C12CCC2 160990282 KUAWBPOWLANSNN-LSDHHAIUSA-N 288.391 2.275 10 20 CECD COc1ccc(O)c(CN2CC[C@H]3[C@H](CCCN3C)C2)c1 156093909 CGXRPGNODYLISG-CJNGLKHVSA-N 290.407 2.317 10 20 CECD CCc1nc(CN(C)c2ccc(OC)cc2OC)n[nH]1 159477044 ZRNCFCOLINOWQY-UHFFFAOYSA-N 276.340 2.021 10 20 CECD Cc1ccc(O)c([C@H](C)NCC(=O)NCC(C)C)c1 228693860 JUZGMLBZSCCATB-LBPRGKRZSA-N 264.369 2.123 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](N)C(C)C 37807399 PISKJHGXCXKXKR-OAHLLOKOSA-N 277.412 2.084 10 20 CECD COc1cc(Cl)cc(CN2CCN[C@@H](C)[C@H]2C)c1O 379436603 NIWQTQJGRBGFBX-VHSXEESVSA-N 284.787 2.236 10 20 CECD C[C@H](NC[C@@H](C)O)c1cc(Br)ccc1O 134835015 NWZHVBGMCUEXMR-SFYZADRCSA-N 274.158 2.186 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc(C)n[nH]1 66096239 ARGCJIIILQLKQC-UHFFFAOYSA-N 273.336 2.476 10 20 CECD CC1(C)CCC(O)(CNC(=O)c2cccc(O)c2O)CC1 126624664 GYNLVGHWBACJNE-UHFFFAOYSA-N 293.363 2.159 10 20 CECD Cc1ccc(C(=O)N[C@H](C)c2ccccn2)c(O)c1O 181777060 FEKMDCJZFQJFRD-SNVBAGLBSA-N 272.304 2.292 10 20 CECD CCOC(=O)[C@H](NCc1ccccc1O)[C@@H](C)CC 187863514 DEDJBZWAOAFMOE-SMDDNHRTSA-N 265.353 2.460 10 20 CECD CC[C@@H]1CN(C(=O)Cc2ccc(N)cc2)CCS1 157088291 PXQJYCYWVIFIHF-CYBMUJFWSA-N 264.394 2.165 10 20 CECD O=C(NCc1ccccc1O)c1ccc2c(c1)OCCO2 133775869 GHTJTOJHLMMUMZ-UHFFFAOYSA-N 285.299 2.093 10 20 CECD C[C@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)n1cccn1 45054023 RGDOEVUHXDZUFO-CYBMUJFWSA-N 286.379 2.169 10 20 CECD CC(C)(C)C(=O)NCCNCc1c(O)cccc1Cl 264940724 GHPUQEQEWNKWBU-UHFFFAOYSA-N 284.787 2.298 10 20 CECD CC[C@H](N[C@H](C)C(=O)NC(C)C)c1ccccc1O 228929477 RNHQNXFXQZONGU-YPMHNXCESA-N 264.369 2.346 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@H]1CCCCO1 140110710 FVAJFEWOQHUPDI-CYBMUJFWSA-N 278.352 2.103 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2)ns1 278136451 AGLVLQWECPUBNP-UHFFFAOYSA-N 275.377 2.448 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)CC[S@@](=O)C1 277362000 FHFZDAFSIHIBNN-MLCYQJTMSA-N 287.812 2.246 10 20 CECD COc1ccc(O)c(CN2C[C@@H](O)Cc3ccccc32)c1 279426375 NSIBSSXZFJSOQX-AWEZNQCLSA-N 285.343 2.324 10 20 CECD C[C@H]1c2nncn2CCN1Cc1cccc(Cl)c1O 276879008 ZQLABQNUNKVMAM-VIFPVBQESA-N 278.743 2.214 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCCS1 274934290 OGICWSMSORNFQF-QMTHXVAHSA-N 295.404 2.431 10 20 CECD Cc1cccc(CCNC(=O)N(C)Cc2ccccc2O)n1 281686260 UXILRSYUWHSNEO-UHFFFAOYSA-N 299.374 2.480 10 20 CECD CCCCN(CCCO)Cc1cc2c(cc1O)OCO2 289466242 OYQRKFZTZLUEAC-UHFFFAOYSA-N 281.352 2.105 10 20 CECD CC(C)(CNCc1c(O)ccc(Cl)c1F)OCCO 808437809 NEKZBCLHNWRCIT-UHFFFAOYSA-N 291.750 2.062 10 20 CECD Cc1ccc(C(=O)N[C@H](C)C(F)(F)F)c(O)c1O 291870521 WPQYBSGXCINGHZ-ZCFIWIBFSA-N 263.215 2.087 10 20 CECD COCc1cc(CNCc2ccc(N(C)C)c(F)c2)no1 298519193 RHTUABYGWXXZFM-UHFFFAOYSA-N 293.342 2.316 10 20 CECD CN(Cc1cccc(Cl)c1O)C[C@@H](O)C1CC1 809753050 ZIVXOQCRFSWNEA-GFCCVEGCSA-N 255.745 2.248 10 20 CECD C[C@H](N[C@@H]1CCCC[C@H]1N)c1ccc(F)cc1O 818615477 PWRYGOVGPNBTNL-ZWKOPEQDSA-N 252.333 2.452 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1ccc(N(C)C)cc1 814300945 NLEOZCQWPMVXCJ-CQSZACIVSA-N 291.439 2.395 10 20 CECD CC1(C)CN(Cc2cccc(Cl)c2O)C[C@@H](CO)O1 817413588 ZVDXPDBQEDVMSM-NSHDSACASA-N 285.771 2.017 10 20 CECD Cc1cc(O)c(CN[C@@H](C)C[S@](C)=O)cc1Cl 825498106 VJEXKPKCKMDXFQ-XYZCENFISA-N 275.801 2.211 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)Cc1cnc[nH]1 826769124 HWZYYOFUABBDCQ-UHFFFAOYSA-N 262.332 2.247 10 20 CECD COC(=O)NC1CCN(Cc2c(O)cccc2Cl)CC1 827935595 ZPFCIOVIEKQJLQ-UHFFFAOYSA-N 298.770 2.366 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CCN(CC3CC3)C1)CC2 834575889 PHUNMUDISQIDFU-LSDHHAIUSA-N 272.392 2.453 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCOC1 734405735 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NZCPDRIXSPPWCA-AWEZNQCLSA-N 285.771 2.067 10 20 CECD Cc1cc(O)c(CN[C@H](C)C(=O)NC(C)C)cc1C 840974865 PGQDRZDWBUGFPU-GFCCVEGCSA-N 264.369 2.012 10 20 CECD CC(C)OCCC(=O)N[C@H](C)c1ccccc1O 827923184 KYCCZHABODCKTJ-LLVKDONJSA-N 251.326 2.385 10 20 CECD C[C@@H]1C[C@@H](NC/C=C/CO)c2c(O)ccc(F)c21 850507745 HPGJXTGHONBQET-ONKIFHLLSA-N 251.301 2.218 10 20 CECD COc1ccc(N(C)C[C@@H]2COC(C)(C)O2)cc1 852210013 WAPKXBYMXQUFOY-CYBMUJFWSA-N 251.326 2.283 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C\c1cn(C)cn1 929530991 FULMKZBOFLCHFG-YFHOEESVSA-N 298.390 2.158 10 20 CECD CN(CC1=CCSC1)Cc1cc2c(cc1O)OCO2 853618478 FMRMBPJFVABMHK-UHFFFAOYSA-N 279.361 2.226 10 20 CECD Cc1ccc(O)c(CNC(=O)CN2[C@@H](C)CC[C@@H]2C)c1 862761004 ZQYZNTVLBXZWGC-STQMWFEESA-N 276.380 2.190 10 20 CECD CCOc1cccc(CN(CCO)[C@@H](C)CC)c1O 862387812 QLLYBOGMRQTBPP-LBPRGKRZSA-N 267.369 2.384 10 20 CECD CCCN(CC)Cc1cc2c(cc1O)OC[C@H]2O 768444564 MIDWOCUIQGQWDO-CYBMUJFWSA-N 251.326 2.050 10 20 CECD Cc1cc(O)c(CN2CCSC[C@H]2CO)cc1Cl 877780419 PUAKQOPMJLVCKG-LLVKDONJSA-N 287.812 2.264 10 20 CECD CCN(C)c1ccc(CN(C)C2(C(N)=O)CCCC2)cc1 773808125 ZYXHJOKILZWMGT-UHFFFAOYSA-N 289.423 2.373 10 20 CECD O=C1N[C@@H](c2cccc(F)c2O)N2CCc3ccccc3[C@@H]12 877856657 TVLZBNVGOAZZQK-GOEBONIOSA-N 298.317 2.259 10 20 CECD COc1ccc(CNCCNC(=O)C=C(C)C)cc1C 1123001444 DMZSZQMJVKDDFX-UHFFFAOYSA-N 276.380 2.176 10 20 CECD CC(C)(C)CN(CCCO)Cc1ccc(N)cc1 1120263356 NLXIURQUUPCIKK-UHFFFAOYSA-N 250.386 2.499 10 20 CECD C[C@@H](O)[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 780891918 CNROCUNZDTVTPT-UKRRQHHQSA-N 262.397 2.345 10 20 CECD CCN(CCC(=O)NC)Cc1cc(Cl)cc(F)c1O 897710176 OPOAHDVDEPVWOX-UHFFFAOYSA-N 288.750 2.143 10 20 CECD CCOc1ccc(CNCC2([S@@](C)=O)CCC2)c(O)c1 797903883 WKWUXJKBBHAJAD-HXUWFJFHSA-N 297.420 2.182 10 20 CECD CC[C@@H](C)[C@@H](OC)C(=O)NCc1cccc(OC)c1O 793689086 JCXBTSKXBZCKDY-QMTHXVAHSA-N 281.352 2.078 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCCC[C@@H]2N(C)C)c(O)c1O 1323605729 PMCQOKNPSRDJAJ-STQMWFEESA-N 292.379 2.009 10 20 CECD CN(Cc1cc(Br)ccc1O)CC(C)(C)N 692005390 YZLKHOMCTHENHF-UHFFFAOYSA-N 287.201 2.324 10 20 CECD COc1ccc(CNC(=O)c2cnoc2C(C)C)c(O)c1 1349796989 AURLWXNRYRHDLD-UHFFFAOYSA-N 290.319 2.442 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1C[C@H]1F 1351666302 LJBODPDYTFCTMO-WCQYABFASA-N 263.312 2.245 10 20 CECD Nc1ccc(CNC(=O)NCC2(O)CCCCCC2)cc1 1353538782 BECIEMLAGRPAGP-UHFFFAOYSA-N 291.395 2.153 10 20 CECD C[C@H](NCc1oncc1C(=O)O)c1ccc(N(C)C)cc1 1593318147 AZRSCZOAONDHGC-JTQLQIEISA-N 289.335 2.290 10 20 CECD O[C@@H]1CCC[C@H](CNCc2ccc3c(c2)CCO3)C1 230666711 AEVQLIIHGPPYIQ-SWLSCSKDSA-N 261.365 2.262 10 20 CECD CC1(C)C[C@H](NCc2cc3c(cc2O)OCO3)CCO1 160631319 MXLPMGCHOJBWRZ-LLVKDONJSA-N 279.336 2.168 10 20 CECD COc1cccc(CN[C@@H]2C[C@H](OC)C23CCC3)c1O 713480295 FSRPMKAYZFINLI-KGLIPLIRSA-N 277.364 2.448 10 20 CECD CN(CCCNC(=O)Cc1ccc(N)cc1)c1ccccc1 22238837 JTKVUURFHJCQAG-UHFFFAOYSA-N 297.402 2.454 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](C3OCCO3)C2)c1 179373423 LYZPRICEWZHJSI-ZDUSSCGKSA-N 277.364 2.286 10 20 CECD Cc1ccc(C(=O)NCc2ccccc2F)c(O)c1O 177661045 SMNJPOHGJLKFFL-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CC(C)C(=O)NCCN[C@H](C)c1cc(Cl)ccc1O 184869217 CBSAUMPJBPXHHQ-SNVBAGLBSA-N 284.787 2.468 10 20 CECD CN(C)c1ccc(CN2CCC[C@]23CCOC3=O)cc1 190037167 ZGHPLUHYYVQBRM-MRXNPFEDSA-N 274.364 2.034 10 20 CECD CCCN(CC(=O)NC)Cc1cc(Cl)ccc1O 133287426 VRRHNGYREXTKFS-UHFFFAOYSA-N 270.760 2.004 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1C[C@@H]2CNC[C@@H]2C1 90319939 RAYOQHZRORSVCL-AOOOYVTPSA-N 287.190 2.350 10 20 CECD CC(C)CN1CCO[C@H](CN[C@H](C)c2ccccc2O)C1 248385271 HSXGHLZSOFBXKJ-HUUCEWRRSA-N 292.423 2.400 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](CCO)C(C)C)c1 273462190 CXCWJHKHCYRTCL-BXUZGUMPSA-N 295.379 2.236 10 20 CECD CO[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C)c(O)c1O 272738001 LLCRLGFEOLMKEZ-VXGBXAGGSA-N 279.336 2.094 10 20 CECD CCOC(=O)[C@H](C)[C@@H](C)NCc1ccc(N(C)C)cc1 283068939 JXUCXVCVBKRJCT-CHWSQXEVSA-N 278.396 2.430 10 20 CECD CC1(C)CN(C(=O)C2=CC[C@@H](N)C2)c2cc(F)ccc21 638384927 FIYVRIPKXIUBFI-GFCCVEGCSA-N 274.339 2.497 10 20 CECD CCOC(=O)c1cnc(Sc2nnnn2C(C)C)s1 809344749 VWGZIKMQQDOUGS-UHFFFAOYSA-N 299.381 2.038 10 20 CECD C[C@H](N[C@H]1C[C@@H](O)C1)c1cc(Br)ccc1O 296073018 WTKKMLUPPLCTQI-UJNFCWOMSA-N 286.169 2.329 10 20 CECD Oc1ccc(F)cc1CN1CC[C@@H](O)C12CCCC2 293957591 PQCYSGFDQBVRLI-CQSZACIVSA-N 265.328 2.411 10 20 CECD O=C(N[C@H]1CCOC2(CCC2)C1)c1c(F)ccc(O)c1O 295028158 SDMMUWOQBWTAJZ-VIFPVBQESA-N 295.310 2.068 10 20 CECD CCOCC(C)(C)CNC(=O)c1ccc(C)c(O)c1O 293699046 OHQRQWOVBLLKPF-UHFFFAOYSA-N 281.352 2.199 10 20 CECD Cc1cc(CN2CCOC[C@H]2C[C@H](C)O)ccc1N(C)C 294487802 HQCHUTTXMXNWPG-GOEBONIOSA-N 292.423 2.033 10 20 CECD C[C@@H](NC[C@H]1CCCCN1)c1ccc(F)cc1O 817949369 JWHPXMIDSRLWTH-ZYHUDNBSSA-N 252.333 2.324 10 20 CECD CCOc1ccc(CNCc2cnccc2OC)c(O)c1 814297965 NCAKZCWDZYZERO-UHFFFAOYSA-N 288.347 2.484 10 20 CECD CC(C)c1noc(NCCc2ccc(O)c(O)c2)n1 811811106 LNSKSYOIWAYYAD-UHFFFAOYSA-N 263.297 2.259 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2COc3ccccc32)c(O)c1O 813892254 FNTBXPRRDHGSRE-LLVKDONJSA-N 299.326 2.312 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H]2COCCO2)c(O)c1 815561485 IHKXOEZXWVJVDW-STQMWFEESA-N 265.353 2.075 10 20 CECD CN(C)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 814712241 OGSNSEHPIVYTQT-UHFFFAOYSA-N 279.347 2.454 10 20 CECD C[C@@H](CN)N[C@@H](C)c1ccc(Br)cc1O 817970182 NLPVHLNKXCOHLC-YUMQZZPRSA-N 273.174 2.153 10 20 CECD OC[C@]1(F)CCN(Cc2ccc3ccccc3c2O)C1 816600857 JOOCDFFSOCCQJK-INIZCTEOSA-N 275.323 2.452 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](C)SC)c1 728977793 DEWJEQUYBPGVLI-BDAKNGLRSA-N 269.366 2.330 10 20 CECD C[C@@H](CC(=O)O)NCc1ccc(N2CCSCC2)cc1 820085945 ZVGMSNSRIARXPT-LBPRGKRZSA-N 294.420 2.193 10 20 CECD CCc1cccc(CN2CCC(NC(=O)OC)CC2)c1O 827923902 MTPAOQQOIYEKEW-UHFFFAOYSA-N 292.379 2.275 10 20 CECD Nc1ccc(C(=O)NCCCSc2nccs2)nc1 829527849 HFIIULZPIWPABZ-UHFFFAOYSA-N 294.405 2.033 10 20 CECD NCC[C@@H](NCc1ccc2c(c1)CCCO2)C(F)(F)F 904358315 KVPOZRUDEPCHCW-CYBMUJFWSA-N 288.313 2.381 10 20 CECD C[C@H]1C[C@@H](NC(=O)c2cc(O)cs2)c2nccn21 839785781 IWPNHVHKQVDXCD-IONNQARKSA-N 263.322 2.086 10 20 CECD CN(C(=O)c1cc(O)cs1)[C@H]1CCCc2c1cnn2C 830863460 RZXPDTJVBHZIHC-NSHDSACASA-N 291.376 2.337 10 20 CECD CC(C)[C@@H]1CCN1C(=O)NCCc1ccc(N)cc1 841960329 NFNPPEZRFWYBIB-AWEZNQCLSA-N 261.369 2.251 10 20 CECD CN(Cc1cccc(Cl)c1O)C1CCNCC1 843044706 FZGUOHUSGMYYQK-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CCC1(O)CCC(NC(=O)Nc2ccc(N)cc2)CC1 841296705 XQKKTPWIZOYWMX-UHFFFAOYSA-N 277.368 2.474 10 20 CECD COC[C@@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 743474199 RJTCWQMLXODVLG-ZIAGYGMSSA-N 278.396 2.209 10 20 CECD CCc1cccc(CN2CC[C@](F)(C(=O)OC)C2)c1O 848891505 ZIZOVCDDWUPAKF-OAHLLOKOSA-N 281.327 2.042 10 20 CECD Oc1ccccc1CN[C@H]1CCCN2CCCC[C@H]12 848575653 URHHWBSKPCTISU-LSDHHAIUSA-N 260.381 2.499 10 20 CECD COc1cc(O)c(CN2CC[C@H]3C[C@@H]3C2)cc1OC 853576798 QVJWWQKMDVOEAU-WDEREUQCSA-N 263.337 2.251 10 20 CECD Oc1ccccc1CNC[C@H]1CCCN1CC(F)F 858232489 YYHPLZGHQCROSH-GFCCVEGCSA-N 270.323 2.211 10 20 CECD C/C(=C/C(=O)N1CCNc2ncc(C)cc21)c1cnccn1 858001350 VVCCLFJRXUEVAL-WQLSENKSSA-N 295.346 2.042 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCOC[C@H]2C)c(O)c1 756533051 HOOHVXKISUMQMM-ZIAGYGMSSA-N 278.396 2.072 10 20 CECD COc1cccnc1C(=O)NCc1ccc(N(C)C)cc1C 865903998 IJCMWLVCBDNTQG-UHFFFAOYSA-N 299.374 2.395 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cnn(C(F)F)c1 767901096 XJOWKDJMMBSPKB-DUXPYHPUSA-N 295.245 2.341 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccccc1O 879649033 JURGEQLKMRCNIW-QJPTWQEYSA-N 264.369 2.346 10 20 CECD C[C@@H](NC(=O)CC(C)(C)C)C(=O)N(C)c1ccc(N)cc1 877076185 NPSYZSDYKPHKOG-LLVKDONJSA-N 291.395 2.173 10 20 CECD CCc1onc(C)c1/C=C1/SC(=S)NC1=O 899336632 XAHWRAGQVLWGDV-XBXARRHUSA-N 254.336 2.034 10 20 CECD CN(Cc1ncc[nH]1)Cc1cc(F)c(N(C)C)cc1F 894587270 YATASVQDAYSYMK-UHFFFAOYSA-N 280.322 2.386 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)C[C@@H]1CCOC1 891659230 GUHMLLVKZOBBLX-LBPRGKRZSA-N 295.379 2.268 10 20 CECD Cc1ccc(C[C@@H](CO)NC(=O)c2cc(O)cs2)cc1 788005982 POGOHMBJRMDODS-LBPRGKRZSA-N 291.372 2.096 10 20 CECD Cc1ccc(O)c(CN2CCO[C@@H](c3ccnn3C)C2)c1 897559742 ZFQHLWCGZJPZPU-MRXNPFEDSA-N 287.363 2.008 10 20 CECD CCc1cc(NCc2ccc(OC)c(OC)c2O)n(C)n1 893363953 QOQSIFBVRPMGJG-UHFFFAOYSA-N 291.351 2.317 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)CC(F)F 893562927 WXGWOEMYRKNSKS-UHFFFAOYSA-N 275.295 2.496 10 20 CECD CC[C@H](C)C[C@H](CO)NCc1ccc(OC)c(OC)c1O 895111608 GUCJLZQJLMQMNN-WCQYABFASA-N 297.395 2.296 10 20 CECD CCOC(C)(C)CNCc1ccc(OC)c(OC)c1O 893875035 JYVVQQBQLOOJCH-UHFFFAOYSA-N 283.368 2.314 10 20 CECD C[C@H](NC(=O)c1csc(O)n1)c1ccc(N(C)C)cc1 792332128 DIIACLOQCSJULH-VIFPVBQESA-N 291.376 2.406 10 20 CECD Cc1ccc2c(c1)CCCN2C(=O)c1ccoc1CC(N)=O 794946608 XWRIMEUFIKYWOP-UHFFFAOYSA-N 298.342 2.209 10 20 CECD CC(C)N(CCN(C)C)C(=O)Nc1ccc(N)cc1 688150453 VAHYZVZCIBEMTR-UHFFFAOYSA-N 264.373 2.073 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2COC[C@H]2C)c1 699834566 ITQWYBAWCRTVTA-NRUUGDAUSA-N 251.326 2.086 10 20 CECD COc1ccc(CNC2CC(N(C)C(C)=O)C2)cc1C 998330254 HYKWOZAJQHRLPD-UHFFFAOYSA-N 276.380 2.103 10 20 CECD CN(C)c1cc(F)c(CNC2(CO)CCC2)cc1F 1329140111 JOFBXIUNKSBBPO-UHFFFAOYSA-N 270.323 2.035 10 20 CECD C[C@@H](Nc1ncc(O)cn1)c1ccc(N(C)C)cc1 1339665314 DZZHBLKKPJMRNW-SNVBAGLBSA-N 258.325 2.421 10 20 CECD COc1cc(C)c(CN(CC(=O)O)CC(C)C)c(O)c1 1607148686 PHADFMKHILJMIG-UHFFFAOYSA-N 281.352 2.252 10 20 CECD Cc1ccc([C@@H](C)NCCc2ccn(C)n2)c(O)c1 230897887 YHKSUOPWBUOHCP-GFCCVEGCSA-N 259.353 2.327 10 20 CECD CCOCCOCCNCc1cccc(Cl)c1O 897203723 COGKUTALBYNGEP-UHFFFAOYSA-N 273.760 2.188 10 20 CECD CC[C@H](N[C@@H](C)c1ncn(C)n1)c1ccccc1O 275720045 NOWIRKOPFMWTEA-JQWIXIFHSA-N 260.341 2.323 10 20 CECD COc1ccc(CN[C@H]2CS[C@@H](C)C2)c(O)c1 397975952 OSLICDPMZHBWNY-GXSJLCMTSA-N 253.367 2.384 10 20 CECD C[C@@H](CC(=O)N(C)C)NCc1ccc(N2CCCC2)cc1 177975006 LTASMXYYHVYKBV-AWEZNQCLSA-N 289.423 2.243 10 20 CECD CN(Cc1ccccn1)C(=O)NCc1ccc(N(C)C)cc1 50076516 LXKOXEYSHGUCEQ-UHFFFAOYSA-N 298.390 2.489 10 20 CECD CN(CCOc1ccccc1)C(=O)Cc1ccc(N)cc1 37797946 XYLBQXKVWFNUHR-UHFFFAOYSA-N 284.359 2.349 10 20 CECD CCCN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1 183701873 CGACNSAWZHDIKG-UHFFFAOYSA-N 294.395 2.244 10 20 CECD CN(C)C1(CNCc2cc(F)ccc2O)CCC1 220929627 VJMHJICJPAKIHO-UHFFFAOYSA-N 252.333 2.105 10 20 CECD COc1ccc(O)c(CN(C)[C@@H]2CCN(C)C[C@@H]2C)c1 290626969 XOWGWACDBOMLPG-SWLSCSKDSA-N 278.396 2.173 10 20 CECD Cc1cc(O)c(CN2CC(=O)N[C@@H]3CCCC[C@@H]32)cc1C 92703156 VJRDOOSNBPPNLX-CABCVRRESA-N 288.391 2.252 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@@H](C)C(=O)O)c1O 269238700 APACYWFNBKICNU-ZETCQYMHSA-N 285.727 2.153 10 20 CECD CO[C@H](C)CCNC(=O)N(C)Cc1ccc(N(C)C)cc1 263758858 LKUUZBTYMROLER-CYBMUJFWSA-N 293.411 2.319 10 20 CECD COc1cc(O)c(CN2CCC(C)(OC)CC2)cc1OC 271630458 OUBFDXMPGYQEKC-UHFFFAOYSA-N 295.379 2.410 10 20 CECD C[C@H](NCC1(N2CCOCC2)CC1)c1ccc(F)cc1O 278467448 NIGPQAGFRJMELK-LBPRGKRZSA-N 294.370 2.047 10 20 CECD CCC1(C(=O)NCc2cccc(OC)c2O)CCOCC1 272322975 KWJAEYSBJNHNQQ-UHFFFAOYSA-N 293.363 2.224 10 20 CECD CC(C)C[C@@H]1C[C@H](NC(=O)c2cccc(O)c2O)CCO1 279800897 JSRXZQFCXUNGMN-VXGBXAGGSA-N 293.363 2.421 10 20 CECD CC[C@]1(NCc2ccc(N3CCOCC3)cc2)CCOC1 378764369 XOBJCUGMIOQHCB-KRWDZBQOSA-N 290.407 2.182 10 20 CECD CCOC(C)(C)C(=O)N1CCOc2cc(N(C)C)ccc21 631560104 QNMQAEUOCADMKX-UHFFFAOYSA-N 292.379 2.293 10 20 CECD C[C@H]1C[C@@H](C)[C@@H](CN)CN1Cc1cccc(F)c1O 817866286 WWHDCIZOHXOKFR-MDZLAQPJSA-N 266.360 2.337 10 20 CECD CC[C@@H](C)CONC(=O)NCc1ccc(OC)cc1O 813826567 PRWOIIYGYIRGEX-SNVBAGLBSA-N 282.340 2.178 10 20 CECD C[C@@H](NC[C@@H]1CCCCN1)c1cc(F)ccc1O 817950802 ZGECGCNAYHRQBA-PWSUYJOCSA-N 252.333 2.324 10 20 CECD CO[C@@H]1COCC[C@H]1CNCc1ccc(N(C)C)c(F)c1 824709731 SHVIXFFWFMRXIU-XJKSGUPXSA-N 296.386 2.033 10 20 CECD CC[C@@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(F)cc1O 834907513 URYQNCGXTOFGIG-UFGOTCBOSA-N 280.343 2.226 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CCCN(CCCO)C2)c1 834850620 OEILSIIZUMKOEF-LSDHHAIUSA-N 292.423 2.198 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(OC)cc2O)[C@H]1SC 839067024 MCBVBZSOTKXPNL-BPLDGKMQSA-N 297.420 2.399 10 20 CECD C[C@H]1CCCCN1[C@@H](C)CNC(=O)c1cc(O)cs1 732271202 QRFLTHLODUJGOC-QWRGUYRKSA-N 282.409 2.446 10 20 CECD CC(C)(CO)[C@H](NC(=O)Nc1ccc(N)cc1)C1CC1 841297575 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WZZJKJHDIBLCNO-SNVBAGLBSA-N 253.317 2.487 10 20 CECD O=C1NCC2(CCN(Cc3cccc(Cl)c3O)CC2)O1 783721529 COHCQKDIVLCVFI-UHFFFAOYSA-N 296.754 2.120 10 20 CECD CCn1nccc1CNCc1cc(C)cc(OC)c1O 895361021 WGWLCQKKHUEDKQ-UHFFFAOYSA-N 275.352 2.215 10 20 CECD C[C@@H](CC[S@@](C)=O)NCc1c(O)ccc(Cl)c1F 790976682 LAXOSGXQYXKYGR-DCXZOGHSSA-N 293.791 2.431 10 20 CECD C[C@H]1COC[C@@H]1NCc1cccc(Br)c1O 829430524 CHTHGMQSMLTLML-KWQFWETISA-N 286.169 2.279 10 20 CECD C[C@@H](CCCO)CNCc1cc(F)cc(F)c1O 708495818 FNSQKIUDYUWWCV-VIFPVBQESA-N 259.296 2.169 10 20 CECD CCN(CC)c1ccc(CN2CC[C@](C)(C(N)=O)C2)cc1 793389448 HZZPGARCYCUQHD-KRWDZBQOSA-N 289.423 2.230 10 20 CECD CCCN(C[C@@]1(OC)CCOC1)c1ccc(CN)cc1 692493636 DBMSZGAGHCIONW-INIZCTEOSA-N 278.396 2.167 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCCC[C@H]2N(C)C)c(O)c1O 1323605728 PMCQOKNPSRDJAJ-QWHCGFSZSA-N 292.379 2.009 10 20 CECD CCOC(=O)[C@@H](NCc1ccc(N)cc1)C(C)(C)C 1334774791 OCVDIGDRQBJTKH-CYBMUJFWSA-N 264.369 2.336 10 20 CECD CO[C@H]1CCC[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1516718578 AQVLVDGZQONWIV-DOMZBBRYSA-N 294.370 2.323 10 20 CECD CC(C)c1ccc(O)c(CNc2cnn(CC(=O)O)c2)c1 1588968632 OATJYWZOQAKKTC-UHFFFAOYSA-N 289.335 2.409 10 20 CECD O[C@@H]1CCC[C@@H](CNCc2ccc3c(c2)CCO3)C1 230666703 AEVQLIIHGPPYIQ-IUODEOHRSA-N 261.365 2.262 10 20 CECD Oc1ccc(Br)cc1CNCC1(O)CCC1 163954666 FHUMAASQHPSSCI-UHFFFAOYSA-N 286.169 2.159 10 20 CECD Cc1conc1NC(=O)NCc1ccc(N(C)C)cc1 153323835 MPUQUOAKVPBAML-UHFFFAOYSA-N 274.324 2.371 10 20 CECD CCN(Cc1c(O)cccc1OC)C[C@H](C)OC 812807703 ICRBTQCTTOEZFR-NSHDSACASA-N 253.342 2.258 10 20 CECD C[C@@H](O)CC(C)(C)CNC(=O)Nc1ccc(N)cc1 841301083 ZMDJUMYCCGSVFP-SNVBAGLBSA-N 265.357 2.187 10 20 CECD C[S@@](=O)CCNCc1ccc(N2CCCCC2)cc1 134738814 NQYJGAZLPVSKRG-IBGZPJMESA-N 280.437 2.145 10 20 CECD CCC1(CNC(=O)c2cccc(O)c2O)CCOCC1 279056380 BMOLQZHGMYDZAV-UHFFFAOYSA-N 279.336 2.034 10 20 CECD CCOC(=O)[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 49371332 AGBMHPRWZHELNE-NWDGAFQWSA-N 264.369 2.355 10 20 CECD C[C@H](NCCC1(O)CCC1)c1cc(F)ccc1O 284382068 OMQFDTWSVYMMOM-JTQLQIEISA-N 253.317 2.487 10 20 CECD O=C(C[C@H]1C=CCC1)NCCc1ccc(O)c(O)c1 96968127 PCPCUOXLIBEUSU-NSHDSACASA-N 261.321 2.113 10 20 CECD CCN1C[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)CC1=O 391552898 UUYHGPAROUKKCV-OCCSQVGLSA-N 275.396 2.024 10 20 CECD OC[C@H]1C[C@H](NCc2ccc(Br)cc2O)C1 897355477 SKZSPTUQGKYUTR-JLIMDTESSA-N 286.169 2.015 10 20 CECD CCCCOCC(=O)N[C@H](C)c1cc(OC)ccc1O 118495604 SZRPNVCHLVGTNI-LLVKDONJSA-N 281.352 2.395 10 20 CECD C/C=C/C[C@H](CO)NCc1cc(OCC)ccc1O 185823195 VARILYGDBGTOQW-MASHWEEQSA-N 265.353 2.208 10 20 CECD CSC[C@H](CCO)N[C@H](C)c1ccc(F)cc1O 185530256 BXJPESPSYRFVHC-KOLCDFICSA-N 273.373 2.296 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC(C)(CO)CC2)c1O 186933908 DXFUWWCTXSSKGK-UHFFFAOYSA-N 295.354 2.328 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)N(C)C)c1ccc(N(C)C)cc1 188995782 LFPGBGPENBMODQ-SWLSCSKDSA-N 277.412 2.270 10 20 CECD CCOCc1cc(CNC[C@H]2CC[C@@H](O)C2)ccc1OC 188798103 BQZRTTGQBJWDOH-GOEBONIOSA-N 293.407 2.482 10 20 CECD CCc1nc(C)c(C(=O)NCc2ccccc2O)o1 293614220 FOHJOWYUDOZOCX-UHFFFAOYSA-N 260.293 2.181 10 20 CECD Cc1n[nH]c(C)c1[C@@H]1COCCN1Cc1ccccc1O 368461528 JEJWTSKKHFZQOF-AWEZNQCLSA-N 287.363 2.306 10 20 CECD Cc1cc(CN2CC[S@](=O)C[C@H](C)C2)ccc1N(C)C 294121157 NIBXQJUDRCDAGG-XCLFUZPHSA-N 294.464 2.261 10 20 CECD COC1(CNC(=O)c2c(F)ccc(O)c2O)CCCCC1 295072368 WNBBJZZPPQRVJZ-UHFFFAOYSA-N 297.326 2.316 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2cc(C)ccc2O)n1 818346010 PUEFVOCLWBNGRY-LLVKDONJSA-N 274.368 2.471 10 20 CECD CC[C@H](NC[C@H]1CNCCO1)c1cc(Cl)ccc1O 817982993 JHFSTQMAOKGLLS-YPMHNXCESA-N 284.787 2.075 10 20 CECD Cc1cccc(CN[C@@H]2CCC[C@@H]([S@](C)=O)C2)c1O 826911110 RZYHCWRDEMVMMP-LPMFXHHGSA-N 281.421 2.480 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H]3OCC[C@@H]3C2)c1O 829620619 CFDOBZLAKFJWPJ-ABAIWWIYSA-N 293.338 2.345 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCCCCCN)c1 828667450 PYTNOYNHLLDDBY-GFCCVEGCSA-N 294.395 2.487 10 20 CECD Cc1c(CNC(=O)CN2CC(C)(C)C2)n(C)c2ccccc12 582794834 ISWAJPNHRLEWEW-UHFFFAOYSA-N 299.418 2.445 10 20 CECD CCn1cccc(CN[C@@H]2CCc3cccc(O)c32)c1=O 834786899 DMTMQPKOTMNYHQ-CQSZACIVSA-N 284.359 2.351 10 20 CECD Cc1nccnc1C(=O)NCc1c(O)ccc2c1CCCC2 830559650 RCHIHEFQIUVBPP-UHFFFAOYSA-N 297.358 2.299 10 20 CECD C[C@@H](NC[C@@H]1CCN1C)c1ccc(Cl)cc1O 903317820 VHUGYORTPYMBSP-KOLCDFICSA-N 254.761 2.400 10 20 CECD CC(C)Nc1ccccc1NCCN1CCOC1=O 902105930 PGOLRBICQUZIOF-UHFFFAOYSA-N 263.341 2.371 10 20 CECD C[C@@]1(CNCc2ccc3ccccc3c2O)CCC(=O)N1 835061371 RXFKOQPYRRNGGC-KRWDZBQOSA-N 284.359 2.304 10 20 CECD Cc1ccc(O)c(CNc2c(C)ccn(C)c2=O)c1 902254917 IWETZXLSJNOAAV-UHFFFAOYSA-N 258.321 2.320 10 20 CECD O=C(O[C@@H]1C[C@H]2CCCC[C@@H]2NC1=O)c1cc(O)cs1 837516502 YOBUZSQZYYDSIC-DVVUODLYSA-N 295.360 2.058 10 20 CECD CCN1CC(=O)N[C@@H]1c1cc(OC)cc(C(C)(C)C)c1O 849184070 XUYPRKUEHZLASY-HNNXBMFYSA-N 292.379 2.149 10 20 CECD CCN(CC)c1ccc(CNC(=N)N2CCC2)cc1F 849006320 WBUVMTINZWTCGL-UHFFFAOYSA-N 278.375 2.402 10 20 CECD C[C@H](NCC[C@]1(O)CCCOC1)c1ccc(N(C)C)cc1 846214253 LJEDTOAZYSDCRG-WMLDXEAASA-N 292.423 2.335 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)C2(C)CCCC2)cc1 843296877 HLUMVPCQGVMHFQ-OAHLLOKOSA-N 289.423 2.449 10 20 CECD NC[C@@H](NCc1c(O)ccc(Cl)c1F)C1CC1 841028034 JSQODZDIEUJVQM-SNVBAGLBSA-N 258.724 2.012 10 20 CECD CCCc1noc(CN2CCCc3cc(CN)ccc32)n1 843350348 NLPQPBINRXTSNA-UHFFFAOYSA-N 286.379 2.434 10 20 CECD CCC(N)(CC)CNCc1cc(OC)c(OC)cc1O 841031095 PYZCAGRZBBXJRT-UHFFFAOYSA-N 282.384 2.017 10 20 CECD CCc1cccc(CN2C[C@H](C)C[C@@H](CO)C2)c1O 848917980 MALIZMBLTRYAHU-CHWSQXEVSA-N 263.381 2.405 10 20 CECD CCCOC(=O)[C@@H](C)N1CCCc2cc(CN)ccc21 843350091 IVNFRUVQCVGISM-GFCCVEGCSA-N 276.380 2.240 10 20 CECD C[C@H]1CC(NC(=O)NCCc2ccc(N)cc2)C[C@H](C)O1 841865852 HTCSYNLCTQUMSN-RYUDHWBXSA-N 291.395 2.067 10 20 CECD Cc1cc(C(=O)COC(=O)c2cccc(O)c2O)c(C)[nH]1 758548239 QQYDYRWKZAANAL-UHFFFAOYSA-N 289.287 2.082 10 20 CECD CCON(C)C(=O)NCc1ccc2c(c1)CCCN2C 753446357 LIFBUYTTYVGWHU-UHFFFAOYSA-N 277.368 2.162 10 20 CECD CCCn1nccc1C(=O)NCc1ccc(N(C)C)cc1 854272077 XQRAXPVHJKBRSY-UHFFFAOYSA-N 286.379 2.289 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCOC[C@@H]2OCC)c1 759173900 QOOBGJYEYIMGNQ-ZBFHGGJFSA-N 295.379 2.075 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@]2(C)CC2(F)F)c1 862755521 VFZNUKDOBJASBA-GFCCVEGCSA-N 255.264 2.362 10 20 CECD CCCOc1ccc(CN[C@H](CCOC)C(=O)O)cc1C 871878710 SOYHWPHUBUZQRZ-CQSZACIVSA-N 295.379 2.363 10 20 CECD CC[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@H]1O 1116448814 GEHKPYBZOSLKRP-NVXWUHKLSA-N 274.408 2.490 10 20 CECD CC(C)[C@H](C)NC(=O)CN[C@H](C)c1ccccc1O 879647863 OJJGDLXXJCJBLO-NWDGAFQWSA-N 264.369 2.204 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1c(C)ccnc1O 1116502515 VPYQJWHMMQSZHD-UHFFFAOYSA-N 299.374 2.400 10 20 CECD OCCN(Cc1cc(Cl)ccc1O)C1CCOCC1 783716784 AWLMCYHFVWKLKV-UHFFFAOYSA-N 285.771 2.019 10 20 CECD C[C@@H](N[C@H]1CCN(C2CC2)C1)c1c(O)cccc1F 886522281 GKFHVNNRLHUGCV-MNOVXSKESA-N 264.344 2.419 10 20 CECD COc1ccc(CN2CC[C@@H]3C[C@@H]3C2)c(O)c1OC 895432932 GEJCADJJLVEOJE-ZYHUDNBSSA-N 263.337 2.251 10 20 CECD Cc1ccc(O)c(CNC(=O)NC/C=C\C2CC2)c1 1331059134 RJQAUGGOHAQMIH-IHWYPQMZSA-N 260.337 2.466 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CC1CC1 1342459765 YVUKCXRAHSSYET-UHFFFAOYSA-N 254.326 2.294 10 20 CECD CSC[C@@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 1262163680 BUJBRXSWTCQSBH-MRVPVSSYSA-N 293.747 2.091 10 20 CECD CN(C)c1cc(F)c(CN[C@H](CO)CC2CC2)cc1F 1351508120 PMVIDKLNQGTNJB-LBPRGKRZSA-N 284.350 2.281 10 20 CECD C[C@H](N[C@@H](C)C1CCNCC1)c1cc(C(=O)O)ccc1O 1604357554 LVELXJSKZLVTFQ-QWRGUYRKSA-N 292.379 2.129 10 20 CECD Nc1ccc(CNC(=O)NC[C@H]2Cc3ccccc3O2)cc1 1580445799 WLTYDVVSYVJQHD-OAHLLOKOSA-N 297.358 2.072 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCC(C)(C)C(N)=O 230670421 PCIWXUOFOLFWIN-QWRGUYRKSA-N 276.380 2.350 10 20 CECD CCOC(=O)[C@@H](C)NCc1cccc(Cl)c1O 158736799 FIFUHXSBHPOEDI-MRVPVSSYSA-N 257.717 2.087 10 20 CECD COC(=O)[C@]1(F)CCN(Cc2cc(C)cc(C)c2O)C1 164440193 VJWBILPMTKJVOG-HNNXBMFYSA-N 281.327 2.096 10 20 CECD CC[C@@H](NC[C@H](C)N1CCN(C)CC1)c1ccccc1O 155688226 LEBVTBTZWHBWSI-GOEBONIOSA-N 291.439 2.069 10 20 CECD COc1ccc(CN[C@H](C)Cn2cccn2)cc1C 35272355 NBQOLPBSRXWFNZ-CYBMUJFWSA-N 259.353 2.378 10 20 CECD CCc1nc(CN[C@H](C)c2ccc(N(C)C)cc2)n[nH]1 275026440 VIRILXUFRVCXGT-LLVKDONJSA-N 273.384 2.284 10 20 CECD CCC[C@H]1CN(Cc2cc(OC)ccc2O)CCO1 180318795 DOYDBFMORKZNPE-AWEZNQCLSA-N 265.353 2.402 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccccc2O)n1C 298766047 AOWZTPCQBFXRBU-UHFFFAOYSA-N 258.321 2.311 10 20 CECD CC[C@H]1CN(Cc2cc(OC)ccc2O)[C@@H](C)CO1 403831372 QAYXRFAVTWUHGE-AAEUAGOBSA-N 265.353 2.400 10 20 CECD CCC[C@H](CNCc1ccc(OC)cc1O)OC 378710658 SUQLJLYMEWVYRW-CYBMUJFWSA-N 253.342 2.306 10 20 CECD CN(CCOC(C)(C)C)Cc1cc2c(cc1O)OCO2 689894029 HVPCMSJPXZQFMZ-UHFFFAOYSA-N 281.352 2.368 10 20 CECD C[C@H](N[C@H](CO)C[C@H]1CCCO1)c1ccc(F)cc1O 886669586 AVHBTRTVKUJMJT-WCFLWFBJSA-N 283.343 2.112 10 20 CECD C[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)CCN1C 174514713 WBWVGKFYQJODSP-TZMCWYRMSA-N 279.403 2.464 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)COCC1CC1 115280624 DUVCICGLEGOVSP-UHFFFAOYSA-N 276.380 2.104 10 20 CECD CN(CC(=O)N(C)Cc1ccccc1O)Cc1ccccc1 66046887 LOYCKKDOWIPUTJ-UHFFFAOYSA-N 298.386 2.483 10 20 CECD CN(CCCC(=O)O)Cc1ccc(N(C)C)cc1 32105506 ZCOVLXOMSVJIAE-UHFFFAOYSA-N 250.342 2.049 10 20 CECD Cc1cnccc1CC(=O)N(C)Cc1ccccc1O 185846350 ZTKGWWHUHOCGEB-UHFFFAOYSA-N 270.332 2.297 10 20 CECD COC(=O)CN(Cc1ccc(N(C)C)c(F)c1)C(C)C 125730239 XWFDEDIIZSHKQZ-UHFFFAOYSA-N 282.359 2.275 10 20 CECD CC(C)NC(=O)CCNCc1cc(Cl)ccc1O 134491700 OTBZTRUMGXNNFS-UHFFFAOYSA-N 270.760 2.050 10 20 CECD CC(C)C[C@H](CO)NCc1ccc(N2CCOCC2)cc1 40774858 QILSDMXORYHPHU-MRXNPFEDSA-N 292.423 2.020 10 20 CECD CN(C)c1ccc(CNCCOCC(F)F)cc1 190894951 MPLFCOOLSOSKEJ-UHFFFAOYSA-N 258.312 2.124 10 20 CECD C[C@@H]1CCC[C@@]1(O)CNCc1ccc2c(c1)CCO2 292995097 MOKVDKDILDYBOV-MLGOLLRUSA-N 261.365 2.262 10 20 CECD COc1cccc(CN2CCS[C@@H]3COCC[C@@H]32)c1O 91856408 QCXHNQYGNVSMGD-GXTWGEPZSA-N 295.404 2.107 10 20 CECD COc1ccc(C)cc1CCNC(=O)Cc1ccc(N)cc1 237191369 ZFKJKAYGYPTPDK-UHFFFAOYSA-N 298.386 2.487 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](CO)C2)cc1F 92763696 MBKHIGRXPYCJTA-AWEZNQCLSA-N 280.387 2.486 10 20 CECD CCOc1ccc(O)c(CN2CCOC[C@@H]2C)c1 91815062 MTBLJCLLTYIRBY-NSHDSACASA-N 251.326 2.012 10 20 CECD O=C(/C=C\c1ccco1)NCc1ccc(O)c(O)c1 255612512 AFVLAPUKPFQILO-XQRVVYSFSA-N 259.261 2.020 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1ncnn1C 270915220 UEDXPMNNBVYVAT-UHFFFAOYSA-N 272.352 2.167 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)[C@@H]2CCOC2)c1 271842464 RDZBTHDBFOTLBM-VXGBXAGGSA-N 265.353 2.306 10 20 CECD CO[C@H](C)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273598076 RCWQRPOJENPYDL-ZJUUUORDSA-N 268.313 2.376 10 20 CECD CCCn1ncnc1CN(C)c1ccc2c(c1)OCO2 279031740 DPPNTYABDUPUPP-UHFFFAOYSA-N 274.324 2.053 10 20 CECD CCC1(O)CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 282844503 FPZATZJBMMTIHF-UHFFFAOYSA-N 299.374 2.086 10 20 CECD Cc1cc(C)c([C@H](C)NCC(F)(F)CO)c(O)c1 285087009 JUTUEDLYOJXLQN-JTQLQIEISA-N 259.296 2.287 10 20 CECD Cc1ncc(C(=O)NCc2ccccc2O)c(C2CC2)n1 282773003 OYOOPLGGOJKVSC-UHFFFAOYSA-N 283.331 2.298 10 20 CECD CN(C)c1ccc(CN[C@@H]2COc3ccccc3[C@H]2O)cc1 288644687 UQTXRLBTSWFMGR-SJLPKXTDSA-N 298.386 2.337 10 20 CECD Cc1nocc1CNCc1ccc(N(C)C)c(F)c1 293696017 WTACRDPFQPVPKG-UHFFFAOYSA-N 263.316 2.478 10 20 CECD CC[C@@H](NCCN)c1ccc(C(F)(F)F)cc1O 817934671 AKUFHYVWDLXZSM-SNVBAGLBSA-N 262.275 2.410 10 20 CECD Oc1c(CNCC2(O)CCOCC2)ccc2ccccc12 816548067 SQYXNGLKVYXVTK-UHFFFAOYSA-N 287.359 2.177 10 20 CECD CC[C@@H](NC[C@H]1CCCN1)c1ccc(F)cc1O 817954593 ZMDVMWFKTLKAMD-DGCLKSJQSA-N 252.333 2.324 10 20 CECD COC(=O)c1coc(C(=O)CSc2nccs2)c1 729152375 LFXIHRPTFXQYEL-UHFFFAOYSA-N 283.330 2.498 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccoc2)c1 728979591 IXBFEANRROQBLH-VIFPVBQESA-N 261.277 2.485 10 20 CECD COc1ccc(CNC(=O)/C=C(/C)Cl)c(O)c1 907925727 IFKDKJHRDZORBR-YVMONPNESA-N 255.701 2.160 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@H]1C(=O)O 833629708 LOOUTVMDJPUMCX-OIBJUYFYSA-N 287.718 2.337 10 20 CECD CCNc1ncc(C(=O)NCCc2ccc(N)cc2)s1 832659022 HPAARFOAHKRKNU-UHFFFAOYSA-N 290.392 2.130 10 20 CECD COc1cccc([C@@H](C)NC[C@H](C)CCCO)c1O 846170570 OTKZQMGRITVHJP-VXGBXAGGSA-N 267.369 2.460 10 20 CECD CO[C@H](CNC(=O)Nc1ccc(N)cc1)C(C)(C)C 841299139 GJAIXLVKKQJJDQ-GFCCVEGCSA-N 265.357 2.451 10 20 CECD CCCCN(CCCO)C(=O)NCCc1ccc(N)cc1 841960549 SISXXQCSZLRTGD-UHFFFAOYSA-N 293.411 2.005 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(Cl)cc1O 842912062 PLJPHZIXRMCLBL-RLCGTCKNSA-N 271.744 2.110 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H]2CC(=O)N(C3CC3)C2)c1 846205711 KIGFJJXZHXFXGM-OLZOCXBDSA-N 288.391 2.362 10 20 CECD CC[C@@H]1CN(C)CCCN1C(=O)c1cc(O)cs1 846987768 IIDKWRVSOSJABK-SNVBAGLBSA-N 268.382 2.010 10 20 CECD COc1cccc([C@H](C)NCc2nc(C3CC3)n[nH]2)c1O 846170603 PHUFXPWECIEKIA-VIFPVBQESA-N 288.351 2.247 10 20 CECD COc1cccc([C@H](C)N[C@H](C)CN2CCCC2=O)c1O 846145046 OHBXYXSHOMLUOK-NEPJUHHUSA-N 292.379 2.062 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](CCN)C2)c1O 923493814 VYSCOHVESPECLZ-LLVKDONJSA-N 296.798 2.419 10 20 CECD CCN1C[C@H](CN[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 846209989 VFSILPSFIRXPDK-KBPBESRZSA-N 289.423 2.272 10 20 CECD Cc1cc(C(=O)N[C@@H]2COC[C@@H]2C)c(C)n1-c1ccccn1 928891264 FMDNBNKOEQLCOY-XHDPSFHLSA-N 299.374 2.254 10 20 CECD CCCOCCOC(=O)NCc1ccc(OC)cc1O 859144732 YJYAYMHSGVYKNU-UHFFFAOYSA-N 283.324 2.054 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)CCCF)C2)cc1 854981540 VJGAFDRSTOTOBD-ZDUSSCGKSA-N 294.370 2.387 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)NCc1ccc2c(c1)CCCO2 921618572 JHLPKBXBAWOVQL-CHWSQXEVSA-N 290.407 2.404 10 20 CECD CCC(=O)N1CC[C@H](CNCc2ccc(OC)c(C)c2)C1 1026627296 PVRYULUYTLCACB-OAHLLOKOSA-N 290.407 2.352 10 20 CECD CC[C@@H]1C(=O)NCCCN1Cc1ccc(N(C)CC)cc1 933217044 SDNCTQSDRJBSHY-MRXNPFEDSA-N 289.423 2.243 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H]1C[C@@H](O)C1 862527864 JHBAIYZSDNVBRM-WKFQBHICSA-N 259.708 2.045 10 20 CECD Oc1ccc(Cl)c(F)c1CNCCC1CC(O)C1 762504918 ZNYDWXFDFNGFGA-UHFFFAOYSA-N 273.735 2.435 10 20 CECD CN(Cc1cc(-c2ccccc2)ccc1O)[C@H]1CCNC1=O 770377498 ACDNNHKEWFECPG-INIZCTEOSA-N 296.370 2.380 10 20 CECD CCc1cc(-c2nc(Cc3ccc(N)cc3)no2)n(C)n1 872170011 ARSHJKBDBRMIFE-UHFFFAOYSA-N 283.335 2.206 10 20 CECD Cc1cc(O)c(CN2CCSC[C@@H]2CO)cc1Cl 877780420 PUAKQOPMJLVCKG-NSHDSACASA-N 287.812 2.264 10 20 CECD CCN(C)c1ccc(Cn2cc(-c3ccnn3C)nn2)cc1 881313786 SXJUJMTYXPMQAU-UHFFFAOYSA-N 296.378 2.183 10 20 CECD CCC1(O)CCC(NCc2cc3c(cc2O)OCO3)CC1 771873057 AQDLZBUVBIZYKH-UHFFFAOYSA-N 293.363 2.294 10 20 CECD C[C@H](NC(=O)NCc1ccccc1O)[C@H]1CCCOC1 780044238 MMBVBTABTYUCFO-AAEUAGOBSA-N 278.352 2.007 10 20 CECD C[C@H](O)CN(Cc1cc(F)cc(F)c1O)C1CC1 895193112 TYQHVSLWNKPLBV-QMMMGPOBSA-N 257.280 2.016 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cc(C)c(C)cc2O)C1 896962667 PWRKRXUTRODMFE-CYBMUJFWSA-N 277.364 2.394 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2c(C)cccc2O)C1 896125353 QYBBGUUHLWSGTH-NEPJUHHUSA-N 263.337 2.132 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)c1 792191788 ADTWPHKWLYXNTH-FVGIMDHTSA-N 267.394 2.042 10 20 CECD CC[C@@H](CCO)CNCc1cc(F)cc(F)c1O 708455886 ZRIBAOFFRDVTRI-VIFPVBQESA-N 259.296 2.169 10 20 CECD CCc1cccc(CN(C)[C@@H](C)C[S@@](C)=O)c1O 709309430 UXZMZKNDDCWIPR-BBATYDOGSA-N 269.410 2.153 10 20 CECD CCOc1cccc(CN(CC(=O)O)[C@@H](C)CC)c1O 86752938 PCHMZFNXSLYRSO-NSHDSACASA-N 281.352 2.476 10 20 CECD Cc1cccc(CN[C@H]2CCn3ccnc3C2)c1O 779192199 LKGWVIJIQQIZAJ-ZDUSSCGKSA-N 257.337 2.002 10 20 CECD Nc1ccc(CNC(=O)N2CC(F)(F)C(F)(F)C2)cc1 1337069979 FCXUFQXBOSIPND-UHFFFAOYSA-N 291.248 2.065 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2cc(F)cc(F)c2O)C1 1343246710 MSEDBXFKIMDCKQ-KCJUWKMLSA-N 285.290 2.102 10 20 CECD Nc1ccc(CNC[C@@H]2NCCc3ccccc32)cc1 1345159345 GNUJYKDHMKATFL-KRWDZBQOSA-N 267.376 2.245 10 20 CECD CC[C@H](CN[C@H](C)c1cccc(OC)c1O)C(=O)O 1603567874 KYJDPMJZHMGDKE-NXEZZACHSA-N 267.325 2.162 10 20 CECD CN(C)c1ccc(/C=C/CNC[C@H]2C[C@@H](N)C2)cc1 1578425776 MHBVHHKEKANHRV-MRINAFOASA-N 259.397 2.093 10 20 CECD C[C@@H](N[C@@H](C(=O)O)c1cccnc1)c1ccccc1O 1599841153 ODNZUKADVPXZIH-QMTHXVAHSA-N 272.304 2.264 10 20 CECD O=C(Cc1noc2ccccc12)NCc1ccc(O)c(O)c1 158913473 SFXMRLMNJJIEGY-UHFFFAOYSA-N 298.298 2.098 10 20 CECD Cc1c(/C=C/C(=O)N2CCc3ccccc32)cnn1C 155055645 DIZFNLLQWUFOJX-BQYQJAHWSA-N 267.332 2.331 10 20 CECD CC[C@H](N[C@@H](C)CN1CCCC1=O)c1ccccc1O 37782112 WGCDHYYFCQWVOX-JSGCOSHPSA-N 276.380 2.444 10 20 CECD COc1ccc(O)c([C@H](C)NCC[C@H](C)OC)c1 273568726 KEWCEYQTUXEMRH-QWRGUYRKSA-N 253.342 2.476 10 20 CECD COc1ccc(O)c(CN2CCCC[C@@H]2[C@@H](C)N)c1 63191912 PIVXBQGBGUSJLX-BXUZGUMPSA-N 264.369 2.103 10 20 CECD CC1(C(=O)NCc2ccc(N)cc2)CC(F)(F)C1 720482847 LPCFCWJDISZWLS-UHFFFAOYSA-N 254.280 2.320 10 20 CECD COc1cccc(C(=O)NCc2cccc(OC)c2O)c1 68488641 IKQWYHMEXHHTGY-UHFFFAOYSA-N 287.315 2.339 10 20 CECD COc1ccc(N(CC(=O)N(C)C)[C@@H](C)C2CC2)cc1 111236613 GVPZHMGHOCGIJP-LBPRGKRZSA-N 276.380 2.388 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2cccc(C)n2)c1 124903257 QVMAVQFOBHAXRG-UHFFFAOYSA-N 287.319 2.426 10 20 CECD COc1ccc(N2CCC(N[C@H](C)CCO)CC2)cc1 121313738 HDOOJCBECIGXLP-CYBMUJFWSA-N 278.396 2.025 10 20 CECD CCCOC(=O)[C@@H](C)N(C)c1ccc2c(c1)OCO2 121353392 XNVUECVPXVYBHC-SNVBAGLBSA-N 265.309 2.193 10 20 CECD Cc1cccc(CNC(C)(C)CCS(C)(=O)=O)c1O 182492394 UKHQZRGNMHYAJE-UHFFFAOYSA-N 285.409 2.004 10 20 CECD CCc1nnc(NC(=O)/C=C/c2ccc(O)c(O)c2)s1 180689765 KSZHPNQJSGZAJU-GQCTYLIASA-N 291.332 2.164 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CC[C@H](C(=O)OC)C2)c1 193500087 CUWFMFUZIWYZFO-WCQYABFASA-N 293.363 2.222 10 20 CECD CC(C)[C@H]1OCCC[C@@H]1CNC(=O)c1cccc(O)c1O 193128190 QBNRMKAMMVJUBS-IAQYHMDHSA-N 293.363 2.279 10 20 CECD CCO[C@H](CC)C(=O)N1CCOc2cc(N(C)C)ccc21 530452498 RTTSLLPYBFMEJE-CQSZACIVSA-N 292.379 2.293 10 20 CECD NC(=O)C[C@H]1CCN(Cc2c(O)ccc3ccccc23)C1 377193060 OLQPKPJLHHQPBI-GFCCVEGCSA-N 284.359 2.243 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H](C)CN(C)C)c1 293651306 LHVCMJMHDKWDNB-NWDGAFQWSA-N 294.395 2.027 10 20 CECD COc1cccc(CN2CC[C@H](SC)C2)c1O 294910381 ACMPLAWSZKSXKG-NSHDSACASA-N 253.367 2.338 10 20 CECD Oc1ccccc1CN1CCCN(CC(F)F)CC1 290406016 JTNPKICDXSBXTM-UHFFFAOYSA-N 270.323 2.165 10 20 CECD CO[C@@H](CC(C)C)CS(=O)(=O)Nc1ccc(O)cc1 817347974 DEOJUNKAIRPXGQ-ZDUSSCGKSA-N 287.381 2.195 10 20 CECD COc1cccc(CNC(=O)[C@H]2CCCSC2)c1O 810328074 HQHXLJBITYYWRU-NSHDSACASA-N 281.377 2.160 10 20 CECD CCN(Cc1nc(CCOC)no1)c1ccc(OC)cc1 728918508 ZPPOFTLKGYXTNE-UHFFFAOYSA-N 291.351 2.294 10 20 CECD Nc1ccc(CC(=O)N2CCCC[C@@H]2c2ncc[nH]2)cc1 827980970 VHASAQANANHAKU-CQSZACIVSA-N 284.363 2.288 10 20 CECD CCO[C@@H]1CCC[C@H]1NCc1cc2c(cc1O)OCO2 825284613 SPARMLIIIZZWOS-DGCLKSJQSA-N 279.336 2.168 10 20 CECD Cc1nn(C)c(C)c1CC(=O)N[C@H](C)c1ccccc1O 827923605 VRDNFBVCHOPTSE-SNVBAGLBSA-N 287.363 2.162 10 20 CECD Cc1cc(O)c(CNCCC[S@@](C)=O)cc1Cl 825298366 ZDUZUVZMYLSNKH-QGZVFWFLSA-N 275.801 2.212 10 20 CECD COc1ccc(CNCc2c(O)cccc2OC)cc1O 725851517 SJUGHXCWQNWFAE-UHFFFAOYSA-N 289.331 2.405 10 20 CECD Cc1ccncc1/C=C\C(=O)N1CCOc2ccncc21 492502622 PBRCKSRDIYSPAX-IHWYPQMZSA-N 281.315 2.224 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CNc1ccccn1 900731151 CCPQAVLXBKKNKS-UHFFFAOYSA-N 298.390 2.184 10 20 CECD CCN1CCC[C@@H](N[C@@H](C)c2c(O)cccc2F)C1=O 903387760 IYSCTAKRGLRAMC-CMPLNLGQSA-N 280.343 2.193 10 20 CECD CC/C(C)=C\C(=O)N(CC(=O)O)Cc1ccccc1O 911488777 NQVSXYNZSQBKRG-FLIBITNWSA-N 277.320 2.162 10 20 CECD CCc1cccc(CNCCc2nnc3ccccn23)c1O 848890762 LCKQHFKIFODEBK-UHFFFAOYSA-N 296.374 2.330 10 20 CECD COc1cccc(CNC(=O)C2SCCCS2)c1O 841404633 HBVVWWQVDQLVCL-UHFFFAOYSA-N 299.417 2.213 10 20 CECD CN(C)c1ccc(CN[C@H](CN)C2CCCC2)cc1F 841088402 VOAKGEIMBIVIIO-OAHLLOKOSA-N 279.403 2.499 10 20 CECD CCN(CC)c1ccc(CNC[C@H](N)C2CC2)cc1F 841048907 GOWOWOUOCRHNKV-HNNXBMFYSA-N 279.403 2.499 10 20 CECD CCOc1cccc(CN[C@H](CN)CC(C)C)c1O 841038274 IKTHNPNHKPFZAY-ZDUSSCGKSA-N 266.385 2.254 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)[C@@H]2C[C@H]2C)cc1 844851608 BXVUYWPYQKSEPU-IUODEOHRSA-N 276.380 2.246 10 20 CECD CC[C@H](N)CNCc1ccc(N(CC)CC)c(F)c1 841073364 WEGUVIVZCBPEKY-ZDUSSCGKSA-N 267.392 2.499 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ocnc2C)c1 751061235 UYTOUIDDUGGQOS-MRVPVSSYSA-N 276.292 2.188 10 20 CECD C[C@@H](NCCCn1cncn1)c1cc(F)cc(F)c1O 756831932 ZMSQMLKOYSXHLT-SECBINFHSA-N 282.294 2.003 10 20 CECD COc1ccc(N(C)CC(=O)Nc2ccon2)cc1Cl 757857907 XRVMCSQMVFKXCH-UHFFFAOYSA-N 295.726 2.412 10 20 CECD CO[C@H](C1CC1)[C@H](C)NC(=O)NCc1cc(C)ccc1O 858521276 LZWRTHUWAKNWHV-NHYWBVRUSA-N 292.379 2.313 10 20 CECD C[C@@H](N[C@@H]1CCN(C2CC2)C1)c1cc([N+](=O)[O-])ccc1O 756535569 RFRSZSZFTOTDHX-GHMZBOCLSA-N 291.351 2.188 10 20 CECD CC[C@]1(C)NC(=O)N(Cc2ccc(N(C)C)cc2C)C1=O 761358982 SXIGWSFCJNDVML-INIZCTEOSA-N 289.379 2.282 10 20 CECD COCCCOCCN(C)Cc1c(C)cccc1O 877173053 XJMSZRPQKFKCGQ-UHFFFAOYSA-N 267.369 2.186 10 20 CECD CCOc1ccc(CN[C@H]2CCC[C@H]2CCO)c(O)c1 778216196 KDVLONQKLHPRFG-WFASDCNBSA-N 279.380 2.432 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(C)=O)[C@@H](C)C2)cc1C 1044391926 AIGBKMDZMVZKMS-XJKSGUPXSA-N 290.407 2.493 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCC[C@@]1(C)N)c1ccccc1O 870988480 QPFKKVBWPMONMD-PVXIVEMSSA-N 276.380 2.477 10 20 CECD Cc1cc(Br)cc(CN2CCN[C@H](C)C2)c1O 775638872 JVLRZSFXNVAANN-SNVBAGLBSA-N 299.212 2.257 10 20 CECD CCCOc1ccc(CN[C@H](C)CC(N)=O)cc1C 873080482 PPDVMXFYEDLKDO-GFCCVEGCSA-N 264.369 2.137 10 20 CECD CC[C@H](CO)C(=O)NCc1ccc(N(CC)CC)c(F)c1 779628745 XGICJFNAKWFSLX-CYBMUJFWSA-N 296.386 2.307 10 20 CECD Cc1ccc(CNC(=O)c2ccc(C)c(O)c2O)cn1 770477411 RHGOWRZNKBLKTP-UHFFFAOYSA-N 272.304 2.040 10 20 CECD COc1ccc(O)c(CNC(=O)NC[C@@H]2C=CCC2)c1 883412202 SXWBWOBTVXMGKH-LLVKDONJSA-N 276.336 2.166 10 20 CECD CC[C@](C)(O)Cc1cn(Cc2ccc(N(C)C)cc2)nn1 881272453 VRZVLWDPUFSTJI-INIZCTEOSA-N 288.395 2.096 10 20 CECD CC(C)(C)[C@@H]1CN(C(=O)c2cc(O)cs2)CCO1 791080302 AJKYIYXIBRSDBA-NSHDSACASA-N 269.366 2.341 10 20 CECD CCN(CC)C[C@@H](C)NC(=O)Nc1ccc(N)cc1 41681710 WWONZGFXQJCUMB-LLVKDONJSA-N 264.373 2.121 10 20 CECD CN(Cc1ccccc1O)Cc1ccoc1C(=O)O 737494556 UKRMATCUCXPTIT-UHFFFAOYSA-N 261.277 2.315 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@@H]2CCO)c1 190304460 MDAQKAMPHHCNAZ-BXUZGUMPSA-N 265.353 2.042 10 20 CECD C[C@@H]1CNCCN1Cc1ccc(N2CCCC2)cc1 1326221718 JQVHKOQGLUIJMX-CQSZACIVSA-N 259.397 2.081 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)(F)F)c1cc(F)ccc1O 717774004 PGUCCXTYXAYOCZ-VXNVDRBHSA-N 281.249 2.495 10 20 CECD COc1cccc(CN2CCO[C@H](C)[C@@H]2C)c1O 93418396 VDUKULACYWXALT-WDEREUQCSA-N 251.326 2.010 10 20 CECD O=C(O)c1cccc(CCNC(=O)c2cc(O)cs2)c1 1608930007 DPBIEDNKXFDVMB-UHFFFAOYSA-N 291.328 2.124 10 20 CECD Cc1ccc2c(c1)N[C@@H](c1cc(C(=O)O)ccc1O)NC2=O 1600497640 XXELVZNVYKLADP-CQSZACIVSA-N 298.298 2.253 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)OCC(=O)O 1611171416 FGWGLGXRPXSKDJ-UHFFFAOYSA-N 279.317 2.397 10 20 CECD COc1cc(C)c(CN2CC[C@@H](C)[C@H](C(=O)O)C2)c(O)c1 1574181547 BZGMUSMHFGIGOO-QMTHXVAHSA-N 293.363 2.252 10 20 CECD C[C@H](N[C@@H]1CCC[C@H](N)C1)c1cc(C(=O)O)ccc1O 1593221825 BIQBLOZMSYQVKU-ZMLRMANQSA-N 278.352 2.011 10 20 CECD C[C@H](NC[C@H]1CCCN(C)C1)c1cc(C(=O)O)ccc1O 1593257151 LWSWVLMGOGGYLH-NWDGAFQWSA-N 292.379 2.083 10 20 CECD CC1(CNCc2ccc(N3CCOCC3)cc2)CC1 224187782 KATMQOCKSXYTAC-UHFFFAOYSA-N 260.381 2.413 10 20 CECD CCN1CCCc2cc(CNCC(F)(F)C(=O)O)ccc21 1776875510 LQGYFKXCDNHTLO-UHFFFAOYSA-N 298.333 2.269 10 20 CECD CCCNC(=O)CN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 36780978 YPFZORUNNFCUJL-NEPJUHHUSA-N 276.380 2.365 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2O)C[C@@H]1O 270835108 DDYJJRNICYVRPI-HZMBPMFUSA-N 297.782 2.451 10 20 CECD CC(C)(C)N1CCN(C(=O)Nc2ccc(N)cc2)CC1 48946303 DKVQOVXUNIGUCB-UHFFFAOYSA-N 276.384 2.217 10 20 CECD C[C@H](N[C@@H](C)C1(CO)CC1)c1ccc(F)cc1O 829208499 KITMMSGGEODBMK-UWVGGRQHSA-N 253.317 2.343 10 20 CECD CN(Cc1ccccc1O)[C@@H](C(N)=O)c1ccc(F)cc1 109772811 RSORIVLLRWYAOE-OAHLLOKOSA-N 288.322 2.190 10 20 CECD Nc1ccc(NC(=O)CCOCC(F)(F)F)cc1 22171888 BIIBYPPHKPBNRL-UHFFFAOYSA-N 262.231 2.176 10 20 CECD COc1cc(CN2CCN(CC(C)C)CC2)c(O)cc1C 179433542 UCZAMWJUINGIQX-UHFFFAOYSA-N 292.423 2.483 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C(C)C)on2)c1 122635124 SNYQAUDYSNTJPI-UHFFFAOYSA-N 290.319 2.442 10 20 CECD C[C@H](NCc1nnc2n1CCCC2)c1ccc(F)cc1O 183844146 OGOVIUKIPWDWAP-JTQLQIEISA-N 290.342 2.310 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)[C@@H](CO)SC)c1 185511168 RMNQWWXXRQMGQT-GPCCPHFNSA-N 285.409 2.164 10 20 CECD CC[C@H](NCC1(S(C)(=O)=O)CCC1)c1ccccc1O 280970630 LHKWTUHYZTXRII-ZDUSSCGKSA-N 297.420 2.400 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)[C@@H](C)N2CCOCC2)c1 185375795 XOCRHWQWKABQPJ-QLFBSQMISA-N 292.423 2.460 10 20 CECD CO[C@@]1(C)C[C@H](NC(=O)c2cccc(O)c2O)C1(C)C 185778424 RPWXRIDWDSBCER-NHYWBVRUSA-N 279.336 2.031 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cc(C)nn2C)c1 284182520 FVYNLAFWPXXCOX-NSHDSACASA-N 275.352 2.294 10 20 CECD CCN(CC)c1ccc(CNCC(=O)NCC(C)C)cc1 134638351 ATZBBXHOIJPRNN-UHFFFAOYSA-N 291.439 2.395 10 20 CECD CCOCCN(C)C(=O)NCc1ccc(N(C)C)c(F)c1 91724630 XTRQKUAUCVODDH-UHFFFAOYSA-N 297.374 2.070 10 20 CECD Cc1nn(C)c(Sc2nccs2)c1[N+](=O)[O-] 265159956 VRHGFULGYPJUJK-UHFFFAOYSA-N 256.312 2.244 10 20 CECD CCOC[C@@H](NC(=O)NCc1ccccc1O)C(C)C 276475700 HQPBYFIFIPXZEM-CYBMUJFWSA-N 280.368 2.253 10 20 CECD CCCOc1ccc(CNCCC[C@H](C)O)c(O)c1 278685461 PLLWESNHQBZVGM-LBPRGKRZSA-N 267.369 2.432 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@@]2(CCO[C@@H]2C)O1 280358019 CJWQGBYLMDNNLE-XHBSWPGZSA-N 295.354 2.300 10 20 CECD C[C@@H]1C[C@@H](C)[C@H](C(=O)N(C)Cc2ccccc2O)O1 282558100 SMGVPBBDKRAVNN-JTNHKYCSSA-N 263.337 2.164 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](F)C(F)(F)F 293546978 SOLHXYWFRBVVSO-LHLIQPBNSA-N 295.232 2.045 10 20 CECD Oc1ccc(Cl)cc1CN1CCOCC12CC2 802658849 RXQCNGFGEIBNKH-UHFFFAOYSA-N 253.729 2.410 10 20 CECD COC(=O)c1cnc(SCCCn2ccnc2)s1 295320388 OCMAAUYVPCKPTI-UHFFFAOYSA-N 283.378 2.309 10 20 CECD CNC(=O)[C@H](C)N[C@@H](C)c1ccc(Cl)c(Cl)c1O 291993673 WWDLUARULBCKJR-BQBZGAKWSA-N 291.178 2.484 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCC[C@@H](OC)C2)c(O)c1 816550665 XUPKEKKNLNEVIR-WCQYABFASA-N 293.363 2.222 10 20 CECD C/C(=C/C(=O)N1C[C@H](C)Oc2ncccc21)c1cnccn1 829227110 GGIBHFLWLLFNLR-KGTBHZDVSA-N 296.330 2.089 10 20 CECD Cc1nccnc1C(=O)NCc1ccc2c(c1)CCCN2C 824675913 AAMGKBVPSDVSSY-UHFFFAOYSA-N 296.374 2.097 10 20 CECD COc1cccc(O)c1CN[C@@H](C1CC1)[C@@H](CO)C1CC1 824846455 SHFFLVDDQXTLDH-YOEHRIQHSA-N 291.391 2.288 10 20 CECD COc1cccc(CN2CC(CC(F)F)C2)c1O 822520889 RCJRZQXCODTZGK-UHFFFAOYSA-N 257.280 2.488 10 20 CECD O=C(O)C[C@@H]1CCCN1Cc1cc2c(cc1O)CCC2 833211206 VVJBGATXRRKSNL-AWEZNQCLSA-N 275.348 2.320 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCCN2C)c1 732287666 ZKHPNKYEMJUOML-FZMZJTMJSA-N 292.379 2.062 10 20 CECD CCOC(=O)C(C)(C)CC(=O)Nc1ccc(N)cc1 832250190 MBEXHCDFPTUPIW-UHFFFAOYSA-N 264.325 2.187 10 20 CECD Nc1ccc(CNC(=O)COc2ccc3c(c2)CCC3)cc1 837303336 HOYWSSINCXKXHN-UHFFFAOYSA-N 296.370 2.453 10 20 CECD C[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)CS1 840276681 MVWDCKJAXUJFKS-GXSJLCMTSA-N 266.366 2.085 10 20 CECD CNC(=O)C[C@@H](C)N[C@@H](C)c1ccc(Cl)cc1O 841752534 BGLJSQAZIPRVQS-BDAKNGLRSA-N 270.760 2.221 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](O)C1CCC1 840951870 KTGDSPSVJIGWCP-INIZCTEOSA-N 262.397 2.312 10 20 CECD CO[C@@H](CC(C)C)C(=O)N(C)Cc1ccccc1O 841405959 WQZIJSNQKGFEDY-AWEZNQCLSA-N 265.353 2.412 10 20 CECD COc1cccc(CNC[C@@H](N)c2ccccc2)c1O 841038554 XZEZPZFLJDTAFO-CQSZACIVSA-N 272.348 2.190 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2CCCNC2=O)c(O)c1C 840825400 GEZJQOZQZZGQKD-OLZOCXBDSA-N 276.380 2.186 10 20 CECD Cc1noc(CN(C)Cc2ccc(N(C)C)c(C)c2)n1 847088341 XAWFZLAXCWHJFN-UHFFFAOYSA-N 274.368 2.384 10 20 CECD O=C(NCc1ccccc1O)Nc1ccn(CC(F)F)n1 748950825 DVRKZSJXBFSILB-UHFFFAOYSA-N 296.277 2.176 10 20 CECD CCOc1cccc(CN(C[C@@H](C)O)C2CC2)c1O 848928395 CBOGEVZDIDYERI-LLVKDONJSA-N 265.353 2.136 10 20 CECD C[C@H](CN1CCOCC1)N[C@H](C)c1ccc(Cl)cc1O 841744687 JYIJYAFKKYIYNF-VXGBXAGGSA-N 298.814 2.417 10 20 CECD Cc1cc(C(N)=O)ccc1NC(=O)NCc1ccccc1O 748443655 PJJZVGOMVSXQPM-UHFFFAOYSA-N 299.330 2.121 10 20 CECD C[C@H]1CC[C@@H](NC(=O)NCCc2ccc(N)cc2)C1 841886136 YMJYUHYZODFFJC-SMDDNHRTSA-N 261.369 2.299 10 20 CECD CCOC[C@@H]1CN(Cc2ccc(N(C)CC)cc2)CCO1 859771812 LFHAGNLFJIWFEO-KRWDZBQOSA-N 292.423 2.380 10 20 CECD Cc1noc(NCc2cc(F)c(N(C)C)cc2F)n1 865290172 RERFVBIAYJEJSY-UHFFFAOYSA-N 268.267 2.334 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CSC1CC1 935945879 NXWRANKEYYECFZ-UHFFFAOYSA-N 286.393 2.390 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC[C@H](O)C2CCCC2)c1 865874845 JWALHKNEPHDDDC-HNNXBMFYSA-N 294.351 2.331 10 20 CECD CC(=O)C1=NN(c2ccc(Br)cc2C)C(=O)C1 871951907 WBPQPTITPJBGQN-UHFFFAOYSA-N 295.136 2.439 10 20 CECD CCCOc1ccc(CN[C@H](C)C(=O)N(C)C)cc1C 873072717 YWHMTDIEFMXQDR-CYBMUJFWSA-N 278.396 2.350 10 20 CECD Cn1ccnc1[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 774658412 NOGAYNCUMSWAFB-SNVBAGLBSA-N 291.376 2.207 10 20 CECD CCCN1C[C@H](CNCc2c(C)cccc2O)CC1=O 877594681 ISEUGPDHWOEKJE-ZDUSSCGKSA-N 276.380 2.049 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCC2(C1)OCCO2 775678628 HGSOPVPBCSPUFC-UHFFFAOYSA-N 287.718 2.134 10 20 CECD COc1ccc(CN2CC(C)(C)OC[C@@H]2C)c(O)c1OC 894009469 NAQDMEPAYUGHTJ-NSHDSACASA-N 295.379 2.409 10 20 CECD CCC[C@H](CCO)CNCc1ccc(OC)c(OC)c1O 893073436 KZQBIGMJENLURO-GFCCVEGCSA-N 297.395 2.298 10 20 CECD CC[C@@](C)(O)CNCc1ccc(Br)cc1O 691452238 FFLLXVLWKYXVCO-GFCCVEGCSA-N 288.185 2.405 10 20 CECD C[C@H](NCCOC[C@H]1CCCO1)c1cc(F)ccc1O 756583061 MMTCXSJRCZIZRC-WCQYABFASA-N 283.343 2.378 10 20 CECD C[C@H]1CC[C@H](C(=O)NCCc2ccc(O)c(O)c2)C1 776491803 ZJYPKPACWFZKSH-JQWIXIFHSA-N 263.337 2.193 10 20 CECD CCOc1cccc(CN2C[C@@H](C)OC[C@H]2C)c1O 245930789 PIXTUTQAJVVZTB-VXGBXAGGSA-N 265.353 2.400 10 20 CECD Cc1nnc(O)c(CNCc2cc(Cl)ccc2O)c1C 1323472569 ONDFIFMFQYYSHT-UHFFFAOYSA-N 293.754 2.448 10 20 CECD Cc1nnc(O)c(CNCc2ccc3c(c2)CCO3)c1C 1320641145 YTQGCGPUQIMLAD-UHFFFAOYSA-N 285.347 2.024 10 20 CECD COc1cc(O)c(CNC/C=C\C2CC2)cc1OC 1326341983 FLMWYOBKSMXNTJ-ARJAWSKDSA-N 263.337 2.465 10 20 CECD C[C@@H](NC(=O)NCc1ccc(N)cc1)C(C)(C)CN(C)C 1336060860 NPMHDUVIGDAMKE-GFCCVEGCSA-N 292.427 2.044 10 20 CECD CCOCc1cc(CNCc2csnn2)ccc1OC 1333369952 YTLOYRZHQCECBU-UHFFFAOYSA-N 293.392 2.373 10 20 CECD COc1cccc(CNC(=O)/C=C\c2nccs2)c1O 1348007089 SLSCZKNGGXUNNZ-WAYWQWQTSA-N 290.344 2.187 10 20 CECD O=C(NCc1cccc(O)c1O)c1ncsc1C1CC1 1350316546 YVHKUAVHOCJRRJ-UHFFFAOYSA-N 290.344 2.362 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@H]2C[C@@H]2C(=O)O)c1 1599598001 DDYNSFHDXROPGT-PFWNZEGQSA-N 279.336 2.161 10 20 CECD COc1cc(Cl)cc(CN(C2CC2)[C@@H](C)C(=O)O)c1O 1594058874 MFMKGXFIXNRCMZ-QMMMGPOBSA-N 299.754 2.492 10 20 CECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2)cn1 16234949 WGNIPHIHIUPBPI-UHFFFAOYSA-N 285.347 2.086 10 20 CECD CC[C@@H](NCCN(C)CCCOC)c1ccccc1O 156028210 SCXUKGYPGNIPQC-OAHLLOKOSA-N 280.412 2.401 10 20 CECD CCOc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C)c1O 156061172 MNYZFRQVILQZHH-CABCVRRESA-N 290.407 2.459 10 20 CECD COc1cccc(CNC[C@H]2CCO[C@@H](C)C2)c1O 271259450 AJXZIYVRVQDTRB-RYUDHWBXSA-N 265.353 2.306 10 20 CECD COc1cccc(CNC(=O)CCc2ccncc2)c1O 105651439 UDBQVOOLDFALDZ-UHFFFAOYSA-N 286.331 2.045 10 20 CECD CC[C@@]1(C(=O)NCCCSc2nccs2)CCNC1 119488096 IPXBQNRLCWPNDO-CYBMUJFWSA-N 299.465 2.131 10 20 CECD COc1cc(N(C)Cc2noc(C)n2)cc(OC)c1OC 125728486 ZFMFWKKRWKNAJA-UHFFFAOYSA-N 293.323 2.040 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NC2CC=CC2)c1 127896143 HXHHVHXKLLWTAG-SNVBAGLBSA-N 276.336 2.480 10 20 CECD CCOC(=O)N1CCCN(Cc2cc(F)ccc2O)CC1 180016265 HOLHSHRXTVNFQO-UHFFFAOYSA-N 296.342 2.196 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H]1CCCS1 180858399 UBPAOLFKLINJKX-MALLOTDXSA-N 279.361 2.123 10 20 CECD Cc1cccnc1CNC(=O)/C=C/c1ccc(O)c(O)c1 180756066 LPECUSGCYWPZMZ-FNORWQNLSA-N 284.315 2.131 10 20 CECD Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)no1 75159409 QRQDVXHNFCAIGV-UHFFFAOYSA-N 286.331 2.497 10 20 CECD NCC1(C(=O)NCCCSc2nccs2)CCCC1 238003735 YYYJIBWGVNEZRV-UHFFFAOYSA-N 299.465 2.261 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)COc1cccnc1 263939772 GVBFHDLOHYEGJF-UHFFFAOYSA-N 299.374 2.185 10 20 CECD CN(C)c1ccc(CNC[C@](C)(O)c2ccco2)cc1 266162939 OHGROBSDCFOARB-INIZCTEOSA-N 274.364 2.343 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N2CC(O)C2)c1 268261716 QNBKLYCWJBZKKB-UHFFFAOYSA-N 284.359 2.219 10 20 CECD CCOc1cccc(CN(CCO)C2CCC2)c1O 275961317 KDKCARGCJDTITL-UHFFFAOYSA-N 265.353 2.138 10 20 CECD O=C(NCc1ccccc1O)c1n[nH]c2c1CCCCC2 276599765 XXIVGAANXQBBGT-UHFFFAOYSA-N 285.347 2.314 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2c(O)cccc2Cl)C1 271193921 RQFGEWKDULQHAG-AWEZNQCLSA-N 283.755 2.431 10 20 CECD Cc1cc(O)c(CN2CC[C@H](n3cncn3)C2)cc1C 368798224 DXGDGBTWRHLTRI-AWEZNQCLSA-N 272.352 2.048 10 20 CECD Cc1cccc(CN[C@@H]2CCc3c[nH]nc3C2)c1O 378457134 PXXGYKFDAJKYHL-CYBMUJFWSA-N 257.337 2.071 10 20 CECD O=C1NCc2c(NCc3cc(F)ccc3O)cccc21 809722266 QXXXZLWUZIOPEC-UHFFFAOYSA-N 272.279 2.387 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)CC(C)(C)O)c1 295057300 NZELKLBJIGYBBC-LLVKDONJSA-N 267.369 2.430 10 20 CECD CC(=O)NCC[C@@H]1CCCN(Cc2ccccc2O)C1 809777493 ALYRCYWIEUQFAP-AWEZNQCLSA-N 276.380 2.130 10 20 CECD C[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1C 297299876 YMEWILQHJZGTDF-BDAKNGLRSA-N 267.300 2.355 10 20 CECD CN(Cc1c(O)cccc1Cl)CC(C)(C)CO 294720123 FKEYKOKTZGJCNE-UHFFFAOYSA-N 257.761 2.496 10 20 CECD CCC[C@@H](OC)C(=O)N1CCOc2cc(N(C)C)ccc21 295481482 ZUCFCJRTNGFUQL-CQSZACIVSA-N 292.379 2.293 10 20 CECD C[C@@H]1CN(Cc2cc(-c3ccccc3)ccc2O)CC(=O)N1 294970949 JCEGTORNQQGRAD-CYBMUJFWSA-N 296.370 2.380 10 20 CECD CCOCCOC1CN(Cc2cc(OCC)ccc2O)C1 297820658 YVVRKHQBOHIFFQ-UHFFFAOYSA-N 295.379 2.028 10 20 CECD O=C(CCNCc1ccc2c(c1)CCO2)Nc1cccnc1 818997048 QLCIUKJDBMEORU-UHFFFAOYSA-N 297.358 2.135 10 20 CECD CCOC(=O)[C@H](C)NCc1cc(Cl)c(C)cc1O 825667490 ZBMGJXNNKPOGHV-VIFPVBQESA-N 271.744 2.395 10 20 CECD Cc1cc(O)c(CN(CCO)C2CCOCC2)cc1Cl 825629065 QPOWKTFEHJBIIG-UHFFFAOYSA-N 299.798 2.327 10 20 CECD COc1cc(Cl)cc(CNCCC(C)(C)N)c1O 903939202 VFOLCOJHAMRGQX-UHFFFAOYSA-N 272.776 2.271 10 20 CECD O=C(CCCc1cccnc1)NCc1ccccc1O 830526054 CDCCSOWYOAFSKK-UHFFFAOYSA-N 270.332 2.426 10 20 CECD CC[C@@H](O)[C@@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 912125199 MHWNFBGHXQHWJX-QWHCGFSZSA-N 293.363 2.172 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1c(C)cnn1C 839620981 FXGCPJFZVPDHGO-UHFFFAOYSA-N 287.363 2.487 10 20 CECD CC1(NCc2cc(Cl)cc(F)c2O)CCNCC1 841065096 MVLNEOUMGWKNML-UHFFFAOYSA-N 272.751 2.416 10 20 CECD CC[C@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@H](C)O 842250733 KKFAGRVANMSCMD-HUBLWGQQSA-N 278.396 2.337 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](n2cncn2)C1 840938712 QWZGHTBEIRHBDX-MRXNPFEDSA-N 285.395 2.100 10 20 CECD COc1ccc(O)c(CNCCc2ccc(N)cc2)c1 841034657 JEPOUSLMXYIGTG-UHFFFAOYSA-N 272.348 2.315 10 20 CECD O=C1CCCN1[C@H]1CCCN(Cc2ccccc2O)CC1 840975010 RYGVJURURYRLMA-HNNXBMFYSA-N 288.391 2.369 10 20 CECD CCCC[C@@H](CN)NCc1cccc(OC)c1O 841028330 BEKBTBWBRYTSBB-LBPRGKRZSA-N 252.358 2.008 10 20 CECD Oc1ccc2ccncc2c1CN1CC[C@H](N2CC=CC2)C1 742162978 LLCUTDDZPCOCQH-HNNXBMFYSA-N 295.386 2.387 10 20 CECD COc1ccc(O)c(CN2CCCc3c(cnn3C)C2)c1 840954727 MXSFEMPHXHOCSK-UHFFFAOYSA-N 287.363 2.083 10 20 CECD CCc1cccc(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)c1O 848905470 IBKUNVIVORYZJV-ZUSKZHGZSA-N 281.421 2.296 10 20 CECD CCNC(=O)[C@H](C)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756355139 JMQLDYWDMHFPPD-ATZCPNFKSA-N 280.343 2.194 10 20 CECD Cc1cccc2c1OC[C@@H](NC(=O)c1cc(O)cs1)C2 854531863 HTOCFBMBXXWSJE-NSHDSACASA-N 289.356 2.496 10 20 CECD C[C@@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O 756735936 JHKXQDRYNJWPEL-PSASIEDQSA-N 296.317 2.084 10 20 CECD C[C@H](N[C@H](C)C(=O)N(C)C)c1cc(Cl)ccc1O 756735460 DGOVIDMLXGAOSZ-DTWKUNHWSA-N 270.760 2.173 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C)[C@@H](CO)C2)c1 857061143 KPPBDYZPACLYJW-TZMCWYRMSA-N 279.380 2.241 10 20 CECD C[C@H](NCCc1cnccn1)c1cc(F)cc(F)c1O 756787076 NXFFABMVXLXVIS-VIFPVBQESA-N 279.290 2.354 10 20 CECD Oc1cccc(Cl)c1CNCCCNc1ncccn1 751507071 RNVQNIVVAQNRNS-UHFFFAOYSA-N 292.770 2.427 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCC(F)(F)F)c1 858261597 CUUNPNJLLJHULF-UHFFFAOYSA-N 276.258 2.452 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccn(C)c2)c1 764322158 LUUXDRLOCLARMS-SNVBAGLBSA-N 274.320 2.230 10 20 CECD CCCN(CC(=O)OCC)Cc1c(O)cccc1OC 768999570 ZLVBIWLPCFISAA-UHFFFAOYSA-N 281.352 2.176 10 20 CECD CC[C@H](NCCN1CCO[C@@H](C)C1)c1ccccc1O 775501100 BRXWFASMBSCOTI-ZFWWWQNUSA-N 278.396 2.154 10 20 CECD CC1(NCc2cccc(Br)c2O)COC1 877690962 HLFQPQSERQTAJK-UHFFFAOYSA-N 272.142 2.033 10 20 CECD CC(C)[C@@H]1CCN1C(=O)/C=C/c1ccc(O)c(O)c1 779545278 RKHRNESKQAIIPM-FUEXJSSKSA-N 261.321 2.368 10 20 CECD CCN(C)c1ccc(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)cc1 773887624 GFZFLPFDHYJZJE-IKDJWVMYSA-N 294.464 2.484 10 20 CECD COc1ccc(O)c(CNCC[C@@H](O)C2CCCC2)c1 877778695 RADOWJMDCYHZTN-MRXNPFEDSA-N 279.380 2.432 10 20 CECD CN(C)c1ccc(CNC(=O)c2nccs2)cc1F 770328128 UGNMYBIFGGYMCC-UHFFFAOYSA-N 279.340 2.278 10 20 CECD CCCN(CC(=O)N(C)C)Cc1ccc(N(C)CC)cc1 773745371 BGUOVMFPWLODNH-UHFFFAOYSA-N 291.439 2.443 10 20 CECD COCC[C@@H](C)OC(=O)/C=C/c1ccc(O)c(O)c1 784287382 RAGKQEBWLNGNJB-DFVUYQKZSA-N 266.293 2.079 10 20 CECD C[C@H](N[C@H](C)c1ncnn1C)c1c(O)cccc1F 886598579 FROCYSIEXGOUDN-DTWKUNHWSA-N 264.304 2.072 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)[C@@H](O)C2)cc1Cl 897680656 UTVIYQJQEWXDMK-ZANVPECISA-N 255.745 2.167 10 20 CECD CC1(N)CCN(Cc2cc(Br)ccc2O)CC1 704598008 VWCUVSVVKBYKDB-UHFFFAOYSA-N 299.212 2.468 10 20 CECD CCOc1ccc(N2CCN(CCCOC)CC2)cc1 1209054981 PYSMKKINDJYGAY-UHFFFAOYSA-N 278.396 2.244 10 20 CECD COCCN(Cc1cc2c(cc1O)OCO2)CC(C)C 73585867 RWHKMVLOCNABGP-UHFFFAOYSA-N 281.352 2.225 10 20 CECD COc1ccc(O)c(CN(C)CC2(N(C)C)CCC2)c1 97934062 QDPGTNNMBZNCOT-UHFFFAOYSA-N 278.396 2.317 10 20 CECD COc1cccc(O)c1CN1CC[C@H]([C@H]2CCOC2)C1 769517204 ZXLJKGMAUNJUFW-STQMWFEESA-N 277.364 2.259 10 20 CECD CCOC(=O)c1cc(CN(C)c2ccc(OC)cc2)[nH]n1 1326786037 FWMZZIWHCOIOFA-UHFFFAOYSA-N 289.335 2.231 10 20 CECD Cc1n[nH]c(C)c1C[C@H](C)C(=O)NCc1ccccc1O 1333757120 WCPMVVPSJJKITN-JTQLQIEISA-N 287.363 2.227 10 20 CECD C[C@H]1CC[C@H](C(=O)O)N(Cc2ccc(N(C)C)cc2)C1 1776619909 XKDGQERLZDICRZ-SWLSCSKDSA-N 276.380 2.438 10 20 CECD C[C@H]1OCC[C@H]1C(=O)Nc1c(Cl)ccc2nonc12 1261140086 HNLALRYXWGAHCJ-RNFRBKRXSA-N 281.699 2.240 10 20 CECD Nc1ncnc2c1ncn2CCCSc1nccs1 102599331 AJOUAMXXIRWUSU-UHFFFAOYSA-N 292.393 2.047 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCC[C@@H](O)C2)c1 224866322 AVSDOPVGTILFLW-WCQYABFASA-N 265.353 2.042 10 20 CECD CCC[C@H](CCO)CNCc1cc2c(cc1O)OCO2 231383994 XODOOUREIXQZEP-LLVKDONJSA-N 281.352 2.009 10 20 CECD Nc1ccc(NC(=O)N[C@H]2CCCCC23OCCO3)cc1 841298446 POYCJOGTHPCQKC-ZDUSSCGKSA-N 291.351 2.076 10 20 CECD CN1CCC[C@@H](CCNCc2cc(F)cc(F)c2O)C1 883145191 RGNUOSABPVTUHQ-NSHDSACASA-N 284.350 2.492 10 20 CECD O=C(O)[C@@H](NCc1cc(F)ccc1O)c1ccccc1 236451917 JBRAVLCXRCZFKY-AWEZNQCLSA-N 275.279 2.447 10 20 CECD COc1ccc(O)c(CNCCc2ccncc2)c1 48261627 JRUAVZPVRUOZIU-UHFFFAOYSA-N 258.321 2.128 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cnns2)c1 400234878 AGHQHDQAGCTJCF-QMMMGPOBSA-N 265.338 2.103 10 20 CECD CCC[C@](C)(O)CNCc1cccc(OC)c1O 226250416 XCHHCNJWWQFMRL-AWEZNQCLSA-N 253.342 2.042 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](C)OCC2CC2)c1 103529207 ULFIBONWWZTXDV-MNOVXSKESA-N 293.363 2.393 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC1CCOCC1 117148609 DPRABIDGXJKITJ-UHFFFAOYSA-N 290.407 2.494 10 20 CECD COc1cccc(CNC(=O)c2scnc2C)c1O 68489091 VRJXPXLFCCZDPE-UHFFFAOYSA-N 278.333 2.096 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1cc(Cl)cc(OC)c1O 184677135 ICSANPPJAMARJO-NSHDSACASA-N 299.754 2.192 10 20 CECD CC(=O)N1CC[C@H](CN(C)Cc2cccc(C)c2O)C1 180783942 NMFYZLLIONZPPV-CQSZACIVSA-N 276.380 2.001 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2CCCCO2)cc1 183795517 WJOAODNQMAHPSQ-HNNXBMFYSA-N 293.363 2.244 10 20 CECD Cc1nc(C)c(C(=O)NCCc2ccc(O)c(O)c2)s1 156668818 LUFIIKWQCCTMKR-UHFFFAOYSA-N 292.360 2.144 10 20 CECD COCCC(C)(C)C(=O)N(C)Cc1ccccc1O 183909640 KHZUMFIMBHTHHS-UHFFFAOYSA-N 265.353 2.413 10 20 CECD C[C@H](CNc1ccccc1)NC(=O)c1cccc(O)c1O 193132322 KJBQTUIBXXBUPQ-LLVKDONJSA-N 286.331 2.328 10 20 CECD CCCN(Cc1ccccc1O)C(=O)/C=C/CN(C)C 265895622 MTEPVKQDOAKERM-JXMROGBWSA-N 276.380 2.249 10 20 CECD CN(C)c1ccc(CNC(=O)NC2CCC2)cc1F 264447837 OCJFEAUXGRHGOV-UHFFFAOYSA-N 265.332 2.243 10 20 CECD CC[C@H]1CO[C@H](C)CN1C(=O)c1ccc(C)c(O)c1O 272751952 OKXXILFZTPUCTP-MNOVXSKESA-N 279.336 2.046 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H](C)CN(C)C)c1 293651317 LHVCMJMHDKWDNB-VXGBXAGGSA-N 294.395 2.027 10 20 CECD CN(C)c1ccc(CNc2c([N+](=O)[O-])ncn2C)cc1F 299303135 CKNNTUKONFYSOE-UHFFFAOYSA-N 293.302 2.146 10 20 CECD Oc1cccc2c1[C@H](NCCc1nnc3ccccn13)CC2 390126105 GHRAQHYKIQDONU-CYBMUJFWSA-N 294.358 2.255 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCS(C)(=O)=O)c1O 808683847 KIVAYRQNJWQWBU-VIFPVBQESA-N 291.800 2.049 10 20 CECD CCN[C@H](C)CN[C@@H](C)c1cc(F)cc(F)c1O 817974097 YJVNMXSONDIMNH-BDAKNGLRSA-N 258.312 2.319 10 20 CECD Cc1cc([C@@H](C)NC[C@H](N)c2ccc(N(C)C)cc2)no1 817944315 ZCLSPZQGXWHMER-DOMZBBRYSA-N 288.395 2.400 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)OCCCF 496291673 IXCXBYRSANKBNN-UHFFFAOYSA-N 282.315 2.448 10 20 CECD Cc1cc(O)c(CNC[C@H](O)C2CCOCC2)cc1Cl 825287726 LURQVHMVWBZIPH-HNNXBMFYSA-N 299.798 2.231 10 20 CECD O=C(NCCCSc1nccs1)c1cccnc1O 733973132 VFYXNOOCKIZOCY-UHFFFAOYSA-N 295.389 2.156 10 20 CECD CC[C@H](NC(=O)NCc1ccc(N(C)C)cc1C)[C@@H](C)O 838480644 ZIRKTMGOMCZYKR-DOMZBBRYSA-N 293.411 2.020 10 20 CECD C/C=C/C[C@H](NC(=O)c1cc(O)cs1)C(=O)OCC 832228392 RCIBXRLIZQTYTL-GFAPAMAISA-N 283.349 2.081 10 20 CECD O=C(NCc1cccc([N+](=O)[O-])c1)c1cc(O)cs1 732279712 NNGVRMIGRZHRCC-UHFFFAOYSA-N 278.289 2.292 10 20 CECD COC(=O)[C@H]1C[C@H]2CC[C@H]1N(Cc1ccccc1O)C2 839172869 RLWGFJSCOWGXQC-KWCYVHTRSA-N 275.348 2.166 10 20 CECD CC[C@@]1(C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCO1 588553400 OGTCBPVGLGAJIJ-WRLNGNIRSA-N 291.347 2.139 10 20 CECD COC(=O)[C@H]1C[C@H]2CC[C@H]1N(Cc1cccc(C)c1O)C2 839173990 XTYSJTJOCAUTPQ-VHDGCEQUSA-N 289.375 2.474 10 20 CECD COc1ccc(N(CC(=O)N2CCC2)CC2CC2)cc1 831582996 MVBRVUIWPIJWCV-UHFFFAOYSA-N 274.364 2.144 10 20 CECD COc1cc2c(c(OC)c1)N(C[C@@H](C)OC)CCC2 839654949 CSJPUXWQFKICRR-LLVKDONJSA-N 265.353 2.491 10 20 CECD CCN[C@H](C)CNCc1cc(Cl)cc(OC)c1O 841066718 VFKFUFBSMFOZBB-SECBINFHSA-N 272.776 2.142 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 840892046 XKRAPBNOOYUUOR-IUCAKERBSA-N 286.322 2.234 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCCC[C@H]2F)c(O)c1O 840520369 SNGMSQSTLKEQEW-GHMZBOCLSA-N 267.300 2.417 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)[C@H]2CC=CCC2)cc1 846663983 UDCRSXGWVBCRFF-GOEBONIOSA-N 287.407 2.225 10 20 CECD CC(C)CN1CC(=O)N[C@@H]1c1cc(Cl)ccc1O 917506170 QQVOBNAZSHDRHN-ZDUSSCGKSA-N 268.744 2.132 10 20 CECD CC[C@@H](NC[C@H]1CC(=O)N(CC)C1)c1ccc(F)cc1O 846208402 JNJXOGZPONGAFF-BXUZGUMPSA-N 294.370 2.440 10 20 CECD CC[C@@H](NC[C@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 846074161 VWWYEMVHNMTFSA-IUODEOHRSA-N 288.391 2.444 10 20 CECD Cc1ccc(C(=O)Nc2cc(N(C)C)ccn2)c(O)c1O 753014327 CVDBSFPJIJJMAQ-UHFFFAOYSA-N 287.319 2.120 10 20 CECD CC1CCN(C[C@@H](C)NC(=O)Cc2ccc(N)cc2)CC1 852861325 BOXDUJJYSNAZNB-CQSZACIVSA-N 289.423 2.048 10 20 CECD Cc1ccc([C@H](C)NCCN2CCOC[C@@H]2C)c(O)c1 756533048 HOOHVXKISUMQMM-KBPBESRZSA-N 278.396 2.072 10 20 CECD Cc1c(Cl)c(C(=O)NCc2ccccc2O)nn1C 857471924 MCUDAWNRNMZWHS-UHFFFAOYSA-N 279.727 2.018 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](C(C)C)N(C)C 935946659 KSUYEHTWEFSNLD-CQSZACIVSA-N 299.411 2.080 10 20 CECD Cc1cc(O)c(CN2Cc3cnn(C)c3C2)cc1C 877633102 ZIYMVYQYBYTRNN-UHFFFAOYSA-N 257.337 2.258 10 20 CECD Cc1ccc(CN2CC[C@H](CN3CCCC3=O)C2)c(O)c1 877638726 MILPISTTWGISJC-AWEZNQCLSA-N 288.391 2.145 10 20 CECD CCO[C@@H](CC(=O)NCc1ccc(O)c(O)c1)C(C)C 778927284 OCKKVWDBKSOZSQ-AWEZNQCLSA-N 281.352 2.165 10 20 CECD CCN1C[C@H](CN[C@H](C)c2c(O)cccc2F)CC1=O 886633464 WKTZTILKWIJWIK-MNOVXSKESA-N 280.343 2.050 10 20 CECD CCNC(=O)C(C)(C)CN[C@@H](C)c1c(O)cccc1F 886578347 SQQPIQWPEGEBCP-JTQLQIEISA-N 282.359 2.344 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCC=CO2)c1O 894530741 MAZZTXCBSPAWPO-ZDUSSCGKSA-N 263.337 2.492 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@]12CCCN(CC1)C2 898280222 XOTSAXYFTYVNFT-HNNXBMFYSA-N 294.782 2.148 10 20 CECD CCOC(=O)/C(=C\c1cnc(F)c(C)c1)c1nccn1C 899350123 VAKQPJVSQMHYDH-WQLSENKSSA-N 289.310 2.366 10 20 CECD CO[C@@H]1CN(Cc2ccc3ccccc3c2O)CCO1 895962159 HRSBVAOXDWTHKX-HNNXBMFYSA-N 273.332 2.350 10 20 CECD CN1CC[C@@H]1CNCc1ccc2ccccc2c1O 896595428 RMSUNXHXVQXVOE-CQSZACIVSA-N 256.349 2.339 10 20 CECD CC[C@@]1(NCc2ccc(OC)c(OC)c2O)CCOC1 893997276 TYGBGTOYXPHXPX-OAHLLOKOSA-N 281.352 2.068 10 20 CECD CC[C@@]1(NCc2cc(F)cc(C(C)=O)c2O)CCOC1 792419785 SXSOFXITGPATLE-OAHLLOKOSA-N 281.327 2.393 10 20 CECD CC(C)[C@](C)(O)CNCc1ccc(N(C)C)cc1 304061109 PCMZTCKWRQHAAB-OAHLLOKOSA-N 250.386 2.249 10 20 CECD CCn1ccnc1Sc1ncc([N+](=O)[O-])s1 799927674 DVZICVDMNRDOHT-UHFFFAOYSA-N 256.312 2.419 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@H]2CCO)cc1 189948379 UXEKRKWETWBVGB-GOEBONIOSA-N 262.397 2.393 10 20 CECD CO[C@H]1CCCN(C(=O)Nc2ccc(N)cc2)CC1 692030329 VSMSQKUKKNCLFQ-ZDUSSCGKSA-N 263.341 2.302 10 20 CECD CC(C)(C)[C@@H](CC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1321923987 DQSNJNJBJUUEJV-GFCCVEGCSA-N 296.323 2.279 10 20 CECD CN1CCCc2cc(CNC(=O)N3CC=CC3)ccc21 1330131646 DXDYJVCDBCIHII-UHFFFAOYSA-N 271.364 2.150 10 20 CECD C[C@@H](C[S@@](C)=O)N(C)Cc1ccc(N2CCCC2)cc1 1343004212 GSJJUNXDDILDDJ-VBKZILBWSA-N 294.464 2.486 10 20 CECD Cc1ccc(O)c(CNCc2ccc(C(=O)O)[nH]2)c1 1600464477 CYXPMMFEHVHRTP-UHFFFAOYSA-N 260.293 2.017 10 20 CECD O=C(O)c1cc(CNCCCSc2nccs2)c[nH]1 1602258480 UJNLNLIRJCQPKA-UHFFFAOYSA-N 297.405 2.441 10 20 CECD COc1cc(Cl)cc(CNCCCn2cccn2)c1O 228670752 CMIHPYNRADCJQU-UHFFFAOYSA-N 295.770 2.431 10 20 CECD c1csc(SC[C@H]2C[C@@]3(CCNC3)CO2)n1 1580897029 BVTHFCXXVSNQIQ-MWLCHTKSSA-N 256.396 2.004 10 20 CECD Cc1nnsc1CN1CCOc2cc(N(C)C)ccc21 820881288 VTUDKGJHJAKDIA-UHFFFAOYSA-N 290.392 2.312 10 20 CECD COC[C@H]1CCCN(Cc2cc(OC)ccc2O)C1 180198864 SCYIPJXREOGVIC-LBPRGKRZSA-N 265.353 2.259 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCO[C@H](C)C2)c1O 61919860 QBMRYUVKNYFOQN-SNVBAGLBSA-N 281.327 2.345 10 20 CECD CN1CCCC[C@H](CNCc2cc(F)ccc2O)C1 700787819 NSHYAQPZHATIFH-GFCCVEGCSA-N 266.360 2.353 10 20 CECD CC(C)C[C@H](NCc1ccc(F)c(F)c1O)C(=O)O 703234258 PMZABNFFWMSEIB-JTQLQIEISA-N 273.279 2.259 10 20 CECD O=C1NC(=S)S/C1=C\c1cc(F)ccc1O 179171223 OYVGSDJFPJGOKG-YWEYNIOJSA-N 255.295 2.020 10 20 CECD CN(C)c1ccc(CNCc2ccc(CO)o2)cc1F 174323753 FKQPXJJGDIJYDS-UHFFFAOYSA-N 278.327 2.267 10 20 CECD CC(C)OCCCNCc1ccc(N2CCOCC2)cc1 20198337 QOGIPHLTUSOMPY-UHFFFAOYSA-N 292.423 2.428 10 20 CECD Cc1ccc(C(=O)N2CCS[C@H](C)[C@H]2C)c(O)c1O 179507730 XSMIGBGJZGJTLL-NXEZZACHSA-N 281.377 2.372 10 20 CECD Cc1ccc(C(=O)NC[C@H](CCO)CC(C)C)c(O)c1O 179545745 NHHRZYQURJDGKY-GFCCVEGCSA-N 295.379 2.181 10 20 CECD COc1ccc(O)c(CNc2ncccc2[N+](=O)[O-])c1 301299727 UGOKACYPWRJBAJ-UHFFFAOYSA-N 275.264 2.316 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)N[C@@H](C)c1cc(OC)ccc1O 170900680 HWVMGNRBQSWZHA-DUFXMDAXSA-N 279.336 2.003 10 20 CECD C[C@@H](Cn1ccnc1)NCc1cc(Cl)ccc1O 37158078 LAGIAIACILYBJX-JTQLQIEISA-N 265.744 2.420 10 20 CECD C[C@H]1CCCCN1C(=O)CN(C)c1ccc2c(c1)OCO2 121336276 ZTHLNBARMGXYNW-LBPRGKRZSA-N 290.363 2.253 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(F)cc1O)CC2 185317473 URHQJFJUSGPJAL-CABZTGNLSA-N 290.342 2.097 10 20 CECD COc1ccc(O)c(CN(C)[C@@H](C)C(=O)OC(C)C)c1 180557512 JDUHFADQGBVSNY-NSHDSACASA-N 281.352 2.173 10 20 CECD CN(C)[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)CC1 277406894 IBUVLFCVACRFQW-CYBMUJFWSA-N 292.379 2.037 10 20 CECD Cc1ccc(C(=O)N(C)CCCOC(C)C)c(O)c1O 272791732 WXCHTLNPFOHAMZ-UHFFFAOYSA-N 281.352 2.293 10 20 CECD CC[C@H](N[C@@H](C)c1nncn1C)c1ccc(F)cc1O 286375900 ZUMJPFQEUZUFHG-CABZTGNLSA-N 278.331 2.462 10 20 CECD Cc1cccc(CN2C[C@@H](C)OC3(CCOCC3)C2)c1O 280482279 ODGXSGJWSYTYRF-CQSZACIVSA-N 291.391 2.471 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C[C@@H](O)C1CC1 809751590 IZAHULCOMIQWFY-GFCCVEGCSA-N 273.735 2.387 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1C1CCCC1 819166120 MTIBDIGZBPXOOM-UHFFFAOYSA-N 274.320 2.099 10 20 CECD Cc1nc([C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)no1 811156223 JANFJLLJGFWWLV-RZAAKKIOSA-N 290.275 2.107 10 20 CECD Cc1cc(O)c(CN[C@@H](C)c2ncnn2C)cc1Cl 825671762 OMQCBMLPWNOUHI-VIFPVBQESA-N 280.759 2.333 10 20 CECD Oc1cccc2c1[C@@H](N[C@@H]1CCN(CC3CC3)C1)CC2 834575884 PHUNMUDISQIDFU-CABCVRRESA-N 272.392 2.453 10 20 CECD CCOCC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 839916535 VDLBVHUQOZIDBW-ZDUSSCGKSA-N 278.396 2.145 10 20 CECD COc1ccc(CNC(=O)c2cc(O)cs2)c(OC)c1 731868835 ZEEPKIFEBPJVDM-UHFFFAOYSA-N 293.344 2.401 10 20 CECD C[C@H]1CCC[C@H](OCC(=O)NCc2ccc(O)cc2O)C1 910955197 OQQMFPYNUYPFCH-FZMZJTMJSA-N 293.363 2.309 10 20 CECD Cc1ncsc1CCC(=O)NCc1ccc(O)cc1O 910945010 SDSVPNMJLUTXDP-UHFFFAOYSA-N 292.360 2.112 10 20 CECD Cc1cnn(CCC(=O)NCc2cc(Cl)ccc2O)c1 846473165 PYEUMTCDTCSHON-UHFFFAOYSA-N 293.754 2.257 10 20 CECD NCC[C@@H](NCc1cccc(Cl)c1O)C(F)F 841072898 CHVIBKFYCOOXMT-SECBINFHSA-N 264.703 2.118 10 20 CECD CS[C@H](C)C(=O)NCc1cc(Cl)ccc1O 846472704 LVKWWKLDCKHCJB-SSDOTTSWSA-N 259.758 2.413 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@H]2CCNC2)c1O 843351541 NYOHDZBFIJJKCU-LBPRGKRZSA-N 282.771 2.042 10 20 CECD Cc1ccc([C@@H](C)N[C@H](CO)CCF)c(O)c1C 846209333 QJEANJRWWPHIRQ-NEPJUHHUSA-N 255.333 2.380 10 20 CECD CN(CCC(=O)OC(C)(C)C)C(=O)c1cc(O)cs1 759098936 MFMYUYGWWSHTQA-UHFFFAOYSA-N 285.365 2.258 10 20 CECD C[C@H](CCO)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756584994 IDVFHWQYDWHGLW-KKZNHRDASA-N 253.317 2.440 10 20 CECD Cc1ccc(C(=O)NCCCOC(C)(C)C)c(O)c1O 855706034 ZTWBVSYXLDUWDL-UHFFFAOYSA-N 281.352 2.341 10 20 CECD CC(=O)N1CC[C@@H](N[C@@H](C)c2c(C)cc(C)cc2O)C1 857084596 XLNYOVBQVSUBDL-GXTWGEPZSA-N 276.380 2.280 10 20 CECD O=C(Cc1ccc(O)c(F)c1)NCc1ccccc1O 857471915 LUMAUGGCBBVMAA-UHFFFAOYSA-N 275.279 2.096 10 20 CECD Cc1ccc(O)c(CNC(=O)COC2(C)CCC2)c1 862757815 FAVDQBVVFRCQQJ-UHFFFAOYSA-N 263.337 2.276 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)[C@H](C)C2)c1 764265801 SZMKQPQFEVJREU-GHMZBOCLSA-N 291.347 2.022 10 20 CECD CCCN(CC(=O)OC)Cc1c(C)cccc1O 876512662 VPQOKZOXFDEYRT-UHFFFAOYSA-N 251.326 2.086 10 20 CECD COc1ccc(N(C)CCCn2ccnc2)cc1OC 775948186 HRIKVAAUAHEUEQ-UHFFFAOYSA-N 275.352 2.427 10 20 CECD Cc1ccc(CN[C@H](C(=O)N2CCCC2)C(C)C)c(O)c1 877046780 SYDTXHWIUMBQKJ-INIZCTEOSA-N 290.407 2.437 10 20 CECD CCCOc1ccc(CNC2(CO)CCOCC2)cc1C 873051564 CYDKRTZYDCPHQB-UHFFFAOYSA-N 293.407 2.415 10 20 CECD CCc1nn(C)cc1/C=C1\SC(=S)N(CC)C1=O 770568760 MTDXIBRZRDPUAT-POHAHGRESA-N 281.406 2.204 10 20 CECD Cc1cccc(O)c1CN1CCC(O[C@H]2CCOC2)CC1 876782389 PWHZJVMPAXPKBV-HNNXBMFYSA-N 291.391 2.471 10 20 CECD COc1ccc(CN[C@H](C)[C@H]2CCN(C(C)=O)C2)cc1C 1047655611 AVYBKTVIAWWULQ-CJNGLKHVSA-N 290.407 2.350 10 20 CECD CCC(=O)N1CCCC[C@H]1C(=O)N(C)c1ccc(N)cc1 877081119 VAWAUCDSUKKABH-AWEZNQCLSA-N 289.379 2.023 10 20 CECD OCC1(NCc2ccc(N3CCCC3)cc2)CCC1 133159329 AYDRGEMOWXEYDX-UHFFFAOYSA-N 260.381 2.291 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccnc(C2CC2)c1 783589998 RVVTVLKKFROBEF-UHFFFAOYSA-N 298.342 2.343 10 20 CECD COCC1CN(Cc2c(O)ccc(Cl)c2F)C1 895970385 VEYNTNHTUBIHFA-UHFFFAOYSA-N 259.708 2.263 10 20 CECD CCOCCCN(C)c1ccc(OCC(=O)OC)cc1 784563016 CUEDOTTVBSYCON-UHFFFAOYSA-N 281.352 2.101 10 20 CECD OCCN(Cc1cc(Cl)ccc1O)C1CCC1 784672814 OZZNDSMIKBZSJW-UHFFFAOYSA-N 255.745 2.392 10 20 CECD FC[C@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 895575932 WEDRBWMNRKJBQZ-CQSZACIVSA-N 296.361 2.454 10 20 CECD CC1(CNCc2ccc(N3CCSCC3)cc2)COC1 796267788 YTZYNVVACFMYAE-UHFFFAOYSA-N 292.448 2.366 10 20 CECD C[C@@H](O)CN[C@H](C)c1cccc(C(F)(F)F)c1O 798179741 LXWQBQVEYSHASD-HTQZYQBOSA-N 263.259 2.442 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1Cc2ccc(F)cc21 793688419 GIUUUVWIAZRMTE-CYBMUJFWSA-N 287.290 2.193 10 20 CECD CN(C)c1cc(F)c(CN[C@@]2(C)CCOC2)cc1F 1331270254 DLXBCBIVCVJVBY-AWEZNQCLSA-N 270.323 2.299 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H](C)C(=O)N(C)C 218320714 GVCYOPSCDPAFQH-IJLUTSLNSA-N 276.380 2.315 10 20 CECD Cc1ccc(CNc2cccc(-c3nn[nH]n3)c2)c(O)c1 1605856825 YWOBCHCNSIRMQE-UHFFFAOYSA-N 281.319 2.493 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C[S@@](C)=O)cc1 168215896 GLUYKHMCAPUWFL-DJJJIMSYSA-N 282.453 2.389 10 20 CECD CC1(O)CCC(NC(=O)Nc2ccc(N)cc2)CC1 926142733 LOFFOTRGFYJUDY-UHFFFAOYSA-N 263.341 2.084 10 20 CECD COc1ccc(N(C)Cc2nnc3n2CCCC3)cc1 844355115 LCULARAVUCQKHB-UHFFFAOYSA-N 272.352 2.259 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCO[C@H]2C)c1 300589625 DSJQRQIBLJABMN-SDDRHHMPSA-N 265.353 2.476 10 20 CECD NC[C@@H]1CN(Cc2ccccc2O)CC[C@H]1C(F)(F)F 704353293 YFWLSSSFQXNQQY-VXGBXAGGSA-N 288.313 2.351 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)[C@H](C)CO1 708423565 STFRECNRUKHWBE-BDAKNGLRSA-N 257.280 2.280 10 20 CECD CCc1cccc(CN[C@H](C)C(=O)NC(C)(C)C)c1O 691468304 UNMVLOVPJMIHIT-LLVKDONJSA-N 278.396 2.347 10 20 CECD CS[C@@H](CO)[C@@H](C)NCc1c(O)cccc1Cl 152451314 CIAMCBCNGCWLQU-PELKAZGASA-N 275.801 2.248 10 20 CECD Oc1ccc(F)cc1CN1CC[C@@H]([C@@H]2CCOC2)C1 361050586 HRSKWOYHYXLUSD-VXGBXAGGSA-N 265.328 2.390 10 20 CECD COCCN1CCC(N[C@@H](C)c2cc(F)ccc2O)CC1 185145268 QUZCRKYCZXXKGQ-LBPRGKRZSA-N 296.386 2.293 10 20 CECD COc1ccc(O)c(C(=O)N(C)Cc2ccccc2O)c1 80133574 CQSQDNHNHKKWAQ-UHFFFAOYSA-N 287.315 2.379 10 20 CECD CSC1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 194682478 UCWFHWPPFVKJKG-HWKANZROSA-N 279.361 2.123 10 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C[S@](=O)[C@H]1CCC[C@@H](NCc2cc(F)ccc2O)C1 826910299 DWOUTBXIHRIADO-NQCMUKECSA-N 285.384 2.311 10 20 CECD CC[C@H]1NCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1C 829764062 FJQNKNOTAYJFGB-JKSUJKDBSA-N 289.423 2.065 10 20 CECD CCCOC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 908460457 ULEIIKINFJDFAQ-HNNXBMFYSA-N 293.411 2.492 10 20 CECD Cc1cc(O)c(CNCCN2CCCOCC2)cc1Cl 825927499 DGXFCFVEJSCDLM-UHFFFAOYSA-N 298.814 2.166 10 20 CECD COc1cc(O)c(CN[C@H](C)[C@@H](OC)C2CC2)cc1OC 825099087 UKZKLCOWMGNQOW-QLJPJBMISA-N 295.379 2.313 10 20 CECD Oc1ccc(Cl)cc1CN1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 824837469 HOIZTHGRLXXWSC-QHSBEEBCSA-N 277.751 2.431 10 20 CECD CC[C@@H]1CCCCN1CCNC(=O)c1cc(O)cs1 733365952 VMTODOOJRYJBHP-LLVKDONJSA-N 282.409 2.448 10 20 CECD C[C@H](CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)C1CC1 832281590 UNXOVSDFYAYCNB-MLGOLLRUSA-N 289.423 2.305 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H](N)C1CC1 841965789 KGHYOMMSTYNWSZ-CQSZACIVSA-N 291.395 2.051 10 20 CECD Cc1cccc(CNCCC(C)(C)S(C)(=O)=O)c1O 840960771 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COC(=O)CCCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776268639 FALWOVAVISRBTA-LBPRGKRZSA-N 292.379 2.273 10 20 CECD COc1cccc(CNC[C@@H]2CCC[C@H]2OC)c1O 774831726 YAGORTNXCFWRGP-WCQYABFASA-N 265.353 2.306 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H]3CNC[C@@H]3C2)cc1F 770395465 RJJYZYDBFUNZMT-GASCZTMLSA-N 291.414 2.323 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCO[C@H](C)C1 776326163 YZAXVVNTVAHNIN-KGLIPLIRSA-N 290.407 2.492 10 20 CECD Cc1nn(C)c(C)c1[C@@H](C)C(=O)N(C)c1ccc(N)cc1 877077615 OUHVDNIIVXELDG-SNVBAGLBSA-N 286.379 2.386 10 20 CECD CC(C)N(CCO)Cc1cc(Cl)cc(F)c1O 775643208 OPEGQFJODMGHFT-UHFFFAOYSA-N 261.724 2.387 10 20 CECD CC(C)c1cc(C(=O)O)c2c(N)c(C(=O)O)sc2n1 409441319 OPXSEFUFMTUCAV-UHFFFAOYSA-N 280.305 2.398 10 20 CECD COCCc1nsc(NCc2ccc(OC)cc2O)n1 795284164 JBXQDCIKRPHPHH-UHFFFAOYSA-N 295.364 2.053 10 20 CECD CCc1cccc(CNCCOCC(F)F)c1O 709423557 NVELWMXQAZTHHF-UHFFFAOYSA-N 259.296 2.326 10 20 CECD C[C@H](CO)N[C@H](C)c1cccc(C(F)(F)F)c1O 798180256 CUPZYONWPRCIMY-HTQZYQBOSA-N 263.259 2.442 10 20 CECD Cc1[nH]ncc1C(=O)N(C)Cc1ccc(N(C)C)cc1 63689987 UXMRCPXUBFLLAW-UHFFFAOYSA-N 272.352 2.056 10 20 CECD COc1ccc(O)c(CN[C@@H]2C[C@H](C)O[C@H](C)C2)c1 724624241 CKNANUCSQRQEMG-PJXYFTJBSA-N 265.353 2.446 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H](OC)C1 768755169 VXQBCIQCPUVDPV-LLVKDONJSA-N 251.326 2.012 10 20 CECD COc1cccc(O)c1CN1CCO[C@H](C(F)(F)F)C1 769467001 QEEUBBDJDKYDME-LBPRGKRZSA-N 291.269 2.164 10 20 CECD CC(=O)NCCC1=CCN(c2ccccc2[N+](=O)[O-])CC1 1089802814 YIPKDWIHOPJFLR-UHFFFAOYSA-N 289.335 2.258 10 20 CECD CN1CCN(c2ccc(CNC3(C)CC3)cc2F)CC1 1318938086 AMMIPQQGLYKOBD-UHFFFAOYSA-N 277.387 2.220 10 20 CECD COc1ccc(N(C)CCN(C)Cc2cc(C)[nH]n2)cc1 1326526336 BKGWIUAFJLMUJJ-UHFFFAOYSA-N 288.395 2.295 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccccc1O 101645572 QNIIWFINIHFCEE-UHFFFAOYSA-N 271.316 2.299 10 20 CECD C[C@@H]1CCCC[C@@H]1OCC(=O)NCc1cccc(O)c1O 1348045652 FTEFQOPQPYYPGV-RISCZKNCSA-N 293.363 2.309 10 20 CECD C[C@H](N[C@H]1CC[C@@H](CO)CC1)c1cc(C(=O)O)ccc1O 1593360032 NFSGCSHCDGELQE-GMXVVIOVSA-N 293.363 2.292 10 20 CECD C[C@H](NC[C@@H]1CCC[C@@H](O)C1)c1cc(C(=O)O)ccc1O 1593252113 NZPLQNGLOVSVJT-DMDPSCGWSA-N 293.363 2.292 10 20 CECD CN(C)c1ccc(OCc2cncs2)cc1C(=O)O 1598330257 PVJSSGWLMFBCQH-UHFFFAOYSA-N 278.333 2.486 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@H]3[C@@H]2C(=O)O)c1 300001704 QMBSZTUGPQVNNS-NJZAAPMLSA-N 275.348 2.386 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@@H]1CCCOC1 708557841 CHIWZAOVUOUDMS-VIFPVBQESA-N 257.280 2.187 10 20 CECD COC(=O)N(C)CCN[C@H](C)c1cc(C)ccc1O 689583656 DFMOKKMMUIRLGL-LLVKDONJSA-N 266.341 2.049 10 20 CECD C[C@@H]1SCC[C@H]1NC(=O)Nc1ccc(N)cc1 383932236 CBTSKUIBNQHGTR-GZMMTYOYSA-N 251.355 2.284 10 20 CECD Cc1cc(CNCc2ccc3c(c2)CCCN3C)n[nH]1 716465254 WRESGTRJKOIQTI-UHFFFAOYSA-N 270.380 2.390 10 20 CECD OC[C@@H](NCc1cc(F)ccc1O)C1CCCC1 386259053 MHHOOVYGCRBVBK-CYBMUJFWSA-N 253.317 2.172 10 20 CECD Cc1cc(O)c(CN2CCS(=O)(=O)CC2)cc1C(C)C 103265434 XGARHGDVHLQPRI-UHFFFAOYSA-N 297.420 2.054 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H]2C(=O)NC2CC2)cc1C 52086459 GJCNYLFJDXTQSP-OAHLLOKOSA-N 288.391 2.252 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cncs1 189653864 DQTITIWBAMDJSI-UHFFFAOYSA-N 289.404 2.410 10 20 CECD CCC[C@H](O)CNC(=O)NCc1ccc(N(C)C)cc1C 304231763 NVEXKJOKCCXTQQ-HNNXBMFYSA-N 293.411 2.021 10 20 CECD CCN(CC)C(=O)[C@@H](C)N[C@H](C)c1cc(OC)ccc1O 37126598 FREOPVUQABEYJX-VXGBXAGGSA-N 294.395 2.308 10 20 CECD C[C@H](N[C@@H]1CCc2[nH]ncc2C1)c1ccccc1O 183618715 VPSKQOYSNMYJQB-CMPLNLGQSA-N 257.337 2.323 10 20 CECD CC(C)[C@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CCO1 279778169 HDFMFNKDXKKDHA-GXFFZTMASA-N 279.336 2.031 10 20 CECD Cc1nc(C(=O)NCc2c(O)ccc3c2CCCC3)c[nH]1 75160103 ZPBGSAIREQMLNZ-UHFFFAOYSA-N 285.347 2.233 10 20 CECD CCn1cc(C(=O)NCc2ccc3c(c2)CCCN3C)cn1 74536821 VACKKWCXCAJVPM-UHFFFAOYSA-N 298.390 2.215 10 20 CECD OCCc1ccc(NCc2cc3c(cc2O)OCO3)cc1 42880380 LNFVMUZKASRLKC-UHFFFAOYSA-N 287.315 2.268 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)NCC(C)C)c1 135727350 SPCHUVYPIXIMSN-RYUDHWBXSA-N 294.395 2.212 10 20 CECD Cc1nc(C(C)(C)NCc2cc([N+](=O)[O-])ccc2O)no1 264252434 AKZAKTBRORLSSK-UHFFFAOYSA-N 292.295 2.017 10 20 CECD COc1cc(Cl)cc(CN(CCO)C2CCC2)c1O 275945409 IQZBAJDGVZLTPC-UHFFFAOYSA-N 285.771 2.401 10 20 CECD Cc1ccc(C(=O)NCC2(N(C)C)CCCC2)c(O)c1O 272532765 ATQCHSVPFVDJPN-UHFFFAOYSA-N 292.379 2.010 10 20 CECD Cc1ccc(O)c(CN2C[C@@H](C)O[C@@]3(CCOC3)C2)c1 280357245 UCGLWXMXWQMMNH-CJNGLKHVSA-N 277.364 2.080 10 20 CECD CCN(Cc1noc(CCOC)n1)c1ccc(OC)cc1 289359370 MQERBFKIKVVMPT-UHFFFAOYSA-N 291.351 2.294 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H](F)C(F)(F)F)cc1F 290106511 IGZGMZHXURDRFN-SNVBAGLBSA-N 296.239 2.408 10 20 CECD CC(C)n1cc(CN(C)c2ccc3c(c2)OCO3)nn1 290560518 ZQIGLADRAYYUAH-UHFFFAOYSA-N 274.324 2.224 10 20 CECD Cc1cc(Br)c(O)c(CN(C)[C@H](C)CO)c1 809745224 GQMLHIDXECCHJO-SECBINFHSA-N 288.185 2.276 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CSC1CC1 295846929 XFKNTAXFOCAMNH-VIFPVBQESA-N 281.377 2.041 10 20 CECD Cc1cc(C)c([C@H](C)NCC(=O)NCC2CC2)c(O)c1 294381249 RLPZDNMCHOCKBA-LBPRGKRZSA-N 276.380 2.186 10 20 CECD CC[C@@H](N[C@H]1CCNC1)c1cccc(Cl)c1O 817945339 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286.331 2.235 10 20 CECD Cc1ccc(C(C)(C)NC(=O)c2cccc(O)c2O)cn1 846655971 VEZRUBFNABCULK-UHFFFAOYSA-N 286.331 2.466 10 20 CECD Cc1n[nH]c(C)c1[C@H](C)NC(=O)c1cc(O)cs1 910070018 FSVCNTDYPRYOGQ-LURJTMIESA-N 265.338 2.285 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)C[C@H](C)N)c1 843129235 OEEQVDNNUHVJCN-WDEREUQCSA-N 252.358 2.006 10 20 CECD CCN(CC(=O)N(C)CC1CC1)c1ccc(OC)cc1 746109143 KMHQBZBGVZWNIM-UHFFFAOYSA-N 276.380 2.390 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCO[C@H](CF)C1 840955713 YJVXTIRDAHNGFP-OAHLLOKOSA-N 266.360 2.231 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H]2C[C@@H](N)C2)cc1 844167098 OXFGNSAVCBWMOI-GASCZTMLSA-N 289.423 2.229 10 20 CECD COCC[C@@H](C)CNCc1ccc([N+](=O)[O-])c(OC)c1O 840955662 UFTVUDLUOUQJDQ-SNVBAGLBSA-N 298.339 2.071 10 20 CECD CC[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841040306 NZGHHXKUAGMAGS-LBPRGKRZSA-N 289.379 2.246 10 20 CECD C[C@H]1COC[C@@H]1NCc1ccc(N2CCSCC2)cc1 924709596 YNKPMBLOIQCVTI-BBRMVZONSA-N 292.448 2.364 10 20 CECD COCCC(=O)Nc1c(-c2ccccn2)nc2ccccn12 751305060 APCCSXBIXDDFPG-UHFFFAOYSA-N 296.330 2.371 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1cc(C)ccc1O 756731954 DTKNRUWXINVLMI-OLZOCXBDSA-N 267.369 2.403 10 20 CECD COC1(CNC(=O)NCc2cc(C)ccc2O)CCCC1 858495296 ZYUACAZJXWTWKG-UHFFFAOYSA-N 292.379 2.459 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C(C)(F)F 935945727 IPWPBDSJVGWYLK-UHFFFAOYSA-N 264.268 2.149 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]21 934945316 ZFKSAYXTVLZBAW-RJTWHSRJSA-N 273.332 2.006 10 20 CECD CCn1cc(CNC(=O)N[C@H](C)c2ccccc2O)cn1 868602888 AWVPMJXSBVLCOL-LLVKDONJSA-N 288.351 2.169 10 20 CECD C[C@@H](O)CN(Cc1cc(F)c(N(C)C)cc1F)C1CC1 862407234 VWYLBERGVXHGKN-SNVBAGLBSA-N 284.350 2.376 10 20 CECD CCN1CCN(Cc2cc(F)c(N(C)C)cc2F)CC1 862211549 JRPCZUAZUCXGJY-UHFFFAOYSA-N 283.366 2.168 10 20 CECD Cc1cccc(O)c1CN1CCC2(CC1)OCCCO2 877551692 JYNVZMXYPCPQQK-UHFFFAOYSA-N 277.364 2.430 10 20 CECD Cc1cccc(O)c1CNCCc1cn2c(n1)SCC2 877395554 ZNMJFEBDBDASEM-UHFFFAOYSA-N 289.404 2.335 10 20 CECD CCOC(=O)CN(Cc1c(C)cccc1O)C1CC1 876608616 BYRBMIAAABGCCG-UHFFFAOYSA-N 263.337 2.228 10 20 CECD COC(=O)[C@H](NCc1ccc2c(c1)CCO2)c1cccnc1 771898864 VRUBKUIBBWLHJA-MRXNPFEDSA-N 298.342 2.020 10 20 CECD C[C@@H](NC(=O)[C@H]1CNCc2ccccc21)c1ccccc1O 870988279 LEGXVUSLORCYRP-WBMJQRKESA-N 296.370 2.456 10 20 CECD CCOc1ccc(N2CCN(C(=O)c3ccc[nH]3)CC2)cc1 1116348283 TVKCZRGIHZDTFC-UHFFFAOYSA-N 299.374 2.376 10 20 CECD C[C@@H](Nc1nccc(CO)n1)c1ccc(N(C)C)cc1 772299056 VUVYPICVWLJAGX-LLVKDONJSA-N 272.352 2.208 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1c(O)cccc1F 886549506 IYSHNLZKNTXOHG-QWRGUYRKSA-N 271.332 2.233 10 20 CECD Cc1cc(C(=O)OC[C@H](C)O)c(C)n1-c1ccccn1 787605425 CGODVFKWQRRGHQ-NSHDSACASA-N 274.320 2.027 10 20 CECD COc1ccc(O)c(CN2CCn3nc(C4CC4)cc3C2)c1 896939947 PSDMIMCICYNKCU-UHFFFAOYSA-N 299.374 2.491 10 20 CECD CCCOc1ccc(CNC[C@@H]2COCO2)cc1C 894891169 ZSYFIBUMCPWGJN-CQSZACIVSA-N 265.353 2.246 10 20 CECD Cc1noc(CCCN(C)Cc2ccccc2O)n1 268686355 PWIATXOOIHEVQL-UHFFFAOYSA-N 261.325 2.148 10 20 CECD Cc1nc([C@H]2CCN(Cc3cc(F)cc(F)c3O)C2)n[nH]1 895013232 YUUNRFZGDVGGCU-VIFPVBQESA-N 294.305 2.086 10 20 CECD CCCCOC(=O)CN(C)Cc1ccccc1O 269663241 USTIHBOSKZZOGX-UHFFFAOYSA-N 251.326 2.167 10 20 CECD CC[C@H](N[C@@H]1CCCN(C)C1=O)c1ccc(C)cc1O 794800020 BFEMEYPHCDPTPZ-UONOGXRCSA-N 276.380 2.362 10 20 CECD CN(Cc1ncc[nH]1)Cc1cccc(Cl)c1O 798182202 CHSGDMHHZLPOLP-UHFFFAOYSA-N 251.717 2.401 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H]3C[C@@]3(CO)C2)c1O 782624077 IYPIZGZGDFTJOX-ABAIWWIYSA-N 295.766 2.062 10 20 CECD C[C@@H](CCC(=O)O)CNCc1ccc(N(C)C)cc1 1321113643 MSKQYAFICGKDPD-LBPRGKRZSA-N 264.369 2.343 10 20 CECD CCOc1cccc(CN(C)CCCN(C)C)c1O 211451023 NKRATZVUUQBVCN-UHFFFAOYSA-N 266.385 2.174 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C(=O)O)[C@H]2C)cc1C 1610475665 HXOWKLBLBGJSLA-YPMHNXCESA-N 263.337 2.304 10 20 CECD O=C(O)c1cnc(SCCCn2ccnc2)s1 1610863215 TYASJRHKYXWLEN-UHFFFAOYSA-N 269.351 2.220 10 20 CECD COc1cccc(CN[C@H]2CCCC[C@H]2C(=O)O)c1O 1610357523 IZKPDJLLZCFLRH-NEPJUHHUSA-N 279.336 2.134 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCCC2)c(O)c1 228089862 BONFXMPBQNHEOW-OLZOCXBDSA-N 276.380 2.362 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCC[C@H]2N)c1 1579230289 DLKNCTRPRPKJMR-SCDSUCTJSA-N 292.379 2.096 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2ccn(C)n2)c1 230898148 KEXYDCDAUNAOLL-LLVKDONJSA-N 275.352 2.028 10 20 CECD COc1ccc(CNc2ccc(C(=O)O)c(C)n2)c(O)c1 1599573705 JCWZZEUNXKPMAP-UHFFFAOYSA-N 288.303 2.415 10 20 CECD Nc1ccc(NC(=O)N2CCOC3(CCCC3)C2)cc1 841298158 MVOJFZUYCVNXER-UHFFFAOYSA-N 275.352 2.446 10 20 CECD Nc1ccc(CCNC(=O)NC2CCSCC2)cc1 841774010 QIUSUZSKJVVRNU-UHFFFAOYSA-N 279.409 2.006 10 20 CECD CC1(C)[C@H](O)C[C@H]1NCc1ccc2c(c1)CCCO2 922017130 LOLIRIHJLIELMU-HUUCEWRRSA-N 261.365 2.261 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1cc(F)ccc1F 36961382 RHFULCAVZFCBRM-UHFFFAOYSA-N 285.271 2.471 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1c(O)cccc1Cl 83551981 DKPHZZXMCVVOBC-SNVBAGLBSA-N 284.787 2.440 10 20 CECD C[C@H](CNCc1cc(F)cc(F)c1O)N(C)C1CC1 708504844 VICMINQSHWEHMD-SECBINFHSA-N 270.323 2.243 10 20 CECD Oc1ccc(Cl)cc1CNCC1=CCCOC1 379736076 LXXQKJOIRMVESF-UHFFFAOYSA-N 253.729 2.482 10 20 CECD CC(C)OCC(C)(C)NCc1cc2c(cc1O)OCO2 396483119 MTTIYDSWLCUGPT-UHFFFAOYSA-N 281.352 2.414 10 20 CECD Cc1ccc(O)c(CNC(C)(C)CCS(C)(=O)=O)c1 174640982 PDEKCLQDQCQOBD-UHFFFAOYSA-N 285.409 2.004 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2nc[nH]n2)cc1 26259538 KZQGZOASUVVQPQ-UHFFFAOYSA-N 281.319 2.465 10 20 CECD C[C@H](CC(=O)NCc1cccc(O)c1O)c1ccncc1 1349079208 MBRROQHZZJJFEH-LLVKDONJSA-N 286.331 2.303 10 20 CECD CC(C)(C)C[C@@H](O)CNC(=O)/C=C/c1ccc(O)c(O)c1 181097546 GZYGCCCVGBFQQW-HOSRBBHYSA-N 293.363 2.024 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1ccc(N(C)C)c(F)c1 75943822 DTXIDKQVFIDHFE-HNNXBMFYSA-N 279.359 2.122 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H](C)c1ccccc1O 183523647 UPOCURAGKFBPOV-GIPNMCIBSA-N 255.383 2.155 10 20 CECD COCc1ccc(/C=C2/SC(=S)N(C)C2=O)o1 130277622 YOFPCISVWOMDSU-WEVVVXLNSA-N 269.347 2.257 10 20 CECD COc1cc(O)c(CNCC=C(C)C)cc1OC 191614962 JNJRMRGVVPTLCW-UHFFFAOYSA-N 251.326 2.465 10 20 CECD Cc1cnc2c(c1)N(C(=O)/C=C\c1cccnc1)CCO2 255345040 KNWJPQPSWJZZSJ-PLNGDYQASA-N 281.315 2.224 10 20 CECD C[C@H](NCCc1ccnn1C)c1ccc(N(C)C)cc1 184018543 YMBIWUVRVSAOCD-ZDUSSCGKSA-N 272.396 2.379 10 20 CECD CCOc1cccc(CN(C)CCOCCCOC)c1O 272366772 ONWLMKSBTOBSGT-UHFFFAOYSA-N 297.395 2.276 10 20 CECD CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@@H](C)S1(=O)=O 289966760 YUYJVHRIPCQRHV-TZMCWYRMSA-N 297.420 2.098 10 20 CECD COCCN1CC[C@@H](N[C@H](C)c2c(C)cc(C)cc2O)C1 284206266 SLLXVSRWVLYHJM-HUUCEWRRSA-N 292.423 2.380 10 20 CECD CC(=O)C(=O)COC(=O)Cc1c(Cl)cccc1Cl 808488551 XCXILUYWWQOTAA-UHFFFAOYSA-N 289.114 2.237 10 20 CECD COc1cc(N(C)Cc2cnns2)cc(OC)c1OC 294964393 LFOSANYXINGSQA-UHFFFAOYSA-N 295.364 2.200 10 20 CECD CCCN1CCC[C@H]1CNC(=O)c1ccc(C)c(O)c1O 804777719 FBPSWVRPQZIJIS-LBPRGKRZSA-N 292.379 2.010 10 20 CECD CCOC(=O)N1CC[C@H](N[C@@H]2CCc3cccc(O)c32)C1 296307945 DXIZCHZQJLHJFG-QWHCGFSZSA-N 290.363 2.200 10 20 CECD C[C@H](CN)N[C@H](C)c1ccc(Br)cc1O 817966422 NLPVHLNKXCOHLC-HTQZYQBOSA-N 273.174 2.153 10 20 CECD COc1cccc(CNC(=O)C[C@H](C)C2CC2)c1O 729860273 WHANVWXOBXVAAC-JTQLQIEISA-N 263.337 2.453 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)Cc2cnn(C)c2)c1 825046497 UWNSJOINJXMMIT-GFCCVEGCSA-N 289.379 2.245 10 20 CECD Cc1cc(Br)cc(CNCC2(N)CC2)c1O 904448582 BXHJQQDJGANXET-UHFFFAOYSA-N 285.185 2.044 10 20 CECD Cc1ccncc1/C=C\C(=O)N(C)c1ccc([N+](=O)[O-])nc1 493483063 NSVOIBGTJVRTJL-UTCJRWHESA-N 298.302 2.369 10 20 CECD CO[C@H]1c2ccccc2C[C@H]1NC(=O)c1cc(O)cs1 839813358 QUZXUSIJBCRNIN-OCCSQVGLSA-N 289.356 2.496 10 20 CECD C[C@@H]1C[C@H](CN(C)c2ccc(OCC(=O)O)cc2)CCO1 846279872 OWZNDATWFSDCLT-CHWSQXEVSA-N 293.363 2.401 10 20 CECD O=C(N[C@@H](CO)CC1CCCCC1)c1cccc(O)c1O 841471247 XSOUVZKJLDKCGD-GFCCVEGCSA-N 293.363 2.159 10 20 CECD C[C@H]1CCN(CCNCc2ccc(N(C)C)c(F)c2)C1 744449689 BQQHCRFBVKCPHA-ZDUSSCGKSA-N 279.403 2.323 10 20 CECD CCOCCN(C)CCN(C)c1ccc(OC)cc1 844399158 HOWYYRMVOANGLJ-UHFFFAOYSA-N 266.385 2.100 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N[C@@H]1CCSC1 845011364 DUBHRDXPPCVQNM-SNVBAGLBSA-N 286.784 2.350 10 20 CECD O=C(NCc1ccccc1O)c1cccnc1S 748345247 ASTWZVUUOBLIHN-UHFFFAOYSA-N 260.318 2.006 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@@H](C)S1 743373870 DIURSCVAGUGVHP-NXEZZACHSA-N 281.377 2.447 10 20 CECD C[C@@H](NC[C@H]1C[C@@H](O)C1)c1ccc(Cl)cc1O 858543418 IPTIWRKRCCLWPO-KKZNHRDASA-N 255.745 2.467 10 20 CECD C[C@@H]1COC[C@@H]1NCc1cc(F)c(N(C)C)cc1F 922641298 ZZWFCFBONVZIKH-RNCFNFMXSA-N 270.323 2.155 10 20 CECD COc1ccc(N2CCC(N[C@H]3CCCNC3)CC2)cc1 841041678 DTXQUDQOBMJOFW-HNNXBMFYSA-N 289.423 2.006 10 20 CECD CC(C)(C)c1nc(COC(=O)c2cccc(O)c2O)no1 758559674 FSAUELSOMQPHFM-UHFFFAOYSA-N 292.291 2.135 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCC[C@@]3(N)C2)cc1C 857226758 YWDFBBPBNKHWFB-GOEBONIOSA-N 260.381 2.322 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)COCC2CC2)c1 858588752 OGKMEKLFZPDBEM-LBPRGKRZSA-N 292.379 2.315 10 20 CECD Cc1ccncc1/C=C/C(=O)NCCc1ccc(O)c(O)c1 752597610 YJZDYNBGLQYDSR-HWKANZROSA-N 298.342 2.173 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1[C@H]2c3ccccc3C[C@H]21 860243621 RQZHFXDVUAIDBS-XOKHGSTOSA-N 295.338 2.300 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H](F)c1ccccc1 769607622 OOZYLKRAZPKDHP-HNNXBMFYSA-N 289.306 2.467 10 20 CECD CC(C)N1CC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 761577986 ISIDKKWFEFBYDX-LBPRGKRZSA-N 289.379 2.486 10 20 CECD Cc1cc(Br)cc(CN2CC(C)(O)C2)c1O 877581206 QLQUZBPFNFHLAK-UHFFFAOYSA-N 286.169 2.030 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCN(CC(F)(F)F)C1 876991110 HJTNPPLRZKIRGE-NSHDSACASA-N 288.313 2.427 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)[C@@H]1CCCOC1 780044240 MMBVBTABTYUCFO-DGCLKSJQSA-N 278.352 2.007 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCO[C@H]1C1CC1)c1ccccc1O 1122171327 JBHYMABAXIOYTB-YVLXSGLVSA-N 290.363 2.320 10 20 CECD C[C@H](NCCN(C)CC(F)F)c1c(O)cccc1F 886644724 JLOHASAZNLBVAS-VIFPVBQESA-N 276.302 2.379 10 20 CECD CCCn1cc(C(=O)NCCc2ccc(N)cc2)c(C)n1 1121810832 QAGZQGUZNZLTAG-UHFFFAOYSA-N 286.379 2.156 10 20 CECD CN(c1nnc(-c2sccc2O)n1C)[C@H]1CCSC1 1121274127 MCOMQCWYSDEOQV-QMMMGPOBSA-N 296.421 2.191 10 20 CECD CC[C@@H](C)N(C)CCNCc1ccc(OC)c(OC)c1O 892854587 VAUWKJVPVLBDLR-GFCCVEGCSA-N 296.411 2.229 10 20 CECD CCOc1ccc(CNCC[C@@H](C)N(C)C)c(O)c1 895298470 XAGMTFGDRDMQNZ-GFCCVEGCSA-N 266.385 2.221 10 20 CECD CC[C@H](N[C@H]1CCC[C@@H]1C(=O)NC)c1ccc(F)cc1O 796852614 KKKSNRBGRFQCIS-IHRRRGAJSA-N 294.370 2.487 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CO)C2CC2)cc1 734161210 NCUDLECIWMNPAI-INIZCTEOSA-N 262.397 2.393 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(C)=O)[C@H]2C)cc1C 985871089 NQKAQSJAVKYXJJ-SWLSCSKDSA-N 276.380 2.103 10 20 CECD COc1ccc(CNCCCNC(=O)C2(C)CC2)cc1C 1158542786 MNORVRHJYZQMPR-UHFFFAOYSA-N 290.407 2.400 10 20 CECD COc1ccc(CNC(=S)NCC2CCC2)c(O)c1 1322459822 JNSSKIACUKUJOL-UHFFFAOYSA-N 280.393 2.165 10 20 CECD Cc1cc(NC(=O)c2cccc(O)c2O)cc(C(=O)O)c1 1600276264 JPDXLIHSVDQQKS-UHFFFAOYSA-N 287.271 2.357 10 20 CECD Cc1onc(C2CC2)c1C(=O)NCc1cccc(O)c1O 1548791580 YUGOILOZAORACE-UHFFFAOYSA-N 288.303 2.202 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](C)[C@H](C(=O)O)C2)c1O 229118606 GDEBNMFNTZECEG-LDYMZIIASA-N 299.754 2.207 10 20 CECD CCN(CCCN(C)C)Cc1cc(OC)ccc1O 230744745 SRZRJWGRUGGAAN-UHFFFAOYSA-N 266.385 2.174 10 20 CECD CC[C@H](F)C(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1752892000 UPLQBNKNJQCIGP-JSGCOSHPSA-N 296.386 2.346 10 20 CECD O=C(O)CC[C@H]1C[C@@H](NCc2cc(F)cc(F)c2O)C1 1777641157 XQSMRRMOJCVMDC-DKTWLAJQSA-N 285.290 2.403 10 20 CECD Oc1c(F)cccc1CN1CCO[C@H]2CCC[C@@H]21 160208431 PTEMWAWBWAPTRI-STQMWFEESA-N 251.301 2.285 10 20 CECD CCc1cccc(CN2CC[C@H](OCCOC)C2)c1O 848905792 ODTVJXKDWLAEIN-HNNXBMFYSA-N 279.380 2.192 10 20 CECD Cc1cccc(O)c1CNC[C@](C)(O)C(F)(F)F 877120486 SWNRWCJEZYJUGE-NSHDSACASA-N 263.259 2.104 10 20 CECD C[C@H](N[C@H]1CCc2cccc(O)c21)c1cnn(C)c1 297704506 MOAUQPHCPXQASX-GWCFXTLKSA-N 257.337 2.464 10 20 CECD Cc1ccc([C@H](C)NCCc2ccnn2C)c(O)c1 184011868 YSCXWGHXWKTVSJ-LBPRGKRZSA-N 259.353 2.327 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 188502405 BRYGQEDPEXJTRT-STQMWFEESA-N 277.412 2.270 10 20 CECD COC[C@](C)(O)CNCc1cc(Cl)cc(Cl)c1O 69911642 CXFAZALHOUTWQX-GFCCVEGCSA-N 294.178 2.186 10 20 CECD CC[C@@]1(C(=O)NCc2ccc(N(C)C)cc2C)CCNC1 119714842 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GFOMYEDKIVRGJJ-UHFFFAOYSA-N 259.708 2.405 10 20 CECD COC[C@@H](C)CC(=O)NCc1cc(Cl)ccc1O 846477566 UYAABEYWFPGBKZ-VIFPVBQESA-N 271.744 2.334 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCNCC1(C)C 843054002 ASCSZUVMFYYVIX-UHFFFAOYSA-N 261.413 2.245 10 20 CECD COCCNCCNCc1cc(Cl)cc(Cl)c1O 841047736 IBLLJVBLPLFLNY-UHFFFAOYSA-N 293.194 2.025 10 20 CECD CCCN(Cc1ccc(N(C)C)c(F)c1)[C@H]1CCNC1 843053486 YTZQNKZKRIVNMC-AWEZNQCLSA-N 279.403 2.466 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@H]2CN2CCCC2)cc1 841300857 XLAIYGULXGXXGT-HNNXBMFYSA-N 288.395 2.361 10 20 CECD CCCN1CCC(NCCc2ccc(N)cc2)CC1 841034220 GRBAMZNYNYHLTG-UHFFFAOYSA-N 261.413 2.275 10 20 CECD COC[C@H](C)Cc1nc(Cc2ccc(N)cc2)no1 843158668 GCRWTMYYNIVBGO-SNVBAGLBSA-N 261.325 2.068 10 20 CECD Cn1cccc1CNC(=S)Nc1ccc([N+](=O)[O-])cc1 743061649 NUTOQDHYLBTMBV-UHFFFAOYSA-N 290.348 2.420 10 20 CECD COc1ccc(N(C)Cc2cnsn2)cc1OC 846783918 UILXGSAVJUGVLA-UHFFFAOYSA-N 265.338 2.192 10 20 CECD C[C@@H](Cc1cnccn1)NCc1ccc(N(C)C)cc1 742724489 SBFIBSJNQBWZTO-ZDUSSCGKSA-N 270.380 2.263 10 20 CECD CNCc1ccc(NCc2cc3c(cc2O)OCO3)cc1 841071305 NJWSONXDVFQGAR-UHFFFAOYSA-N 286.331 2.452 10 20 CECD OC[C@H](C[C@H]1CCCO1)NCc1ccc2c(c1)CCCO2 922341575 SEYRQVJKKMUDJF-JKSUJKDBSA-N 291.391 2.031 10 20 CECD CC[C@H](C(=O)NCc1cc(Cl)ccc1O)N(C)C 846475811 JYZDJQVDTDKXPH-LLVKDONJSA-N 270.760 2.002 10 20 CECD CNC[C@H](C)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 854231985 MOPWINSRVOOAAO-YWVKMMECSA-N 252.333 2.277 10 20 CECD C[C@H](c1ccccc1)[C@H](O)CNC(=O)c1cc(O)cs1 856291873 GGPNRFJQWFNZJP-ZWNOBZJWSA-N 291.372 2.348 10 20 CECD CNC(=O)Cc1ccc(-n2c(C)cc(C=O)c2C)cc1 858290224 RQYSJUCWOSBIIN-UHFFFAOYSA-N 270.332 2.195 10 20 CECD CNc1ccc(C(=O)NCc2cc(Cl)ccc2O)cn1 857548367 KRXPXWSXXVYUTE-UHFFFAOYSA-N 291.738 2.412 10 20 CECD O=C(N[C@@H]1CCC[C@H]2OCC[C@@H]12)c1cc(O)cs1 761607289 GYPXRDDAXZFKFD-HBNTYKKESA-N 267.350 2.141 10 20 CECD C[C@H](NC(=O)[C@@H]1CCCO1)c1ccc(N(C)C)cc1 772994937 AAVURCBFSBLNTC-FZMZJTMJSA-N 262.353 2.109 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCOC1)c1ccc(N(C)C)cc1 773015434 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COc1c([N+](=O)[O-])ccc(CN[C@H]2CC2(C)C)c1O 278634280 HGCRJPNAYUDBKC-JTQLQIEISA-N 266.297 2.197 10 20 CECD CC[C@H](NCCCOCCO)c1cccc(Cl)c1O 287633245 KMNRXQGGDOVUBW-ZDUSSCGKSA-N 287.787 2.485 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H](C)CO 298767488 CCPGWJNLYISPIX-SECBINFHSA-N 278.377 2.266 10 20 CECD COc1cccc(CNCc2cnc([C@H](C)O)s2)c1O 809741161 LFYGYDDCJNCRFP-VIFPVBQESA-N 294.376 2.200 10 20 CECD COC(=O)c1cnc(SCC(=O)CC2CC2)s1 295270470 JNCOVLWXRILVFT-UHFFFAOYSA-N 271.363 2.391 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC[C@H](CC)O1 819761489 RWANCBURSXDRHB-WCQYABFASA-N 298.379 2.452 10 20 CECD OCC[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)CC1 817418889 KGYCUEDWJVMRND-LBPRGKRZSA-N 293.363 2.105 10 20 CECD CO[C@@H]1COCC[C@@H]1CNCc1ccc(N(C)C)c(F)c1 824709730 SHVIXFFWFMRXIU-CZUORRHYSA-N 296.386 2.033 10 20 CECD CC[C@H](O)[C@@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 822576085 GVNYERCJOFANGA-WBMJQRKESA-N 290.407 2.092 10 20 CECD C[C@@H](NC(=O)CC1(O)CCC1)c1ccc(N(C)C)cc1 828863139 ZQGLAUSTXAJISI-GFCCVEGCSA-N 276.380 2.235 10 20 CECD O=C(O)Cc1ccc(NC(=O)c2cc(O)cs2)cc1 739878646 JQFYQPWTLTZIBH-UHFFFAOYSA-N 277.301 2.333 10 20 CECD CCC[C@H](C)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832292282 DWYKYKAALPVDGL-WFASDCNBSA-N 277.412 2.305 10 20 CECD CCOc1ccc(CN2CC(c3nc(C)no3)C2)c(O)c1 839131207 PCSLFNKPEZGLCB-UHFFFAOYSA-N 289.335 2.082 10 20 CECD O=C(c1cc(O)cs1)N1CCOCC12CCCC2 831443804 JRARHHHLYATMLB-UHFFFAOYSA-N 267.350 2.239 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCO[C@@H](CF)C1 840955599 WRMSCUZNWNIUOS-JTQLQIEISA-N 277.698 2.355 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CC(C)(C)C1 840162948 BJRAWOYQSLBZKJ-AWEZNQCLSA-N 277.364 2.438 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)/C=C\SC)cc1 844854203 JSGQRDQCSNKXSN-XFXZXTDPSA-N 294.420 2.467 10 20 CECD COc1cc(CN2C[C@H](C)N(C)[C@H](C)C2)c(O)cc1C 840089963 LPHBIOFYWZXORO-BETUJISGSA-N 278.396 2.234 10 20 CECD CCOc1ccc(CN[C@H]2CCCC[C@H]2CN)c(O)c1 841028720 CPBBMTKNDOJMBH-WFASDCNBSA-N 278.396 2.398 10 20 CECD CCCNC(=O)N(C)CCN(C)c1ccc(OC)cc1 844282088 SGCGWEGDKDMAIS-UHFFFAOYSA-N 279.384 2.183 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1cc([N+](=O)[O-])ccc1O 842755007 VLUSKMZQXZXQMB-PWSUYJOCSA-N 282.340 2.187 10 20 CECD Cc1cc(N(C)C)ccc1CNCCOCC(F)F 840942199 VKLZJOVSERZZDE-UHFFFAOYSA-N 272.339 2.432 10 20 CECD O=C(c1cc(O)cs1)N1CCCC2(CCOCC2)C1 743674713 SQXFNQRUQIAATK-UHFFFAOYSA-N 281.377 2.487 10 20 CECD CC(C)CO[C@H]1CCN(C(=O)c2cc(O)cs2)C1 759357872 NYPRENIBHJKZOP-NSHDSACASA-N 269.366 2.341 10 20 CECD O=C(NC[C@@H](O)CCc1ccccc1)c1cc(O)cs1 753522591 GKZCHOJDXIBIBM-LBPRGKRZSA-N 291.372 2.177 10 20 CECD CCN(CCCCS(C)(=O)=O)c1ccc(OC)cc1 759689437 LROZJCUFERQQHP-UHFFFAOYSA-N 285.409 2.346 10 20 CECD c1cc2c(cc1CNCCCO[C@@H]1CCOC1)CCCO2 921835001 KZZSSOZGEOKLPR-MRXNPFEDSA-N 291.391 2.297 10 20 CECD Cc1nnc(CC(=O)NCc2cc(Cl)ccc2O)s1 855022939 MZZJTYIDYMXRNE-UHFFFAOYSA-N 297.767 2.064 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(C)cc2O)[C@@H]1C 877466970 UTBPCVCZWGPUJW-DGCLKSJQSA-N 263.337 2.084 10 20 CECD CCCOc1ccc(CNCC[C@@H](O)COC)cc1C 873099501 KZRRNHKPGFYOLI-OAHLLOKOSA-N 281.396 2.271 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCN(CC2CC2)C1 877025012 WQJRBQAJRMJBDP-AWEZNQCLSA-N 260.381 2.275 10 20 CECD CCN(C)c1ccc(CN2CCCC[C@H]2CO)cc1 773730215 MAFOBDZAHXWYOY-INIZCTEOSA-N 262.397 2.490 10 20 CECD Cc1cc(C(=O)Nc2c(Cl)ccc3nonc23)on1 1116837934 ZVVILMOHRNQGBM-UHFFFAOYSA-N 278.655 2.425 10 20 CECD Cc1ccc(O)c(CN2CCC(O)(C(F)F)CC2)c1 779208365 HUYVEKSCCMSMIK-UHFFFAOYSA-N 271.307 2.293 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2C[C@@H](C)[C@H](C)C2)c1O 774904284 GBWMWDRGOFEXPN-NXEZZACHSA-N 280.324 2.397 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1cc(C)cc(OC)c1O 887329896 RTNVSABRLHEMOW-INIZCTEOSA-N 292.379 2.330 10 20 CECD Cc1cc(CN2C[C@H]3CC[C@H]2[C@H](O)C3)ccc1N(C)C 887040045 XTBBJQHGDCMVQZ-BHYGNILZSA-N 274.408 2.406 10 20 CECD C[C@H]1COC[C@@H]1NCc1cc(Cl)cc(F)c1O 896735040 AOVMWJGDFCHQFL-CPCISQLKSA-N 259.708 2.309 10 20 CECD COc1ccc(CNCC2CC=CC2)c(O)c1OC 895564876 MPXKRNALSGEXOX-UHFFFAOYSA-N 263.337 2.465 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC[C@@H]1CCC[C@H](O)C1 795491575 SQVZEXDICREPHH-XHSUHYBKSA-N 292.331 2.205 10 20 CECD CC[C@@H](NCc1ncnn1CC)c1ccc(F)cc1O 796986634 YSNYDYXLVZYZOI-GFCCVEGCSA-N 278.331 2.384 10 20 CECD CCN1CCC[C@H](N[C@H](C)c2ccc(F)cc2O)C1=O 722357601 PWGQWVONSXYCIG-MFKMUULPSA-N 280.343 2.193 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)CC[C@H]1O 792181285 ZSBVEHBTXQHOGB-LDYMZIIASA-N 273.735 2.387 10 20 CECD Cc1cc(CNCc2c(O)cccc2Cl)ncn1 756989265 CHLPEIJOANHVSX-UHFFFAOYSA-N 263.728 2.434 10 20 CECD Cc1nc([C@H](C)NCc2ccc3c(c2)CCO3)no1 1325733206 HSXIJGKDKPGCMU-VIFPVBQESA-N 259.309 2.164 10 20 CECD CCOC(=O)[C@H](NCc1ccc(OC)c(C)c1)C1CC1 1338877745 BQUMSTMJXOTDOR-OAHLLOKOSA-N 277.364 2.435 10 20 CECD CN(C)c1cc(F)c(CNCCc2ccnn2C)cc1F 1348100343 UOWTUORLFQEVMW-UHFFFAOYSA-N 294.349 2.097 10 20 CECD NCC[C@@H]1CN(C(=O)Cc2ccc(N)cc2)c2ccccc21 1344446852 BWKCKFRHTZSRSZ-CQSZACIVSA-N 295.386 2.291 10 20 CECD O=C(O)c1cnc(SCc2nnc3n2CCCC3)s1 1602534441 BGECCHSJXAAZDN-UHFFFAOYSA-N 296.377 2.061 10 20 CECD O=C(O)[C@@H]1CCC[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1 1601800408 WFKOVDZQXQTBIP-GHMZBOCLSA-N 289.331 2.125 10 20 CECD N[C@@H]1CCC[C@@H]2CN(Cc3cc(F)c(F)cc3O)C[C@H]21 1580177496 PJDNSELZRHIIMC-GLXFQSAKSA-N 282.334 2.230 10 20 CECD CCc1cc(CN[C@@H](C)c2cc(C(=O)O)ccc2O)on1 1597478832 WTSKEYKYKFBLBY-VIFPVBQESA-N 290.319 2.492 10 20 CECD O=C(O)[C@H]1C[C@@H]2[C@@H](NCc3cc(F)cc(F)c3O)C[C@H]2C1 1777608925 BNUOCHKCVSWXPR-ZCCMAOKESA-N 297.301 2.259 10 20 CECD Cc1cnc(CNCc2ccc(C(=O)O)cc2O)s1 1777481933 OHRBPDFGSNIYDT-UHFFFAOYSA-N 278.333 2.145 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)CC(=O)OC 161356807 NHFIOYZLGIADJT-GFCCVEGCSA-N 293.363 2.330 10 20 CECD CS[C@@H](C)CNCc1ccc(N2CCOCC2)cc1 128061985 MGFFUZBHKKOWSL-ZDUSSCGKSA-N 280.437 2.364 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC(F)(F)F 46914979 QVLRXXSEVNFFPR-UHFFFAOYSA-N 262.231 2.096 10 20 CECD CC[C@@H](N[C@H](C)c1cc(OC)ccc1O)C(=O)OC 182430736 WUINJJQZCNAYPK-BXKDBHETSA-N 267.325 2.003 10 20 CECD COc1ccc(O)c(CN[C@H](C)C2CCOCC2)c1 89725901 FDHOVMJGGUQABM-LLVKDONJSA-N 265.353 2.306 10 20 CECD CCOC(=O)c1cnc(SC[C@@H](C)C(=O)O)s1 1596739785 KDEMDRHCCDCKAA-ZCFIWIBFSA-N 275.351 2.133 10 20 CECD Oc1cccc(Cl)c1CNCCCn1cccn1 113318884 JIRPNEOKYFFWBK-UHFFFAOYSA-N 265.744 2.422 10 20 CECD COC[C@H]1CCCCN1Cc1cccc(OC)c1O 307785867 SCBWOGWTNKARAW-CYBMUJFWSA-N 265.353 2.402 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2C)ncn1 134944328 CYCXVXLHLQYNNV-UHFFFAOYSA-N 284.363 2.089 10 20 CECD CN(C)c1ccc(CN2CCC[C@@]23CCOC3=O)cc1 190037148 ZGHPLUHYYVQBRM-INIZCTEOSA-N 274.364 2.034 10 20 CECD CCOC(=O)N1CCC[C@@H](C(=O)Nc2ccc(N)cc2)C1 236889918 WMGYFWTVOORTOQ-LLVKDONJSA-N 291.351 2.076 10 20 CECD CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(Cc2ccccc2O)[C@H]31 289752867 QRQGVONXDJKCSF-UNPMEBSKSA-N 259.349 2.247 10 20 CECD CCOCCO[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1 92067263 NODIFHLVKGUENK-KRWDZBQOSA-N 292.423 2.380 10 20 CECD CC(F)(F)CCNCc1cc2c(cc1O)OCO2 294178764 JZERIKAQVQYNTM-UHFFFAOYSA-N 259.252 2.256 10 20 CECD Nc1c(Cl)cc(N2C(=O)NC3(CC3)C2=O)cc1Cl 277958123 HRBDJHWMPPLFGM-UHFFFAOYSA-N 286.118 2.164 10 20 CECD Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ns1 278305997 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910945399 UYHZIXSWJOWNTM-HNNXBMFYSA-N 261.321 2.460 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CCOC)C(=O)O)cc1 841807277 POIMLXVRQRFOLD-HNNXBMFYSA-N 294.395 2.112 10 20 CECD COc1ccc(NC(=O)NCc2ccccc2O)cn1 748324949 KIUQUTMAINMVTB-UHFFFAOYSA-N 273.292 2.118 10 20 CECD Cc1cn2nc(NCc3ccccc3O)sc2n1 748308423 RKMUNHFCZWZNJC-UHFFFAOYSA-N 260.322 2.417 10 20 CECD COc1ccc(CN[C@@H](COC(C)(C)C)C(=O)O)cc1C 841804076 BQRHRXVISOXHCF-ZDUSSCGKSA-N 295.379 2.362 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1ncccc1O 743718400 ANHOUIZEQYIXEM-UHFFFAOYSA-N 298.342 2.302 10 20 CECD C/C(=C(/F)C(=O)NCc1ccc(O)cc1O)C1CC1 910957673 UZZXXKIPSRNQSK-JYRVWZFOSA-N 265.284 2.368 10 20 CECD C[C@@H]1CCN(CCNCc2ccc(N(C)C)c(F)c2)C1 744449688 BQQHCRFBVKCPHA-CYBMUJFWSA-N 279.403 2.323 10 20 CECD Cc1cc(Br)cc(CN2CCNC[C@@H]2C)c1O 843047768 SWVWGEMDHWZDDJ-JTQLQIEISA-N 299.212 2.257 10 20 CECD O=C(CSc1ncc(Cl)s1)NC[C@H]1CCCO1 849999238 XFAZTORBPGQUGN-SSDOTTSWSA-N 292.813 2.184 10 20 CECD COc1cc(CN[C@H]2C[C@@H](O)C2)c(O)c(C(C)(C)C)c1 850321638 MQYBXNDUPMUINL-TXEJJXNPSA-N 279.380 2.311 10 20 CECD C[C@H]1C[C@H](NCC(=O)NCC2CC2)c2c(O)ccc(F)c21 757630969 AZUVSIXVRSFAPJ-CABZTGNLSA-N 292.354 2.195 10 20 CECD COCCOCCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756462682 YPCKEVUJOZSPIO-ZYHUDNBSSA-N 283.343 2.332 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H]2COCCO2)cc1 765251977 QNJDPNJXUJFXGC-CZUORRHYSA-N 278.396 2.209 10 20 CECD CCN(C)C(=O)[C@@H](NCc1ccc(C)cc1O)C(C)C 877563242 JCZPDDPWLNIJFJ-HNNXBMFYSA-N 278.396 2.293 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)Cc1nncn1C 771791771 UDXQVXZLLPUPDX-UHFFFAOYSA-N 287.411 2.292 10 20 CECD C[C@H](NCCCCN)c1ccc(N2CCOCC2)c(F)c1 1118121959 LVYOTVDDKSQZRT-ZDUSSCGKSA-N 295.402 2.052 10 20 CECD COc1ccc(O)c(CN(CCN(C)C)CC(C)C)c1 132548283 JLLOWYVQEALQGL-UHFFFAOYSA-N 280.412 2.420 10 20 CECD CCOC(=O)[C@H](F)C1CN(Cc2ccc(C)cc2O)C1 877549704 HGJZRBCAAHCXRC-CQSZACIVSA-N 281.327 2.034 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1Cc2ccccc21 773747628 CMHOTJRETPMEHT-IAQYHMDHSA-N 297.354 2.485 10 20 CECD CCCc1cc(C(=O)N(C)c2ccc(N)cc2)n[nH]1 877080069 FSFQRJQISZXNFN-UHFFFAOYSA-N 258.325 2.221 10 20 CECD C[C@H](NC[C@H]1CC[C@H](O)C1)c1c(O)cccc1F 886598773 JVMSQXNHGICYFD-DCAQKATOSA-N 253.317 2.343 10 20 CECD CN1CCc2cc(C(=O)NCc3ccccc3O)ccc21 779000395 CUFTVNIINQCECC-UHFFFAOYSA-N 282.343 2.315 10 20 CECD Cc1cncnc1NCc1ccc(N2CCC(O)CC2)cc1 882635311 UKPSMYFBYVILKO-UHFFFAOYSA-N 298.390 2.358 10 20 CECD C[C@@H]1CN(C2CC2)C[C@@H]1NCc1cc(F)cc(F)c1O 883039257 IVIGNEBABPVJEX-OTYXRUKQSA-N 282.334 2.243 10 20 CECD CCOCc1cc(CNCc2cn(C)cn2)ccc1OC 898045043 GNTQXPHCLVFGHR-UHFFFAOYSA-N 289.379 2.255 10 20 CECD C[C@]1(CNCc2cc(F)cc(F)c2O)CCCO1 708438227 WGZRGTBSCPSRPW-CYBMUJFWSA-N 257.280 2.329 10 20 CECD CN(C)c1ccc(CNC2C[C@@H]3CC[C@H](C2)N3)cc1 709374951 AKODZUKNQYSYNY-YIONKMFJSA-N 259.397 2.125 10 20 CECD CCSCC(=O)N1CCN(c2ccc(OC)cc2)CC1 194163370 LKSQBPIGCZHJPJ-UHFFFAOYSA-N 294.420 2.097 10 20 CECD CN(C)c1ccc(CNCC2(N(C)C)CCC2)cc1 97929301 AQAUHEJNJMDNRS-UHFFFAOYSA-N 261.413 2.327 10 20 CECD CN(C)CCOc1ccc(N(C)Cc2csnn2)cc1 761221311 DQGLFTLERLYHIE-UHFFFAOYSA-N 292.408 2.115 10 20 CECD COc1ccc(CNC[C@@H]2CC[C@@H](NC(C)=O)C2)cc1C 994567175 CBYRURCADOOZJI-HZPDHXFCSA-N 290.407 2.398 10 20 CECD COC(=O)c1cc(C)nc(NCc2cc(C)ccc2O)n1 1348123375 WRBIMJINWDFKSV-UHFFFAOYSA-N 287.319 2.198 10 20 CECD COC(=O)C[C@](C)(NCc1ccc(N)cc1)c1ccncc1 1356082855 FURNNZOHXSJVCP-KRWDZBQOSA-N 299.374 2.232 10 20 CECD C[C@@H]1C[C@H]1c1nnc(N(C)Cc2ccccc2O)n1C 1355655256 ZBWCGZJDLATZLN-ZYHUDNBSSA-N 272.352 2.281 10 20 CECD COc1ccc(O)c(CN[C@H]2CCN3CCCC[C@@H]23)c1 217627874 RRZMICWWCBZJCV-GJZGRUSLSA-N 276.380 2.117 10 20 CECD Oc1cc(Cl)ccc1CN[C@@H]1CC12CCNCC2 1580888767 YSGDUNATSGTXJW-CYBMUJFWSA-N 266.772 2.277 10 20 CECD COc1cc(O)c(CN2CCC[C@H]2C[C@@H](C)O)cc1OC 160478252 MPFQWUNKXICTQM-YPMHNXCESA-N 295.379 2.145 10 20 CECD COc1ccc(O)c([C@H](C)NCCOC(C)C)c1 163985309 CIJMHMZXYPJSOS-NSHDSACASA-N 253.342 2.476 10 20 CECD CC[C@H](C)OCC(=O)NCc1ccc(N(C)C)cc1C 151877492 RDXXDGZTJABDNH-ZDUSSCGKSA-N 278.396 2.492 10 20 CECD CN(Cc1cc(F)ccc1O)C[C@H]1CCCN1C 234346006 CQZTUJKXGJSAKP-CYBMUJFWSA-N 252.333 2.057 10 20 CECD Cc1ccc(CN2CCO[C@@H]([C@H]3CCCO3)C2)c(O)c1 876806928 WHDYAVMKKBNUQC-HZPDHXFCSA-N 277.364 2.080 10 20 CECD COc1ccc(CNC2CC2)cc1Cn1cccn1 50125471 ASESXMLXMCROBS-UHFFFAOYSA-N 257.337 2.192 10 20 CECD OCC1(CCNCc2c(O)cccc2Cl)CC1 395852841 GTAPXENHNVIBRV-UHFFFAOYSA-N 255.745 2.298 10 20 CECD COc1ccc(O)c(CN2CC[S@@](=O)C(C)(C)CC2)c1 322128223 OPFJMXRNECCFDZ-HXUWFJFHSA-N 297.420 2.134 10 20 CECD N#Cc1cccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)c1 180634995 HPPBEQAKWHLJGA-FNORWQNLSA-N 294.310 2.299 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)c1 185317369 MEVRBKFAIOPGEU-DGCLKSJQSA-N 286.379 2.266 10 20 CECD COc1cccc(CNC(=O)c2[nH]c(C)cc2C)c1O 131039864 UUNRTPPQMFOOIT-UHFFFAOYSA-N 274.320 2.276 10 20 CECD CN1CCC(NCc2cccc(Br)c2O)CC1 42411904 SWEQCCAGGRUKHZ-UHFFFAOYSA-N 299.212 2.339 10 20 CECD CC(C)Cn1ncnc1CN(C)c1ccc(N)cc1 88595630 WWLOBUIZKUVKNX-UHFFFAOYSA-N 259.357 2.153 10 20 CECD COc1cccc(CN2CCOCC23CCC3)c1O 93510360 UYKCTLGYIYIGII-UHFFFAOYSA-N 263.337 2.156 10 20 CECD CCCOc1ccc(CN2CCO[C@@H](COC)C2)c(O)c1 93529179 KNCDDASYDMEMDB-OAHLLOKOSA-N 295.379 2.028 10 20 CECD CC[C@@H](C(=O)NCc1ccc2c(c1)CCCN2C)N(C)C 268831570 WPKHNTVBAWAVGU-HNNXBMFYSA-N 289.423 2.025 10 20 CECD Cc1c(CN=c2cc[nH]cc2C(N)=O)n(C)c2ccccc12 530376309 ZEYUWSCDIQIBRX-UHFFFAOYSA-N 294.358 2.015 10 20 CECD CN1C[C@H](NCc2cc(-c3ccccc3)ccc2O)CC1=O 263743810 NYLOTYRUHXBQCE-MRXNPFEDSA-N 296.370 2.380 10 20 CECD C[C@H](NCc1nccn1C)c1ccc(F)c(F)c1O 276993542 XTUGKTCEKFANLA-QMMMGPOBSA-N 267.279 2.255 10 20 CECD CC[C@@H](NCC1(CO)COC1)c1cccc(Cl)c1O 287725009 OUALMVRFYZLNPD-GFCCVEGCSA-N 285.771 2.095 10 20 CECD Cc1cc[nH]c1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 281250268 JLPGKJRHRLDIKB-SNVBAGLBSA-N 274.320 2.095 10 20 CECD COc1cccc(CN2CC[C@H](n3cccn3)C2)c1O 291202028 HRTDIIVGKRZHRI-ZDUSSCGKSA-N 273.336 2.044 10 20 CECD Cc1ccc(C(=O)N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)c(O)c1O 295982646 PWIQHIPVEHVGTK-AUZPSNTRSA-N 285.343 2.300 10 20 CECD CCc1cccnc1C(=O)NCCc1ccc(N)cc1 818544877 VBWFSHAZMVPIQT-UHFFFAOYSA-N 269.348 2.199 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@]2(C)CCCNC2)c1 817966868 XFKMNWZYEBMCJH-LRDDRELGSA-N 278.396 2.441 10 20 CECD C[C@@H](NCc1cc(Cl)cc(F)c1O)C1(CO)CC1 826990277 CVYWUEBCRTVOOQ-MRVPVSSYSA-N 273.735 2.435 10 20 CECD C[C@@H]1[C@H](C(=O)NCCCSc2nccs2)CCN1C 825822080 CPGYZULSNRTPNX-GHMZBOCLSA-N 299.465 2.082 10 20 CECD CCOc1ccc(CN[C@@H]2CCC[C@H]2OC)c(O)c1 824903619 ICPOSLXFNPDHRL-UKRRQHHQSA-N 265.353 2.448 10 20 CECD Cc1cc(Br)c(O)c(CN[C@H](C)C(=O)O)c1 820949346 RDSHTTPVSGWHEM-SSDOTTSWSA-N 288.141 2.026 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2NCC2(C)C)cc1 827341241 XZYXWZWPZHNHCT-OAHLLOKOSA-N 289.423 2.147 10 20 CECD Cc1cc(NC(=O)c2cc(O)cs2)ccc1C(N)=O 732287141 QLJGVMJZCKSRRK-UHFFFAOYSA-N 276.317 2.113 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@@H](C)c1ccc(C)c(C)c1O 903300321 YBPCOAWREFFIPX-NWANDNLSSA-N 279.380 2.464 10 20 CECD CN(C)c1ccc(CN2CC(OC(F)F)C2)cc1 839146019 YNOSTRQCPIERGI-UHFFFAOYSA-N 256.296 2.176 10 20 CECD COC(=O)[C@H]1CCCC[C@]1(C)NC(=O)c1cc(O)cs1 831624311 TVUOEEXKTLIEAG-YGRLFVJLSA-N 297.376 2.305 10 20 CECD CCOc1ccc(N(C)Cc2oncc2C(=O)O)cc1 846249811 RYKBQVRGVUYZNL-UHFFFAOYSA-N 276.292 2.408 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC1CCNCC1 841915577 SOXSIKINPKYOPY-UHFFFAOYSA-N 291.395 2.066 10 20 CECD C/C=C/C[C@@H](CO)NCc1ccc(N(C)C)cc1C 840938394 OLWJNTYEKJLTDT-NFAHFFEMSA-N 262.397 2.478 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](CCN)C(F)(F)F 841091710 DFUZDEJJGSGHFR-ZDUSSCGKSA-N 289.345 2.430 10 20 CECD CN(C)c1cc(F)c(CNCCc2cnn(C)c2)cc1F 858102020 OFVJJHQODGBZST-UHFFFAOYSA-N 294.349 2.097 10 20 CECD Oc1ccccc1CNc1ncnc2ccncc12 752633658 ZFBJVODWTBTJPE-UHFFFAOYSA-N 252.277 2.343 10 20 CECD Cc1ccc(O)c(CNC[C@@H]2CC(=O)N(C(C)(C)C)C2)c1 850396260 IKFQIUKNDRNZCT-ZDUSSCGKSA-N 290.407 2.437 10 20 CECD COC[C@@H]1CCCN1C(=O)NCc1ccc(N(C)C)cc1 751993150 GVVPLKVCTOPAPZ-HNNXBMFYSA-N 291.395 2.073 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2ncccc2C)c1 858410332 WGDLYCDHDPDRSR-UHFFFAOYSA-N 285.347 2.403 10 20 CECD CCOc1ccc(CNCC2(CO)CCCC2)c(O)c1 769935718 PRWYCDQNYXYLJD-UHFFFAOYSA-N 279.380 2.433 10 20 CECD C/C=C\C[C@@H](CO)NCc1ccc(OCC)cc1O 769937160 NJBJYWJGKHXANV-DXTPNHAXSA-N 265.353 2.208 10 20 CECD Cc1ccc(CNCCCNc2ncccn2)c(O)c1 876874561 HQFCCIAVTZZTAL-UHFFFAOYSA-N 272.352 2.082 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)N(C)C 874108595 ZACFKQCOWVVIJU-CQSZACIVSA-N 291.439 2.440 10 20 CECD Cc1cccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)c1O 777219780 NCAYJAQHLRNCOJ-GFCCVEGCSA-N 278.396 2.436 10 20 CECD CCCOCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773015447 OKCAQZQAOSWEFH-LBPRGKRZSA-N 264.369 2.356 10 20 CECD C[C@H](NCCCNc1ncccn1)c1ccccc1O 783519491 LUCPDNMBDJBQKA-LBPRGKRZSA-N 272.352 2.335 10 20 CECD C[C@H]1C[C@H](CO)CN(Cc2cc(F)cc(F)c2O)C1 895032768 ALAHIVSCZSCDDA-UWVGGRQHSA-N 271.307 2.121 10 20 CECD COc1ccc(NCc2ccc(OC)c(OC)c2O)cn1 893117988 AUCITJMGPQATRN-UHFFFAOYSA-N 290.319 2.425 10 20 CECD COc1cc(C)cc(CN[C@H](C)CC(C)(C)O)c1O 894885734 HUIZWEPBEODALO-LLVKDONJSA-N 267.369 2.348 10 20 CECD COc1ccc(CN2CC[C@@H](O)C(C)(C)C2)c(O)c1OC 893884131 AQZQVPPYJCJIRU-CYBMUJFWSA-N 295.379 2.002 10 20 CECD COc1ccc(CN[C@H](CO)CC(F)(F)F)cc1C 717751824 YSFDFDYOCMHQCH-NSHDSACASA-N 277.286 2.407 10 20 CECD O=C(OC[C@H]1CCC[C@@H](O)C1)c1cc(O)cs1 795401339 INWUMYSEGAVAKE-DTWKUNHWSA-N 256.323 2.162 10 20 CECD CCc1cccc(CN[C@@H](C)Cn2ccnc2)c1O 691516446 XVAKJJCOOORHBQ-LBPRGKRZSA-N 259.353 2.329 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCC[C@@H]1CCO 778216492 OSOQNJZAKWYOBM-DGCLKSJQSA-N 265.353 2.042 10 20 CECD CCCN1CCCC[C@@H]1C(=O)N(C)c1ccc(N)cc1 1336742378 KGKBZICRRMCKEK-OAHLLOKOSA-N 275.396 2.496 10 20 CECD C[C@@H](CCCCN)N[C@@H](C)c1cc(C(=O)O)ccc1O 1609738992 ZIAXGZMEIDYYSN-QWRGUYRKSA-N 280.368 2.259 10 20 CECD CC[C@@](C)(CN)C(=O)NCCCSc1nccs1 1576947977 DRFLSCPLBOPPCN-LBPRGKRZSA-N 287.454 2.117 10 20 CECD N[C@@H]1CCC[C@@H]2CN(Cc3cc(F)c(F)cc3O)C[C@@H]21 1580177498 PJDNSELZRHIIMC-OLUVUFQESA-N 282.334 2.230 10 20 CECD CC(=O)Nc1cccc(NC(=O)Cc2ccc(N)cc2)c1 19515104 MUFYRLUTEIOVDW-UHFFFAOYSA-N 283.331 2.408 10 20 CECD Cc1cc(C(=O)N2CCC[C@H](N)C2)c(C)n1-c1ccccn1 158314467 VYRKXOXJHNQQOS-AWEZNQCLSA-N 298.390 2.052 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(C#N)[nH]2)c1 153916675 GYQKZWNKSLSUGK-SECBINFHSA-N 285.303 2.092 10 20 CECD CC(C)NC(=O)CCN[C@H](C)c1ccc(N(C)C)cc1 135103658 AAHIOQYFTXSDHY-CYBMUJFWSA-N 277.412 2.318 10 20 CECD CCC(O)(CC)CNCc1cc(F)cc(F)c1O 708445730 XJAQJHFZZBVSGX-UHFFFAOYSA-N 259.296 2.311 10 20 CECD CC[C@H](NCCc1cnccn1)c1ccccc1O 390177139 GYRHDHWVCQFODS-AWEZNQCLSA-N 257.337 2.466 10 20 CECD COCCN[C@@H](C)c1ccc(Br)cc1O 134906120 FHZLZXXPBSEVSC-QMMMGPOBSA-N 274.158 2.452 10 20 CECD CN(C)c1ccc([C@@H](CNC(=O)CC2CC2)N(C)C)cc1 1340843375 YUZIQOADDSINJM-MRXNPFEDSA-N 289.423 2.272 10 20 CECD Cc1ncc(/C=C/C(=O)N2CCOc3ccncc32)s1 174912870 MWNBKHPQTVNZKZ-NSCUHMNNSA-N 287.344 2.285 10 20 CECD CCN(CC)c1ccc(CNC(=O)NCCOC)cc1F 66975549 JJGPYTJIVBGMOI-UHFFFAOYSA-N 297.374 2.118 10 20 CECD CC(C)[C@@H]1C(=O)NCCN1Cc1cccc(Cl)c1O 180043212 UFNPJMHCHCTWKI-GFCCVEGCSA-N 282.771 2.002 10 20 CECD C[C@H](N[C@H](C)C[S@](C)=O)c1ccc(F)c(F)c1O 187913419 GUHHQVJEYKRRLL-MPSDLYAZSA-N 277.336 2.088 10 20 CECD CN1CCCN(Cc2c(O)cccc2Cl)CC1 211487188 UJQXOAJVACXOCJ-UHFFFAOYSA-N 254.761 2.183 10 20 CECD COC(=O)[C@]1(C)CCCN1Cc1ccc(N(C)C)cc1 189990887 GDGSRVISFLSORY-INIZCTEOSA-N 276.380 2.280 10 20 CECD Cc1ccc([C@H](C)NCCC(=O)NC(C)C)c(O)c1 181270216 YZGGXOZHFBTXAW-LBPRGKRZSA-N 264.369 2.266 10 20 CECD O=C(NC[C@H]1CCC(F)(F)C1)c1cccc(O)c1O 281486204 DNGXWZXDTHYNRF-QMMMGPOBSA-N 271.263 2.263 10 20 CECD Cc1cc(NCCc2ccc(O)c(O)c2)ncc1[N+](=O)[O-] 85689436 DLKJTQGUCQKWSE-UHFFFAOYSA-N 289.291 2.364 10 20 CECD COc1ccc(N2CCN(C(=O)NC(C)C)CC2)cc1F 84732631 LPOSCCWWCYUZKM-UHFFFAOYSA-N 295.358 2.074 10 20 CECD CN(Cc1ccccc1O)C[C@H]1CC2(CCC2)C(=O)O1 192102793 JKXHWZWWNIQHBZ-CYBMUJFWSA-N 275.348 2.310 10 20 CECD O=C(O)CN(Cc1cc(F)ccc1O)C1CCCC1 236428872 JMWIUXMFEPMDKB-UHFFFAOYSA-N 267.300 2.361 10 20 CECD C[C@@H](NC[C@@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O 273372638 GLSWGCNLXHMGHB-KOLCDFICSA-N 266.297 2.130 10 20 CECD CC1(C)CN(C(=O)c2c(F)ccc(O)c2O)CCS1 276524531 CYWDFLKAHDUHOW-UHFFFAOYSA-N 285.340 2.205 10 20 CECD C[C@H](CN1CCOCC1)N(C)Cc1c(O)cccc1Cl 279498195 VSAKCEISARXCML-GFCCVEGCSA-N 298.814 2.198 10 20 CECD CCCN(Cc1cnc(N(C)C)nc1)c1ccc(CN)cc1 278349862 IOUMFYWQPHPEEF-UHFFFAOYSA-N 299.422 2.418 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCO[C@@H](C)C2)cc1OC 271819342 MOFDNVYTUHSNHT-NWDGAFQWSA-N 295.379 2.314 10 20 CECD CCOCC(=O)NCc1cc(Cl)cc(Cl)c1O 807836529 ZMWITUOVQSYIBA-UHFFFAOYSA-N 278.135 2.352 10 20 CECD C[C@H]1CC[C@H](CNCc2ccc(N3CCOCC3)cc2)O1 398093080 STZMSSKAQBVMHY-WMLDXEAASA-N 290.407 2.180 10 20 CECD CC[C@@H](NC[C@@H]1CNCCCO1)c1cc(Cl)ccc1O 817982700 VNUDWIDPBFUMDX-GXTWGEPZSA-N 298.814 2.465 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCc2cccnc21 816888929 FAZBNQJIMCKQPP-AWEZNQCLSA-N 282.343 2.476 10 20 CECD Cc1cc(Br)cc([C@H](C)NC2CNC2)c1O 817956259 VAYMXYRKDAAECS-QMMMGPOBSA-N 285.185 2.086 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@@]1(C)CO 827699088 DXFQZMJEGNKYCH-YGRLFVJLSA-N 269.772 2.496 10 20 CECD Cc1cc(O)c(CN[C@@H](C)C(=O)NC(C)C)cc1Cl 826123685 SSJUZZZYMRXWSL-JTQLQIEISA-N 284.787 2.357 10 20 CECD COCCC1(CNC(=O)c2c(F)ccc(O)c2O)CCC1 826932800 HBOJIUSTLHPHJV-UHFFFAOYSA-N 297.326 2.174 10 20 CECD Cc1cccc2c1N[C@H](c1cc(C(=O)O)ccc1O)NC2=O 738750639 XIWMZKZNIJCQSH-AWEZNQCLSA-N 298.298 2.253 10 20 CECD Cc1ccc(O)c(CNCc2ccc(C(=O)O)o2)c1 738637136 VEWRMWBCTVTRTQ-UHFFFAOYSA-N 261.277 2.282 10 20 CECD C[C@@H](Cc1ccco1)NC(=O)NCc1ccccc1O 748461600 ZWJOLQRXZTVKCA-NSHDSACASA-N 274.320 2.416 10 20 CECD COc1cccc([C@H](C)NCCCNC(=O)C(C)C)c1O 846157064 JBGKHINRQLPKEW-LBPRGKRZSA-N 294.395 2.214 10 20 CECD O=C(O)c1cc2ccccc2c(CN2CCOCC2)c1O 740095650 DKCPRMCAELLIFS-UHFFFAOYSA-N 287.315 2.076 10 20 CECD COc1cccc2c1O[C@H](c1cc(F)ccc1O)NC2=O 917500335 AAGLQRAKQAUSEW-OAHLLOKOSA-N 289.262 2.361 10 20 CECD N[C@@H]1Cc2ccccc2N(Cc2ccccc2O)C1 841106653 NJSWNYFMLZZDAW-CQSZACIVSA-N 254.333 2.282 10 20 CECD COC[C@@H](C)CC(=O)NCc1ccc(N(C)C)c(F)c1 755250995 PVNASXYZNLHHGX-NSHDSACASA-N 282.359 2.181 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCO[C@@H](C)C2)c1 862757401 SNCGURWBWBQXTL-RYUDHWBXSA-N 263.337 2.132 10 20 CECD C[C@@H]1C[C@H](CO)CN(Cc2cc(F)c(N(C)C)cc2F)C1 862396066 GQIXRLRNOBHFNX-NEPJUHHUSA-N 298.377 2.481 10 20 CECD Cn1cnc(/C=C/C(=O)N2CCCc3cccc(O)c32)c1 935168349 BJHNDYUMJPLHBF-BQYQJAHWSA-N 283.331 2.118 10 20 CECD CN(C)CCN(C(=O)/C=C/c1cn(C)cn1)c1ccccc1 931134575 VCUGNUHODOTAPH-MDZDMXLPSA-N 298.390 2.028 10 20 CECD CN(Cc1cnc(N2CCCC2)nc1)Cc1ccccc1O 768872092 CDKXNCWEWSJYCQ-UHFFFAOYSA-N 298.390 2.414 10 20 CECD CC[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(C)=O 873371559 XNRGBUQBFYOEEE-VGVVRCBHSA-N 264.277 2.022 10 20 CECD CCCOC(=O)[C@H](C)N[C@H](C)c1ccccc1O 879648364 LNTDRKCHWDWMMM-MNOVXSKESA-N 251.326 2.385 10 20 CECD COc1ccc(O)c(CNCc2cccc(F)n2)c1 776252682 VUZOWYKPBMUHLS-UHFFFAOYSA-N 262.284 2.225 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1ccc(C)cc1O 877588091 VTTCCQRRCQGJGD-CYBMUJFWSA-N 263.337 2.132 10 20 CECD Cc1nn(C(C)C)cc1C(=O)NCc1cccc(O)c1O 1123977620 JZTGATGBTZKPCW-UHFFFAOYSA-N 289.335 2.114 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CC[C@H](C)O2)c1O 894970181 SRWXVRNMKZFRGN-AAEUAGOBSA-N 265.353 2.366 10 20 CECD C[C@H](NC(=O)NCc1ccccc1O)[C@@H]1CCCOC1 780044242 MMBVBTABTYUCFO-WCQYABFASA-N 278.352 2.007 10 20 CECD CCOc1ccc(O)c(CNC[C@@H]2CC(C)=NO2)c1 895311845 SFMRRQOGFHVQSK-ZDUSSCGKSA-N 264.325 2.045 10 20 CECD CC[C@@H](N[C@@H](CO)CC(F)F)c1ccccc1O 717749541 KJPQHSVBVUABLL-MWLCHTKSSA-N 259.296 2.449 10 20 CECD COc1ccc(CNC(=O)Cc2ncc(C)s2)c(O)c1 794388414 SIMWPBOFZCFKHR-UHFFFAOYSA-N 292.360 2.025 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cc(C)ncn2)c1 756774256 BLDZPYCPYYKOFU-LLVKDONJSA-N 273.336 2.350 10 20 CECD COc1ccc(CNC[C@@H]2CCCCS2(=O)=O)cc1C 694591063 QUBLLVKNXSCBEG-AWEZNQCLSA-N 297.420 2.061 10 20 CECD CC[C@H](OC)C(=O)Nc1c(Cl)ccc2nonc12 1323416001 BYQYNYSLRWQAHH-QMMMGPOBSA-N 269.688 2.240 10 20 CECD CN(C(=O)c1cnc(C2CC2)[nH]1)c1ccc(N)cc1 1332980191 FMDXJMSCLJGKJQ-UHFFFAOYSA-N 256.309 2.146 10 20 CECD Nc1ccc(CNC(=O)NC[C@H](O)C2CCCCC2)cc1 1357791149 JSTYDRGRLPHPJK-HNNXBMFYSA-N 291.395 2.009 10 20 CECD C[C@@H]1CN(C(=O)C2=CCCNCC2)c2ccc(F)cc2O1 1521379108 GDPXBDSHHWGUQZ-LLVKDONJSA-N 290.338 2.249 10 20 CECD C[C@@H](Sc1ncc(C(=O)O)s1)c1nccc(N)n1 1604456497 GWIIFKNERUPHDZ-RXMQYKEDSA-N 282.350 2.067 10 20 CECD Cc1ccc(CN[C@@H](C(=O)O)C(C)(C)C)c(O)c1 1607782700 DGXMIQZXNSURGF-LBPRGKRZSA-N 251.326 2.290 10 20 CECD Cc1cc(CN[C@H](C(=O)O)C2CC2)ccc1N(C)C 1607645919 BYEWXZKCQPJRGT-AWEZNQCLSA-N 262.353 2.014 10 20 CECD C[C@H](N[C@@H]1CCCC[C@H]1O)c1cc(C(=O)O)ccc1O 1604357746 PFINMPZWAKKAAV-MRCXROJRSA-N 279.336 2.045 10 20 CECD COc1cccc(CN[C@H]2C[C@@H](OC)C2(C)C)c1O 227827921 HRSSEDQWSHKVHF-QWHCGFSZSA-N 265.353 2.304 10 20 CECD C[C@@H]1CCN(Cc2cc(F)cc(F)c2O)[C@@H](C(=O)O)C1 1594423913 KYSRBLWYGWSLGN-PRHODGIISA-N 285.290 2.356 10 20 CECD CCN1CCc2cc(CNC[C@H](C)CC(=O)O)ccc21 1776877592 WMZGTCJAMJTSLH-GFCCVEGCSA-N 276.380 2.269 10 20 CECD COCCO[C@H]1CCCN(Cc2ccccc2O)C1 802652386 FVIBXSLXXAOIEA-AWEZNQCLSA-N 265.353 2.020 10 20 CECD Cc1ccc(O)c(CNCCCOC[C@H]2CCCO2)c1 71406650 LTHPTWRPKXXSLK-OAHLLOKOSA-N 279.380 2.376 10 20 CECD Cc1cc(NS(=O)(=O)C2CC2)c(C)c(C)c1O 187061071 WGIYMCDPUNTQEQ-UHFFFAOYSA-N 255.339 2.222 10 20 CECD C[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1C 181159446 LAIKIUNKBCDKQU-LJRGRFNSSA-N 261.321 2.368 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2cc(F)ccc2O)C1 185788926 PQJVQZARQCIGCA-CMPLNLGQSA-N 280.343 2.193 10 20 CECD COc1ccc(O)c(CN(C)Cc2ncc(Cl)n2C)c1 181143839 SPSPSLWUBDBASN-UHFFFAOYSA-N 295.770 2.420 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccccc2CC1 126436248 ZPJHOQLMPJXXDO-UHFFFAOYSA-N 283.327 2.339 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2=CCOCC2)cc1 192778904 JQVALVJNSCXGGJ-UHFFFAOYSA-N 288.391 2.496 10 20 CECD CN(C)c1ccc(CN2CC[C@@](C)(C(=O)O)C2)cc1 86778924 CGAYVXVRDMYMFV-OAHLLOKOSA-N 262.353 2.049 10 20 CECD COc1cccc(CN2CCOC[C@H]2C2CC2)c1O 93645668 PWBVAJWELBKQIP-ZDUSSCGKSA-N 263.337 2.012 10 20 CECD NC(=O)C1(CNCc2c(O)cccc2Cl)CCCC1 265649799 YEUMWYXVGOLIBL-UHFFFAOYSA-N 282.771 2.181 10 20 CECD COC[C@@H](NCc1ccc(N(C)C)cc1)[C@H]1CCCO1 278757343 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728983061 SWRIVRQDROBIEU-ZANVPECISA-N 267.325 2.003 10 20 CECD CO[C@H](CNC(=O)c1cc(O)cs1)C(C)(C)C 829415539 QDAAIKPTRURRAR-SNVBAGLBSA-N 257.355 2.245 10 20 CECD CCOc1ccc(O)c(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1 824839381 XTQCLXYMZPXNDE-YALNPMBYSA-N 287.359 2.176 10 20 CECD CN(C)c1ccc(CN2CCCc3c(cnn3C)C2)cc1 839624476 HDNHUSKEPHWRLP-UHFFFAOYSA-N 284.407 2.435 10 20 CECD CCOc1ccc(CNCCC(C)(C)N)c(O)c1 903938777 KBWXSERHISXICV-UHFFFAOYSA-N 252.358 2.008 10 20 CECD Cc1cc(C(=O)NCc2ccc(N)cc2)nn1C(C)(C)C 837302762 FUWFVVICLMIXSC-UHFFFAOYSA-N 286.379 2.459 10 20 CECD CN(C)c1ccc(/C=C\CN2CC[C@](F)(C(=O)O)C2)cc1 901513756 CVCIMGFNRPRNFE-MJSXRHKHSA-N 292.354 2.264 10 20 CECD COC1CCN(CCN[C@@H]2CCc3cccc(O)c32)CC1 834616753 QPEAZFXAEGUZHH-OAHLLOKOSA-N 290.407 2.080 10 20 CECD CCOc1cccc(CNC[C@H](O)c2ccco2)c1O 747098892 CXDKJKRAWJDGEI-LBPRGKRZSA-N 277.320 2.207 10 20 CECD CC1(NCc2cc(Cl)ccc2O)CCNCC1 841064816 KUAWYMWXPPDOOF-UHFFFAOYSA-N 254.761 2.277 10 20 CECD COc1cc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(O)cc1C 840131222 UIUMECOYBWAISS-WMHQRMGPSA-N 287.359 2.094 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCC[C@H](N)C2)c1O 841057297 IWXCDHQJACVKNB-RYUDHWBXSA-N 284.787 2.414 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](N)[C@H](C)C1 843052484 UPLZZGXAVSBEBT-CJNGLKHVSA-N 261.413 2.230 10 20 CECD Cc1ccc(O)c(CNC[C@H](N)c2ccccc2)c1 841036116 JYICQFGXZFXVAH-HNNXBMFYSA-N 256.349 2.490 10 20 CECD Cc1cc(O)c(CN2C[C@H]3CCC[C@@]3(N)C2)cc1C 857226757 YWDFBBPBNKHWFB-GDBMZVCRSA-N 260.381 2.322 10 20 CECD COC[C@@](C)(O)CN[C@H](C)c1ccc(C)c(C)c1O 756578579 WXZYXXLMUYNJBH-DOMZBBRYSA-N 267.369 2.057 10 20 CECD Cc1ccc(O)c(CNCc2cc3c(cc2O)OCO3)c1 858238079 UBQIEHXUNIUFDP-UHFFFAOYSA-N 287.315 2.425 10 20 CECD O=S(=O)(NCc1ccccc1O)c1cccc(F)c1F 751149050 KSDTYENERZPMDP-UHFFFAOYSA-N 299.298 2.149 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@H](C)c1cc(F)cc(F)c1O 756773959 DFKBRZZIAZYPML-JQEORGNBSA-N 298.333 2.236 10 20 CECD COCCOC[C@@H](C)N[C@H](C)c1cc(OC)ccc1O 756731557 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SSPXCNRSHWQRSV-MPBGBICISA-N 297.420 2.134 10 20 CECD CC(C)n1cc(CN(C)Cc2ccccc2O)nn1 289009396 FNFMWYIRZOTGGU-UHFFFAOYSA-N 260.341 2.197 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]2c2ncc[nH]2)c1 377016325 WQJRGGFCNVENMS-ZDUSSCGKSA-N 273.336 2.461 10 20 CECD CC[C@@H](N[C@@H](CCO)COC)c1cccc(Cl)c1O 287740476 PQLNGJJXAPRRGW-GXFFZTMASA-N 287.787 2.484 10 20 CECD COc1ccc(CNCc2cc(C)ccc2O)c(OC)n1 289689158 SLKLTDOTVQHPLC-UHFFFAOYSA-N 288.347 2.403 10 20 CECD CC1(C)CN(C(=O)c2cccc(O)c2O)[C@@H]1[C@@H]1CCCO1 290610079 NTKWZBJYSXVORL-GXTWGEPZSA-N 291.347 2.127 10 20 CECD C[C@H](CCCO)CNCc1ccc(N2CCOCC2)cc1 384408148 WASURQQSAYXJGG-OAHLLOKOSA-N 292.423 2.021 10 20 CECD C[C@H](CCCO)CNCc1ccc(N(C)C)c(F)c1 294738086 GXGMVTSSLMUCDW-GFCCVEGCSA-N 268.376 2.390 10 20 CECD C[C@@H](NC(=O)c1cc(C=O)c[nH]1)c1ccc(N(C)C)cc1 816180136 GKDHRTABDVOHGW-LLVKDONJSA-N 285.347 2.384 10 20 CECD COc1ccc(CNC(=O)NCc2occc2C)c(O)c1 813841501 OAWCTIYDMZLMRT-UHFFFAOYSA-N 290.319 2.302 10 20 CECD CN(CCCF)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 714790844 PYOJDBXAMNBTIA-GQCTYLIASA-N 282.271 2.488 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2cnnn2C)cc1 813371028 PDRGHEQGLAUKFO-UHFFFAOYSA-N 295.346 2.475 10 20 CECD CC[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(N(C)C)cc1 817976892 WMWIPSBYASZLFU-XUWVNRHRSA-N 259.397 2.011 10 20 CECD O=C(O)CN(CCC(F)(F)F)Cc1cc(F)ccc1O 1602053368 GXPRPJATZAKXQX-UHFFFAOYSA-N 295.232 2.370 10 20 CECD NCC[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 904405801 PTWGAQFCZWSIDS-SECBINFHSA-N 272.751 2.355 10 20 CECD CCO[C@H]1C[C@@H](NCc2cc(OC)c(OC)cc2O)C1 839147161 FMSYAEQHFFYYMG-TXEJJXNPSA-N 281.352 2.067 10 20 CECD CN(C)Cc1cccc(CNC(=O)c2cc(O)cs2)c1 732267024 SVIGAXMFDQZCPR-UHFFFAOYSA-N 290.388 2.445 10 20 CECD CCN(CC(=O)NCc1ccc(N(C)C)cc1)C1CCC1 839493211 DXCLFALMFJNOGS-UHFFFAOYSA-N 289.423 2.243 10 20 CECD CN1CCC[C@@H](CCNCc2cc([N+](=O)[O-])ccc2O)C1 839183559 YGCFHCKIOXMEHZ-LBPRGKRZSA-N 293.367 2.122 10 20 CECD CN(C[C@H]1C[C@@]12CCOC2)c1ccc(OCC(=O)O)cc1 903601135 FMFRPUOVCPQHEK-MLGOLLRUSA-N 291.347 2.013 10 20 CECD Nc1ccc(CCNC(=O)NOC2CCCCC2)cc1 841882100 KOSWUCYKLIXUBG-UHFFFAOYSA-N 277.368 2.375 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[S@](=O)[C@@H](C)[C@H]1C 840917409 JXYRZYAGYHGHSZ-CKNLXJGOSA-N 294.464 2.402 10 20 CECD CCCONC(=O)N(C)CCN(C)c1ccc(OC)cc1 845283044 YAOMEQTXPJYRFU-UHFFFAOYSA-N 295.383 2.114 10 20 CECD CN(C)c1ccc(CNC(=O)C2(C(=O)O)CCCC2)cc1 911121612 XREZPLKRCTZZGA-UHFFFAOYSA-N 290.363 2.014 10 20 CECD CCOc1ccc(N(C)CCn2cc([N+](=O)[O-])cn2)cc1 746672711 HLFVDKJEGDCHLQ-UHFFFAOYSA-N 290.323 2.326 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1C[C@@]12CCOC2 846472645 CXAFOZRLYWOPJB-SMDDNHRTSA-N 281.739 2.088 10 20 CECD CC[C@H](NC[C@@H]1CNC(=O)C1)c1cccc(Cl)c1O 840837921 LVJWCRFCYQTDBU-SKDRFNHKSA-N 282.771 2.222 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1ccc(OC)c(C)c1 840959109 UABJSDDEQTYLPN-AWEZNQCLSA-N 277.364 2.435 10 20 CECD C[C@@H]1C[C@H](NCCO[C@H]2CCOC2)c2c(O)ccc(F)c21 927079038 CLGZFMREFYUABA-MDZLAQPJSA-N 295.354 2.475 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](C)N(C)C)c1O 846145142 LTAKUNWAHBWLDQ-GHMZBOCLSA-N 252.358 2.002 10 20 CECD Cc1cc(CN(C)c2ccc3c(c2)OCO3)nc(C)n1 851867550 IOQWGGWOGMMVAO-UHFFFAOYSA-N 271.320 2.459 10 20 CECD C[C@@H](N[C@@H](C(N)=O)c1ccccc1)c1ccc(F)cc1O 756380292 GRDCNQWIGYEZNL-MEBBXXQBSA-N 288.322 2.409 10 20 CECD COc1cccc(O)c1CN1CCS[C@H](C)C1 769320677 UFUWQYPJGLQMPM-SNVBAGLBSA-N 253.367 2.338 10 20 CECD C[C@H]1CC[C@@H](CNC(=O)N[C@H](C)c2ccccc2O)O1 875656933 NIYQOWJLJDYQEM-TUAOUCFPSA-N 278.352 2.320 10 20 CECD CCC(CC)C(=O)N1CCN(Cc2ccccc2O)CC1 778996919 WGUYKWWTYHLSSP-UHFFFAOYSA-N 290.407 2.473 10 20 CECD CCOC(=O)CCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773021060 RGNMBGDBHWAEPO-LBPRGKRZSA-N 292.379 2.273 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2ccc(C)cc2O)C1 877591358 CJIGCKXNYWRACU-INIZCTEOSA-N 277.364 2.476 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@@H](O)C2)cc1F 874448054 MSPSXXINPKKYOS-BETUJISGSA-N 294.370 2.059 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCO[C@H](C)C2)c1 776473488 LDKOGUKSZCEWDH-GRYCIOLGSA-N 293.363 2.393 10 20 CECD COCC1(C)CCN(C(=O)c2ccc(C)c(O)c2O)CC1 781012293 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COc1ccccc1C(=O)NCc1ccc(N)cc1 32109037 TZQOOYOQOMWHEL-UHFFFAOYSA-N 256.305 2.207 10 20 CECD Cc1cccc(O)c1CNCC1([S@@](C)=O)CCC1 877496189 NWLPHLDCEFAIRN-GOSISDBHSA-N 267.394 2.091 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnc(Cl)cn2)cc1 178159797 DWGOCSVUOGNPCG-UHFFFAOYSA-N 290.754 2.126 10 20 CECD CCOC[C@@H]1CCCCN1C(=O)c1cccc(O)c1O 313490719 YZFRCBYINRQAES-NSHDSACASA-N 279.336 2.129 10 20 CECD CCCCNC(=O)[C@H](C)N(C)Cc1ccccc1O 111235243 KIHOXFZNLSFSFP-LBPRGKRZSA-N 264.369 2.129 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2CCCO2)cc1F 69914265 BSTNCVHUSLPXHI-GFCCVEGCSA-N 280.343 2.077 10 20 CECD COCCCCNC(=O)N[C@H](C)c1cc(OC)ccc1O 171735733 PMSDAAHXHVTCEA-LLVKDONJSA-N 296.367 2.188 10 20 CECD COc1cccc(CNC(=O)Cc2ccc(F)cc2)c1O 68488677 YPKSIUHMOWHRGN-UHFFFAOYSA-N 289.306 2.399 10 20 CECD COCCC[C@@H](C)C(=O)NCc1cccc(OC)c1O 182344900 PONAQAQGQWMBCX-LLVKDONJSA-N 281.352 2.080 10 20 CECD C[C@H]1OCC[C@H]1NCc1cccc(Br)c1O 134240049 LCKQFJHWECTGSV-LDYMZIIASA-N 286.169 2.422 10 20 CECD O=C(NCc1ccccc1O)c1snnc1C1CC1 290315282 GEQSWNDCJKTMME-UHFFFAOYSA-N 275.333 2.051 10 20 CECD Nc1ccc(NC(=O)c2ncoc2[C@H]2CCCO2)cc1 238017349 WNUUSGNNSIHSPI-LLVKDONJSA-N 273.292 2.361 10 20 CECD CC(C)Cn1ccnc1NC(=O)Cc1ccc(N)cc1 261689291 DUCBDFRGYZFAKV-UHFFFAOYSA-N 272.352 2.303 10 20 CECD Cc1cccc(CN2CC[C@H](c3nccn3C)C2)c1O 367698782 FYVWODZFXFPZIH-AWEZNQCLSA-N 271.364 2.424 10 20 CECD C[C@@H](NCc1cnnn1C)c1cc2c(cc1O)CCCC2 287475618 WQROONMEVOZBDL-LLVKDONJSA-N 286.379 2.250 10 20 CECD Oc1ccc(F)cc1CNCCO[C@H]1CCCCO1 813333330 LOHHWWVCKCEWDX-AWEZNQCLSA-N 269.316 2.164 10 20 CECD Cc1cc(O)c(CNCCCCC(=O)O)cc1C 821045823 FSSNOYGDGCIQSJ-UHFFFAOYSA-N 251.326 2.354 10 20 CECD CCc1cccc(CN2CC[C@H]3NC(=O)CC[C@@H]3C2)c1O 827134023 ZRPPCKDBSYRAAW-UKRRQHHQSA-N 288.391 2.055 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C(C)C)no2)c1 734015238 BTYJUBFHFGUVON-UHFFFAOYSA-N 290.319 2.442 10 20 CECD CCOCc1cc(CN[C@@H](C)[C@H](C)C(=O)O)ccc1OC 901448777 MTPSANCVQYIDAK-RYUDHWBXSA-N 295.379 2.431 10 20 CECD Cc1ccc(CCNC(=O)c2cc(O)cs2)cn1 732301670 FZQGTNDRZUQCMC-UHFFFAOYSA-N 262.334 2.130 10 20 CECD COC(=O)c1cnc(SC[C@](C)(O)C(F)F)s1 905959811 URTIILVGSDPXCL-VIFPVBQESA-N 283.321 2.038 10 20 CECD CC(C)OC1CCN(C(=O)c2cc(O)cs2)CC1 732289165 DFEHSPHZNKTWFX-UHFFFAOYSA-N 269.366 2.483 10 20 CECD Cc1ccc(CNC(=O)NCc2ccccc2O)nc1C 838060860 LPDGOCFMYXAOEH-UHFFFAOYSA-N 285.347 2.403 10 20 CECD Cc1ncc(CNCc2ccc(N(C)C)c(F)c2)o1 839169824 JLTDKELCVFHFAL-UHFFFAOYSA-N 263.316 2.478 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)N1 843049841 WQRGFJHDQXPQPB-VXGBXAGGSA-N 265.376 2.074 10 20 CECD C[C@@H]1CC[C@@H](C)N1CC(=O)NCc1ccc(N(C)C)cc1 741139158 DBBUXIZVWUKJQU-ZIAGYGMSSA-N 289.423 2.242 10 20 CECD CCc1cccc(CN2CCC(C(=O)OC)CC2)c1O 848876047 GUWQAFHIWJSJOK-UHFFFAOYSA-N 277.364 2.340 10 20 CECD CCOc1ccc(CN[C@H]2CCNC2(C)C)c(O)c1 841085461 DDWIQEDWDPRAFO-AWEZNQCLSA-N 264.369 2.021 10 20 CECD C/C=C\C[C@H](CO)NCc1ccc2c(c1)CCCO2 922007770 FYDLFPZBLBDROL-MPNWYJEXSA-N 261.365 2.428 10 20 CECD O=C1NC(=S)S/C1=C/c1nc(Cl)cs1 759071783 GORYPZTZVQJRQF-HNQUOIGGSA-N 262.768 2.285 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2CC(OC)C2)c1 860241491 JXJOPRJFWHNHOU-BMQDGWLCSA-N 279.336 2.003 10 20 CECD C[C@@H](N[C@H](C)c1ccccc1O)C(=O)NCC(F)(F)F 879649285 PFPFIZLKWUJDDJ-RKDXNWHRSA-N 290.285 2.110 10 20 CECD Cc1ccc(CN(C2CC2)[C@H](C)CS(C)(=O)=O)c(O)c1 876736627 MDNYLYJKSQGEQZ-GFCCVEGCSA-N 297.420 2.098 10 20 CECD COc1ncc(/C=C/C(=O)N(C)c2ccccc2OC)cn1 775806052 GTRNILXWAWSEGC-CMDGGOBGSA-N 299.330 2.170 10 20 CECD C[C@H](N[C@@H]1C[C@@H](O)C1(C)C)c1c(O)cccc1F 886594119 GFWJYGGZTRYAMW-XXILOJSOSA-N 253.317 2.341 10 20 CECD C[C@H](N[C@@H](CO)CC1CC1)c1c(O)cccc1F 886554924 GZSMCJXMCJPRCA-GXSJLCMTSA-N 253.317 2.343 10 20 CECD C[C@H](NCCOC[C@H]1CCCO1)c1c(O)cccc1F 886528801 ROZCEKXEGWRFDU-NWDGAFQWSA-N 283.343 2.378 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)[C@@](C)(CO)C2)c1O 895345872 WYTJJFAVKDWBDG-MLGOLLRUSA-N 279.380 2.160 10 20 CECD COc1ccc(CN[C@@H](CO)CC(C)(C)C)c(O)c1OC 893202801 OGSMIGXGXOSCQJ-GFCCVEGCSA-N 297.395 2.296 10 20 CECD CCOC1CCN(Cc2ccc(OC)c(OC)c2O)CC1 891667843 QGYRJWGDINOTSU-UHFFFAOYSA-N 295.379 2.410 10 20 CECD Cn1cnnc1NCc1ccc(N2CCCC2)cc1 1332715870 JQFOTAJNYFIZHL-UHFFFAOYSA-N 257.341 2.027 10 20 CECD O=C(NCc1ccc(O)cc1O)c1nc(C2CC2)cs1 1349951333 MQSWGPHGTFKNGH-UHFFFAOYSA-N 290.344 2.362 10 20 CECD O=C(O)c1cnc(NCc2cccc(Cl)c2O)nc1 1602533876 RQJWIGGARJBFOS-UHFFFAOYSA-N 279.683 2.146 10 20 CECD C[C@@H](NCCCCCCN)c1cc(C(=O)O)ccc1O 1593265742 WOYMWZGXSPSNRT-LLVKDONJSA-N 280.368 2.260 10 20 CECD C[C@@H](Cn1ccnc1)N[C@H](C)c1cc(C(=O)O)ccc1O 1592929947 FOHDTPZTECXPKH-WDEREUQCSA-N 289.335 2.026 10 20 CECD O=C1NC(=S)S/C1=C/c1cc(C(=O)O)ccc1F 1777698916 MFARWFJPYVLQPZ-XBXARRHUSA-N 283.305 2.013 10 20 CECD Cc1ncccc1CNCc1ccc(C(=O)O)cc1O 1777533230 ICWMAZKBHSSAQB-UHFFFAOYSA-N 272.304 2.084 10 20 CECD COC[C@@H](C)NCc1ccc(N2CCSCC2)cc1 163635879 CAGKHEMISRCSKT-CYBMUJFWSA-N 280.437 2.364 10 20 CECD Nc1ccc(CC(=O)NCc2ccc(F)cc2)cc1 20185659 LTNJGCQPTOYJLJ-UHFFFAOYSA-N 258.296 2.267 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)Cc2cnn(C)c2)c1 825045060 BFDJJOKEWYABHQ-LBPRGKRZSA-N 259.353 2.155 10 20 CECD COc1cccc(O)c1CN[C@H]1CCN(C(C)(C)C)C1 850351469 NCEBFWXQHWHHJO-LBPRGKRZSA-N 278.396 2.363 10 20 CECD Cc1ccc(CN(C)C[C@H]2CCCN(C)C2)c(O)c1 876597165 LYIHNLIJBVYPBH-AWEZNQCLSA-N 262.397 2.474 10 20 CECD Cc1ccc(CNC2CCN(C3CC3)CC2)c(O)c1 876909571 BRPFLCBYIMIGGH-UHFFFAOYSA-N 260.381 2.417 10 20 CECD CC(C)CNC(=O)[C@@H](C)N[C@H](C)c1ccccc1O 135719055 DPKJLZQKCCVJHP-VXGBXAGGSA-N 264.369 2.204 10 20 CECD CCCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 37280105 MHRTTXYDYOHOHE-QWHCGFSZSA-N 277.412 2.318 10 20 CECD CC[C@H]1CN(Cc2cc(OC)ccc2O)CCCO1 281221161 KKULIEDRAOIBHL-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD O=C(O)[C@]12CCC[C@H]1CN(Cc1ccccc1O)C2 701535146 JBADHVNPCHHDQZ-WFASDCNBSA-N 261.321 2.079 10 20 CECD Oc1ccccc1CN1CCO[C@H](C(F)(F)F)C1 698953456 NBVLDNXWTKSLFS-NSHDSACASA-N 261.243 2.155 10 20 CECD Nc1ccc(CC(=O)NCCCOc2ccccc2)cc1 50212089 SLEIMDLHJOAHET-UHFFFAOYSA-N 284.359 2.397 10 20 CECD CCN(C)c1ccc([C@@H](C)NCC(F)(F)CO)cc1 184693568 OAHSBNADKUJCNH-LLVKDONJSA-N 272.339 2.421 10 20 CECD COc1ccc(N(C)CC(=O)N(C)C2CC2)cc1Cl 121926607 UWTGDZURQCGUKC-UHFFFAOYSA-N 282.771 2.406 10 20 CECD CC[C@@H](N[C@H](C)CCS(C)(=O)=O)c1ccccc1O 156382877 RAMRENSWCTXHIL-DGCLKSJQSA-N 285.409 2.256 10 20 CECD Cc1cc(C(=O)N2CC(CO)C2)c(C)n1-c1ccccc1 184222168 ZLRJZPZBPORNGL-UHFFFAOYSA-N 284.359 2.158 10 20 CECD COC(=O)COc1ccc(N(C)CCCOC(C)C)cc1 183802887 ACUJSYCPNPCBGK-UHFFFAOYSA-N 295.379 2.490 10 20 CECD C[C@@H](C[C@@H](C)O)NCc1cc(Br)ccc1O 228562078 TYRGURJMKIJYCI-DTWKUNHWSA-N 288.185 2.404 10 20 CECD COc1ccc(N2CCN(C(=O)C(C)C)CC2)cc1F 84815167 HILVYPWNZIATJT-UHFFFAOYSA-N 280.343 2.139 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](N(C)C)C2)cc1F 130142518 ITTHGDRWVQMISZ-CQSZACIVSA-N 279.403 2.418 10 20 CECD COC(=O)CN(Cc1cc(C)ccc1O)C(C)C 93287317 XYAHJPCJLFBEPE-UHFFFAOYSA-N 251.326 2.084 10 20 CECD CC[C@H](N)C(=O)NCc1ccc(N(CC)CC)c(F)c1 236914162 MWRRWUKJODOJHK-ZDUSSCGKSA-N 281.375 2.025 10 20 CECD Oc1cc2c(cc1CN[C@H]1CCCc3cn[nH]c31)OCO2 268883923 YNRQJEKRXDLXNK-NSHDSACASA-N 287.319 2.011 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 271888830 JLJPZKSIWORXNF-DGCLKSJQSA-N 294.370 2.323 10 20 CECD Cc1cc(C)c([C@@H](C)NCCc2n[nH]c(C)n2)c(O)c1 285318667 SWYKZULYURUOFL-LLVKDONJSA-N 274.368 2.329 10 20 CECD COc1cc(O)c(CN2CC[C@@H](OC)C[C@@H]2C)cc1OC 282364303 PVYMTIWKKMZDDS-WCQYABFASA-N 295.379 2.409 10 20 CECD CN1CC[C@@]2(CCN(Cc3ccc(N(C)C)cc3)C2)C1 292183463 QSURATSTPZPEII-QGZVFWFLSA-N 273.424 2.280 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)N[C@H](C)[C@H](C)OC)c1 811957593 GCURIWUEJJYLSZ-VWYCJHECSA-N 296.367 2.184 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)NC(C)C)C2)cc1 818049400 YPCZONOAOKCQQP-CYBMUJFWSA-N 291.395 2.229 10 20 CECD CNC[C@@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 818608079 LIASQXGNALLGAR-CQSZACIVSA-N 291.439 2.345 10 20 CECD C[C@@H](CN)N[C@H](C)c1ccc(N2CCOCC2)cc1Cl 817970566 ZZTNMZHXVGYIAY-NWDGAFQWSA-N 297.830 2.174 10 20 CECD COc1ccc(N2CCC(NCCCC(=O)O)CC2)cc1 818593820 QVCITPMWFFYJGL-UHFFFAOYSA-N 292.379 2.118 10 20 CECD CNC(=O)C[C@@H](C)NCc1ccc2ccccc2c1O 825068552 SLDQLBNNZJLYRN-LLVKDONJSA-N 272.348 2.160 10 20 CECD C[C@@H](Cc1ccco1)NC(=O)c1cc(O)cs1 732271679 OJCYFKOWMRTDER-QMMMGPOBSA-N 251.307 2.408 10 20 CECD Cc1ccc([C@@H](C)NC[C@H]2CCCN2CCCO)c(O)c1 834850404 LXWZMWNTEXMLOG-HUUCEWRRSA-N 292.423 2.198 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CCCOC2)c1O 846143575 JPZBVYHWUHUFLD-NWDGAFQWSA-N 265.353 2.478 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]1C1CCC1 845833114 CUCMZFATFLSMCI-NWDGAFQWSA-N 261.321 2.150 10 20 CECD C[C@H](N[C@H]1CCN(CC(F)F)C1)c1ccccc1O 841765337 PPCSOUJHDPBDCQ-QWRGUYRKSA-N 270.323 2.382 10 20 CECD COCC1(NCc2ccc(N(C)C)cc2C)CCOCC1 840950354 MQOMWEUMJXRXKN-UHFFFAOYSA-N 292.423 2.346 10 20 CECD N=C(NCc1cc(Cl)ccc1O)NCC1CCC1 849049572 SAXPOBGOXMKJFQ-UHFFFAOYSA-N 267.760 2.460 10 20 CECD Cc1cc(CNC(=O)C(C)(C)N)c(C)n1-c1ccccc1 859601037 ATFJALKLHHMPRK-UHFFFAOYSA-N 285.391 2.448 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)c1noc(C(F)F)n1 854920996 HOCRRQBRHCSLON-SCSAIBSYSA-N 289.263 2.265 10 20 CECD COc1ccc(N(C)Cc2nncs2)c(OC)c1 930077593 TXXGJBUSHKIOEV-UHFFFAOYSA-N 265.338 2.192 10 20 CECD C[C@@H](NC(=O)NC[C@@]1(C)CCCO1)c1ccccc1O 868384684 FVEYHUVXBMKCOU-IAQYHMDHSA-N 278.352 2.322 10 20 CECD COC(=O)c1cncc(CN[C@H](C)c2ccccc2O)c1 931554776 RWXULSFMBMBRNV-LLVKDONJSA-N 286.331 2.425 10 20 CECD CO[C@]1(CN[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)CCOC1 763570477 FEFZJCSOYIJWJQ-SIVJFFJCSA-N 295.354 2.475 10 20 CECD Cc1ccc(CN(C)CC(=O)NCc2ccccc2)c(O)c1 876755034 IYBDVJGMHDFULX-UHFFFAOYSA-N 298.386 2.449 10 20 CECD OC[C@H]1C[C@@H](NCc2ccc3ccccc3c2O)C1 877666827 IPGVHJOSPRYDQK-VDISTLRHSA-N 257.333 2.406 10 20 CECD C[C@H](NC(=O)c1cnns1)c1ccc(N(C)C)cc1 773007373 HTLQWQPMTWYWMS-VIFPVBQESA-N 276.365 2.095 10 20 CECD CCOC(CCNCc1cc([N+](=O)[O-])ccc1O)OCC 786834065 IWAXVZMKQYFHSH-UHFFFAOYSA-N 298.339 2.179 10 20 CECD COCCOC[C@@H](C)NCc1ccc2c(c1)CCCN2C 892733850 UXFMPGZNPAXSQU-CQSZACIVSA-N 292.423 2.210 10 20 CECD COc1ccc(CN[C@H](C)C2CCOCC2)c(O)c1OC 893120137 GRVULOALYUPSQR-LLVKDONJSA-N 295.379 2.314 10 20 CECD Cc1ccc(CN2[C@H](C)C(=O)N(C)[C@@H](C)[C@H]2C)c(O)c1 895923592 WZKKJAPNBFMTAW-YNEHKIRRSA-N 276.380 2.140 10 20 CECD Oc1cc(NCc2ccc(N3CCCC3)cc2)ncn1 891797554 VTOBHAMRHMKGNB-UHFFFAOYSA-N 270.336 2.395 10 20 CECD CCOc1ccc(N(C)Cc2oncc2C(=O)OC)cc1 795918086 KPCBLIOHXDZJRS-UHFFFAOYSA-N 290.319 2.496 10 20 CECD CCOCCCNCc1cc(C)cc(OC)c1O 894157741 YMPLYKHQYYDNSK-UHFFFAOYSA-N 253.342 2.225 10 20 CECD C[C@@H]1CCCN1CCNC(=O)N(C)Cc1ccccc1O 897478084 KEBCOLNEAIZCQS-CYBMUJFWSA-N 291.395 2.018 10 20 CECD C[C@H](N[C@@H](C)c1cc(F)cc(F)c1O)C(=O)N1CCCC1 798936241 ANMJJBCBUXDUEK-UWVGGRQHSA-N 298.333 2.332 10 20 CECD COc1ccc(CNC(=O)COC2CCCCC2)c(O)c1 794379519 OPMUBTIWLBLTSC-UHFFFAOYSA-N 293.363 2.366 10 20 CECD CCCn1ncnc1CN(C)c1ccc(OC)c(OC)c1 790273171 WDUMLBISJKXKNN-UHFFFAOYSA-N 290.367 2.342 10 20 CECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)c1cccc(O)c1O 790729294 KIKYJSCYJJPCSC-ZDUSSCGKSA-N 299.330 2.004 10 20 CECD O=C(O)C1(CNCc2ccc3c(c2)CCO3)CCCC1 756302411 SNGHPVXHYSNPNL-UHFFFAOYSA-N 275.348 2.356 10 20 CECD CC[C@@H](NC[C@H]1CCCCS1(=O)=O)c1ccccc1O 694591868 WUQZTIWNNVJSTO-TZMCWYRMSA-N 297.420 2.400 10 20 CECD C[C@@H]1C[C@H](NCc2ccc3c(c2)CCO3)CCN1C 90720249 FNDIGJYMDPSVHM-IUODEOHRSA-N 260.381 2.194 10 20 CECD C[C@H](CCO)CNCc1cc(F)c(N(C)C)cc1F 1328757132 LTUBBFLZONWDFS-SNVBAGLBSA-N 272.339 2.139 10 20 CECD CCC[C@@](C)(O)CNCc1ccc(OC)c(OC)c1O 1333722690 FVUTYDKLWVRYTO-OAHLLOKOSA-N 283.368 2.050 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@@H]1F)c1ccc(N(C)C)cc1 1349583178 GGZVHMIGXHTNPP-BIMULSAOSA-N 250.317 2.288 10 20 CECD COc1cccc(CNC(=O)c2cnoc2C(C)C)c1O 1519816697 GUVYQAYCXGCPAW-UHFFFAOYSA-N 290.319 2.442 10 20 CECD COc1cccc(CNCc2cccc(CO)c2)c1O 222110789 PQOMVWQNOIXOET-UHFFFAOYSA-N 273.332 2.183 10 20 CECD Cc1cc(O)c(CN[C@H](CC2CC2)C(=O)O)cc1C 1607700395 ZIMNNWIJVUTDOM-CYBMUJFWSA-N 263.337 2.352 10 20 CECD O=C(O)[C@H](CC(F)(F)F)NCc1cc(F)ccc1O 1610716288 ZCTSPIWTOHJFMV-QMMMGPOBSA-N 281.205 2.027 10 20 CECD CCN1CCCc2cc(CN[C@@H](C)CC(=O)O)ccc21 1776875192 OCMVRFFHKULGDY-LBPRGKRZSA-N 276.380 2.412 10 20 CECD CCN1CCc2cc(CN=c3cc[nH]cc3C(=O)O)ccc21 1776878059 ZKZQXJVBKNLOIY-UHFFFAOYSA-N 297.358 2.196 10 20 CECD O=[N+]([O-])c1cnn(CCSc2nccs2)c1 153815096 QUWXEIPWJBZQKC-UHFFFAOYSA-N 256.312 2.040 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]2C(C)(C)O)c1 154431087 GWBRCBQEBQLKAU-AWEZNQCLSA-N 265.353 2.136 10 20 CECD CCOc1cccc(CN[C@H](C)c2ccn(C)n2)c1O 839189676 BPFGVPZPWZFOTE-LLVKDONJSA-N 275.352 2.375 10 20 CECD Cc1ccc(CNCCCOC[C@@H]2CCCO2)c(O)c1 876900777 QVQMNVWXVJTOIY-HNNXBMFYSA-N 279.380 2.376 10 20 CECD Oc1c(Br)cccc1CNc1nnco1 308901838 CGTCDZNUKITJIH-UHFFFAOYSA-N 270.086 2.150 10 20 CECD CCOc1cccc(CNC[C@H](CO)C(C)C)c1O 394049346 YXDOROVTSGJDFI-CYBMUJFWSA-N 267.369 2.145 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](CO)C(C)C)c1 394028008 IFBNLBJBWGTOMR-NWDGAFQWSA-N 267.369 2.316 10 20 CECD CN(CC(=O)NCc1ccccc1)Cc1ccccc1O 109770324 SRGIOJPFZIVACT-UHFFFAOYSA-N 284.359 2.140 10 20 CECD COc1cccc(CNC(=O)CC[C@H]2CC[C@@H](C)O2)c1O 175928768 IXXXBYKQFYVSPH-DGCLKSJQSA-N 293.363 2.365 10 20 CECD CO[C@]1(CNCc2ccc(N3CCCC3)cc2)CCOC1 122875809 VMRARQLKMDMKPW-KRWDZBQOSA-N 290.407 2.182 10 20 CECD COCCN(C[C@@H](C)OC)c1ccc(OC)c(OC)c1 182342629 FACJPJSNBLNXPS-GFCCVEGCSA-N 283.368 2.192 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCO2)cc1 79389924 GBWBSMLAANUPDR-HNNXBMFYSA-N 276.380 2.328 10 20 CECD CC1(C)C[C@H](NC(=O)NCc2ccccc2O)CCO1 269984313 JDRGFRHUYLCLBX-GFCCVEGCSA-N 278.352 2.149 10 20 CECD CSc1ccccc1C(=O)N1CC[S@](=O)[C@@H](C)[C@H]1C 265493014 ILSLUNIBBRVORK-FDMGOTLNSA-N 297.445 2.390 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1nnc(C)n1C 270834653 DOFWVZWHLTWITE-UHFFFAOYSA-N 286.379 2.475 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H]2CCCO2)c1 273426115 UEBSIJBKOUSANV-ZYHUDNBSSA-N 279.336 2.008 10 20 CECD CN(C)c1ccc(OCC(=O)NCc2ccco2)cc1 277759163 KFDWRABWMPMAJX-UHFFFAOYSA-N 274.320 2.041 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H]3CCN(C)C[C@@H]32)c1 272609191 KDYYAKKCWJXRPJ-CJNGLKHVSA-N 290.407 2.317 10 20 CECD NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1Cc1cc(Cl)ccc1O 373739232 VOHJHMFYEHLAQR-WFBYXXMGSA-N 294.782 2.131 10 20 CECD CN(C)c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1F 276020153 QSSSCCFIQYVTFG-HNNXBMFYSA-N 280.387 2.485 10 20 CECD COc1cc(O)c(CN2CC[C@@H](OC)C[C@H]2C)cc1OC 282364297 PVYMTIWKKMZDDS-DGCLKSJQSA-N 295.379 2.409 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CC(F)(F)F 808093941 ZYFJPJGQMPYHFC-UHFFFAOYSA-N 282.258 2.447 10 20 CECD CC1(C)COCCN1CCN[C@H]1CCc2cccc(O)c21 297734114 NRKJSKFZKLCSOE-AWEZNQCLSA-N 290.407 2.080 10 20 CECD Cc1cc(O)c(CN(C)C[C@@H](O)C(F)(F)F)cc1C 809750744 GDGQSPRAHCNPDX-GFCCVEGCSA-N 277.286 2.364 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](C)C[C@H](CO)C2)c1 817412923 QZCRPWYOCPIYDS-STQMWFEESA-N 279.380 2.241 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2CNCCCO2)c(O)c1C 817982240 PSXQDRBTLFCHLM-KGLIPLIRSA-N 278.396 2.038 10 20 CECD CC1(CCNCc2cc(Cl)c(F)cc2O)OCCO1 816569815 XPSGWSAHOGQWRP-UHFFFAOYSA-N 289.734 2.427 10 20 CECD CC(C)[C@@H](N)CN[C@@H](C)c1cc(F)cc(F)c1O 817959895 WKGLEXBEOPAZRZ-UFBFGSQYSA-N 258.312 2.304 10 20 CECD CCc1cccc(CNC[C@H](CO)CC2CC2)c1O 827359608 QFJJLROEFJAMLF-CYBMUJFWSA-N 263.381 2.453 10 20 CECD CCOCc1cc(CNC[C@H](C)N(C)C)ccc1OC 824988007 FXYBPVALPFMYIP-ZDUSSCGKSA-N 280.412 2.271 10 20 CECD COC[C@H]1CCCCN1C(=O)c1cc(O)cs1 839794665 ZQTDXBPCGYIWJP-SECBINFHSA-N 255.339 2.095 10 20 CECD O=C(NC[C@H](O)C1CCCCC1)c1cc(O)cs1 732284826 DDBZVDOBAPDMBQ-NSHDSACASA-N 269.366 2.125 10 20 CECD Cc1nccc(C(=O)N(C)Cc2ccc(N(C)C)cc2)n1 917390934 BAEXGSWIGQJAFD-UHFFFAOYSA-N 284.363 2.123 10 20 CECD C[C@H](NC[C@@H](O)C1CCC1)c1cc([N+](=O)[O-])ccc1O 834906977 VKXKWIRUHPWOPK-LKFCYVNXSA-N 280.324 2.112 10 20 CECD CN(C)c1ccc([C@H]2NC3(CCCC3)C(=O)N2C)cc1 742438316 ANTZOOPZWVWKGR-AWEZNQCLSA-N 273.380 2.126 10 20 CECD NC[C@@H]1CC[C@@H](NCc2cc(Br)ccc2O)C1 841084521 KFPXFGAKUOIWCZ-BXKDBHETSA-N 299.212 2.372 10 20 CECD CC[C@@H](SC)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 844163224 VVDSKXPACXIPDT-ZIAGYGMSSA-N 295.452 2.010 10 20 CECD C[C@@H](CCCN)NCc1c(O)ccc(Cl)c1F 841080046 NFTVXPFSOJFBIQ-QMMMGPOBSA-N 260.740 2.402 10 20 CECD C[C@]1(C(=O)NCc2cc(Cl)ccc2O)CCOC1 846472630 CHLVOCJWSSIJNZ-ZDUSSCGKSA-N 269.728 2.088 10 20 CECD COc1cccc([C@H](C)NC[C@@]2(C)CCOC2)c1O 846143411 FKEDIWGEIAXHON-XHDPSFHLSA-N 265.353 2.478 10 20 CECD COc1ccc(O)c(CNC[C@@H]2NCCc3ccccc32)c1 841068730 IMNLFOFQCUPRLX-KRWDZBQOSA-N 298.386 2.377 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]([C@H](C)N)C2)c1O 843353952 RUQGEWPQYLFFLR-CMPLNLGQSA-N 294.370 2.293 10 20 CECD CCOc1ccc(CN[C@@H]2CCC[C@@H](N)C2)c(O)c1 841054622 FVRRXICRXYJECQ-CHWSQXEVSA-N 264.369 2.150 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCCF 854325139 ZMJOPZRTBSMGTN-UHFFFAOYSA-N 252.333 2.461 10 20 CECD COCCOCCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756462681 YPCKEVUJOZSPIO-PWSUYJOCSA-N 283.343 2.332 10 20 CECD COCC1(NC(=O)/C=C\c2ccc(O)c(O)c2)CCCC1 855217622 BZZXXAPVTKAWHH-ALCCZGGFSA-N 291.347 2.186 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@H]1CCC(=O)N(C)C1 862428188 NBFCIHODEVYIQP-INIZCTEOSA-N 289.423 2.114 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@]2(C)CCCCO2)c1 862754931 LMWRRMCNFPMWTQ-HNNXBMFYSA-N 263.337 2.276 10 20 CECD CCOC(=O)[C@H]1CSCCN1Cc1cc(C)ccc1O 768230010 PYZPBQQEVYJDLC-CYBMUJFWSA-N 295.404 2.181 10 20 CECD C[C@@H]1C[C@@H](CO)CN(Cc2cc(F)c(N(C)C)cc2F)C1 862396070 GQIXRLRNOBHFNX-VXGBXAGGSA-N 298.377 2.481 10 20 CECD CCCOc1ccc(CN[C@@]2(CCO)CCOC2)cc1C 873115097 GGKTYCWVAUZRQQ-KRWDZBQOSA-N 293.407 2.415 10 20 CECD CC[C@H](NCCNc1cnccn1)c1ccccc1O 775512687 AGPKWECVUBTMNZ-ZDUSSCGKSA-N 272.352 2.335 10 20 CECD CN(C)c1ccc(CNC(=O)COC2(C)CCC2)cc1F 773047479 JXIPRKQOEZANOY-UHFFFAOYSA-N 294.370 2.467 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2c3c[nH]nc3CC[C@@H]2C)c1 880837963 WKLDKXSMCJUSRU-ZBEGNZNMSA-N 299.374 2.406 10 20 CECD CCCCO[C@@H](C)C(=O)OCC(=O)c1ccc(O)c(O)c1 783217322 OKZPVHHZXWSWKX-JTQLQIEISA-N 296.319 2.029 10 20 CECD CCCC[C@@H](NCc1cc(F)cc(F)c1O)C(=O)OC 894468779 CVTQUQGPTIEKQU-GFCCVEGCSA-N 287.306 2.492 10 20 CECD C[C@@H](O)CN(C)Cc1cc(Br)cc(F)c1O 894449854 FBYMMCRNXDMPGB-SSDOTTSWSA-N 292.148 2.106 10 20 CECD COc1cc(C)cc(CNCC[C@H](C)OC)c1O 894214955 LXNFVVNQMVENQR-NSHDSACASA-N 253.342 2.224 10 20 CECD COCCO[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 276085360 XJZVMUMVPOMCMQ-LLVKDONJSA-N 285.771 2.283 10 20 CECD CCOc1cccc(CN2CCC[C@@H]([C@@H](C)N)C2)c1O 70171604 PNSSTLQJRWWKIR-CHWSQXEVSA-N 278.396 2.350 10 20 CECD Cc1ccc(C(=O)OC[C@H]2CCC[C@@H](O)C2)c(O)c1O 795375387 UBBRIPWTXYBTNV-WDEREUQCSA-N 280.320 2.114 10 20 CECD COc1ccc(CNC(=O)c2ccnc(C)c2)c(O)c1 794373910 OMNIIMLOIXOHHE-UHFFFAOYSA-N 272.304 2.034 10 20 CECD CN1C(=O)C(=Cc2ccc(C(F)F)cc2)C(=O)N(C)C1=O 794865506 JBEZZJGOHDEUKR-UHFFFAOYSA-N 294.257 2.058 10 20 CECD CCc1ncoc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 1336432782 KAEFFJFBIWOBEZ-SECBINFHSA-N 290.319 2.009 10 20 CECD CCOCCN(C)c1nnc(-c2sccc2O)n1CC 1352318539 DCOXTTNUBIPVFH-UHFFFAOYSA-N 296.396 2.205 10 20 CECD CCc1nn(C)cc1NCc1cccc(OC)c1O 222951119 QJKRUSISUWVAEY-UHFFFAOYSA-N 261.325 2.309 10 20 CECD CCN(CC(=O)O)Cc1c(O)ccc(Cl)c1F 1605415726 NDGLKPAMRKUYDJ-UHFFFAOYSA-N 261.680 2.091 10 20 CECD Cc1cc(Br)cc(CN2CCC23CNC3)c1O 1579551904 ZQVUPCLKWHOXIO-UHFFFAOYSA-N 297.196 2.011 10 20 CECD CCN(C)c1ccc(CN[C@H]2C[C@@H](C(=O)O)C2)c(C)c1 1776856644 ZSZHOSNOORAJBK-OKILXGFUSA-N 276.380 2.404 10 20 CECD O=C(CC[C@@H]1CCCCO1)NCc1ccccc1O 134524543 DLXIENVOKQYFLP-ZDUSSCGKSA-N 263.337 2.358 10 20 CECD Cc1cc(O)c(CN2CC[C@H](CN(C)C)C2)cc1C 153141419 PNWFCWFPXVTYBI-CQSZACIVSA-N 262.397 2.393 10 20 CECD COc1cccc(O)c1CN1CC[S@@](=O)C(C)(C)CC1 825024747 UBCLPYRRPWRTIO-HXUWFJFHSA-N 297.420 2.134 10 20 CECD Cc1nc(C(=O)N[C@H](C)c2ccccc2O)c(C)o1 827952505 VUSWITKTHFEROY-MRVPVSSYSA-N 260.293 2.488 10 20 CECD Cc1cccc(CN2CCN(CC(F)(F)F)CC2)c1O 158023553 LORAWTIMESYTHS-UHFFFAOYSA-N 288.313 2.381 10 20 CECD COc1cccc(CN[C@H]2C[C@H](OC)C23CCC3)c1O 713480294 FSRPMKAYZFINLI-KBPBESRZSA-N 277.364 2.448 10 20 CECD C[C@@H](NCCc1cnccn1)c1cc(F)ccc1O 390038512 IVCXKABDVIGBIM-SNVBAGLBSA-N 261.300 2.215 10 20 CECD CCC(C)(C)C(=O)NCc1cccc(OC)c1O 105650641 XZPXYKAISLNCMB-UHFFFAOYSA-N 251.326 2.453 10 20 CECD COc1cccc(CNC(=O)[C@@H](C)C(C)C)c1O 172159634 RVZDPLNVDQXUAV-JTQLQIEISA-N 251.326 2.309 10 20 CECD CN(C)C(=O)c1ccccc1NC(=O)Cc1ccc(N)cc1 66153876 XXLIEBIEYQGYBG-UHFFFAOYSA-N 297.358 2.152 10 20 CECD Cc1cc(C(=O)Nc2cnn(C)c2)c(C)n1-c1ccccn1 25310727 IWVQYZXGOCNFLH-UHFFFAOYSA-N 295.346 2.475 10 20 CECD COc1cccc(CN[C@@H]2CCO[C@@H](C)C2)c1O 219886637 SMISRQXKBQMJBK-CMPLNLGQSA-N 251.326 2.058 10 20 CECD CC1(C)[C@@H](O)C[C@@H]1NCc1c(O)cccc1Cl 128336069 NCNRIPJIRZTOBQ-RYUDHWBXSA-N 255.745 2.295 10 20 CECD CCO[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)C12CCC2 187129809 KNTVIICLYNTGCU-STQMWFEESA-N 291.347 2.175 10 20 CECD Cc1ccc(C(=O)NCC[C@H]2CCCCO2)c(O)c1O 183226133 ODNNLIVSNDWLJJ-LLVKDONJSA-N 279.336 2.095 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@@H]1C 188115620 IIFVBKSXUCDAOR-BBRMVZONSA-N 290.407 2.384 10 20 CECD COCCCN(C)CCN[C@H](C)c1cc(F)ccc1O 185554235 GBSNWUFLJYBKNE-GFCCVEGCSA-N 284.375 2.150 10 20 CECD C[C@H](CN(C)Cc1cc(Cl)ccc1O)C(=O)O 86806817 UWNJTJOSBPTFIR-MRVPVSSYSA-N 257.717 2.198 10 20 CECD Cn1ccc(CCNCc2c(O)cccc2Cl)n1 230881785 LQFKKAAEBBCZBG-UHFFFAOYSA-N 265.744 2.111 10 20 CECD C[C@@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(N(C)C)cc1 90181697 COCMTYZNVRRTET-OCCSQVGLSA-N 287.407 2.167 10 20 CECD Cc1ccc([C@H](O)CNCc2cc([N+](=O)[O-])ccc2O)o1 265934481 DVAINQAGOVSLER-CYBMUJFWSA-N 292.291 2.025 10 20 CECD C[C@@H](O)CCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 278964370 BPWJSQKGZDDBJX-NXEZZACHSA-N 268.313 2.112 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1c(C)cc(C)cc1O 284277543 XGABCKVNMXJGBC-CZUORRHYSA-N 281.396 2.447 10 20 CECD CCN(C)c1ccc([C@@H](C)NCc2cnnn2C)cc1 287435086 TZDUNZSTDOMJKJ-GFCCVEGCSA-N 273.384 2.122 10 20 CECD CC[C@H](NC[C@@]1(O)CCOC1)c1cccc(Cl)c1O 287277821 BHZBZNGUVSUQDP-JSGCOSHPSA-N 285.771 2.238 10 20 CECD CN(C)c1ccc(CNc2cccc(OCC(N)=O)c2)cc1 378923863 ZWFVVCZSSDTYIC-UHFFFAOYSA-N 299.374 2.229 10 20 CECD Cc1cccc(CN[C@@H]2CCC(=O)N[C@H]2C(C)(C)C)c1O 289872997 RKIASZKXXPDIHA-CZUORRHYSA-N 290.407 2.484 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](c3nccn3C)C2)c1 377888020 HWJAAMVXHBEXMQ-GFCCVEGCSA-N 287.363 2.124 10 20 CECD CC(C)[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCCO1 295431966 UXPCWYHHYCLKBD-LBPRGKRZSA-N 297.326 2.124 10 20 CECD CN(C)c1ccc(CNCc2c[nH]c3nccnc23)cc1 290929342 RSVXLTJNBWSRBJ-UHFFFAOYSA-N 281.363 2.314 10 20 CECD CCCn1ncnc1CSc1ncc(C(=O)OC)s1 295327919 OUGHKXDYAMFZHJ-UHFFFAOYSA-N 298.393 2.224 10 20 CECD CCC(CC)(CNC(=O)NCc1ccccc1O)OC 291940113 SXEIGOQDCLKVTP-UHFFFAOYSA-N 280.368 2.397 10 20 CECD C[C@@H](N[C@H]1CCNC1)c1cc2c(cc1O)CCCC2 817945224 XMXIMGCVTGDOJT-RISCZKNCSA-N 260.381 2.284 10 20 CECD COc1ccc(O)c(CNC[C@H](CC(C)C)C(=O)O)c1 818630465 JXESJEUHKPYBQW-LBPRGKRZSA-N 281.352 2.237 10 20 CECD Cc1occc1CNC(=O)NCc1ccccc1O 726237380 RYNZXLDZDZMXQI-UHFFFAOYSA-N 260.293 2.293 10 20 CECD CCOc1ccc(CNC[C@H](C)CCCO)c(O)c1 824603399 RIIXIVGKWWZXQG-GFCCVEGCSA-N 267.369 2.289 10 20 CECD CCc1ncc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 588407383 TYDHWBXMPDMENC-XQRVVYSFSA-N 285.303 2.102 10 20 CECD CN(C)c1ccc([C@H](N)CNCc2ccc(CN)cc2)cc1 904353227 JJWVZFODBCIOJY-GOSISDBHSA-N 298.434 2.001 10 20 CECD CNC(=O)C[C@H](C)N[C@H](C)c1cc(Cl)ccc1O 834900099 MDYKYEVSJSDNQG-DTWKUNHWSA-N 270.760 2.221 10 20 CECD CC1=C(C(=O)O)C[C@@H](CSc2nccs2)O1 833580684 IHPCWZSXCVZPNB-ZETCQYMHSA-N 257.336 2.383 10 20 CECD CN(C)c1ccc(CNC[C@@]2(C)CCOC2)cc1F 733328537 ZVOCGZOZSILDFD-OAHLLOKOSA-N 266.360 2.408 10 20 CECD CC(C)O[C@H]1C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 837724836 KCCOIKCZMFGDTA-KMUUFKDPSA-N 291.347 2.183 10 20 CECD CC(C)N(CC(=O)O)Cc1ccc(N(C)C)c(F)c1 833497293 CKIOPDOOIAYLIN-UHFFFAOYSA-N 268.332 2.187 10 20 CECD Cc1cc(CN(C)C[C@H](C)C(=O)O)ccc1N(C)C 846226023 WXXCGQVUXSTKNU-LBPRGKRZSA-N 264.369 2.214 10 20 CECD NC[C@@H]1CCCC[C@@H]1NCc1cc(F)ccc1O 841031322 ROTYXBNHUPSCTB-GWCFXTLKSA-N 252.333 2.138 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H](C)c1cc(Cl)ccc1O 842909546 IRLIDWRZDORRDB-RLCGTCKNSA-N 271.744 2.110 10 20 CECD O=C(CC[C@@H]1CCCCO1)NCc1ccc(O)cc1O 910954837 MOUUIKJFMWNXSW-ZDUSSCGKSA-N 279.336 2.063 10 20 CECD CC[C@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@@H](C)O 842250738 KKFAGRVANMSCMD-ZOWXZIJZSA-N 278.396 2.337 10 20 CECD COc1cccc([C@@H](C)NCC2(OC)CCOCC2)c1O 846157819 XOGOHHQGWJAEHY-GFCCVEGCSA-N 295.379 2.247 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@@H](C)c1cc(Cl)ccc1O 840826235 IRLIDWRZDORRDB-LJUAHTATSA-N 271.744 2.110 10 20 CECD COc1ccc(OCC(=O)NCc2ccccc2O)cc1 748352999 HBDRHBVLNGFTQM-UHFFFAOYSA-N 287.315 2.096 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2[C@H](C)N)c1O 843346102 LSVAJBNEGJGCIP-ZUZCIYMTSA-N 294.370 2.436 10 20 CECD CCNC(=O)[C@H](C)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756355141 JMQLDYWDMHFPPD-WCABBAIRSA-N 280.343 2.194 10 20 CECD CCn1ccnc1C(=O)NCc1cc(Cl)ccc1O 857548170 HBTHELLGKSXQRK-UHFFFAOYSA-N 279.727 2.192 10 20 CECD CN(C)c1cc(F)c(CNC[C@@H]2CCOC2)cc1F 858093995 JGQRXXBBZPTFBJ-JTQLQIEISA-N 270.323 2.157 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C(=O)O)[C@H](C)C2)c1 863738842 FOXKWBXGXHMLRY-RISCZKNCSA-N 293.363 2.334 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H]1C 768465202 YNNSFAYHGUBEGW-RULNRJAQSA-N 263.337 2.048 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2C[C@H]3COC[C@H]3C2)c1O 872267222 ULPMSRJRDBBCJJ-AOOOYVTPSA-N 298.726 2.032 10 20 CECD CCN[C@@H](C)C(=O)NCc1ccc(N(CC)CC)c(F)c1 876756218 QWLMDMFMIXFEKI-LBPRGKRZSA-N 295.402 2.286 10 20 CECD CCOCc1nc([C@H](C)NCc2ccc(C)cc2O)no1 877541101 LJOPKRGXGMHEKP-NSHDSACASA-N 291.351 2.471 10 20 CECD COc1ccc(O)c(CN(C)[C@H](C)C(=O)NC(C)(C)C)c1 777218564 BLVDLSPYBDZNBS-LLVKDONJSA-N 294.395 2.136 10 20 CECD Nc1cccc(C(=O)NCCCSc2nccs2)n1 1118199071 AJAOORQDKWFMBE-UHFFFAOYSA-N 294.405 2.033 10 20 CECD Cc1cccc(O)c1CNCC[S@](=O)C(C)(C)C 877056949 XXANVYOABIYWSM-SFHVURJKSA-N 269.410 2.337 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H](OCC2CC2)C1 779428250 LCRSBDFDSAFIFP-GFCCVEGCSA-N 281.377 2.485 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2CCCOC2)cc1 784563770 JTLNHOSDTQKFIQ-ZDUSSCGKSA-N 293.363 2.101 10 20 CECD CC(C)[C@H](CO)CN[C@H](C)c1c(O)cccc1F 886609629 YCRPSDWDQDLQEH-MNOVXSKESA-N 255.333 2.446 10 20 CECD CN1CCN(c2ccc(CN3CC[C@@H](CF)C3)cc2)CC1 895571955 CQGYZFIJYQFGRZ-INIZCTEOSA-N 291.414 2.230 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)cc2)[C@H](C)C1 796316770 PETLCGFDHLCRHT-CQSZACIVSA-N 261.413 2.279 10 20 CECD COc1ccc(CNC(=O)c2ccc(C)nc2)c(O)c1 794376140 AVOPLVRYLYRYIX-UHFFFAOYSA-N 272.304 2.034 10 20 CECD C[C@H](CC[S@@](C)=O)NCc1c(O)ccc(Cl)c1F 790976684 LAXOSGXQYXKYGR-NTCNTBNZSA-N 293.791 2.431 10 20 CECD CC[C@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)OC 790913735 SHJUFGSVEFVHDX-SMDDNHRTSA-N 292.379 2.129 10 20 CECD COc1cccc(O)c1CN1CCC(OC)CC1 768215456 GZBSUYUSDOXHBK-UHFFFAOYSA-N 251.326 2.012 10 20 CECD COc1cc(C)cc(CNCC2([S@@](C)=O)CCC2)c1O 1334368463 VJUVIMMIZHAXCF-HXUWFJFHSA-N 297.420 2.100 10 20 CECD Nc1ccc(CN2CCN(Cc3cscn3)CC2)cc1 1336116036 ACEZFKFYFJZNOD-UHFFFAOYSA-N 288.420 2.043 10 20 CECD NCC[C@H]1CN(C(=O)Cc2ccc(N)cc2)c2ccccc21 1344446850 BWKCKFRHTZSRSZ-AWEZNQCLSA-N 295.386 2.291 10 20 CECD CC(C)c1nocc1C(=O)NCc1cccc(O)c1O 1347232741 BFOCISIBJIVPCM-UHFFFAOYSA-N 276.292 2.139 10 20 CECD COc1ccc(CNC(=O)C2(C(C)(F)F)CC2)c(O)c1 1350989965 GDGBWOGWALCLPW-UHFFFAOYSA-N 285.290 2.452 10 20 CECD C[C@@H](NC[C@@]1(C)CCOC1)c1cc(C(=O)O)ccc1O 1609776540 HFWHEMJOBGFCHM-MEBBXXQBSA-N 279.336 2.168 10 20 CECD Oc1cc2c(cc1CNCCOC1CCCC1)OCO2 111607876 AJJQJKHLWAPAMR-UHFFFAOYSA-N 279.336 2.170 10 20 CECD O=C(O)c1occc1CNCc1c(O)cccc1F 1602590750 FUFPCCAGPVZKGO-UHFFFAOYSA-N 265.240 2.112 10 20 CECD CCN1CC[C@@H](CNCc2ccc(N(C)C)cc2)C1 37643732 AVMDMJBEKQQHNR-HNNXBMFYSA-N 261.413 2.184 10 20 CECD C[C@H]1CC[C@@H](C(=O)O)CN1Cc1cc(F)ccc1O 397483164 GSRHOCGIEZKQPM-VHSXEESVSA-N 267.300 2.216 10 20 CECD Cc1ccc(O)c(CN[C@H](C)C(=O)NCc2ccco2)c1 113341287 LEVFDJPQERZJPR-GFCCVEGCSA-N 288.347 2.088 10 20 CECD Cc1n[nH]c(C)c1/C=C1/SC(N2CCCCC2)=NC1=O 103472634 ANVFRVGUONIAHZ-XYOKQWHBSA-N 290.392 2.483 10 20 CECD Cc1nc(C)c(C)c(NCCc2ccc(O)c(O)c2)n1 301692430 OHCXDAIRMZNJGD-UHFFFAOYSA-N 273.336 2.468 10 20 CECD CCC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 62574807 MCUHROLSVCXEIB-GFCCVEGCSA-N 262.353 2.048 10 20 CECD Nc1ccc(CC(=O)NCCCC(F)(F)F)cc1 123030856 XTCBPNOZGDKKJE-UHFFFAOYSA-N 260.259 2.270 10 20 CECD CCN(C)C(=O)[C@H](C)NCc1cc(Cl)ccc1O 188488115 WPTGEBOOXWTZFC-VIFPVBQESA-N 270.760 2.002 10 20 CECD C[C@H](NC1CCN(C(=O)C2CC2)CC1)c1ccccc1O 37142834 ZWCGOLMGDDUGTR-LBPRGKRZSA-N 288.391 2.444 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1coc(C2CCC2)n1 192791505 AOQKZLVRGGDCDG-UHFFFAOYSA-N 288.303 2.283 10 20 CECD CC(C)c1nocc1C(=O)NCc1ccc(O)c(O)c1 528867234 ZIFASMOBJZQHRN-UHFFFAOYSA-N 276.292 2.139 10 20 CECD CSC(C)(C)CNC(=O)NCc1ccccc1O 266585341 VXVUEBCGOXFRMD-UHFFFAOYSA-N 268.382 2.333 10 20 CECD Cc1nc(C(=O)NCc2ccc(N3CCCC3)cc2)c[nH]1 264672194 JMKPTSJEPSXDRF-UHFFFAOYSA-N 284.363 2.248 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCc2cccnc2)c1 273429177 VCUDDFZGKFYGSM-NSHDSACASA-N 286.331 2.425 10 20 CECD CCS(=O)(=O)CCN[C@H](C)c1ccc(C)c(C)c1O 273563862 IYBFXULVKCSSMX-GFCCVEGCSA-N 285.409 2.094 10 20 CECD CC(C)Oc1ccc(N(C)CCN2CCOCC2)cc1 277229243 OPAQGBKIANGRGE-UHFFFAOYSA-N 278.396 2.242 10 20 CECD O=C1CCCCN1[C@@H]1CCCN(Cc2ccccc2O)C1 374905841 ADMWPUPASAYDEH-OAHLLOKOSA-N 288.391 2.369 10 20 CECD O=S1(=O)C[C@@H](NCc2ccccc2O)c2ccccc21 370355872 ULJZYEJVJCUDOQ-CYBMUJFWSA-N 289.356 2.010 10 20 CECD CO[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)C1CC1 280825577 NQMSDDVVPAQGJD-OAHLLOKOSA-N 276.380 2.136 10 20 CECD Cc1cc(C(=O)NC[C@@H]2CCOC2)c(C)n1-c1ccccn1 298743263 KCYQUARIEPFEEL-AWEZNQCLSA-N 299.374 2.255 10 20 CECD CCO[C@H]1C[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 298792266 ZAMRMPLSTLFVHA-CVEARBPZSA-N 288.391 2.328 10 20 CECD COC[C@H](O)CNc1ccccc1OC[C@H]1CCCCO1 819423273 AKTQVGJVLZMCOB-ZIAGYGMSSA-N 295.379 2.054 10 20 CECD C[C@@H](NC[C@H](N)c1ccc(N(C)C)cc1)c1ccccn1 817942635 QEOAHJROVKVJBC-CJNGLKHVSA-N 284.407 2.498 10 20 CECD CCOc1ccc(CN2C[C@@H](C(=O)O)CC[C@@H]2C)c(O)c1 817881185 PXPYQAUBFOOFLS-AAEUAGOBSA-N 293.363 2.476 10 20 CECD C[C@H](N)CN[C@H](C)c1cccc(C(F)(F)F)c1O 817973281 SJJDJLWSRVZRRS-JGVFFNPUSA-N 262.275 2.409 10 20 CECD C[C@@H]1C[C@@H](N[C@H](C)c2cc(F)ccc2O)CCN1 817970711 CPXVZKNHNZINKO-FOGDFJRCSA-N 252.333 2.322 10 20 CECD Cc1cc(C(=O)NCc2ccc(O)c(O)c2)nn1C(C)C 827317301 RTWRYFQLPNLVAT-UHFFFAOYSA-N 289.335 2.114 10 20 CECD Cc1cc(Br)c(O)c(CNCCC(=O)O)c1 820949259 JQCLLTWITAKYET-UHFFFAOYSA-N 288.141 2.027 10 20 CECD COc1cnc(/C=C/c2ccc3c(c2)CCN3C)nc1O 905076983 PRGRISLUKGEUMW-GQCTYLIASA-N 283.331 2.354 10 20 CECD OCC[C@@H](N[C@@H]1CCc2cccc(O)c21)C1CCOCC1 834766377 SVAOQUHTYRCTQC-HUUCEWRRSA-N 291.391 2.147 10 20 CECD CC[C@H](O)[C@H](C)C(=O)NCCCSc1nccs1 900684004 VRCQYPJTPOCHSI-UWVGGRQHSA-N 288.438 2.149 10 20 CECD CN(C(=O)COC(=O)c1cc(O)cs1)C1CCCCC1 732355009 ZNDNCXRQCUIQCX-UHFFFAOYSA-N 297.376 2.402 10 20 CECD C[C@@H](NCCN1C[C@@H]2CC[C@H](C1)O2)c1ccc(F)cc1O 834887905 ABEZVPHWJFTALM-BNOWGMLFSA-N 294.370 2.045 10 20 CECD C[C@H](OC(=O)c1cc(O)cs1)C(=O)N1CCCCCC1 731910873 VORMGHLMNHBUDZ-JTQLQIEISA-N 297.376 2.402 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCC[C@@H]2C[C@H]12 838256474 SGYNPGXINUWGIK-DHOWGVBFSA-N 273.332 2.416 10 20 CECD CCCN(Cc1ccccc1O)Cc1cnnn1CC 838858676 CPKXECFRRCQPJY-UHFFFAOYSA-N 274.368 2.416 10 20 CECD C[C@@]1(CNCc2cccc(F)c2O)CCCNC1 841057047 LKGVPLANPMLQQU-CQSZACIVSA-N 252.333 2.011 10 20 CECD CCc1cccc(CN2CCC(CC(=O)NC)CC2)c1O 848888180 OBFZRTNRNCVAJU-UHFFFAOYSA-N 290.407 2.303 10 20 CECD O=C(CSCc1cccnc1)NCc1ccccc1O 748345398 BLSXSVPVMFRHSG-UHFFFAOYSA-N 288.372 2.337 10 20 CECD CS(=O)(=O)CCCSc1ncc(Cl)s1 849998403 FQDOXDCSUORNDG-UHFFFAOYSA-N 271.816 2.323 10 20 CECD Cc1cc(CN[C@H]2C[C@H](N)C2(C)C)ccc1N(C)C 923423622 YBCHCOISJFJVRY-GJZGRUSLSA-N 261.413 2.276 10 20 CECD COC/C=C\C(=O)NCc1ccc(N2CCCCC2)cc1 848225230 FCNGUUONBOMUMS-WAYWQWQTSA-N 288.391 2.496 10 20 CECD CC(C)C[C@@H](CCO)CNC(=O)Nc1ccc(N)cc1 841300417 RHROXHVNGHZUGX-GFCCVEGCSA-N 279.384 2.435 10 20 CECD CCc1cccc(CN2C[C@@H](COC)O[C@H](C)C2)c1O 848905149 HVTVLUBQZGOPQU-DOMZBBRYSA-N 279.380 2.190 10 20 CECD COCC1(NC(=O)NCCc2ccc(N)cc2)CCCC1 851663028 RHQVGBNTEWZNGY-UHFFFAOYSA-N 291.395 2.070 10 20 CECD CN(C[C@@H]1CC1(C)C)C(=O)c1c(F)ccc(O)c1O 857339996 ONSZINCZEPAYGN-QMMMGPOBSA-N 267.300 2.355 10 20 CECD CC[C@@H](O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 850529757 SRANUMIRXQFOQA-KKZNHRDASA-N 253.317 2.440 10 20 CECD CC[C@H](O)CCN[C@@H](C)c1cc(F)cc(F)c1O 756657204 BGPXOWIDUJLTRN-WPRPVWTQSA-N 259.296 2.482 10 20 CECD FC(F)CN1CCC[C@@H]1CNCc1ccc2c(c1)CCO2 858232092 SOLFORBYFKWKGR-CQSZACIVSA-N 296.361 2.441 10 20 CECD COc1cccc(CNC(=O)[C@@H]2[C@H]3[C@@H]4CC[C@@H](C4)[C@H]32)c1O 934940113 IJZUCBCNYCLPPC-RJTWHSRJSA-N 287.359 2.309 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](C)Oc2cccnc2)c1 862759497 DYHINEMTDAQIQC-LBPRGKRZSA-N 286.331 2.179 10 20 CECD CN(C)c1ccc(CN2C(=O)N(C)C(C)(C)C2=O)cc1F 761178861 ISUMLSDSDIBXLE-UHFFFAOYSA-N 293.342 2.064 10 20 CECD C/C=C\C[C@@H](CO)NCc1c(O)cccc1Cl 769936077 CYZGVMQQRURFFM-ZMWSMAPVSA-N 255.745 2.462 10 20 CECD CN(C)c1cc(F)c(CN2CCC(C)(O)CC2)cc1F 862245918 BMXJSTHYQWDQOY-UHFFFAOYSA-N 284.350 2.378 10 20 CECD CC(=O)Nc1ccc(CNCc2ccc(C)cc2O)cn1 877485054 WZTNDUWMENUKNR-UHFFFAOYSA-N 285.347 2.344 10 20 CECD CO[C@H](CN(C)c1ccc2c(c1)OCO2)C1CCOCC1 877179849 LBZCPNPLLJAISE-MRXNPFEDSA-N 293.363 2.293 10 20 CECD O=C1N[C@H](c2cccc(O)c2O)Nc2cc(F)c(F)cc21 877858671 KOGMNUWONHJSRR-CYBMUJFWSA-N 292.241 2.230 10 20 CECD Cc1ccc(CN2CCC(C)(C)S(=O)(=O)CC2)c(O)c1 877481945 YEAJHCGRHLGUAI-UHFFFAOYSA-N 297.420 2.100 10 20 CECD Cc1ccc(CN2CCC(NC(=O)C3CC3)CC2)c(O)c1 876562084 SAODVQYDSHQXOU-UHFFFAOYSA-N 288.391 2.191 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1ccc(OCC)cc1O 779715685 NSYAQGWOJOBEQY-MRXNPFEDSA-N 292.379 2.412 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CCC(F)(F)C1 779533324 JGIVWWVGHQHAKV-GQPNGRKGSA-N 283.274 2.415 10 20 CECD CCOc1ccc(CN2C[C@@H](C)O[C@@H](COC)C2)c(O)c1 784666886 CASHMWALOQFWDR-IUODEOHRSA-N 295.379 2.027 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@@H](C(=O)Nc2ccc(N)cc2)C1 884009451 WTDVCQFRWYQMII-RNCFNFMXSA-N 270.336 2.297 10 20 CECD Cc1c(NCc2c(O)ccc(Cl)c2F)nnn1C 883230464 HODZUOUOQNYSAG-UHFFFAOYSA-N 270.695 2.234 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOCC12CCC2 894036574 ZYWQMWOOKPYHBC-UHFFFAOYSA-N 269.291 2.425 10 20 CECD O=S1CCC(NCCCSc2nccs2)CC1 893045674 UJGBLKJMIMDWCD-UHFFFAOYSA-N 290.479 2.126 10 20 CECD Cn1cccc1CNC(=S)NCCc1ccc(F)cc1 789256401 WZDIUTLFSLVMBG-UHFFFAOYSA-N 291.395 2.371 10 20 CECD CC[C@@]1(O)CCCN(Cc2ccc(OC)c(OC)c2O)C1 895758115 CFHWQKRURRSYST-MRXNPFEDSA-N 295.379 2.146 10 20 CECD Cc1cccc(CN2CCC3(CC2)C[C@@H](O)CCO3)c1O 897260942 TUFJVOYNJMNDAT-HNNXBMFYSA-N 291.391 2.207 10 20 CECD COc1cc(C)cc(CN2CC[C@H](O)C(C)(C)C2)c1O 894535959 ZNUSSLAUEZZYJD-AWEZNQCLSA-N 279.380 2.302 10 20 CECD C[C@@H](CCCNCc1cc(F)cc(F)c1O)C(=O)O 1334842290 VISXYUJVTNBTHO-QMMMGPOBSA-N 273.279 2.261 10 20 CECD CN(CC(=O)N(C)C1CCCCC1)Cc1ccc(N)cc1 1345159280 FBADFCBHSMPRDT-UHFFFAOYSA-N 289.423 2.492 10 20 CECD COc1cc(C)cc(CNCc2nc(C(F)F)no2)c1O 1355331761 FJCXEMXJWFITMZ-UHFFFAOYSA-N 299.277 2.320 10 20 CECD CCOc1cccc(CN[C@@H]2CCC[C@H]2C(=O)O)c1O 1610044732 ISPYTNSVEKWMNN-VXGBXAGGSA-N 279.336 2.134 10 20 CECD OC[C@H](Cc1ccccc1)NCc1cc(F)ccc1O 119539487 WSQQFKVPCZVRKK-HNNXBMFYSA-N 275.323 2.225 10 20 CECD COc1cc(Cl)cc(CNCCN2CCCC2)c1O 228677104 BXFGWGRGULAWIG-UHFFFAOYSA-N 284.787 2.240 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)c(O)c1O 157083540 ZBDCVCQVWUDBSW-DGCLKSJQSA-N 291.347 2.094 10 20 CECD C[C@@H]1CCC[C@]1(O)CNCc1cc(F)ccc1O 293951519 IUQOZPNDBNFQRZ-YGRLFVJLSA-N 253.317 2.172 10 20 CECD CN1CC=C(CNCc2cc(F)cc(F)c2O)CC1 708503915 RRRSBAYZGRQJBN-UHFFFAOYSA-N 268.307 2.022 10 20 CECD COc1cccc(CN2CCC[C@@H](OC)CC2)c1O 377243198 ISCLNEFHDCXKMV-CYBMUJFWSA-N 265.353 2.402 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(Cl)c1O)C(=O)NC 697887025 CWYNGDRVJNSSAH-SNVBAGLBSA-N 291.178 2.313 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@H]2c2cccnc2)c1O 105649431 JZCDRADCBUIPPK-UONOGXRCSA-N 298.342 2.216 10 20 CECD O=C1NC(=S)S/C1=C\c1cccnc1Cl 171349374 LJUQKPYADZNNKR-XQRVVYSFSA-N 256.739 2.224 10 20 CECD Cc1cc(NC(=O)[C@H](C)N(C)Cc2ccccc2O)on1 109770643 YLDAFIPOQNKXCC-NSHDSACASA-N 289.335 2.148 10 20 CECD COc1cccc(CNC(=O)[C@@H](C)CSC)c1O 66928160 PEIJBIRBIUMRBB-VIFPVBQESA-N 269.366 2.016 10 20 CECD CC(C)(C)OC(=O)CCNCc1ccccc1O 174433848 WDBCVPWZSXLPOV-UHFFFAOYSA-N 251.326 2.214 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2nc(C)cs2)c1 114512445 FVMSKZYTJGYGEQ-UHFFFAOYSA-N 293.348 2.487 10 20 CECD Cc1cnc2c(c1)N(C(=O)/C=C/c1cncc(F)c1)CCO2 125964910 AGHWRNBQUDODQU-NSCUHMNNSA-N 299.305 2.363 10 20 CECD C[C@H](N[C@H](C)CO[C@H]1CCOC1)c1ccc(F)cc1O 185673349 GTIMKYCCURZICH-MDZLAQPJSA-N 283.343 2.376 10 20 CECD C[C@H](NCC1(N(C)C)CCOCC1)c1ccc(F)cc1O 185449753 USZSRYXOQXHWML-LBPRGKRZSA-N 296.386 2.293 10 20 CECD C[C@@H](NC[C@]1(O)CCSC1)c1ccc(F)c(F)c1O 187744918 QJKVNZLEHFXMHY-AMIZOPFISA-N 289.347 2.189 10 20 CECD C[C@@H]1CN(C(=O)Nc2ccc(N)cc2)CCS1 137213682 UXNLJBIJNOLHMG-SECBINFHSA-N 251.355 2.238 10 20 CECD C[C@@H]1COCC[C@@H]1NCc1ccc(N(C)C)c(F)c1 191757972 CQFOHCNFTBNOBH-RISCZKNCSA-N 266.360 2.406 10 20 CECD COc1cc(Cl)cc(CNC[C@@H](C)CCO)c1O 228675559 IMQARSXMWUBAST-VIFPVBQESA-N 273.760 2.162 10 20 CECD CCC(CC)(CN)C(=O)NCc1ccc(N(C)C)cc1C 236683014 BUFMEHYRKGXZGF-UHFFFAOYSA-N 291.439 2.442 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)CC[S@]1=O 277839926 ZVIAGAIBOJEDCI-ORAYPTAESA-N 280.437 2.096 10 20 CECD Cc1cccc(CN2CCO[C@@]3(CCO[C@H]3C)C2)c1O 279607285 FFYMFZSTCKQPPT-BBRMVZONSA-N 277.364 2.080 10 20 CECD CCN(CC)c1ccc(CN(CC)[C@@H]2CCNC2=O)cc1 281782475 NFQSJOQUEFSOBC-MRXNPFEDSA-N 289.423 2.243 10 20 CECD C[C@H]1CCC[C@H]1NCC(=O)NCc1ccc(N(C)C)cc1 282062701 MSCYQWVEDQHAPV-XJKSGUPXSA-N 289.423 2.147 10 20 CECD CC[C@](C)(OC)C(=O)NCc1ccc(N(C)C)cc1 280853989 BTWRVBRKNRGLHF-HNNXBMFYSA-N 264.369 2.184 10 20 CECD COc1ccc(O)c(CN2C[C@H](C)O[C@H](C3CC3)C2)c1 280468454 CINXODORQOFUPV-ZBEGNZNMSA-N 277.364 2.400 10 20 CECD Cc1nccnc1N(C)Cc1ccc(N2CCOCC2)cc1 290574122 UQAITCVCEWQAAE-UHFFFAOYSA-N 298.390 2.258 10 20 CECD C[C@@H]1CC[C@H](CNCc2ccc(N3CCOCC3)cc2)O1 398093076 STZMSSKAQBVMHY-RHSMWYFYSA-N 290.407 2.180 10 20 CECD C[C@H](CN1CCCCC1)NC(=O)NCc1ccccc1O 299467894 BYCWOZRMOJUODM-CYBMUJFWSA-N 291.395 2.066 10 20 CECD CCN(CC)c1ccc(CN2C[C@H]3C[C@H]2C(=O)O3)cc1F 294782896 LHIPWYHKLQRAJR-DOMZBBRYSA-N 292.354 2.172 10 20 CECD CC(C)N(CC(=O)NC1CC1)Cc1ccc(N(C)C)cc1 298688519 CEIFSOSBTFGIJQ-UHFFFAOYSA-N 289.423 2.242 10 20 CECD C[C@H](NC[C@@H](N)C1CC1)c1cc(Cl)ccc1O 817964920 JGSLEFWURCMBGK-QPUJVOFHSA-N 254.761 2.434 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](CCO)CC2)c1 817419912 ZNANWCDAOBFLGB-CYBMUJFWSA-N 279.380 2.385 10 20 CECD CC[C@H](NC[C@]1(COC)CCCN1)c1ccccc1O 817973368 DSFRTBPRJLBPTI-HOCLYGCPSA-N 278.396 2.202 10 20 CECD CO[C@@H]1CCC[C@H]([C@H](NCc2ccccc2O)C(=O)O)C1 901762760 QKENKDVIPPODKQ-LNSITVRQSA-N 293.363 2.140 10 20 CECD CCn1cc(C(=O)N[C@H](C)c2ccccc2O)cn1 827937054 JDZAHGWPPBHLFG-SNVBAGLBSA-N 259.309 2.100 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)c2ccsc2)cc1 832293263 SPLPJUKTZGXXAY-AWEZNQCLSA-N 289.404 2.244 10 20 CECD C[C@H]1C[C@@H](N[C@H]2C[C@@H](O)C2)c2c(O)ccc(F)c21 834904636 ANMUZPOEPFPZJQ-WYOJIJJFSA-N 251.301 2.193 10 20 CECD O=C(NCc1ccc(O)cc1O)C12CCC(CC1)C2 910949781 PEBHBVCHOVPHKK-UHFFFAOYSA-N 261.321 2.294 10 20 CECD CCNCCNCc1ccc(N2CCCCC2)cc1 841037695 SGDWYTYPESMDPR-UHFFFAOYSA-N 261.413 2.376 10 20 CECD C[C@H](NC[C@]1(O)CCO[C@H]1C)c1ccc(Cl)cc1O 841753369 SKXUPLFQKOWSHO-PKFCDNJMSA-N 285.771 2.236 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCN(CC(F)F)C1)CC2 841762526 PUPZDXMEUHUKPP-VXGBXAGGSA-N 282.334 2.309 10 20 CECD CC(C)C[C@H](CN)NCc1ccc(N(C)C)c(F)c1 841038752 PNESJSYHQFOPFD-CYBMUJFWSA-N 267.392 2.355 10 20 CECD CC(C)(C)CN1C(=O)C(C)(C)N[C@H]1c1ccc(O)c(O)c1 840828538 UDJMYAANHBWART-CYBMUJFWSA-N 292.379 2.353 10 20 CECD COc1ccc(CNC(=S)NC2(C)CCC2)c(O)c1 840747229 WRPOHSCTMSABSN-UHFFFAOYSA-N 280.393 2.308 10 20 CECD CC(C)(C)OCC(=O)NCc1cc(Cl)ccc1O 846473222 KMIOOHSTUBXNKJ-UHFFFAOYSA-N 271.744 2.477 10 20 CECD COC[C@@H](C)CC(=O)NCCCSc1nccs1 755368737 GSIAKAJEGVSBFT-JTQLQIEISA-N 288.438 2.414 10 20 CECD COc1cc(CNCCCO)c(O)c(C(C)(C)C)c1 850006072 PIZMLUKXMKFWOR-UHFFFAOYSA-N 267.369 2.170 10 20 CECD Cc1cc(=NC(=O)N(C)Cc2ccccc2O)c(C)c[nH]1 767943818 RYXFHQCVHXLAFQ-UHFFFAOYSA-N 285.347 2.490 10 20 CECD CN(C[C@H]1CC(C)(C)CO1)c1ccc(OCC(=O)O)cc1 872160394 GKJAUBDKQKZTOD-CQSZACIVSA-N 293.363 2.401 10 20 CECD CCN1C[C@@H](C)N(Cc2cc(F)ccc2O)C[C@H]1C 779018348 FUKDTVGASGXGEA-VXGBXAGGSA-N 266.360 2.446 10 20 CECD CC(C)c1noc(CCC(=O)N(C)c2ccc(N)cc2)n1 877081359 ZSTHZZBPUPVVDM-UHFFFAOYSA-N 288.351 2.371 10 20 CECD Cc1ccc(CN2CC[C@@H](c3nccn3C)C2)c(O)c1 877528926 NYAOFSBGDCQIFV-CQSZACIVSA-N 271.364 2.424 10 20 CECD C[C@@H](CCCO)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776159486 QNIALFVJMRNEEZ-QWHCGFSZSA-N 293.411 2.274 10 20 CECD C[C@H](NCCN1CCNC1=O)c1ccc2ccccc2c1O 886745380 VUGYCRSJXKKBPH-LBPRGKRZSA-N 299.374 2.221 10 20 CECD COc1ccc(CN[C@H]2CS[C@H](C)C2)c(O)c1OC 894903145 KGTIZNKTMYGYIF-MWLCHTKSSA-N 283.393 2.393 10 20 CECD CCOc1cccc(CN2CCC3(CC2)OCCO3)c1O 77253445 AAPOWUIZOXTZKU-UHFFFAOYSA-N 293.363 2.130 10 20 CECD OCCC1CCN(Cc2cc(F)cc(F)c2O)CC1 893920842 DEYKLEMUBXPWAL-UHFFFAOYSA-N 271.307 2.265 10 20 CECD C[C@@H](O)CNCc1cc(Cl)cc(Br)c1O 708159560 ZKGCDSNMELHNDH-ZCFIWIBFSA-N 294.576 2.279 10 20 CECD COc1cc(CN2CCC3(CCO3)CC2)c(O)cc1C 799955719 OHSCOUYDKUAANR-UHFFFAOYSA-N 277.364 2.464 10 20 CECD CN(C)c1ccc(C(=O)NCc2ccccc2O)cc1 82285968 FDXAEULAOHDNPJ-UHFFFAOYSA-N 270.332 2.388 10 20 CECD COc1cccc(CN[C@H]2CCN(C(C)(C)C)C2)c1O 693905632 IKGNGZOKCVKNFL-ZDUSSCGKSA-N 278.396 2.363 10 20 CECD Cc1ccc([C@@H](C)NCC2(S(C)(=O)=O)CCC2)c(O)c1 794828725 NAUYICBHIQUSJE-GFCCVEGCSA-N 297.420 2.319 10 20 CECD CCCN1CCCC[C@@H]1C(=O)NCc1ccccc1O 1322709000 IJHKUANGDUYHPP-CQSZACIVSA-N 276.380 2.273 10 20 CECD CCCN1CC(=O)N[C@H]1c1ccc(N2CCCC2)cc1 1331382945 WYUQVQCTPAIGBK-MRXNPFEDSA-N 273.380 2.127 10 20 CECD CCCCN(CC(N)=O)Cc1ccc(N2CCCC2)cc1 1337009497 BOVGWMVVNZZAGP-UHFFFAOYSA-N 289.423 2.374 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1C[C@H]2CC[C@H]1C2 1350300714 XBMMYUOEJXGOEK-JBLDHEPKSA-N 261.321 2.150 10 20 CECD C[C@H](Nc1ccnc(N)n1)c1ccc(N(C)C)cc1 1354163423 OERCVISESDHEOK-JTQLQIEISA-N 257.341 2.298 10 20 CECD Cc1cncnc1Sc1ncc(C(=O)O)s1 1607914013 BHCNOSQACIETQQ-UHFFFAOYSA-N 253.308 2.091 10 20 CECD Cc1cc(Cl)cc(CN2CC(C)(C(=O)O)C2)c1O 1600218980 JVOPEWVCTZVOQM-UHFFFAOYSA-N 269.728 2.261 10 20 CECD CCc1cccc(CN[C@H](C[C@@H]2CCCO2)C(=O)O)c1O 1597586819 LJFKFDNNBJKFBT-UONOGXRCSA-N 293.363 2.067 10 20 CECD C[C@@H](NCCOCC1CC1)c1cc(C(=O)O)ccc1O 1593272053 OWQJCLADULEPAY-SNVBAGLBSA-N 279.336 2.168 10 20 CECD C[C@H](N[C@H]1CO[C@@H](C2CC2)C1)c1cc(C(=O)O)ccc1O 1593234329 YLXJJIGWTKGJBX-TURKWSHLSA-N 291.347 2.309 10 20 CECD COCCCN[C@H](C)c1ccc(N2CCOCC2)cc1 151634093 FKQNNPSNQDXZEJ-CQSZACIVSA-N 278.396 2.210 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CCN(C(C)=O)C2)cc1 152882036 LQNZZLPJUJYWCK-MRXNPFEDSA-N 289.423 2.243 10 20 CECD CN(Cc1ccccc1O)C(=O)c1c(O)cccc1O 125691335 MMZKRLVZVSPVMY-UHFFFAOYSA-N 273.288 2.076 10 20 CECD Oc1ccc(F)cc1CN1CCC([C@H]2CCNC2)CC1 843126771 MZJBFRNTKLUUSX-ZDUSSCGKSA-N 278.371 2.353 10 20 CECD Nc1ccc(NC(=O)NCCCOCC2CC2)cc1 236355061 DWRBHSNJWPJSCN-UHFFFAOYSA-N 263.341 2.207 10 20 CECD CCOc1cccc(CN2CCCC[C@H]2CCN)c1O 70148530 JELFXUZHZQUUNX-AWEZNQCLSA-N 278.396 2.494 10 20 CECD Cc1cccc(CN2CCO[C@H](C(F)(F)F)C2)c1O 705019631 ODABOJQOARSKCT-NSHDSACASA-N 275.270 2.464 10 20 CECD C[C@@H]1CSCCN(C(=O)Nc2ccc(N)cc2)C1 379573975 XYNXMYCFHRXKDR-JTQLQIEISA-N 265.382 2.486 10 20 CECD CCCOCC(=O)N[C@H](C)c1cc(OC)ccc1O 103529246 GZKCYUHMPVFKPR-SNVBAGLBSA-N 267.325 2.005 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccnc1O 115489596 DABBIODONKATEG-UHFFFAOYSA-N 285.347 2.092 10 20 CECD CNC[C@@H](C)CNCc1cc(Cl)cc(F)c1O 1348516128 SQXLXLBQYRPFGL-MRVPVSSYSA-N 260.740 2.130 10 20 CECD Cn1ccc(CNCc2cccc(Br)c2O)n1 213178959 OYXNPOVRWXUFOM-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CC(C)CONC(=O)N(C)Cc1ccccc1O 120617100 ULSCNOWIBQLWBQ-UHFFFAOYSA-N 252.314 2.121 10 20 CECD Cc1cccc(CN2CCS[C@H]3COCC[C@@H]32)c1O 180683144 RHFWDEYAKFTKBH-KBPBESRZSA-N 279.405 2.407 10 20 CECD Oc1c(Br)cccc1CNCc1cocn1 381600177 NFEYLOBUFAPHIW-UHFFFAOYSA-N 283.125 2.433 10 20 CECD CCc1noc(CN(C)c2ccc(OC)cc2OC)n1 131953730 FDSODNYIEFRRKL-UHFFFAOYSA-N 277.324 2.286 10 20 CECD CCOc1cccc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c1O 271175576 FUUNDNFJQPIYJU-ZBUHCNDUSA-N 297.420 2.132 10 20 CECD CC(C)N1C[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 271554019 WLEHMXLDYZPZQK-ZFWWWQNUSA-N 289.423 2.413 10 20 CECD CO[C@@H](C)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273598075 RCWQRPOJENPYDL-VHSXEESVSA-N 268.313 2.376 10 20 CECD COCCC(C)(C)C(=O)NCc1ccccc1O 273738986 RTTGCHJPAGOLCJ-UHFFFAOYSA-N 251.326 2.071 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1nnc(C)n1C 393200530 YELDAMOQZOLNEQ-JQWIXIFHSA-N 286.379 2.476 10 20 CECD CCN1CCCN(Cc2ccc(N(C)C)c(C)c2)CC1=O 815100558 QZOUDCIAHIBOCS-UHFFFAOYSA-N 289.423 2.115 10 20 CECD CN1CCCc2cc(CN[C@@H]3CCC[C@@H]3N)ccc21 817901449 VSRUNXDXCWLXGT-LSDHHAIUSA-N 259.397 2.038 10 20 CECD COC[C@]1(CN[C@@H](C)c2cc(C)ccc2O)CCCN1 817975147 RCBPZOXTQCYMOW-XJKSGUPXSA-N 278.396 2.120 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@H](N)Cc1ccccc1 827205799 UFKAUQAQCVEYHI-MRXNPFEDSA-N 298.386 2.311 10 20 CECD Cc1cc(Br)c(O)c(CN[C@H]2C[C@@H](O)C2)c1 825256898 LNBAKKJPKBTVGC-AOOOYVTPSA-N 286.169 2.076 10 20 CECD O=C(NCc1cccc2c1OCCO2)c1cc(O)cs1 732283396 YKCLFXQNAQOXFT-UHFFFAOYSA-N 291.328 2.155 10 20 CECD CO[C@@H]1COCC[C@H]1CNCc1cc(Cl)c(C)cc1O 826049760 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689528350 XTJAXKBPCYEYIL-LBPRGKRZSA-N 279.384 2.101 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@H]2NCC[C@H]2C1 381332407 BTZNKBSPVGNBTI-GXFFZTMASA-N 266.772 2.229 10 20 CECD COc1ccc(N(C)C(=O)/C=C/c2cncc(F)c2)cn1 104328933 BLDXGVREYKTEBY-ZZXKWVIFSA-N 287.294 2.301 10 20 CECD Cc1ccc(C(=O)NCCc2cccs2)c(O)c1O 177658521 MAGMEXONQCYROZ-UHFFFAOYSA-N 277.345 2.440 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccc3cn[nH]c23)c1 114541577 WHSRKPIDYYRMBW-UHFFFAOYSA-N 297.314 2.207 10 20 CECD O=[N+]([O-])c1ccc(OCCNCc2ccccc2O)cc1 68989512 BLKAKVCYTPGGFO-UHFFFAOYSA-N 288.303 2.469 10 20 CECD C[C@@H](NC[C@@]1(O)CCOC1)c1ccc2ccccc2c1O 186178051 PSWICIGMLIBABD-PXAZEXFGSA-N 287.359 2.347 10 20 CECD COCCC[C@@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186425120 DVYWIMYJHIRTLE-NEPJUHHUSA-N 295.379 2.208 10 20 CECD Cc1ccoc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183474133 PJDWMSHWOZVSKO-SNVBAGLBSA-N 275.304 2.360 10 20 CECD CCCNC(=O)CCNCc1cccc(Cl)c1O 124724892 OWJYEQUGQSMZLJ-UHFFFAOYSA-N 270.760 2.052 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H]2CO)c1O 184677530 CGBASZPPZJIMSF-LLVKDONJSA-N 271.744 2.011 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccn[nH]1 45013179 CCVURWDXLVORTP-UHFFFAOYSA-N 272.352 2.138 10 20 CECD C[C@H](NC[C@H]1CCCN1C)c1ccc(F)c(F)c1O 191221968 CIYKXKNFNWCAAV-VHSXEESVSA-N 270.323 2.415 10 20 CECD COC(=O)CN(Cc1cccc(OC)c1O)C1CCCC1 93707477 IIHDNDJBVSSMBV-UHFFFAOYSA-N 293.363 2.318 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)CC(C)(C)O 269540440 VCBAVPCZNFLXAQ-UHFFFAOYSA-N 250.386 2.345 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@](C)(O)Cc1ccccc1 269168984 WWALHHDIGDKUSB-GOSISDBHSA-N 299.370 2.344 10 20 CECD CN1CCN(C(=O)c2cccc(O)c2O)Cc2ccccc21 364809620 JGRJTFXDSRVEPH-UHFFFAOYSA-N 298.342 2.190 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H](C3CC3)C2)c(O)c1O 370360076 QYNQGTDHNXLWDH-LLVKDONJSA-N 261.321 2.278 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1C[C@]12CCNC2 372493043 UFTSUVWYZNMDJU-PBHICJAKSA-N 288.391 2.130 10 20 CECD COc1ccc(CNC2CCC(C(=O)O)CC2)c(O)c1 86735059 GHGYVCBHMJCUAR-UHFFFAOYSA-N 279.336 2.134 10 20 CECD COC[C@@H](CO)N[C@@H](C)c1ccc(N2CCCCC2)cc1 280983272 MFIWOEIPVSJMJC-GOEBONIOSA-N 292.423 2.335 10 20 CECD C[C@H]1CN(Cc2ccccc2O)C[C@]2(CCCOC2)O1 370712501 VUIRGGHNDLHSPW-BBRMVZONSA-N 277.364 2.162 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@]2(O)CCO[C@@H]2C)c(O)c1 285447657 ZHXVNIJRWSBLMV-WOSRLPQWSA-N 279.380 2.200 10 20 CECD C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@@H]1C 297299878 YMEWILQHJZGTDF-IUCAKERBSA-N 267.300 2.355 10 20 CECD COC[C@]1(CN[C@H](C)c2ccc(C)cc2O)CCCN1 817974198 JIBZNEXUEWTQQY-CZUORRHYSA-N 278.396 2.120 10 20 CECD Cc1cc([C@H](C)NC[C@@H](N)c2ccc(N(C)C)cc2)no1 817944317 ZCLSPZQGXWHMER-SWLSCSKDSA-N 288.395 2.400 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@H](C)OC)c1 729053495 JJABRAUNPPVWCT-WDEREUQCSA-N 296.367 2.186 10 20 CECD Cc1cc(O)c(CN(CC(F)F)C[C@@H](C)O)cc1C 825098153 BKVJHZKIRXJDIC-LLVKDONJSA-N 273.323 2.457 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C[C@@H](N)C1CC1 828147853 MBTZNFUWTFIUAE-CQSZACIVSA-N 276.380 2.258 10 20 CECD COC(=O)c1cnc(Sc2nc(C)cc(OC)n2)s1 828429374 VLDCLDRUBJGMLP-UHFFFAOYSA-N 297.361 2.188 10 20 CECD Cc1ccncc1/C=C\C(=O)N(C)c1cccnc1 492427584 PPQGBBDHAILDAL-WAYWQWQTSA-N 253.305 2.461 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCCCC(=O)O 820548071 VKPSRZBIYBGDFQ-UHFFFAOYSA-N 278.352 2.206 10 20 CECD CCc1cccc(C(=O)NCc2cc(OC)ccc2O)n1 825840367 SRFHEZQRUUVGHR-UHFFFAOYSA-N 286.331 2.288 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C(=O)O)cc1F 739415440 VKPQKFMEJKLLFK-SNVBAGLBSA-N 268.332 2.235 10 20 CECD Cc1cc(C(=O)Nc2ccn(C)n2)c(C)n1-c1ccccn1 914849702 RHVFPOKUPSOQDP-UHFFFAOYSA-N 295.346 2.475 10 20 CECD CCOc1ccc(CN[C@H](C)C[C@@H](C)N)c(O)c1 843129869 SHIIGFHECYENIL-GHMZBOCLSA-N 252.358 2.006 10 20 CECD CCc1cccc(CN2CCC[C@@H]2C(=O)NC2CC2)c1O 848880623 GMUHZANFMLWFCG-OAHLLOKOSA-N 288.391 2.198 10 20 CECD CCN1CCC[C@@H](NCc2ccc3c(c2)CCCO3)C1=O 922638030 CQHKMQLTMDLQMZ-OAHLLOKOSA-N 288.391 2.112 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC(C)(C)N)c1 925739563 YWCJGIJOYSAJNA-SNVBAGLBSA-N 252.358 2.179 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@@H](C)c1cccc(OC)c1O 846143864 INJOGQQFMYYTSK-GVXVVHGQSA-N 267.369 2.458 10 20 CECD C[C@@H](Cc1cnccn1)NCc1ccc2c(c1)CCO2 742723364 JVFPKNUPDJIPLB-LBPRGKRZSA-N 269.348 2.132 10 20 CECD CO[C@@](C)(C1CC1)[C@H](C)NCc1cc2c(cc1O)OCO2 840961773 ZEDCBUQRMFPLNL-MGPLVRAMSA-N 293.363 2.414 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2C[C@]2(C)OC)c1 850409663 XKLZMTCURSZNFJ-KGLIPLIRSA-N 251.326 2.058 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCC[C@H]2CCOC2)c1 858523119 NHDPIUSMEVZXKC-ZDUSSCGKSA-N 292.379 2.317 10 20 CECD Cc1cc(CN[C@@](C)(CN)C2CC2)ccc1N(C)C 923296695 VUMWMGFAVJDGQM-INIZCTEOSA-N 261.413 2.278 10 20 CECD N[C@]12CCC[C@@H]1CN(Cc1cc(Cl)ccc1O)C2 857226167 GSDKSPAWYWWTLU-RISCZKNCSA-N 266.772 2.359 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O 756735939 JHKXQDRYNJWPEL-WPRPVWTQSA-N 296.317 2.084 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1ccc2c(c1)CCCO2 921996796 IHAUCGGDDIVJBJ-WBVHZDCISA-N 291.391 2.295 10 20 CECD Cc1ccc(O)c(CNC(=O)C2CCSCC2)c1 862760776 VAEPBRFAKSNLIV-UHFFFAOYSA-N 265.378 2.460 10 20 CECD C[C@@H]1CN(Cc2cccc(F)c2O)CC[C@@H]1C(=O)O 863739592 MWSBISXSUALTGW-KOLCDFICSA-N 267.300 2.074 10 20 CECD COc1cc(COC(=O)c2cc(O)cs2)ccn1 762822527 JPIFLBKZLNQBCI-UHFFFAOYSA-N 265.290 2.214 10 20 CECD Cc1ccc(CN2CCC(O)(C(F)F)CC2)c(O)c1 877437437 GBCBMAJBRLHLJQ-UHFFFAOYSA-N 271.307 2.293 10 20 CECD COCC1(CNCc2c(C)cccc2O)CCOCC1 877543281 BQEYJSAEXKTVOE-UHFFFAOYSA-N 279.380 2.233 10 20 CECD C[C@@H](NC(=O)NCC1(C(=O)O)CCC1)c1ccccc1O 874407047 SGJPOJOKBKJNSC-SNVBAGLBSA-N 292.335 2.007 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@@H]2C[C@H]2C1 888343430 IHRVELGAYDVERT-GJZGRUSLSA-N 283.375 2.224 10 20 CECD CCOC(=O)[C@@H](C)[C@H](C)NCc1cc(C)cc(OC)c1O 894453544 HLXUNLWBOCWVCU-RYUDHWBXSA-N 295.379 2.387 10 20 CECD CC(C)n1nccc1C(=O)NCc1ccccc1O 268988949 UZELCKDDWNQQSW-UHFFFAOYSA-N 259.309 2.100 10 20 CECD O=C1CC2(CCN(Cc3c(O)cccc3Cl)CC2)CN1 271184390 MNJIHSKOOXWVIV-UHFFFAOYSA-N 294.782 2.148 10 20 CECD CN(C)c1ccc(CN2CC[S@@](=O)CC2(C)C)cc1 794569684 ZPNQFOITNVUGNL-LJQANCHMSA-N 280.437 2.096 10 20 CECD Oc1ccc(F)cc1CNc1ccc(-n2cncn2)cn1 792193545 XOATVIPYIWOUQX-UHFFFAOYSA-N 285.282 2.119 10 20 CECD CCC(CC)(NCc1ccc2c(c1)CCO2)C(=O)O 720758707 QAANHLSDDUJLKH-UHFFFAOYSA-N 263.337 2.355 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1nccn1C 70443665 HLSVHTNETYIARJ-GFCCVEGCSA-N 258.369 2.337 10 20 CECD C[C@@H](CCO)NCc1ccc(Br)cc1O 691405463 UTWRCUVTCOGPSO-QMMMGPOBSA-N 274.158 2.015 10 20 CECD C=CC(=O)NCc1ccc(N2CCSCC2)cc1 1336703314 YRBVXIMJTFQEAP-UHFFFAOYSA-N 262.378 2.042 10 20 CECD CC(C)c1ccc(C(=O)NCc2ccc(N)cc2)c(O)n1 1356239439 RXJFBQIHVBJXPQ-UHFFFAOYSA-N 285.347 2.423 10 20 CECD O=C(CC[C@H]1CCCCO1)NCc1cccc(O)c1O 1350300611 UZZFJMAWNMETAU-GFCCVEGCSA-N 279.336 2.063 10 20 CECD COc1cccc(CNCC[C@H]2CCCCO2)c1O 227338497 ULYPZPNUCHGPRC-CYBMUJFWSA-N 265.353 2.450 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CCCN 1577457537 AEBFVVFXUQUFCE-UHFFFAOYSA-N 264.369 2.260 10 20 CECD COc1cccc(CN[C@H](C)C2CCOCC2)c1O 134496338 MWYJZXGRQQUYNO-LLVKDONJSA-N 265.353 2.306 10 20 CECD Oc1ccc(Br)cc1CNC1CCOCC1 163757278 ZPAUMWPWVFQBLN-UHFFFAOYSA-N 286.169 2.423 10 20 CECD Cc1cccc(CN2CC[C@H](N3CCCC3)C2)c1O 124582506 YYNXIVHMPBMDTK-HNNXBMFYSA-N 260.381 2.371 10 20 CECD COc1ccc(CN[C@H]2C[C@@H](NC(=O)C3CC3)C2)cc1C 1021762804 MULKYGYXCKLHHV-GASCZTMLSA-N 288.391 2.150 10 20 CECD COc1cccc(CNc2cccnc2OC)c1O 37070682 JORDKCBZNZLDDH-UHFFFAOYSA-N 260.293 2.417 10 20 CECD COc1ccc(O)c(CN2CCO[C@H](C(F)(F)F)C2)c1 698972890 VMCXOCXTJFXUCP-LBPRGKRZSA-N 291.269 2.164 10 20 CECD CCN(CC)c1ccc(CN(C)C(=S)NC)cc1 7403506 XROMULQBMQIMSP-UHFFFAOYSA-N 265.426 2.469 10 20 CECD COc1ccc(N2CCN(Cc3ncc(C)o3)CC2)cc1 173465279 JKFAERUDHUOXHV-UHFFFAOYSA-N 287.363 2.314 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]2CN2CCCC2)c1 179878303 CZFYYTNLMOZXJM-OAHLLOKOSA-N 290.407 2.461 10 20 CECD Cc1cc(O)c(CN2CC[S@@](=O)[C@H](C)[C@@H]2C)cc1C 76666869 XVXDMVZVTMLKFQ-QUJCMNEKSA-N 281.421 2.350 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCCS2)c1 149695607 MGVZRQBGMGHHFC-GFCCVEGCSA-N 253.367 2.386 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H]3OCCC[C@H]3C2)c(O)c1O 182839415 XPDSPLHUFDEPBT-AAEUAGOBSA-N 291.347 2.047 10 20 CECD CCCN(CCC(=O)OC)Cc1ccccc1O 174372843 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CC(=O)C(=O)COc1ccc(Br)cc1F 808015762 PVBQQDDWTQSIIS-UHFFFAOYSA-N 275.073 2.125 10 20 CECD CCN(CC(=O)Nc1nncs1)c1ccc(OC)cc1 299375280 LXVUSLFFEUWGOM-UHFFFAOYSA-N 292.364 2.012 10 20 CECD Cc1cc(C)c([C@H](C)NCCOCCN(C)C)c(O)c1 815619711 WALKUCXZCWCQSX-AWEZNQCLSA-N 280.412 2.238 10 20 CECD C[C@@H](N[C@@H]1CC12CCNCC2)c1cc(F)cc(F)c1O 817976580 OGDVTOLMXNWHRQ-NOZJJQNGSA-N 282.334 2.463 10 20 CECD CC[C@H](N[C@@H]1COCC[C@H]1OC)c1ccccc1O 724874435 VSUWSLYTUGFRPD-GZBFAFLISA-N 265.353 2.237 10 20 CECD C[C@@H](Nc1cc(C(=O)O)ncn1)c1ccc(N(C)C)cc1 906144904 OHOLRWRNIGMGCR-SNVBAGLBSA-N 286.335 2.414 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@H]1CCc2cccc(O)c21 834765509 NBSPOJUAWHELPH-KCQAQPDRSA-N 277.364 2.163 10 20 CECD COc1ccc(CNC(=O)NC[C@@H]2C[C@H]2C(C)C)c(O)c1 836619244 NTVMJDYMCKWKMP-JSGCOSHPSA-N 292.379 2.492 10 20 CECD CC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@H](C)O1 841955443 CCSFFPLXKIAQGO-WFASDCNBSA-N 291.395 2.020 10 20 CECD CCO/C=C\C(=O)NCc1ccc(N(C)C)c(F)c1 841091263 WBSKWTFUIAIAGF-FPLPWBNLSA-N 266.316 2.058 10 20 CECD O=C(NCc1cccc(O)c1)NCc1ccccc1O 748461356 WIPOSIJIDVBSIV-UHFFFAOYSA-N 272.304 2.097 10 20 CECD CC(=O)C1(C(=O)NCc2cc(Cl)ccc2O)CC1 846477946 WADOBZLHTZZLQW-UHFFFAOYSA-N 267.712 2.031 10 20 CECD COc1cccc([C@@H](C)NC[C@@](C)(O)C(C)C)c1O 846147423 UXSHRAYCPYYMSD-IAQYHMDHSA-N 267.369 2.458 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NOCC(F)(F)F 845062616 ATVSQLNRFWQLTD-UHFFFAOYSA-N 298.648 2.339 10 20 CECD COc1cccc([C@H](C)NC[C@@H]2CC[C@H](O)C2)c1O 846165012 KDYDLIHQGJXIOL-TUAOUCFPSA-N 265.353 2.212 10 20 CECD C[C@H]1CN[C@H](C)CN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 843119706 DISFORNCDCKPQM-BDAKNGLRSA-N 299.758 2.136 10 20 CECD C[C@@H]1CCN(Cc2cccc(F)c2O)C[C@@H]1C(=O)O 843039081 AHMVCPMIVRPQJL-KOLCDFICSA-N 267.300 2.074 10 20 CECD Cc1cc(CN2CCCC[C@@H]2CN)ccc1N(C)C 923282738 XEOUMITXXOEPGJ-OAHLLOKOSA-N 261.413 2.374 10 20 CECD CC[C@H](NCCO[C@@H]1CCOC1)c1ccc(F)cc1O 927080139 HIAKOXDSDKFPRE-OCCSQVGLSA-N 283.343 2.378 10 20 CECD C[C@@H]1C[C@H](NCCN2CCC2)c2c(O)ccc(F)c21 756769926 RVRHNZKEOVTUJO-PWSUYJOCSA-N 264.344 2.375 10 20 CECD Cc1ccc([C@H](C)NCCOC[C@@H]2CCOC2)c(O)c1 756564170 QQITVXULXPJXBM-UONOGXRCSA-N 279.380 2.404 10 20 CECD COc1ccc(N2CCN(c3ncccc3OC)CC2)cc1 858311980 QVKPREKKPHTJGK-UHFFFAOYSA-N 299.374 2.425 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)[C@@H]2CCCOC2)c1 858355707 VZYWWSXAPMMJOG-QWHCGFSZSA-N 292.379 2.315 10 20 CECD CN(C)c1ccc(CNC2COC(C)(C)OC2)cc1F 758010512 OEYHNNCVJVYUIV-UHFFFAOYSA-N 282.359 2.133 10 20 CECD CC1([C@@H]2CCCN(C(=O)c3cc(O)cs3)C2)OCCO1 753523011 HKIPVDNLFFCTQA-SNVBAGLBSA-N 297.376 2.069 10 20 CECD CN(C)c1cc(F)c(CN[C@@H](CC(=O)O)C2CC2)cc1F 864510390 WADWIJKPTNIOSA-ZDUSSCGKSA-N 298.333 2.374 10 20 CECD Cc1ccc(O)c(CN(C)Cc2nnc3ccccn23)c1 769201514 BMVWSQRJINBCKV-UHFFFAOYSA-N 282.347 2.375 10 20 CECD COc1cccc(O)c1CN1CCC(n2ccnc2)CC1 769187874 KQOGCXYBEARXEY-UHFFFAOYSA-N 287.363 2.434 10 20 CECD OCCN(Cc1c(O)cccc1Cl)CC1CC1 769109556 RHYHKKGZICXQKL-UHFFFAOYSA-N 255.745 2.250 10 20 CECD CSC[C@@H]1CCCN1C(=O)c1cc(O)cs1 768347410 GFQFEEZJIWFFKT-QMMMGPOBSA-N 257.380 2.421 10 20 CECD CCOC(=O)[C@@H]1CCCN(Cc2c(C)cccc2O)C1 876509529 IIIBZNGZHCYIER-CYBMUJFWSA-N 277.364 2.476 10 20 CECD Cc1ccc(O)c(CNC[C@@H](CO)CC2CCOCC2)c1 1116811519 UVYPCRLYUBCUMH-HNNXBMFYSA-N 293.407 2.215 10 20 CECD Cc1ccc(O)c(CNCc2cc3c(cn2)OCCO3)c1 877652181 DTJZQXRBPRRQEW-UHFFFAOYSA-N 286.331 2.157 10 20 CECD CC[C@H](N[C@H](C)[C@H]1CN(C)CCO1)c1ccccc1O 775522022 HMRPHOBZEAUHGV-IVMMDQJWSA-N 278.396 2.152 10 20 CECD OC[C@H](CNCc1cc(F)cc(F)c1O)Cc1ccco1 883051350 YGPBTBYTUPANGU-JTQLQIEISA-N 297.301 2.204 10 20 CECD C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)[C@H]1CCCOC1 781028989 NGWTXRDSTBAPGF-YQCLLZEUSA-N 291.347 2.042 10 20 CECD Nc1ccc(CCNC(=O)NC[C@H]2C=CCC2)cc1 892039372 SGJXEYSJSNYBQW-ZDUSSCGKSA-N 259.353 2.077 10 20 CECD C[C@@H](NC(=O)C1CCC(O)CC1)c1ccc(N(C)C)cc1 792333047 OHWQQEUSNFLWAI-XEBKBJJBSA-N 290.407 2.481 10 20 CECD CN(C)c1ccc(CNC(=O)N(C)[C@H]2CCCOC2)cc1 796591063 RZQZNJAGRXIPLV-HNNXBMFYSA-N 291.395 2.073 10 20 CECD CSCCONC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 793062277 QGQOZPHTKYOGCT-NSHDSACASA-N 297.424 2.407 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@@H](C)c1ccc(F)cc1O 62747824 OCKIPYMGIATOOZ-MNOVXSKESA-N 282.359 2.487 10 20 CECD CC(C)[C@@H](CO)NCc1ccc(Br)cc1O 691456942 XPDMUPWWJBRBKP-LLVKDONJSA-N 288.185 2.261 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@@H](C(=O)O)C2)cc1 86786077 LQZXZOLQQGTTHA-KGLIPLIRSA-N 276.380 2.486 10 20 CECD O=C1CN(Cc2ccc(N3CCCC3)cc2)CN1CC1CC1 1322304142 LOGRFEHCMQHYAM-UHFFFAOYSA-N 299.418 2.299 10 20 CECD Nc1cc(N2CC=C(c3c[nH]c4ncccc34)CC2)ncn1 1326513548 APXQVOKLANPURH-UHFFFAOYSA-N 292.346 2.229 10 20 CECD OC[C@H]1CSCCN1Cc1ccc(N2CCCC2)cc1 1336753908 BBDUZNNUQWRSRW-INIZCTEOSA-N 292.448 2.197 10 20 CECD CO[C@@H](C)[C@H](C)N[C@H](C)c1cc(C(=O)O)ccc1O 1606666627 OBGRDSYFTVYDON-AEJSXWLSSA-N 267.325 2.164 10 20 CECD Cc1noc(CCCSc2ncc(C(=O)O)s2)n1 1600813179 OWYFZIKFEFUPAK-UHFFFAOYSA-N 285.350 2.258 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCO[C@H]2C2CC2)c1 224930023 QOGSODXYHOWUFA-HIFRSBDPSA-N 263.337 2.058 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)Cn2ccnc2)c1O 228671113 DSTBXGCVRJVSCV-JTQLQIEISA-N 295.770 2.429 10 20 CECD CN(C(=O)c1cccc(F)c1O)c1ccc(N)cc1 1578391829 QEKATRGDRMKWHJ-UHFFFAOYSA-N 260.268 2.390 10 20 CECD CCC(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C)c1 1755574715 PYUCWKXAKTYJTK-CYBMUJFWSA-N 278.396 2.350 10 20 CECD O=C1NC(=S)S/C1=C/c1cccc(C(=O)O)c1F 1777698855 CPEYMAYDHDIFAG-QPJJXVBHSA-N 283.305 2.013 10 20 CECD CC[C@H](NCCCN(C)CCOC)c1ccccc1O 155114101 PRAYOTLGCASLST-HNNXBMFYSA-N 280.412 2.401 10 20 CECD COc1ccc(O)c([C@H]2NC(=O)c3ccccc3N2)c1 49537146 OHKOEBHJJHGFJD-CQSZACIVSA-N 270.288 2.255 10 20 CECD C[C@@H](NCC[C@@H](O)C1CC1)c1ccc(F)cc1O 903406595 JZMIYCNIWHVLJF-NOZJJQNGSA-N 253.317 2.343 10 20 CECD O=C(CC1CC(F)(F)C1)NCCc1ccc(O)c(O)c1 827085840 ZLIMHEPSGSBWTM-UHFFFAOYSA-N 285.290 2.192 10 20 CECD CCCN(CCCC(=O)N(C)C)Cc1ccccc1O 846807149 APKXLTYKLCBGMJ-UHFFFAOYSA-N 278.396 2.473 10 20 CECD Cc1ccc(CNCc2cccc(CO)c2)c(O)c1 877015689 ZWCRJFXHLFKQTN-UHFFFAOYSA-N 257.333 2.483 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H](N)C(C)(C)C)cc1 136918219 XHNMYQBLPXAHMC-AWEZNQCLSA-N 277.412 2.132 10 20 CECD CN(C)c1ccc(CNC(=O)NC2CCCC2)cc1 30996865 ABEDFMNJQPBKQT-UHFFFAOYSA-N 261.369 2.494 10 20 CECD CCOc1cccc(CNC[C@](C)(O)C(F)(F)F)c1O 270547470 LFTWNYQDCWDPLK-LBPRGKRZSA-N 293.285 2.194 10 20 CECD CCCN(CC(N)=O)Cc1cc(Cl)cc(Cl)c1O 311023795 ZQLSVWUGCRRMIA-UHFFFAOYSA-N 291.178 2.396 10 20 CECD CCc1cccc(CN[C@H](C)[C@H](CO)SC)c1O 709456723 SZWLMVMWPYXEKN-MFKMUULPSA-N 269.410 2.157 10 20 CECD Oc1c(F)cc(F)cc1CNCC1CCOCC1 708561210 NVTBZEXOYXQRPH-UHFFFAOYSA-N 257.280 2.187 10 20 CECD CN1CC[C@@H]1CNCc1cc(Cl)cc(Cl)c1O 712609159 OLFHSHKVTBHSPD-SNVBAGLBSA-N 275.179 2.493 10 20 CECD COc1cccc(CNC(=O)[C@@H](C)OCCC(C)C)c1O 105650975 QXEPHUOCMVMIDG-GFCCVEGCSA-N 295.379 2.468 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2noc(C)n2)cc1 179925951 KHHQCCULBVEXRD-UHFFFAOYSA-N 288.351 2.154 10 20 CECD Cc1noc(C)c1CNC(=O)/C=C/c1ccc(O)c(O)c1 180707042 MVVHHTKDAUAMGQ-GQCTYLIASA-N 288.303 2.032 10 20 CECD Cc1cc(NS(=O)(=O)c2cn(C(C)C)cn2)ccc1O 182475422 GADZTDSENNIRDP-UHFFFAOYSA-N 295.364 2.279 10 20 CECD CC(C)NC(=O)CN(C)Cc1cc(Cl)ccc1O 133379328 VFJUTQZAPASAHW-UHFFFAOYSA-N 270.760 2.002 10 20 CECD COc1ccc(O)c(CNCc2cccc3c2OCO3)c1 40667094 RAZFBQLLQGGBSK-UHFFFAOYSA-N 287.315 2.419 10 20 CECD C[C@@H](O)C[C@H]1CCCN1Cc1ccc(N(C)C)cc1 93481988 GBKHNOHONYHFIY-CZUORRHYSA-N 262.397 2.488 10 20 CECD CC[C@H](C(=O)NCc1cccc(OC)c1O)N(CC)CC 269173312 IUJQPHLDZBEKJM-CYBMUJFWSA-N 294.395 2.137 10 20 CECD CC(=O)c1cc(F)cc(CN2CCNC[C@@H]2C(C)C)c1O 530229816 MNHMRSBBNFOHGS-OAHLLOKOSA-N 294.370 2.164 10 20 CECD COc1ccc(N(C)CCn2ccnc2C)c(OC)c1 270947251 ZQGRJYDLSDISLC-UHFFFAOYSA-N 275.352 2.345 10 20 CECD CCc1nnc2ccc(NCc3cccc(OC)c3O)nn12 271350993 STYYFDLQTOSTPC-UHFFFAOYSA-N 299.334 2.013 10 20 CECD Cc1cnccc1CCNC(=O)NCc1ccccc1O 270044873 DTTSSEFFRAMMBQ-UHFFFAOYSA-N 285.347 2.138 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1CO 276769974 IBLKDRIMXDHUBP-ZJUUUORDSA-N 255.745 2.106 10 20 CECD Cc1ccc(O)c(CNC[C@H](O)Cc2ccccc2)c1 290154516 PIQOINWGIKQFJM-MRXNPFEDSA-N 271.360 2.394 10 20 CECD COc1cc(O)c(CN2CC[C@@H](SC)C2)cc1OC 295132817 YJKFLPNHJYYJHY-LLVKDONJSA-N 283.393 2.347 10 20 CECD O=C(NC[C@@H]1CCC(F)(F)C1)c1c(F)ccc(O)c1O 295205716 VXFKEJRVQNPGNZ-SSDOTTSWSA-N 289.253 2.402 10 20 CECD C[C@H](N[C@H](C)CN)c1cccc(C(F)(F)F)c1O 817966320 LIVYJOMIDLPOCU-SFYZADRCSA-N 262.275 2.409 10 20 CECD CCOC(=O)[C@@H]1CCC[C@@H]1NCc1ccccc1O 825040550 NASDQEGXHLXABQ-OLZOCXBDSA-N 263.337 2.214 10 20 CECD CCOc1ccc(CN[C@@H](C)CCCCO)c(O)c1 824653792 IAXVZXSPIHHMAI-LBPRGKRZSA-N 267.369 2.432 10 20 CECD Cc1cc(O)c(CN(C)C2CC(O)C2)cc1Cl 825514931 UGCHRAPXVQZMAI-UHFFFAOYSA-N 255.745 2.309 10 20 CECD C[C@H]1SCC[C@H]1NC(=O)NCCc1ccc(N)cc1 831177736 AZMMQWJIKFGWSX-ZWNOBZJWSA-N 279.409 2.005 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CCC[C@@H]3C[C@H]23)c(O)c1 838776322 LYSITXSDHAYVTP-SWHYSGLUSA-N 290.363 2.389 10 20 CECD CC(C)[C@@]1(C)C[C@H]1NC(=O)c1c(F)ccc(O)c1O 839800219 VGFNRMBRPPSKRL-QMTHXVAHSA-N 267.300 2.401 10 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2.121 10 20 CECD COc1ccc(N(C)CC(=O)NCC(C)(C)C)cc1F 859163176 DHNDORRCLZKNCG-UHFFFAOYSA-N 282.359 2.433 10 20 CECD COCC(C)(C)CN(C)c1ccc(OCC(=O)OC)cc1 756098988 IFEAZDMLCQDQSR-UHFFFAOYSA-N 295.379 2.347 10 20 CECD C[C@@H](NC(=O)NCCCn1cccn1)c1ccccc1O 868087634 YXSLAFCYKBHNDL-GFCCVEGCSA-N 288.351 2.039 10 20 CECD CCOc1ccc(CN2CCN(CC3CC3)CC2)c(O)c1 768775342 ZNXQEQQABFMFHO-UHFFFAOYSA-N 290.407 2.319 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CC12CCC2 874786121 YDKDBWVBTWMISK-LQPUYASZSA-N 259.305 2.170 10 20 CECD CCOCCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773207629 CVUAEFQLLIJCJZ-LBPRGKRZSA-N 279.384 2.149 10 20 CECD Cc1ccc(CN2CCO[C@@H](C(F)F)C2)c(O)c1 877502575 MTSKODVLXXUWND-GFCCVEGCSA-N 257.280 2.167 10 20 CECD COCCCn1nccc1CN[C@H](C)c1ccccc1O 877755789 MYYNXHCCMYVUHJ-CYBMUJFWSA-N 289.379 2.476 10 20 CECD C[C@@H](NC(=O)N(C)CC(C)(C)O)c1ccc(N(C)C)cc1 776250523 UWCSEKADEDQJEK-GFCCVEGCSA-N 293.411 2.226 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2c(C)cccc2O)C1 876512024 DLUQOEKPETXAIK-CQSZACIVSA-N 276.380 2.049 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1ccc(N(C)CC)cc1 773814817 JBPZNYQMXUAWOB-INIZCTEOSA-N 289.423 2.243 10 20 CECD C[C@H](CO[C@@H]1CCOC1)N[C@H](C)c1c(O)cccc1F 886538915 PUJCNDSIRQVFAT-IJLUTSLNSA-N 283.343 2.376 10 20 CECD CCc1onc(C)c1/C=C1/SC(=S)N(C)C1=O 899260261 ACLFUZSJKBZLTO-WEVVVXLNSA-N 268.363 2.376 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)CC1CC(O)C1 785984108 FNIYFIAGLSFLNI-UHFFFAOYSA-N 273.735 2.387 10 20 CECD CCN(CC)c1ccc(CN[C@](C)(COC)C(=O)O)cc1 789902547 BPUNVFOQWMDVJC-MRXNPFEDSA-N 294.395 2.112 10 20 CECD Cc1ccc(CNCc2cc(N(C)C)ccn2)c(O)c1 896299075 QKWCXBSBXDODKB-UHFFFAOYSA-N 271.364 2.451 10 20 CECD COc1ccc(CNC[C@@H]2CCSC2)c(O)c1OC 894120681 RSDHIPDMHHKPRP-JTQLQIEISA-N 283.393 2.252 10 20 CECD COC(=O)[C@@H](NCc1cc(C)cc(OC)c1O)C(C)(C)C 894422202 ICXOJPFYXOFEFO-CQSZACIVSA-N 295.379 2.387 10 20 CECD COC[C@@H](N[C@H](C)c1cc(OC)ccc1O)C1CC1 186153632 GGCFXJWWWFQYMX-QMTHXVAHSA-N 265.353 2.476 10 20 CECD CC[C@H](N[C@@H](C)[C@@H]1CN(C)CCO1)c1ccc(F)cc1O 796839547 QUSSHLYYCVIQMO-PJODQICGSA-N 296.386 2.291 10 20 CECD Oc1cc2c(cc1CN1CCC(C3CC3)CC1)[C@@H](O)CO2 793631577 OZFMSGQHYPELPR-INIZCTEOSA-N 289.375 2.440 10 20 CECD CCOc1cc(NCc2ccc(OC)cc2O)ncn1 795284937 NSCCYRZPGUEEIT-UHFFFAOYSA-N 275.308 2.202 10 20 CECD CC[C@@H](F)C(=O)NCCCNCc1ccc(OC)c(C)c1 1164026307 BXKYBZIRNJSQGC-CQSZACIVSA-N 296.386 2.348 10 20 CECD C[C@@H](NCc1ncc(C(=O)O)s1)c1ccccc1O 1607423616 SLUVBVCXTRIYIB-MRVPVSSYSA-N 278.333 2.398 10 20 CECD Cc1nnc(O)c(CNCc2ccc(N(C)C)cc2)c1C 1320639960 IZPMVSYRQQAUHN-UHFFFAOYSA-N 286.379 2.155 10 20 CECD COc1ccc(N(C)CC(=O)NCC(C)(C)C)cc1 1328802818 FQZPSPXYPRBTKH-UHFFFAOYSA-N 264.369 2.294 10 20 CECD CC[C@H](CCC(=O)O)NCc1cc(F)cc(F)c1O 1331983243 POWYWKLDJKUSSS-SNVBAGLBSA-N 273.279 2.403 10 20 CECD COCC1=CCN(Cc2cc(F)cc(F)c2O)CC1 1333713813 KAXCGCBUNKWULQ-UHFFFAOYSA-N 269.291 2.449 10 20 CECD O=C(NCc1cccc(O)c1O)C1CC2(C1)CC2(F)F 1347234023 LXRQEPATBRETJL-UHFFFAOYSA-N 283.274 2.149 10 20 CECD CN(C)c1ccc([C@H](CNC(=O)CC2CC2)N(C)C)cc1 1340843371 YUZIQOADDSINJM-INIZCTEOSA-N 289.423 2.272 10 20 CECD Nc1ccc(CNC(=O)[C@H](N)CC2CCCCC2)cc1 1524008612 HZMGUUOBEQXRIK-OAHLLOKOSA-N 275.396 2.183 10 20 CECD C[C@H](NCC1(C(=O)O)CCC1)c1cc(F)ccc1O 1589123038 OEJMFWUAKGNUPM-VIFPVBQESA-N 267.300 2.437 10 20 CECD CC[C@@H](C)N[C@H](CC)c1cccc(-c2nn[nH]n2)c1O 1590413553 ANXKNZZJQHUUTB-BXKDBHETSA-N 275.356 2.412 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]2C)cc1OC 160322387 DYJDQJOQFOIDKQ-JTQLQIEISA-N 251.326 2.394 10 20 CECD COc1cccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1O 159672229 BMONBHLVXBCDOV-MAZHCROVSA-N 289.375 2.448 10 20 CECD O=C(CNCc1ccc(N2CCCCC2)cc1)NC1CC1 35247220 SGBKAIKCJGSTKX-UHFFFAOYSA-N 287.407 2.045 10 20 CECD Nc1ccc(NC(=O)NCC[C@@H]2C[C@H]3CC[C@H]2O3)cc1 841299175 VUKRZCRMFORJIS-LERXQTSPSA-N 275.352 2.348 10 20 CECD COCCO[C@H]1CCCN(Cc2ccc(C)cc2O)C1 877502972 XMOQOPVQGCDONC-HNNXBMFYSA-N 279.380 2.328 10 20 CECD COc1ccc(O)c(CNCC2(CO)CCCC2)c1 135075023 QCOKJIMVVXEBLJ-UHFFFAOYSA-N 265.353 2.043 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)c1cccc(F)c1 159637616 QJGGHHUXZYZXAA-UHFFFAOYSA-N 295.335 2.352 10 20 CECD CCC[C@@H](CNCc1cc(OC)ccc1O)OC 293823468 ZXURKSJSDYYDIN-ZDUSSCGKSA-N 253.342 2.306 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@H]2CCC[C@@H](C2)C1 372972884 BSCIZJPQALGLKX-QWRGUYRKSA-N 261.321 2.360 10 20 CECD COc1ccc(O)c(CNC[C@H]2CC[C@@H](C)O2)c1 398118645 ADXOPCLWVNDLCV-ZWNOBZJWSA-N 251.326 2.058 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C2CC(O)C2)c1O 759873358 LNEMPGMQJZQTTG-UHFFFAOYSA-N 283.755 2.203 10 20 CECD O=C(CN1CCCc2cc(OC(F)F)ccc21)N1CCC1 65597640 RGYTUFOZSTTXHW-UHFFFAOYSA-N 296.317 2.273 10 20 CECD CS[C@H](CO)[C@H](C)N[C@@H](C)c1ccc(F)cc1O 185510964 UEZVMYHBEJZZAH-MWODSPESSA-N 273.373 2.294 10 20 CECD C[C@H](O)[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 180853885 QJYPRXPLJIEKTG-VHSXEESVSA-N 255.745 2.248 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccncc2F)c1 184204956 NLKXANWPAWOIQR-UHFFFAOYSA-N 291.282 2.257 10 20 CECD Oc1ccc(CCNCc2cc3c(cc2O)OCO3)cc1 42880377 RXVMXYRGNVXAKD-UHFFFAOYSA-N 287.315 2.159 10 20 CECD C[C@H](N)CCC(=O)NCc1ccc(N2CCCC2)cc1 193300719 HLWNJQDNJMOULO-ZDUSSCGKSA-N 275.396 2.030 10 20 CECD CC(C)OC(=O)CSc1ncc([N+](=O)[O-])s1 192465119 MGUGJUSMFPZPFW-UHFFFAOYSA-N 262.312 2.095 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NCCn2cccn2)s1 1537962823 FJLFCOCLOGCCJA-UHFFFAOYSA-N 276.325 2.185 10 20 CECD Cc1ccc(C(=O)N2CCCC[C@@H]2C[C@H](C)O)c(O)c1O 279860420 SHXMHXYEAIPWJF-NWDGAFQWSA-N 293.363 2.172 10 20 CECD CCn1cnnc1CN[C@H](C)c1ccc(F)c(F)c1O 276899736 IWWQJDKBWNDZDU-MRVPVSSYSA-N 282.294 2.133 10 20 CECD CN(C)c1ccc(CN2CCC[C@](F)(CO)C2)cc1 286822982 KPGQVOFXKMQMFH-OAHLLOKOSA-N 266.360 2.049 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@](C)(O)C2CC2)cc1 286531685 SVQWOLQANPERTE-QGZVFWFLSA-N 290.407 2.310 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C[C@@H](O)c1cccnc1 294994170 QSSLEUPYYNTCIZ-MRXNPFEDSA-N 299.374 2.080 10 20 CECD CC[C@H](NC[C@]1(O)CCN(C)C1)c1cccc(Cl)c1O 806159842 MVJRQEBCEVXBHJ-DZGCQCFKSA-N 298.814 2.153 10 20 CECD CCN(CCOC)C(=O)NCc1ccc(N(C)C)c(F)c1 299411164 HEXCZCGLCFQCAN-UHFFFAOYSA-N 297.374 2.070 10 20 CECD CN(Cc1ccc2ccccc2c1O)Cc1nncn1C 816612548 ROGMAPNMLLRICX-UHFFFAOYSA-N 282.347 2.306 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@@H](n3ccnn3)C2)c1 819897040 NUJKQTRDAOPYQG-OAHLLOKOSA-N 286.379 2.438 10 20 CECD CCC(CC)(CNCc1ccccc1O)C(=O)O 818631295 FIYPYWJEEOXCAU-UHFFFAOYSA-N 251.326 2.373 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CCO[C@]3(CCOC3)C1)CC2 834697450 LHVOACUKANUMHX-JJRVBVJISA-N 289.375 2.307 10 20 CECD Oc1cccc2c1[C@@H](NCCCNc1ncccn1)CC2 834615664 GZMOANZENVVPEP-ZDUSSCGKSA-N 284.363 2.261 10 20 CECD CCC(CC)(CO)C(=O)NCc1ccc(N(C)C)c(F)c1 847405195 BBLNQSDCONMOQM-UHFFFAOYSA-N 296.386 2.307 10 20 CECD NCC1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 843047738 YRULDPYYWJRJFQ-UHFFFAOYSA-N 299.758 2.125 10 20 CECD COc1ccc(N(C)CCN(C)C[C@H]2CCCOC2)cc1 844401158 KPNVVOKLYLVELS-OAHLLOKOSA-N 292.423 2.490 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc(C3CC3)n(C)n2)cc1 741890721 YPVDDOGEZGPZFD-UHFFFAOYSA-N 298.390 2.294 10 20 CECD CC[C@H](C[C@H](C)CO)NC(=O)Nc1ccc(N)cc1 841299749 JLPPAQJEZJXWTD-CMPLNLGQSA-N 265.357 2.187 10 20 CECD COc1cccc([C@H](C)NC[C@@H]2CCCOC2)c1O 846143577 JPZBVYHWUHUFLD-RYUDHWBXSA-N 265.353 2.478 10 20 CECD COc1ccc(N2CCN(C(=O)CC3CC3)CC2)cc1F 753740003 XOHGVPBYTLAYIH-UHFFFAOYSA-N 292.354 2.283 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](N3CCOC3=O)C2)cc1C 853540466 HXXPWTQIXLAPJN-CQSZACIVSA-N 290.363 2.036 10 20 CECD Cc1cc(Br)c(O)c(CN[C@H]2C[C@H](O)C2)c1 850417791 LNBAKKJPKBTVGC-MGCOHNPYSA-N 286.169 2.076 10 20 CECD CO[C@](C)(CNC(=O)NCc1cc(C)ccc1O)C1CC1 858476366 AGONFSHPRUZZAY-MRXNPFEDSA-N 292.379 2.315 10 20 CECD C[S@](=O)[C@H]1CCC[C@H](NCc2ccc3c(c2)CCO3)C1 850356127 NKIYFLVIUAACNS-AVYPCKFXSA-N 293.432 2.401 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CS[C@H](C)C2)c1 858538582 ODYKCGFDJCFOQV-PWSUYJOCSA-N 280.393 2.394 10 20 CECD CCN(CCCO)Cc1cc(F)c(N(C)C)cc1F 862249149 XJEBHWAIBKHIFF-UHFFFAOYSA-N 272.339 2.235 10 20 CECD CCOc1ccc(CN2CCC[C@H]([C@H](C)O)C2)c(O)c1 768518952 JRIJIKBADOPYFK-STQMWFEESA-N 279.380 2.384 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCN1CCCCC1 770403738 KBZBJUUFCLPZHC-FNORWQNLSA-N 291.347 2.140 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1cnc(N)s1 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Cc1ccc(O)c(CNCCCOC[C@@H]2CCCO2)c1 71406649 LTHPTWRPKXXSLK-HNNXBMFYSA-N 279.380 2.376 10 20 CECD CCc1[nH]ncc1C(=O)NCc1ccc(N(C)C)c(F)c1 58974006 GQXWLCFIBIYSRY-UHFFFAOYSA-N 290.342 2.107 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)C[C@@H](C)O)c1O 228677788 KFOFEGHTMZISMZ-DTWKUNHWSA-N 273.760 2.303 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CC=CC1 183452043 INRWXUDRTANYPV-JTQLQIEISA-N 261.321 2.111 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccc(F)cn2)c1 123386639 IKDZKYNKXPOIEL-UHFFFAOYSA-N 291.282 2.257 10 20 CECD CC[C@H](C)[C@H](C)C(=O)NCCc1ccc(O)c(O)c1 184232512 PEYBOYLMCQOWOY-QWRGUYRKSA-N 265.353 2.439 10 20 CECD O=C(N[C@H]1CCOC2(CCCC2)C1)c1cccc(O)c1O 193138741 BVACJAPEVAPUOI-NSHDSACASA-N 291.347 2.319 10 20 CECD CCOc1cccc(CNC(C)(C)CCO)c1O 135227979 AYMUCIFPUNMGRA-UHFFFAOYSA-N 253.342 2.042 10 20 CECD CCCOc1ccc(CN2CC[C@@H](C)[C@@H]2CO)c(O)c1 191176037 FCOCOZNFWWDETI-DOMZBBRYSA-N 279.380 2.384 10 20 CECD CN(C)C(=O)CN(Cc1ccco1)Cc1ccccc1O 96970841 OPWPCBKTRZAVLI-UHFFFAOYSA-N 288.347 2.076 10 20 CECD 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285.409 2.164 10 20 CECD CCCNCCNC(=O)N(CCC)Cc1ccccc1O 841965087 NSCIMQYXMWVCSS-UHFFFAOYSA-N 293.411 2.313 10 20 CECD C[C@@H]1CCC[C@@H]1NC(=O)NCCc1ccc(N)cc1 841795014 VQGKXJTURGCQJD-RISCZKNCSA-N 261.369 2.299 10 20 CECD COc1cccc([C@H](C)NCC2([S@](C)=O)CCC2)c1O 846168044 QIMDJTRKGRWBMJ-YBTHPKLGSA-N 297.420 2.353 10 20 CECD CC[C@H](NC[C@@H]1CNC(=O)C1)c1cc(Cl)ccc1O 840833752 PJKRJVYMUUFRQM-SKDRFNHKSA-N 282.771 2.222 10 20 CECD Cc1cc(N(C)C)ccc1CNCCOC[C@H]1CCOC1 840933139 XWCOTAPNFTYQRM-HNNXBMFYSA-N 292.423 2.204 10 20 CECD COCC1(CC(=O)NCc2ccc(N(C)C)c(F)c2)CC1 843538431 FZOVHPIIJDKPHB-UHFFFAOYSA-N 294.370 2.325 10 20 CECD CO[C@H]1CCC[C@H]1CNC(=O)NCc1cc(C)ccc1O 858346556 OQWCDIGUBAJKPX-WFASDCNBSA-N 292.379 2.315 10 20 CECD COc1ccc(N(C)Cc2cnc(C)cn2)c(OC)c1 752115497 VZTDDHPHJHKVQD-UHFFFAOYSA-N 273.336 2.439 10 20 CECD C[C@@H]1C[C@H](NCC2(CO)CC2)c2c(O)ccc(F)c21 756638144 RSXCFCWHAIGNDF-KOLCDFICSA-N 265.328 2.442 10 20 CECD CCCCC[C@@H](O)C(=O)NCc1cc(C)ccc1O 862755044 NOYGSAXJTPZHKP-CQSZACIVSA-N 265.353 2.258 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(CO)c(C)o2)c1 869409583 AZOAQKZXBKTFIJ-UHFFFAOYSA-N 275.304 2.024 10 20 CECD Cc1ccc(O)c(CNC[C@H](CO)CC2CCOCC2)c1 1116811526 UVYPCRLYUBCUMH-OAHLLOKOSA-N 293.407 2.215 10 20 CECD CCCOCCOC(=O)NCc1cc(C)ccc1O 1118877937 NLIRORUIQUPHNI-UHFFFAOYSA-N 267.325 2.353 10 20 CECD C[C@@H](NC(=O)c1ccon1)c1ccc(N(C)C)cc1 773024051 ZOZNYZZQEUORNN-SNVBAGLBSA-N 259.309 2.232 10 20 CECD COc1ccc(CN(C)c2ccc3c(c2)OCO3)nc1 775993456 VDXKAHBIEZWSMS-UHFFFAOYSA-N 272.304 2.455 10 20 CECD C[C@H](NC(=O)[C@@H]1CCO[C@H]1C)c1ccc(N(C)C)cc1 772997304 FZSAKSLAHMYGCJ-SLEUVZQESA-N 276.380 2.355 10 20 CECD CN1CCC[C@@H](CNCc2c(O)cccc2Cl)C1 83552518 WOEPVRYGESIHIS-NSHDSACASA-N 268.788 2.477 10 20 CECD CN1C(=O)COc2cc(NCc3ccccc3O)ccc21 84830988 RHHZMLZNLBTBDG-UHFFFAOYSA-N 284.315 2.360 10 20 CECD Cc1ccc(CN2CCC3(CC2)C[C@@H](O)CCO3)c(O)c1 897258531 UBZPCFOBKWPADA-HNNXBMFYSA-N 291.391 2.207 10 20 CECD C[C@@H]1OCC[C@]1(C)NC(=O)NCc1ccc(N(C)C)cc1 783928391 XZURTQRTMIGFSM-LRDDRELGSA-N 291.395 2.119 10 20 CECD CCOC(=O)/C(=C\c1cnc(F)cc1C)c1nccn1C 899350085 TUYVGMAZRPXBKV-WQLSENKSSA-N 289.310 2.366 10 20 CECD C[C@H](NCCCSc1nccs1)c1ccc(O)nn1 796773090 YYEPCGHLPBBIOU-VIFPVBQESA-N 296.421 2.472 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@H](c1cc(O)ccc1O)N2 1336755501 BQDOKNONKOGTGY-CQSZACIVSA-N 270.288 2.260 10 20 CECD CCN1CCC(N[C@H](C)c2cc(C(=O)O)ccc2O)CC1 1610008290 CYYZGTZIGSWKLF-LLVKDONJSA-N 292.379 2.225 10 20 CECD COc1cc(Cl)cc(CNC[C@@H]2CCCN(C)C2)c1O 228673973 DKOLIIHWPZTXMZ-NSHDSACASA-N 298.814 2.486 10 20 CECD C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)NC1CC1 228949567 ODLDMVFUABIEDL-VXGBXAGGSA-N 275.396 2.070 10 20 CECD C[C@@H]1CN(Cc2cc(F)c(F)cc2O)CC[C@H]1C(=O)O 1589399463 QZLYUTXYPBYLLK-PSASIEDQSA-N 285.290 2.213 10 20 CECD CC(C)(C)[C@H](NCc1cccc(F)c1O)C(=O)O 1590444879 DCEQLTWMZHSCIH-LLVKDONJSA-N 255.289 2.120 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C[C@@H]1CCCN1 154143809 CXPOFBHJPMNYQR-AWEZNQCLSA-N 276.380 2.273 10 20 CECD C[C@@H]1CC(=O)CC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 159143038 RTZNABKGNLBPBI-WBMJQRKESA-N 288.391 2.374 10 20 CECD N[C@H]1CCCCC[C@@H]1NCc1ccc2c(c1)CCO2 817901281 AQKZOKVDZOIHIH-GJZGRUSLSA-N 260.381 2.371 10 20 CECD O=C(O)[C@@H](NCc1cccc(F)c1O)c1ccccc1 165037408 IOCLXAGJAPFXON-ZDUSSCGKSA-N 275.279 2.447 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(CC)C1)c1ccccc1O 391464451 BMYHGXNTUHXPSM-AAEUAGOBSA-N 262.353 2.054 10 20 CECD Cc1cccc(CN[C@@H](CCO)C(F)(F)F)c1O 894851924 RFDDYZARUSJVJS-JTQLQIEISA-N 263.259 2.104 10 20 CECD CCOc1cccc(CNCc2ccnc(OC)c2)c1O 60942040 MTKADFPKYZUPJQ-UHFFFAOYSA-N 288.347 2.484 10 20 CECD CN1CCc2cc(/C=C3/SC(=S)NC3=O)ccc21 129687559 WTJUODNKKXYRFW-YRNVUSSQSA-N 276.386 2.168 10 20 CECD C/C=C/C[C@@H](CO)NCc1cc(Cl)cc(OC)c1O 186531625 XOATZADZMHVLLI-PCAWENJQSA-N 285.771 2.471 10 20 CECD C[C@@H](CN1CCOCC1)N[C@@H](C)c1cc(Cl)ccc1O 185028634 JAUQQINCCNMSAX-RYUDHWBXSA-N 298.814 2.417 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Cc2cncs2)c1 188552861 ZZHXALMHAAQGDK-SECBINFHSA-N 292.360 2.277 10 20 CECD CNC(=O)C(C)(C)CN[C@H](C)c1cc(Cl)ccc1O 186223573 MDHUWNOILBADHX-SECBINFHSA-N 284.787 2.468 10 20 CECD CCC[C@@H]1C[C@H]1NC(=O)NCc1cccc(OC)c1O 74927819 FTTMNMRCWXFULN-ZYHUDNBSSA-N 278.352 2.389 10 20 CECD CNC(=O)c1ccc(CNCc2ccc3c(c2)CCO3)cc1 43288637 VIRWXFMIOPVPDG-UHFFFAOYSA-N 296.370 2.271 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2[C@H]3CCC[C@H]32)c1 246747443 HNOHVSGDBKVNJL-IMRBUKKESA-N 261.321 2.063 10 20 CECD CNC(=O)CN(Cc1ccco1)c1ccc(OC)c(F)c1 269619479 HRUALPPWOJASNH-UHFFFAOYSA-N 292.310 2.180 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)[C@@H]1OC 272683493 TWIOIYQQONZKDW-IMJJTQAJSA-N 296.386 2.174 10 20 CECD CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 273414879 QPWVFEVMCXYDGC-RYUDHWBXSA-N 264.369 2.184 10 20 CECD CC[C@H](NC[C@]1(O)CCO[C@@H]1C)c1ccc(N(C)C)cc1 278890246 TXZCBNJFWJLRSZ-XOKHGSTOSA-N 292.423 2.333 10 20 CECD COc1ccc(N(CCN2CCNC2=O)C(C)C)cc1F 808736223 NOGBSLVEIDEYIG-UHFFFAOYSA-N 295.358 2.074 10 20 CECD CCC[C@H](O)CN1CCN(c2ccc(OC)c(F)c2)CC1 296815665 QJLITNLPHZNVJJ-AWEZNQCLSA-N 296.386 2.117 10 20 CECD CC(C)n1nccc1NC(=O)NCc1ccccc1O 299498985 LKTCWSUFAZMNDD-UHFFFAOYSA-N 274.324 2.491 10 20 CECD C[C@H]1CC2(CCNCC2)CN1Cc1cccc(F)c1O 818431916 VYNQEVUSPABINL-LBPRGKRZSA-N 278.371 2.495 10 20 CECD CCNC(=O)[C@H](C)NCc1ccc2ccccc2c1O 816561269 QUUOBANLUKRNRW-NSHDSACASA-N 272.348 2.160 10 20 CECD CN(C[C@H](O)CNc1ccccc1OCC1CC1)C1CC1 819452412 RKPQCQYTKWDXGS-OAHLLOKOSA-N 290.407 2.342 10 20 CECD CCC[C@@H](O)CC(=O)N[C@H](C)c1ccccc1O 827940971 MAUIEZYJQGWSQS-GHMZBOCLSA-N 251.326 2.121 10 20 CECD CC1CCN(C(=O)[C@@H](C)OC(=O)c2cc(O)cs2)CC1 732353791 VPTFOHDLFRJFQN-SNVBAGLBSA-N 297.376 2.258 10 20 CECD COc1cccc(CNC(=O)[C@@H](C)C2CCC2)c1O 837485778 QVTQZLYYUIHASY-JTQLQIEISA-N 263.337 2.453 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](N2CCCCC2)C1 732290550 ZFBODDGHGSNNNE-NSHDSACASA-N 280.393 2.154 10 20 CECD COC1CCC(NC(=O)/C=C\c2ccc(O)c(O)c2)CC1 837958083 WGNCAYARVSVNED-OQFOIZHKSA-N 291.347 2.185 10 20 CECD COC(=O)NCc1ccc(N2CCSCC2)cc1 918617362 QKEINXNNTKARAE-UHFFFAOYSA-N 266.366 2.096 10 20 CECD CCc1cccc(CNCCN(C)CCCOC)c1O 848898715 XQNVQKMTWAPFPR-UHFFFAOYSA-N 280.412 2.013 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H]([C@@H](C)N)C2)c1O 843364442 IGBOMRCSZSTVJL-KOLCDFICSA-N 296.798 2.417 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H](C)N1 843049837 WQRGFJHDQXPQPB-RYUDHWBXSA-N 265.376 2.074 10 20 CECD CCc1cccc(CNc2ccc(CCO)nc2)c1O 848911765 IDODMFZOAZDKFD-UHFFFAOYSA-N 272.348 2.497 10 20 CECD CCC(F)(F)C(=O)NCc1ccc(OC)cc1O 846950246 LEWXUISYAWMWKW-UHFFFAOYSA-N 259.252 2.062 10 20 CECD C[C@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)CS1 840243316 COKNYDLVCQWISB-AAEUAGOBSA-N 293.436 2.446 10 20 CECD Cc1nccc(CCc2nc(Cc3ccc(N)cc3)no2)n1 843161580 YIRCEVAEWOELHE-UHFFFAOYSA-N 295.346 2.126 10 20 CECD CC[C@H]1CN(C)CCN1Cc1c(O)ccc2ccncc12 840091772 OIGRJSATHFIKLV-AWEZNQCLSA-N 285.391 2.466 10 20 CECD CCN(CCN)Cc1ccc(N(CC)CC)c(F)c1 863644947 NAKLXCZZFAJFKT-UHFFFAOYSA-N 267.392 2.453 10 20 CECD COc1cccc(O)c1CNCC[C@@H](O)C1CCCC1 865874476 DSNFLKIDWYJKOT-CQSZACIVSA-N 279.380 2.432 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2occc2C)c1 862754177 TVKQPRVMDJBSAN-UHFFFAOYSA-N 259.305 2.461 10 20 CECD C[C@@H](NCCCNC(=O)C(F)(F)F)c1ccccc1O 879649088 IBRNCGLWLUCDGJ-SECBINFHSA-N 290.285 2.111 10 20 CECD CC[C@@H]1C(=O)N(CC)CCN1Cc1cccc(Cl)c1O 779216973 LQJMYVVNKMGEEZ-CYBMUJFWSA-N 296.798 2.488 10 20 CECD CC(C)[C@H](O)C(C)(C)CNC(=O)NCc1ccc(N)cc1 1120592434 WXVJHUKZXDLVAR-AWEZNQCLSA-N 293.411 2.111 10 20 CECD O=[N+]([O-])c1cccnc1NCCc1ccc(O)c(O)c1 301578147 MVFTWWIMXXQJNG-UHFFFAOYSA-N 275.264 2.056 10 20 CECD C[C@@H]1[C@@H](C)[S@](=O)CCN1Cc1cc(F)cc(F)c1O 894039688 LMFGNKMLKNNIBK-IXGDSRDXSA-N 289.347 2.012 10 20 CECD OCCC[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1 894959764 UXLPEVOCWJWMCP-SNVBAGLBSA-N 271.307 2.265 10 20 CECD CC[C@]1(NCc2cc(C)cc(OC)c2O)CCOC1 894551448 WRUIUIBZQRSDOA-HNNXBMFYSA-N 265.353 2.368 10 20 CECD CN(C)c1ccc([C@@H](CN[C@H]2CCSC2)N(C)C)cc1 898451351 YCKGEXWUAOYKAK-GOEBONIOSA-N 293.480 2.450 10 20 CECD Cc1cnc(CN2CCCc3cc(CN)ccc32)nc1 700943198 IWFPMARJNRAKRI-UHFFFAOYSA-N 268.364 2.197 10 20 CECD CC[C@H](NCCn1cccn1)c1ccc(F)cc1O 796813382 XWGOCJBMJZCUTE-ZDUSSCGKSA-N 263.316 2.469 10 20 CECD Cc1cc([C@@H]2CCCN2C(=O)c2cccc(O)c2O)on1 790538301 HDRSFZTXJLUGPX-NSHDSACASA-N 288.303 2.372 10 20 CECD CO[C@H]1C[C@@H](CN2CCCc3cc(CN)ccc32)C1 721955168 MFAPWCSPEZHVGH-OTVXOJSOSA-N 260.381 2.323 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@@H](C)S1=O 792193239 UIHPOVSKAKEJLN-NXEZZACHSA-N 287.812 2.387 10 20 CECD C[C@@H](N[C@@H](CCO)C1CC1)c1cc(F)ccc1O 756740711 SSJFWUKMVCHBSS-RNCFNFMXSA-N 253.317 2.343 10 20 CECD COc1ccc(CNC[C@@H]2C[C@@H](C)N(C(C)=O)C2)cc1C 980276914 YSSRCMMPMXLMMD-CJNGLKHVSA-N 290.407 2.350 10 20 CECD Cc1ccc(CN(C)C(=O)c2cccc(O)c2O)nc1 789865792 UTQFBCOFCBJWFH-UHFFFAOYSA-N 272.304 2.073 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC(F)(F)C2)cc1F 1263707029 VVTZYZVIFWNTHV-UHFFFAOYSA-N 287.285 2.052 10 20 CECD Cc1nc(CCC(=O)NCc2cccc(O)c2O)cs1 1528770901 FRESNKKWBHQBQP-UHFFFAOYSA-N 292.360 2.112 10 20 CECD C[C@@]1(C(=O)O)CC[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1 1776501935 TWJWAQWUKKRTQJ-QMTHXVAHSA-N 294.307 2.033 10 20 CECD C[C@@H](Oc1ccccc1)C(=O)NCc1ccc(O)c(O)c1 158933879 XISABPYLCOJRLK-LLVKDONJSA-N 287.315 2.182 10 20 CECD CN(C)c1ccc(CNC(=O)c2cncc(F)c2)cc1 164482132 LKGBPQNGRSUGSW-UHFFFAOYSA-N 273.311 2.217 10 20 CECD O=C(NCc1ccccc1F)c1cccc(O)c1O 126225395 BEOJSYKJLGEPNY-UHFFFAOYSA-N 261.252 2.167 10 20 CECD CC(C)n1nccc1NC(=O)c1cccc(O)c1O 126203593 XBLFBVMDYXKXTB-UHFFFAOYSA-N 261.281 2.128 10 20 CECD CCOC[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 158535304 XYLBYONDVKIMJF-AWEZNQCLSA-N 276.380 2.086 10 20 CECD C[C@H](N[C@H](C)Cn1cccn1)c1ccc(F)cc1O 62747593 FGFBPZVJKQFFFI-MNOVXSKESA-N 263.316 2.467 10 20 CECD CN1CCC[C@H](CN[C@H]2CCc3cccc(O)c32)C1 381742123 PIOZBCPDFONMRL-OCCSQVGLSA-N 260.381 2.311 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1csnn1 398461878 JELXGOFKYBDOFZ-SNVBAGLBSA-N 262.382 2.455 10 20 CECD C[C@@H](CN)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 54344779 JKDHWFABQWBXFW-AWEZNQCLSA-N 289.423 2.230 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@H]1F 1346245387 DBLZGDFABAMUEC-QWHCGFSZSA-N 250.317 2.069 10 20 CECD C[C@H](NCc1cccc(C(N)=O)c1)c1ccc(F)cc1O 62745978 WAPQSGSNNDLIJG-JTQLQIEISA-N 288.322 2.481 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NOCC(C)C)c1 127971613 GDXHGRBLPVFZMU-SNVBAGLBSA-N 282.340 2.349 10 20 CECD O=C(O)CCCN(Cc1ccccc1O)C[C@@H]1CCCO1 121042620 RNAOGPLEJVTHRW-AWEZNQCLSA-N 293.363 2.238 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnns1 77323943 WOMUCJYTBDPQJK-UHFFFAOYSA-N 290.392 2.266 10 20 CECD C[C@@H](NCc1ncn(C)n1)c1cc(Cl)ccc1O 186214046 ROMWEEJVIWZENA-MRVPVSSYSA-N 266.732 2.025 10 20 CECD Nc1ccc(CCNC(=O)CCC2CCOCC2)cc1 238121369 OXMCOSBWMZLVMJ-UHFFFAOYSA-N 276.380 2.134 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H](C)O[C@@H](CO)C2)cc1 248955889 FVYXWBZSXCELKF-RHSMWYFYSA-N 292.423 2.114 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](C)CO)cc1 269548068 NKGAXEUEWIZWRQ-GFCCVEGCSA-N 286.375 2.452 10 20 CECD CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccccc1O)CC2 271461765 XEHLABOXSYVVPS-JKSUJKDBSA-N 291.391 2.144 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1C 368963201 IOSZHQATWLYBJD-JGGQBBKZSA-N 288.391 2.095 10 20 CECD CCOC(=O)[C@@H](CC(C)C)OC(=O)c1cccc(O)c1O 801859088 UQFBUMPJYBKYSF-GFCCVEGCSA-N 296.319 2.232 10 20 CECD Cc1cccc(CN2CCOCC(F)(F)C2)c1O 290065123 FMSRJFRLXLWPFY-UHFFFAOYSA-N 257.280 2.168 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C1 295687928 UIKXSKPDIYDLPZ-CDGCEXEKSA-N 285.343 2.382 10 20 CECD CCn1cc([C@H](C)NCc2cc3c(cc2O)OCO3)cn1 294862205 OKHPFIFHFVLRHN-JTQLQIEISA-N 289.335 2.188 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H](C)C[C@@H](C)N)C2)cc1 818616587 YNCQGKNJBATKKH-QLFBSQMISA-N 291.439 2.237 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCCC[C@H]2N)c1 818614640 DINQFTMPYBKQLF-ZLKJLUDKSA-N 264.369 2.321 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCC(C(F)F)CC1 827032414 YXWLTMWAKFRSAO-UHFFFAOYSA-N 289.253 2.354 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C(C)C)[C@H](C)N 829763991 DYDZGMMAVUANHH-XJKSGUPXSA-N 291.439 2.297 10 20 CECD COc1cccnc1N(C)C(=O)/C=C/c1cnccc1C 492454937 HJNYPCZEHABCOE-VOTSOKGWSA-N 283.331 2.470 10 20 CECD C[C@H]1CCC[C@@H](C)N1NC(=O)/C=C\c1ccc(O)c(O)c1 907998124 VOQPIXKEJNSFKO-BYHUGJBISA-N 290.363 2.405 10 20 CECD C[C@H](N)C[C@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 902519208 XYWGMOCLUSVOQX-GRDNDAEWSA-N 292.471 2.071 10 20 CECD Cc1cnc(CCN[C@@H]2CCc3cccc(O)c32)cn1 834907881 FFXCLMSRPBPMTO-CQSZACIVSA-N 269.348 2.310 10 20 CECD COC(=O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1cc(F)ccc1O)C2 839171720 JVUAFBAVMGOFBA-LERXQTSPSA-N 293.338 2.305 10 20 CECD CCOCCN1CCCc2cc(OC)cc(OC)c21 839654167 LGBYMTBSDMTUHZ-UHFFFAOYSA-N 265.353 2.493 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H]2CCNCC2(C)C)c1O 842476281 KPNNSZHWNJRKCJ-CQSZACIVSA-N 294.370 2.212 10 20 CECD CCCC[C@@H](CN)NCc1cccc(OCC)c1O 841029773 RXTAJJBQILUQEU-ZDUSSCGKSA-N 266.385 2.398 10 20 CECD Cc1cc(NC(=O)NCCc2ccc(N)cc2)nnc1C 841119072 UNXIQVOXIIEAFZ-UHFFFAOYSA-N 285.351 2.040 10 20 CECD CCOCc1cc(CNC[C@@H](N)C(C)C)ccc1OC 841028822 ICYBSSVMDQSNFP-OAHLLOKOSA-N 280.412 2.305 10 20 CECD CCc1cccc(CN2CC(=O)N[C@H]3CCCC[C@@H]32)c1O 848886195 UXCHVBCAZLZLEQ-GJZGRUSLSA-N 288.391 2.198 10 20 CECD CCN1CC(=O)N[C@H]1c1cc(OC)cc(C(C)(C)C)c1O 849184072 XUYPRKUEHZLASY-OAHLLOKOSA-N 292.379 2.149 10 20 CECD CCCN(Cc1cccc(OC)c1O)[C@H]1CCN(C)C1 843423069 VGTYMSCCMLGVKU-AWEZNQCLSA-N 278.396 2.317 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)NCc1cc(C)ccc1O 858527214 PHSGRCWTKFKVQT-UKRRQHHQSA-N 292.379 2.457 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H]1COC[C@@H]1C 926001431 ZRZYHIPKPASYSS-JSGCOSHPSA-N 292.379 2.349 10 20 CECD CC1CC(CNCc2cc([N+](=O)[O-])ccc2O)C1 856810926 BRBKYINGLPFNIK-UHFFFAOYSA-N 250.298 2.436 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ocnc1C 935948898 SIRZLTSRBDYDOW-UHFFFAOYSA-N 281.308 2.104 10 20 CECD CCC[C@H](CNC(=O)c1cc(O)cs1)OCC 862416048 LKUARPHBUPOCMS-SNVBAGLBSA-N 257.355 2.389 10 20 CECD Cc1ccc(CN(C)C[C@@H](O)C(F)(F)F)c(O)c1 877526903 GGQLPYYBPXLPGB-LLVKDONJSA-N 263.259 2.056 10 20 CECD CCOCCN(C)Cc1c(O)ccc2ccncc12 771634933 FTMJIOKRQVGPNC-UHFFFAOYSA-N 260.337 2.409 10 20 CECD CSC1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 872627398 BWLQDHRJLHYELM-CQSZACIVSA-N 295.404 2.145 10 20 CECD CC[C@H]1C(=O)N(CC)CCN1Cc1cc(C)c(C)cc1O 779218859 VDMDCHKCTJQWEU-HNNXBMFYSA-N 290.407 2.452 10 20 CECD Cc1cc(CN[C@H](C)c2c(O)cccc2F)ncn1 886557272 XHGCOROGUWKZOX-SNVBAGLBSA-N 261.300 2.481 10 20 CECD CSCc1cn(Cc2cc(F)cc(C(C)=O)c2O)nn1 880996051 MXJAFWQWKZKXEE-UHFFFAOYSA-N 295.339 2.237 10 20 CECD CSCC(C)(C)C(=O)NCc1cccc(O)c1O 1123889929 RJZJYGJGOQOIAI-UHFFFAOYSA-N 269.366 2.103 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCSC2)c1O 894315906 NUWHGNXJXADIQF-LLVKDONJSA-N 253.367 2.304 10 20 CECD CC(C)(O)[C@H]1CCCN1Cc1cc(F)cc(F)c1O 894453935 JJCRXSNABQVRMV-GFCCVEGCSA-N 271.307 2.406 10 20 CECD Cc1cc(N)nc(NCc2ccc(N(C)C)c(F)c2)n1 892131314 GNSXZAMWCGBEKN-UHFFFAOYSA-N 275.331 2.184 10 20 CECD CN(C)c1ccc(CN[C@@H](CO)CC(F)(F)F)cc1 717748750 HIGHSQBQNFFPNP-LLVKDONJSA-N 276.302 2.156 10 20 CECD COC(=O)C(C)(C)CNCc1c(O)cccc1Cl 272416688 MQJPJGIPPPPORG-UHFFFAOYSA-N 271.744 2.334 10 20 CECD Oc1ccc(Br)cc1CN1C[C@H]2COC[C@H]2C1 718251192 NXHNSGBMHDBPMI-PHIMTYICSA-N 298.180 2.233 10 20 CECD C[C@@H]1COC[C@H]1NCc1cc(Br)ccc1O 829431593 ISZSPOWFXDWUDC-LDYMZIIASA-N 286.169 2.279 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@@H]1CCN(C2CC2)C1 708481122 OKUMAVNSHDOCOH-JTQLQIEISA-N 282.334 2.244 10 20 CECD CCn1ccnc1SCC(=O)c1ccc(O)c(O)c1 689820505 CECMLLCEZWXKDU-UHFFFAOYSA-N 278.333 2.289 10 20 CECD COc1ccc(CNC2CC(CNC(C)=O)C2)cc1C 1090890153 RUTOTESIQNFDRY-UHFFFAOYSA-N 276.380 2.008 10 20 CECD COc1ccc(CNC(C)(C)CF)c(O)c1OC 1333754432 OUGVRRXYUASCPW-UHFFFAOYSA-N 257.305 2.247 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CCS[C@H]2C)c1 1261457089 XMNAYAGBIRXAKI-CABZTGNLSA-N 296.392 2.094 10 20 CECD C[C@@H](NCc1cc(C(=O)O)no1)c1ccc(N(C)C)cc1 1604341288 JLOZFNJYWDZFIW-SNVBAGLBSA-N 289.335 2.290 10 20 CECD CCCN(CC(=O)O)Cc1cc(F)c(N(C)C)cc1F 1605309419 IYJUHEGHCIXJIT-UHFFFAOYSA-N 286.322 2.327 10 20 CECD CCOc1cccc(CN2CC[C@@H](C)[C@@H](CN)C2)c1O 229060582 ITNQKEFDCZLQGI-OCCSQVGLSA-N 278.396 2.208 10 20 CECD Cc1ccc([C@H](C)NCCN2CCSCC2)c(O)c1 230661671 OHWRKQQGIHETDN-ZDUSSCGKSA-N 280.437 2.400 10 20 CECD CC(C)N1CC[C@@H](CNCc2cc(F)ccc2O)C1 232646459 YVQXQLQVQUIUNX-LBPRGKRZSA-N 266.360 2.351 10 20 CECD CCc1cccc(CNCc2ccnn2CC)c1O 827957383 SSUZXNDGQBHVPX-UHFFFAOYSA-N 259.353 2.461 10 20 CECD Cc1ccc(CN2CCO[C@H]([C@@H]3CCCO3)C2)c(O)c1 876806926 WHDYAVMKKBNUQC-HOTGVXAUSA-N 277.364 2.080 10 20 CECD COc1ccc(CNCc2c(C)cccc2O)cn1 876919479 VCICNXDBTAOTLP-UHFFFAOYSA-N 258.321 2.394 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)C(=O)N1CCCC1 135778666 XMFBNJKUVSYTEO-JTQLQIEISA-N 282.771 2.146 10 20 CECD COc1ccc(O)c(CNC[C@H](CC(C)C)N(C)C)c1 20201879 QNGZOFBMNMRIQQ-AWEZNQCLSA-N 280.412 2.467 10 20 CECD CCOc1cccc(CN2CCC[C@H](N(C)C)C2)c1O 156072782 AGIUXZGIVVQRFD-AWEZNQCLSA-N 278.396 2.317 10 20 CECD C[C@@H]1O[C@H](C)C[C@@H]1CNCc1cc(F)ccc1O 686507313 SDHNFHQCXZGETN-OUAUKWLOSA-N 253.317 2.434 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@]3(CCNC3)C2)c1O 394395637 BLWRHVDMHPZEHX-OAHLLOKOSA-N 296.798 2.240 10 20 CECD CNC(=O)CCCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 398351637 JWROKTNPLDPBEZ-NEPJUHHUSA-N 276.380 2.365 10 20 CECD CC(=O)N1CCCN(Cc2cc(C)c(C)cc2O)CC1 179812090 RHWSCRQFISLXDF-UHFFFAOYSA-N 276.380 2.063 10 20 CECD COC[C@@H](O)CN(c1ccc(OC)cc1)[C@@H](C)C1CC1 178858979 PIXKMGFMWLETFI-WFASDCNBSA-N 279.380 2.307 10 20 CECD COCCN(C)CCCNCc1c(O)cccc1Cl 113321313 DSPGJLACJMEFJF-UHFFFAOYSA-N 286.803 2.104 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](CO)OC[C@H]2C)cc1 305745082 NPCVIWFBVHMRFZ-RHSMWYFYSA-N 292.423 2.114 10 20 CECD CC(C)[C@@H]1C[C@H](NC(=O)c2cccc(O)c2O)CCO1 279778171 HDFMFNKDXKKDHA-MFKMUULPSA-N 279.336 2.031 10 20 CECD Oc1c(Br)cccc1CNC[C@@H](O)C1CC1 70883331 AGJZUMFDARREAX-LLVKDONJSA-N 286.169 2.015 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(=O)N[C@@H](C)C(C)C)c1 182406133 MTXOGXRCCGHPTO-NWDGAFQWSA-N 294.395 2.212 10 20 CECD C[C@@H](NC[C@H]1CCCN1C)c1cc(F)ccc1O 185142731 HOVKWAVECDYEBU-ZYHUDNBSSA-N 252.333 2.276 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@@]1(C)CCCO1 133343280 FTYMSYWSCYPXOD-OAHLLOKOSA-N 278.352 2.103 10 20 CECD Cc1cc(C(=O)N[C@@H](C)CN)c(C)n1-c1ccc(F)cc1 262522114 IWRKXPVRUNVMRA-JTQLQIEISA-N 289.354 2.310 10 20 CECD COC[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 271158845 DZNYRJVYXQAKJB-ZDUSSCGKSA-N 266.360 2.360 10 20 CECD Oc1ccc(Cl)cc1CN1CCOC[C@@H]1[C@H]1CCCO1 377707913 WIZHMHRYUQUIMP-UKRRQHHQSA-N 297.782 2.425 10 20 CECD COCCN(CCN(C)C)Cc1cccc(Cl)c1O 289432375 KWQDOCCTNQIOAH-UHFFFAOYSA-N 286.803 2.056 10 20 CECD CCNCCCN[C@H](C)c1cc(F)cc(F)c1O 817943153 JMVGCOUUBXKWHZ-SECBINFHSA-N 258.312 2.321 10 20 CECD OC1(CCCNCc2ccc3c(c2)CCO3)CCC1 817414859 PKLJKTWGZSCEGQ-UHFFFAOYSA-N 261.365 2.406 10 20 CECD Cc1ccc(C(=O)OCc2cn3ccccc3n2)c(O)c1O 728344962 UTGCQVBIDMAFFQ-UHFFFAOYSA-N 298.298 2.411 10 20 CECD O=C(O)[C@H]1CCCN1Cc1cccc(Cl)c1O 821509298 MZDYPRNHMDYXQR-SNVBAGLBSA-N 255.701 2.095 10 20 CECD O=C1NC(=S)S/C1=C\c1ccc2oncc2c1 821022099 OEMOIHXCBRBQPT-WTKPLQERSA-N 262.315 2.317 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H](C)c1ccc(C)c(C)c1O 834903999 MCNUZJRWXJYDOV-BPLDGKMQSA-N 279.380 2.464 10 20 CECD CC(C)C(=O)NCc1cc(F)c(N2CCOCC2)c(F)c1 837705234 SIHNQGUFWBGOMK-UHFFFAOYSA-N 298.333 2.074 10 20 CECD Cc1cc(C(=O)NCc2cocn2)c(C)n1-c1ccccn1 730803898 VHCYHYGQNNBUBA-UHFFFAOYSA-N 296.330 2.407 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cncnc1C1CC1 836762912 RRFDIAXBMWJNSL-UHFFFAOYSA-N 283.331 2.332 10 20 CECD CN[C@H](CC(C)(C)C)C(=O)NCc1ccc(OC)cc1O 832178831 XRBHBFYCXJATRX-CYBMUJFWSA-N 294.395 2.041 10 20 CECD CNC[C@@H]1CCCN1Cc1ccc(N(C)C)cc1C 843056122 TXYUCDBLRAUHEC-INIZCTEOSA-N 261.413 2.245 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)C(C)(C)CN(C)C 748328043 XVMQAYYQHHSFPM-SECBINFHSA-N 270.398 2.160 10 20 CECD Cc1cc(O)c([C@H]2NC(=O)CN2CC(C)C)cc1Cl 849183702 VVMVBSSHWVGQKZ-AWEZNQCLSA-N 282.771 2.440 10 20 CECD COc1ccc(N(C)CCN(C)Cc2cnsn2)cc1 847007933 HVOMXWGIRUDDGA-UHFFFAOYSA-N 292.408 2.115 10 20 CECD CCC[C@@]1(CO)CCCN1C(=O)Nc1ccc(N)cc1 841297530 SLEUEHRLFILRQR-HNNXBMFYSA-N 277.368 2.428 10 20 CECD COc1cccc([C@@H](C)NCCCn2ccnc2)c1O 846136048 GSQPHUDBADYILH-GFCCVEGCSA-N 275.352 2.338 10 20 CECD CCOc1ccc(O)c(CN2CCC3(CCNC3)CC2)c1 843126301 IKGJQMYOJIPETR-UHFFFAOYSA-N 290.407 2.366 10 20 CECD C[C@H]1CCCc2ncc(C(=O)NCCc3ccc(N)cc3)n21 846664720 AVOYRNCFLGXUCP-LBPRGKRZSA-N 298.390 2.335 10 20 CECD Cc1nc2n(n1)C[C@@H](NCc1ccc3c(c1)CCCO3)CC2 921662369 NRKMRUXMUGJDMI-HNNXBMFYSA-N 298.390 2.016 10 20 CECD Cc1cnn(CC(=O)NCc2ccc(N3CCCC3)cc2)c1 920458361 XRVKEAWZFOZRPA-UHFFFAOYSA-N 298.390 2.108 10 20 CECD CCC[C@@H](OCC)C(=O)OCC(=O)c1ccc(O)c(O)c1 859837117 BDOZQJBPPANQQK-CQSZACIVSA-N 296.319 2.029 10 20 CECD CC(C)C(=O)NCCN[C@@H](C)c1cc(F)cc(F)c1O 756374106 XWTAVYZZDDAPQC-VIFPVBQESA-N 286.322 2.093 10 20 CECD O=C(CCCCO)NCc1cc(Cl)cc(Cl)c1O 868358134 NBXCTOAYDZOIKW-UHFFFAOYSA-N 292.162 2.478 10 20 CECD CC(=O)c1cc(F)cc(CNC2(C(=O)O)CCCC2)c1O 769751064 FJSSOZYJXSAVSD-UHFFFAOYSA-N 295.310 2.221 10 20 CECD CCN(CC)C[C@@H](C)NC(=O)N[C@H](C)c1ccccc1O 868361724 GKMLOPZCFMCISK-CHWSQXEVSA-N 293.411 2.483 10 20 CECD COC(=O)[C@@H]1CC12CCN(Cc1cccc(C)c1O)CC2 775701416 UWPSMDVKQNCBFX-AWEZNQCLSA-N 289.375 2.476 10 20 CECD CC[C@H](C[C@@H](C)CO)NC(=O)/C=C/c1ccc(O)c(O)c1 779534179 OIBREBGJYSGXBY-BVKQBWKVSA-N 293.363 2.024 10 20 CECD CC(=O)NCC[C@@H]1CCCN(Cc2ccc(C)cc2O)C1 877530326 SHHJZONRMVCSGY-HNNXBMFYSA-N 290.407 2.439 10 20 CECD CCC[C@@H](O)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775404374 NENOATFONHYVNT-SWLSCSKDSA-N 278.396 2.481 10 20 CECD COC(=O)[C@H]1CCCCN1Cc1ccc(C)cc1O 876554276 IMNINAMSUOXSDU-CYBMUJFWSA-N 263.337 2.228 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCc2c[nH]nc2C1 883040806 OCXUXJGFALMPCD-LLVKDONJSA-N 279.290 2.041 10 20 CECD CCC[C@@H](C)C(=O)OCC(=O)c1ccc(O)c(O)c1 782986985 QQJMCTFPZLJPJE-SECBINFHSA-N 266.293 2.260 10 20 CECD C[C@H](NC[C@]1(O)CCSC1)c1c(O)cccc1F 886536986 ROODOAFWKJSCFT-TVQRCGJNSA-N 271.357 2.050 10 20 CECD COc1cccc(CNC(=O)N2CCCCCC2)c1O 883084960 GBZXPUMJBASSEQ-UHFFFAOYSA-N 278.352 2.486 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)c1O 894553141 YDVIFUFTPPUAHT-HRBWSGTNSA-N 297.420 2.051 10 20 CECD C[C@H](O)CCCNCc1ccc(N(C)C)c(F)c1 788530000 USLQWXWILURTFN-NSHDSACASA-N 254.349 2.142 10 20 CECD COC[C@H](C)NCc1ccc(Br)cc1O 701016173 VCFMRJQJDZXFIE-QMMMGPOBSA-N 274.158 2.279 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(C)cc1O 188468455 QZSUNYCROYJZSP-RYUDHWBXSA-N 264.369 2.218 10 20 CECD C[C@@H](N[C@H](CO)CC(F)F)c1cc(F)ccc1O 717765963 AHOJWHGSLMJJQI-APPZFPTMSA-N 263.259 2.198 10 20 CECD CON1CCC(NCc2c(O)cccc2Cl)CC1 692192862 VOTBGUAASKGFKQ-UHFFFAOYSA-N 270.760 2.161 10 20 CECD O=C(NC[C@@H]1C[C@H]2C=C[C@H]1C2)c1c(F)ccc(O)c1O 1336968387 CSRYXKVXFYRZKU-GUBZILKMSA-N 277.295 2.179 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1C[C@H]1F 1351666300 LJBODPDYTFCTMO-DGCLKSJQSA-N 263.312 2.245 10 20 CECD Nc1ccc(CNC(=O)NCCCC(F)(F)F)cc1 1353540543 VNTSSADVIZOHNL-UHFFFAOYSA-N 275.274 2.411 10 20 CECD O=C(NCc1cccc(O)c1O)C1[C@H]2CCCC[C@H]12 1528771136 LAFNUWCYSSCARX-QWRGUYRKSA-N 261.321 2.150 10 20 CECD O=C(O)[C@@H]1[C@@H]2CCC[C@H]2CN1Cc1ccc(F)c(F)c1O 1601756918 KHRSMNKTHOIWAQ-PLMOITTCSA-N 297.301 2.356 10 20 CECD COC1([C@@H](N[C@@H](C)c2ccccc2O)C(=O)O)CCC1 1599084840 BTRXYDXSLBJIJI-GWCFXTLKSA-N 279.336 2.065 10 20 CECD CC[C@@H](C)C[C@@H](NCc1cccc(OC)c1O)C(=O)O 1594953672 RQAZRFCMKAXCOU-ZYHUDNBSSA-N 281.352 2.380 10 20 CECD CC(=O)NC1CCN(Cc2c(O)cccc2Cl)CC1 123263016 PCXBDEJCVVRTKW-UHFFFAOYSA-N 282.771 2.146 10 20 CECD CCN1C(=O)/C(=C\c2ccc(C(=O)O)o2)SC1=S 1596388526 WZEFURYFPKVDKG-VMPITWQZSA-N 283.330 2.199 10 20 CECD CN(C)c1cc(F)c(CN[C@@H](C(=O)O)C2(C)CC2)cc1F 1777038095 WKHWZGWKXKXHIQ-ZDUSSCGKSA-N 298.333 2.374 10 20 CECD CNC(=O)[C@H](C)N[C@@H](C)c1ccc2ccccc2c1O 49095646 XASOSKGQVRXRFS-QWRGUYRKSA-N 272.348 2.331 10 20 CECD CCOc1cccc(CNC2(COC)CCC2)c1O 283827702 DUMALINXHFXFJA-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Cn1cc(CNCc2cc(Cl)cc(Cl)c2O)nn1 389832518 JDIRFSLHGKHHMD-UHFFFAOYSA-N 287.150 2.117 10 20 CECD O=C(NC1CCC(F)(F)CC1)c1cccc(O)c1O 390381782 VMHZWOXVWNFEON-UHFFFAOYSA-N 271.263 2.406 10 20 CECD CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@@H](C)O 395246907 ARFWSYLZKTVYAV-CWSCBRNRSA-N 253.342 2.211 10 20 CECD C[C@@H]1SCCN(Cc2cc3c(cc2O)OCO3)[C@@H]1C 118381767 RZMFINMSBWQIDD-ZJUUUORDSA-N 281.377 2.447 10 20 CECD COc1ccc(O)c([C@@H]2NC(=O)CN2Cc2ccccc2)c1 112369103 NASVODXVMFBSDP-QGZVFWFLSA-N 298.342 2.031 10 20 CECD COc1cccc(CNc2ncncc2Cl)c1O 302674085 SYGQZKNHTWQXEU-UHFFFAOYSA-N 265.700 2.456 10 20 CECD C[C@H](NCCCOCCO)c1cc2c(cc1O)CCCC2 186514349 XQNKZLGJGJBFDG-ZDUSSCGKSA-N 293.407 2.321 10 20 CECD CC(C)OCCC(=O)NCc1ccc(N(C)C)cc1 73521299 HUVGUOYRMPXLTF-UHFFFAOYSA-N 264.369 2.184 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CCCCNC2=O)cc1 36976603 NVPOBXIHFFCKMB-MRXNPFEDSA-N 289.423 2.291 10 20 CECD C[C@@]1(O)CCN(Cc2cccc(Br)c2O)C1 180193504 FHBOYGWVZMGQQK-GFCCVEGCSA-N 286.169 2.111 10 20 CECD CN(Cc1nccs1)C(=O)/C=C/c1ccc(O)c(O)c1 181149965 RTVBXDRTPRTSQY-HWKANZROSA-N 290.344 2.226 10 20 CECD C[C@@H]1C[C@@H]1CNC(=O)NCc1ccc(N(C)C)cc1 48141301 IHKRITFLXQGLRY-DGCLKSJQSA-N 261.369 2.208 10 20 CECD NC(=O)COc1ccc(NCc2cc(F)ccc2O)cc1 226580662 BQFYMCSUEUIWRX-UHFFFAOYSA-N 290.294 2.008 10 20 CECD COc1ccc(O)c(CN2CCC(C)(C(=O)O)CC2)c1 86777067 CRNDPDMFYHINOD-UHFFFAOYSA-N 279.336 2.088 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H](O)C(F)(F)F)c1 230659190 QRJSPHPXBIVDQR-GZMMTYOYSA-N 263.259 2.274 10 20 CECD CC[C@@H]1CC[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)O1 268131729 MLZHCGQSZPNKGC-IUODEOHRSA-N 294.370 2.466 10 20 CECD Cc1ccc2c(c1)[C@H](NC(=O)c1cccc(O)c1O)CO2 366164535 XOKTZSBRSKXUEM-GFCCVEGCSA-N 285.299 2.270 10 20 CECD O=C(c1cccc(O)c1O)N1CCOC[C@@H]1c1ccccc1 366174646 ZQNCVPQBBYABJA-CQSZACIVSA-N 299.326 2.312 10 20 CECD Oc1ccccc1CN1CCC[C@@H]1[C@H](O)C(F)(F)F 271261154 IPYIJNQLLIDNJM-PWSUYJOCSA-N 275.270 2.280 10 20 CECD CN(C)c1ccc(CNC[C@H]2CC[C@@H](O)C2)cc1F 276660403 JNTNBXWIBXMZGX-WCQYABFASA-N 266.360 2.142 10 20 CECD COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1cccc(OC)c1O 274850739 BFXARDMUJPGGKI-AAEUAGOBSA-N 293.363 2.174 10 20 CECD CC[C@@H](NCC1([S@](C)=O)CC1)c1ccc(F)cc1O 287500338 NRNFHCKEWIFVRV-BLVKFPJESA-N 285.384 2.483 10 20 CECD COC(=O)[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1C 280182287 GWFBQVPRFULZNB-NXEZZACHSA-N 283.755 2.287 10 20 CECD CON(CC(C)(C)C)C(=O)c1ccc(C)c(O)c1O 286466760 KPFIPUJFRTZHNC-UHFFFAOYSA-N 267.325 2.456 10 20 CECD COC(=O)C(C)(C)CCNCc1cc(OC)ccc1O 280840058 KPAAOEQKQTXATD-UHFFFAOYSA-N 281.352 2.080 10 20 CECD COCCCn1nccc1CN(C)Cc1ccccc1O 282852337 SWEGJHBVJQFTOS-UHFFFAOYSA-N 289.379 2.257 10 20 CECD C[C@H]1C[C@@H](CO)CCN1Cc1ccc(N(C)C)cc1 288595315 DPVVEIDYZKPMON-ZFWWWQNUSA-N 262.397 2.345 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSC(F)F 295625860 ATSKBRVXMVZJMH-SSDOTTSWSA-N 291.319 2.101 10 20 CECD Cc1cc(CN(CCO)CC(F)F)ccc1N(C)C 293943016 BDUHEAYPXDLKSD-UHFFFAOYSA-N 272.339 2.120 10 20 CECD OC[C@H]1CN(Cc2c(O)cccc2Cl)CCC1(F)F 291272368 NWZDAGSNKHUFKO-SECBINFHSA-N 291.725 2.495 10 20 CECD C[C@H](NC[C@@H]1CNC(=O)C1)c1ccc2ccccc2c1O 398338361 JLCRFZYAPUBQCZ-NWDGAFQWSA-N 284.359 2.332 10 20 CECD C[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)[C@H]1CCCOC1 817942899 RHUPOXDBRBVTNB-QRTARXTBSA-N 291.439 2.157 10 20 CECD Cc1cc(CN2CCC[C@H](n3ccnn3)C2)ccc1N(C)C 823468331 FUXONKNYFAIYKB-INIZCTEOSA-N 299.422 2.490 10 20 CECD O=C(CNCc1c(O)cccc1Cl)NC1CCCC1 733327730 FPWBRKPHCIYFDI-UHFFFAOYSA-N 282.771 2.194 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@H]2CCN2C)cc1 903321692 HYTIDNREJRJHIP-BBRMVZONSA-N 261.413 2.497 10 20 CECD C[C@@H](CNC(=O)c1cc(O)cs1)N1CCC[C@@H](C)C1 731869556 LMTLJUPCRFSHMZ-MNOVXSKESA-N 282.409 2.304 10 20 CECD COc1ccc(N(C)CC2(C)COC2)cc1OC 735920394 RJOBNZLBAVKYGK-UHFFFAOYSA-N 251.326 2.177 10 20 CECD COC(=O)c1oc(COC(=O)c2cc(O)cs2)cc1C 732352708 CPQICURENHFJNP-UHFFFAOYSA-N 296.300 2.499 10 20 CECD CCCN(Cc1ccccc1O)c1ncc(C(=O)O)cn1 910357226 ZPEKNUAXHNWUFB-UHFFFAOYSA-N 287.319 2.297 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)NCc1ccc(N(C)C)cc1C 840936269 HYNJZFZFWNNGGL-KBPBESRZSA-N 291.439 2.454 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](CO)CCF)c(O)c1C 846209341 QJEANJRWWPHIRQ-VXGBXAGGSA-N 255.333 2.380 10 20 CECD CCC[C@H](O)CCNC(=O)NCc1ccc(N(C)C)cc1 913926430 CGZUUZSCPCCDRC-HNNXBMFYSA-N 293.411 2.103 10 20 CECD C[C@H](NCc1cc(F)ccc1O)[C@@H]1CCCNC1 841033274 MIKXXSAMAMJVGQ-WDEREUQCSA-N 252.333 2.009 10 20 CECD CN(CC[C@H]1CCOC1)c1ccc(OCC(=O)O)cc1 846280049 SNMOBCISUMVPBP-LBPRGKRZSA-N 279.336 2.013 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)CC[C@@H]1N 843052029 OROTUMJYBITVGJ-SKDRFNHKSA-N 254.761 2.215 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)c2ccc[nH]2)cc1 846445698 FHLZRLGFVGVAGY-UHFFFAOYSA-N 287.363 2.232 10 20 CECD O=C(CN1CCc2ccccc21)NCc1ccccc1O 748347016 RPXZKCQQCIUSIR-UHFFFAOYSA-N 282.343 2.071 10 20 CECD Cc1nc(CNC[C@@H](N)c2ccc(N(C)C)cc2)cs1 841042433 JOKYHRMRGWPTJA-OAHLLOKOSA-N 290.436 2.307 10 20 CECD COC1CCN(CCN[C@@H](C)c2ccc(C)cc2O)CC1 756641112 GHASVLXQUOCYAY-AWEZNQCLSA-N 292.423 2.462 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC/C=C/Cl 759589814 UEOROGRYTDGZCO-LWLQJDLGSA-N 254.669 2.407 10 20 CECD CC[C@@H](NC)C(=O)NCc1ccc(N(CC)CC)c(F)c1 852805283 VDXSXAFYLKZVDO-CQSZACIVSA-N 295.402 2.286 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@]3(C)CCOC3)ccc21 754203288 ZKTJUOMTNOLFOZ-KRWDZBQOSA-N 288.391 2.112 10 20 CECD C[C@@H](NC[C@](C)(O)C1CC1)c1cc(F)cc(F)c1O 756575677 JRFQSROYEMVXAP-CLAHSXSESA-N 271.307 2.482 10 20 CECD CN(C)c1cc(F)c(CNC2CCC(O)CC2)cc1F 862331442 KKHLDIRLZFWPQD-UHFFFAOYSA-N 284.350 2.424 10 20 CECD CC[C@@H](NC[C@H]1C[C@H](N)C1)c1ccc(F)cc1O 873258784 VZNGENRJGZZHRU-IRUJWGPZSA-N 252.333 2.309 10 20 CECD COC(=O)[C@@H](NCc1ccc(N2CCCC2)cc1)C1CC1 1116755408 HJBSYPWJWXTXSC-INIZCTEOSA-N 288.391 2.328 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccccc1O 879649035 JURGEQLKMRCNIW-UTUOFQBUSA-N 264.369 2.346 10 20 CECD CSCC[C@@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 779519105 NUFKUGOEJHRYKD-AYYIZTPMSA-N 281.377 2.369 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCO[C@@H](C)C2)c1 776473493 LDKOGUKSZCEWDH-SRVKXCTJSA-N 293.363 2.393 10 20 CECD CCOCc1cc(CNCC[C@H](O)C2CC2)ccc1OC 898207038 YVTASFJFQCIDCW-INIZCTEOSA-N 293.407 2.482 10 20 CECD COc1cc(C)cc(CN(C)[C@H]2CC(C)(C)OC2=O)c1O 894850470 IRPQFEDUKBGTNI-LBPRGKRZSA-N 293.363 2.235 10 20 CECD Cc1cc(O)c(CNCC[C@@H](C)N(C)C)cc1C 895297763 OGSIHGDJQJNOPV-CYBMUJFWSA-N 250.386 2.439 10 20 CECD CCOc1ccc(CN[C@@H]2CC[C@H](C(=O)OC)C2)c(O)c1 896126498 ZUUZVIYCXQORDP-WCQYABFASA-N 293.363 2.222 10 20 CECD Oc1c(F)cc(F)cc1CNC1CCN(C2CC2)CC1 708481831 UVNGZEXZCQFEKG-UHFFFAOYSA-N 282.334 2.387 10 20 CECD CN(C)c1ccc(CNCC2(CC(=O)O)CC2)cc1 1326261778 VIVLBCJZIYQAOR-UHFFFAOYSA-N 262.353 2.097 10 20 CECD CN(CC1CC1)C[C@@H]1CCN(Cc2ccc(N)cc2)C1 1336285523 MNJGFNZOQGCBPR-INIZCTEOSA-N 273.424 2.433 10 20 CECD Nc1ccc(CN2CCC([C@H](O)C(F)(F)F)CC2)cc1 1336284939 DZSDFYYWDDIZHB-ZDUSSCGKSA-N 288.313 2.404 10 20 CECD Oc1ccccc1CN(CCc1cnn[nH]1)C1CCCC1 1333583950 WZPMSAIHOPWOIK-UHFFFAOYSA-N 286.379 2.498 10 20 CECD COC(=O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1ccc(N)cc1)C2 1352788092 BNJFUTYNXSNJLB-BPLDGKMQSA-N 274.364 2.042 10 20 CECD CS[C@H](CO)[C@H](C)NCc1ccc(N2CCCC2)cc1 219077448 BSPSVACXIPBTIX-XJKSGUPXSA-N 294.464 2.489 10 20 CECD CC1(C)[C@@H](N)C[C@@H]1NCc1c(O)ccc(Cl)c1F 1576380010 FPNCTUUOBVFBOZ-QWRGUYRKSA-N 272.751 2.400 10 20 CECD C[C@@H](NCC(C)(C)C)c1cccc(-c2nn[nH]n2)c1O 1589957210 BSEXYLIZYMUNME-SECBINFHSA-N 275.356 2.269 10 20 CECD CS[C@H]1CC[C@H](NCc2cc3c(cc2O)OCO3)C1 230696817 OXLWITISXQRVJC-QWRGUYRKSA-N 281.377 2.495 10 20 CECD C[C@H]1OCCN(C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 151473324 JPWYTCOIHZXEFA-CHWSQXEVSA-N 291.395 2.071 10 20 CECD Cc1ccc2c(c1)OCCN2C(=O)/C=C/c1cnn(C)c1 154776733 GNKBEMODPWLKAK-GQCTYLIASA-N 283.331 2.167 10 20 CECD COCCN(CCOC)Cc1cc2c(cc1O)CCCC2 159662047 DJXLGPIFURGHPU-UHFFFAOYSA-N 293.407 2.366 10 20 CECD C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)C1CCC1 837480990 MQEIUTZXJMYZFY-SNVBAGLBSA-N 263.337 2.193 10 20 CECD COC(=O)N(C)CCN[C@@H](C)c1cc(C)ccc1O 689583659 DFMOKKMMUIRLGL-NSHDSACASA-N 266.341 2.049 10 20 CECD CN1CCCc2cc(CNC(=O)N3CCCC3)ccc21 58516827 GOLOYDWKAIIWOY-UHFFFAOYSA-N 273.380 2.374 10 20 CECD CCO[C@H]1C[C@@H]1C(=O)NCc1ccc2c(c1)CCCN2C 69960517 PMNJABYWCLDQKD-HOCLYGCPSA-N 288.391 2.110 10 20 CECD COc1cccc(CN(C)CC(=O)OC(C)(C)C)c1O 126941148 HVLIAPZHVXVOBG-UHFFFAOYSA-N 281.352 2.174 10 20 CECD C[C@](O)(CNCc1ccccc1O)c1ccsc1 77460790 USSVOQQICZTOMM-AWEZNQCLSA-N 263.362 2.451 10 20 CECD CN(CCCCCO)Cc1ccc(N(C)C)cc1 263763149 LWDVAPMCKQSQPO-UHFFFAOYSA-N 250.386 2.347 10 20 CECD CCO[C@@H](CCNC(=O)c1cccc(O)c1O)C(C)C 193117916 AZKVCDPOHSTZIG-ZDUSSCGKSA-N 281.352 2.279 10 20 CECD C[C@H](CN)N(C)Cc1cc(Cl)cc(Cl)c1O 382981359 YSJYDXUQIRRINH-SSDOTTSWSA-N 263.168 2.478 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(N)cc2)n(C)n1 236606807 CEXCJOVBNJPHJQ-UHFFFAOYSA-N 286.379 2.098 10 20 CECD COCC(C)(C)CNCc1c(O)cccc1OC 813790284 LRMDYLSJUNDVKT-UHFFFAOYSA-N 253.342 2.163 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@H]2CN3CCC[C@@H]3CO2)c1 91662379 ZVOGOFMNQMJISF-ZNMIVQPWSA-N 290.407 2.214 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)N[C@H](C)c1cc(OC)ccc1O 245812815 HWVMGNRBQSWZHA-LJWDBELGSA-N 279.336 2.003 10 20 CECD CN(C)C(=O)O[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 295122739 NLIPYOLMIJBKPB-LLVKDONJSA-N 298.770 2.318 10 20 CECD Oc1ccccc1CN1CCC[C@H]1[C@@H](O)C(F)(F)F 271261152 IPYIJNQLLIDNJM-CMPLNLGQSA-N 275.270 2.280 10 20 CECD COc1cccc(CN2C[C@@H](O)Cc3ccccc32)c1O 279361964 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CN(C)c1ccc(CNC(=S)NC2CCC2)cc1F 814196695 JHBCBUMTQGHBNH-UHFFFAOYSA-N 281.400 2.408 10 20 CECD c1cc(N2CCOCC2)ccc1CN1CC[C@H]2C[C@@H]2C1 827506688 KDNAQSVXBNHSJJ-JKSUJKDBSA-N 272.392 2.365 10 20 CECD Cc1cc(O)c(CNCc2nonc2C)cc1Cl 825922709 VSVQECZEVLSWKE-UHFFFAOYSA-N 267.716 2.335 10 20 CECD CCOC[C@@H](O)CN(C)Cc1ccc(N(CC)CC)cc1 733610309 IBERZUBZBBQYKO-KRWDZBQOSA-N 294.439 2.362 10 20 CECD CN(C(=O)/C=C\c1ccc(O)c(O)c1)c1nccs1 588405220 ZTTMEZCNCQTGGO-HYXAFXHYSA-N 276.317 2.231 10 20 CECD CCNC(=O)c1ccc(NC(=O)c2cc(O)cs2)cc1 731871299 AHTAMLIGZOHFCH-UHFFFAOYSA-N 290.344 2.456 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](CCN)C1 904407732 ZXLVJDRNOOYBED-AWEZNQCLSA-N 261.413 2.232 10 20 CECD O=C(NCc1cn2ccccc2n1)NCc1ccccc1O 748462704 HEJYCABTILHITH-UHFFFAOYSA-N 296.330 2.039 10 20 CECD CC[C@@H](CN[C@H](C)c1cccc(OC)c1O)OC 846172891 PIJJUATYLYNYLW-MNOVXSKESA-N 253.342 2.476 10 20 CECD NC1(CNCc2c(O)ccc(Cl)c2F)CCC1 841048360 HXHIUWBYEMNREG-UHFFFAOYSA-N 258.724 2.156 10 20 CECD O=C(CCc1nccs1)NCc1ccccc1O 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CC(=O)c1cc(F)cc(CN2CCN(C)[C@@H](C)[C@@H]2C)c1O 771467643 UPKGXCBAHSKFIT-QWRGUYRKSA-N 294.370 2.258 10 20 CECD CCC[C@H](O)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775404376 NENOATFONHYVNT-WFASDCNBSA-N 278.396 2.481 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)CSC)c1O 775028718 SFKJUEXOOIVYSF-QMMMGPOBSA-N 286.353 2.150 10 20 CECD C[C@H](N[C@H](C)c1c(O)cccc1F)C1(CO)CC1 886636349 LXRLIGCSZQAJBP-ZJUUUORDSA-N 253.317 2.343 10 20 CECD CCOc1ccc(CN[C@@H](COC)[C@@H]2CCCO2)c(O)c1 788533862 DDLIKVBBGZAOIA-HOCLYGCPSA-N 295.379 2.075 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)CO1 784143788 HPBNEUKHTQXSNB-DZGCQCFKSA-N 288.391 2.328 10 20 CECD Oc1cc(F)c(Cl)cc1CNCCO[C@H]1CCOC1 897201315 IRKZHFWWOOXBMG-JTQLQIEISA-N 289.734 2.080 10 20 CECD C[C@H](NCCC1(O)CCOCC1)c1ccc(N(C)C)cc1 797032008 MNAPXJALMTZMNM-AWEZNQCLSA-N 292.423 2.335 10 20 CECD Cc1cccc(CCNC(=O)/C=C\c2ccc(O)c(O)c2)n1 792494290 SHUAWIVJBLTZJA-VURMDHGXSA-N 298.342 2.173 10 20 CECD CCOC[C@@H]1CCN(Cc2c(O)cccc2OC)C1 769531919 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164406283 FEKMEFAOKJPIIJ-INIZCTEOSA-N 272.392 2.455 10 20 CECD C[C@@H](CNC(=O)OC(C)(C)C)NCc1ccccc1O 235159163 LASYZQPRNFXXOK-NSHDSACASA-N 280.368 2.395 10 20 CECD Nc1ccc(OCc2cn(CCCCF)nn2)cc1 864630876 NSPHXFZCQRQYDP-UHFFFAOYSA-N 264.304 2.189 10 20 CECD Cc1cccc(O)c1CNCCCOC[C@H]1CCCO1 876900246 WPXBRDJFUPMVJR-CQSZACIVSA-N 279.380 2.376 10 20 CECD COC[C@](C)(O)CN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 382546804 GASHOSLJJGDMNU-XHBSWPGZSA-N 279.380 2.236 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccccn1 173197542 ZSBOWDIOSAKGCN-UHFFFAOYSA-N 283.331 2.187 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N(C)CC(F)F 115854989 WWRFRRFOXVGGAW-UHFFFAOYSA-N 285.338 2.468 10 20 CECD CN1C(=O)c2ccccc2N[C@@H]1c1cc2c(cc1O)OCO2 63495070 UXUDXSYWWSCZLR-HNNXBMFYSA-N 298.298 2.317 10 20 CECD C[C@@H]1C[C@@H](C(=O)Nc2c(Cl)ccc3nonc23)CO1 1346941260 PIFNHAUZQUNWPM-RNFRBKRXSA-N 281.699 2.240 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1C=CCCC1 180859918 AYMYFSCYLVNGQS-YPUOHESYSA-N 259.305 2.336 10 20 CECD CCN1CCN(Cc2cccc(Br)c2O)CC1 131704362 YUNQXEWZWAVHQR-UHFFFAOYSA-N 299.212 2.292 10 20 CECD CN(C)c1ccc(CNC[C@H](O)Cc2ccccc2)cc1 237089609 RDAJXPBYCSUSOQ-GOSISDBHSA-N 284.403 2.446 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@](C)(O)C1CC1 270120215 MBMWPEVSHIRFIS-QGZVFWFLSA-N 290.407 2.262 10 20 CECD COCCN1CC[C@@H](N[C@@H](C)c2ccc(C)c(C)c2O)C1 273567929 JYPVYINEVGVRGN-LSDHHAIUSA-N 292.423 2.380 10 20 CECD COCC[C@@H](CO)NCc1cc(Cl)cc(Cl)c1O 282255815 OXSWJCOYTKQRPB-JTQLQIEISA-N 294.178 2.186 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@]2(O)CCO[C@H]2C)c(O)c1 285447653 ZHXVNIJRWSBLMV-HEHGZKQESA-N 279.380 2.200 10 20 CECD Cn1nc(C(C)(C)C)cc1C(=O)NCc1ccc(N)cc1 297148461 IPRQFIVFCSXFTP-UHFFFAOYSA-N 286.379 2.230 10 20 CECD COc1ccc(O)c(CNC(=O)C2CC(C)(C)C2)c1 802783524 VDDIXDKDOXQSBI-UHFFFAOYSA-N 263.337 2.453 10 20 CECD C[C@H](NC[C@H]1CNC(=O)C1)c1ccc2ccccc2c1O 398338365 JLCRFZYAPUBQCZ-RYUDHWBXSA-N 284.359 2.332 10 20 CECD CCOc1ccc(O)c(CNC[C@@H](OC)C2CC2)c1 293196515 XKOASRBXMZAMJE-OAHLLOKOSA-N 265.353 2.306 10 20 CECD CCCN1C[C@H](CN[C@@H]2CCc3cccc(O)c32)CC1=O 817589902 RELKNDQVEJPLDC-GXTWGEPZSA-N 288.391 2.228 10 20 CECD COCCCOc1ccccc1NC[C@@H](O)CSC 819421183 GAXKZPRFVQKHQW-GFCCVEGCSA-N 285.409 2.238 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CC[C@@H](n2cncn2)C1 816574451 ICMKLEVMFKYMCG-SNVBAGLBSA-N 296.733 2.223 10 20 CECD CO[C@@H]1COCC[C@H]1CNCc1c(O)cccc1Cl 824710446 YWFQGPSIOVDLSU-IINYFYTJSA-N 285.771 2.187 10 20 CECD CC1CCN(CC(=O)N[C@H](C)c2ccccc2O)CC1 827936776 CMNRIJJNMKJPEM-CYBMUJFWSA-N 276.380 2.301 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@H](C)C(=O)O)cc1 734843565 OMSPZFVAZDZVRG-LBPRGKRZSA-N 264.369 2.438 10 20 CECD COc1ncc(/C=C/C(=O)N2CCc3c(F)cccc32)cn1 492743052 VLTCYQDLEVZEBU-AATRIKPKSA-N 299.305 2.227 10 20 CECD CC[C@H](CNCc1cc(Cl)cc(OC)c1O)C(=O)O 903709673 PTAVDCOOPYXCTG-MRVPVSSYSA-N 287.743 2.255 10 20 CECD C[C@H]1COCC[C@@H]1CNC(=O)Nc1ccc(N)cc1 841300649 YPJBWOKBOXEVML-WDEREUQCSA-N 263.341 2.063 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC[C@H](O)CC1 840936310 JAFIJDIRCZHTOJ-KOMQPUFPSA-N 262.397 2.454 10 20 CECD Cn1cc(C(=O)NCc2ccc(N3CCCCC3)cc2)cn1 742475595 GRXOSHOBMYEXEB-UHFFFAOYSA-N 298.390 2.340 10 20 CECD COc1cc(O)c(CN[C@@H](C)CCCCN)cc1OC 841079350 KGRJQLMGNAPGAD-NSHDSACASA-N 282.384 2.017 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCO[C@H](CF)C1 840955600 WRMSCUZNWNIUOS-SNVBAGLBSA-N 277.698 2.355 10 20 CECD COc1cc(O)c(CN2CC[C@@H](OC(C)C)C2)cc1OC 842609518 DQXRIMRMSLPVPE-CYBMUJFWSA-N 295.379 2.409 10 20 CECD COc1cccc(CNC(=O)[C@H](CC(C)C)OC)c1O 841404947 IHOULVLDNCAGNN-ZDUSSCGKSA-N 281.352 2.078 10 20 CECD Cc1cc(Br)cc(CN[C@H](C)CCN)c1O 841052253 SLAFRNVHRFFTBU-SECBINFHSA-N 287.201 2.290 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CCCNC2=O)c(O)c1C 840825402 GEZJQOZQZZGQKD-STQMWFEESA-N 276.380 2.186 10 20 CECD Cc1cc(CN2CC[C@H]3NCC[C@H]3C2)ccc1N(C)C 923358690 KNZWGMMFQFLJTA-JKSUJKDBSA-N 273.424 2.245 10 20 CECD C[C@H]1COC(C)(C)CN1C(=O)/C=C/c1ccc(O)c(O)c1 754753003 KRCUEKFFXYWWOE-ZRQQLDRUSA-N 291.347 2.137 10 20 CECD C[C@@H](NCCn1ccccc1=O)c1ccc(N(C)C)cc1 765396024 LAGFKROYDYMTNS-CQSZACIVSA-N 285.391 2.265 10 20 CECD CCCCCN(CCO)C(=O)c1cc(O)cs1 765233731 PBVPVQXJPQNNJX-UHFFFAOYSA-N 257.355 2.078 10 20 CECD C[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)CCO1 862214757 DBYRPBXUCZXOKV-JTQLQIEISA-N 270.323 2.252 10 20 CECD C[C@H](Nc1nccc(CO)n1)c1ccc(N(C)C)cc1 772299060 VUVYPICVWLJAGX-NSHDSACASA-N 272.352 2.208 10 20 CECD CCN(C)c1ccc(CN(C)C[C@@H](O)C2CC2)cc1 773757557 ZVWAZFCVGHSFAL-MRXNPFEDSA-N 262.397 2.345 10 20 CECD CC(=O)N1CCC(CNCc2c(C)cccc2O)CC1 877010329 UOQAXMBQXJFQMJ-UHFFFAOYSA-N 276.380 2.049 10 20 CECD C[C@@H](NC(=O)[C@@H](C)n1cccn1)c1ccc(N(C)C)cc1 773006729 FLERCLBOYXOQSX-CHWSQXEVSA-N 286.379 2.388 10 20 CECD CCC1(C(=O)NCc2ccccc2O)CCOCC1 778915838 YEBLCQDYFDXCQI-UHFFFAOYSA-N 263.337 2.215 10 20 CECD Cc1cc(Cn2cc([C@@H](O)C3CC3)nn2)ccc1N(C)C 881377869 WKYYEHCTKWNBQV-INIZCTEOSA-N 286.379 2.144 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@@]12CCOC2)c1ccc(N(C)C)cc1 773007379 HZGDCIJAYDMSSY-YLQAJVPDSA-N 288.391 2.356 10 20 CECD CCOc1ccc(CN2CC[C@H](C(=O)OC)[C@@H]2C)c(O)c1 787420841 KYLZOKDNDKSCTL-FZMZJTMJSA-N 293.363 2.174 10 20 CECD CC[C@H](C)C[C@H](N)C(=O)NCc1ccc(N(C)C)cc1C 1122003724 GBTDTSCCOGKYKE-LRDDRELGSA-N 291.439 2.441 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCC(C)(C)O 271720914 RLGHLYGIRLWSRD-UHFFFAOYSA-N 264.369 2.112 10 20 CECD COC[C@H](N[C@@H](C)c1cc(OC)ccc1O)C1CC1 186153582 GGCFXJWWWFQYMX-HZMBPMFUSA-N 265.353 2.476 10 20 CECD C[C@H]1CSCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 792724738 DCTGVPFECBYCFP-YGRLFVJLSA-N 295.404 2.003 10 20 CECD Cc1ccc(O)c(CNCc2cnc3n2CCC3)c1 719940037 NBEUDOKIENQOBE-UHFFFAOYSA-N 257.337 2.133 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C)n1ccnc1 1251885768 DNPVZJOBHQOCNF-CYBMUJFWSA-N 286.379 2.135 10 20 CECD CCc1nnc(CNCc2cc(C)cc(OC)c2O)s1 1262111960 VNJFDJIRRMYBMZ-UHFFFAOYSA-N 293.392 2.413 10 20 CECD CC(C)C(=O)N(C)CSc1ncc(C(=O)O)s1 1603700431 WXZGZZFXHLQUNY-UHFFFAOYSA-N 274.367 2.005 10 20 CECD COC[C@@H](N[C@H](C)c1cc(C(=O)O)ccc1O)C1CC1 1606814276 CGFBMQDZUHGRJS-NOZJJQNGSA-N 279.336 2.166 10 20 CECD CC[C@H](NCc1cc(Cl)c(C)cc1O)C(=O)O 1593623806 ROAQTXQFQBJVBC-JTQLQIEISA-N 257.717 2.307 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2C[C@@H](O)C2(C)C)c1O 128219576 PLNOHVBZBSVPQD-VXGBXAGGSA-N 285.771 2.303 10 20 CECD Cc1nn(C)c(C)c1C(=O)N(C)Cc1ccccc1O 153346991 GWRLDJNDMAKQBP-UHFFFAOYSA-N 273.336 2.015 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccccc2O)cn1 48606761 VKTXIHAIRWWLFC-UHFFFAOYSA-N 256.305 2.368 10 20 CECD CCN(CC)c1ccc(CN(C)CCC(=O)NC)cc1F 179409439 OMCJAAVIRVPKMS-UHFFFAOYSA-N 295.402 2.240 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N(C)C1CC1 115855642 OGEZMJRTZMSWDC-UHFFFAOYSA-N 261.369 2.365 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c(O)c1O 182617188 LYLPIHOEKSFHSY-RTXFEEFZSA-N 291.347 2.094 10 20 CECD Cc1ccc(O)c(CNc2cccc(-c3nnn[nH]3)c2)c1 71407721 QTVCIJHPILYLBJ-UHFFFAOYSA-N 281.319 2.493 10 20 CECD CC[C@H]1CN(Cc2cccc(OC)c2O)CCO1 132013774 BHLFPSZYPBMUPX-LBPRGKRZSA-N 251.326 2.012 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccncn1 194097339 FSCNRBSCPFQNOX-UHFFFAOYSA-N 298.346 2.383 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2CN3CCC[C@H]3CO2)c(O)c1 252538502 AQEPXKZNEPWJBO-KKUMJFAQSA-N 290.407 2.214 10 20 CECD CC(C)n1cc(C(=O)NCc2ccccc2O)cn1 276436161 ZJDAFHLDCPBWHQ-UHFFFAOYSA-N 259.309 2.100 10 20 CECD C[C@@H](NC[C@H](O)C(F)(F)F)c1ccc(F)c(F)c1O 276947818 QJPSZPUQWBWUON-XRGYYRRGSA-N 285.212 2.244 10 20 CECD O=C(NCC1(O)CCCCCC1)c1c(F)ccc(O)c1O 276627339 RZAZUCQSEVXEGH-UHFFFAOYSA-N 297.326 2.052 10 20 CECD Cc1cc(O)c(CN2CCC(CCC(N)=O)CC2)cc1C 271190519 LJKHNMRKMGKLGM-UHFFFAOYSA-N 290.407 2.487 10 20 CECD Cc1ccc(C(=O)N(CC2CCC2)[C@H](C)CO)c(O)c1O 280640302 CJNZRUFRAZKJJU-LLVKDONJSA-N 293.363 2.029 10 20 CECD CC[C@H](NCc1ncn(C)n1)c1ccc(C)cc1O 280269153 XTQQBYSEMVMVCG-LBPRGKRZSA-N 260.341 2.070 10 20 CECD COc1ccc(N(C)Cc2nc(C)n[nH]2)cc1Cl 292586680 UUSPDWKAYJPZQX-UHFFFAOYSA-N 266.732 2.412 10 20 CECD c1cc(N2CCCC2)ccc1CNc1ccc2nncn2n1 298813888 ZTGYFXKBWYEPAK-UHFFFAOYSA-N 294.362 2.337 10 20 CECD C[C@@H]1CC2(CCNCC2)CN1Cc1cccc(F)c1O 818431915 VYNQEVUSPABINL-GFCCVEGCSA-N 278.371 2.495 10 20 CECD Nc1ccc(CCNC2CCC3(CC2)OCCO3)cc1 817956716 BBAGSPDLQGSYAZ-UHFFFAOYSA-N 276.380 2.087 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)c(C)c2)[C@@H]1C 815100765 UPTBBQKQUNYUAN-HIFRSBDPSA-N 290.407 2.444 10 20 CECD C[C@H](N[C@@H]1CCc2cccc(O)c21)[C@H]1CCCNC1 817947501 OTMHCDQAECZQQF-FPMFFAJLSA-N 260.381 2.357 10 20 CECD Cc1nnc(CN(C)Cc2ccc(N(C)C)cc2C)o1 827039137 IAXPGDQVNJJDJL-UHFFFAOYSA-N 274.368 2.384 10 20 CECD O=C(/C=C\c1ccc(Cl)nc1)N1CCCc2n[nH]cc21 493086193 DORCEPNQXGTQRY-XQRVVYSFSA-N 288.738 2.451 10 20 CECD CSC(C)(C)CNC(=O)/C=C\c1ccc(O)c(O)c1 588406711 DKINHHJYQZXJFB-ALCCZGGFSA-N 281.377 2.369 10 20 CECD C[C@@H](NC[C@@H](O)C1CCC1)c1cc(F)cc(F)c1O 834904792 CTVMWZLIRMWRGC-AMIZOPFISA-N 271.307 2.482 10 20 CECD CCCCC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832284023 GHWOQQWYFZNFDM-AWEZNQCLSA-N 263.385 2.059 10 20 CECD CC(=O)CCCCCOC(=O)c1cccc(O)c1O 837648995 YZVJIDATCIMLNY-UHFFFAOYSA-N 266.293 2.404 10 20 CECD CC(C)N1CCC[C@@H](NC(=O)c2cc(O)cs2)C1 832296762 NRIABJGYBCUZMO-SNVBAGLBSA-N 268.382 2.056 10 20 CECD O=C(Nc1cnc(C2CC2)nc1)c1cc(O)cs1 732285670 FDJRQTNCJFXZKE-UHFFFAOYSA-N 261.306 2.373 10 20 CECD CC(C)CN1CCC(NC(=O)c2cc(O)cs2)CC1 732267344 YIJOSFAZNQTIIB-UHFFFAOYSA-N 282.409 2.304 10 20 CECD O=C(O)Cc1cccc(NC(=O)c2cc(O)cs2)c1 738622965 WXKASYKHTKTRJJ-UHFFFAOYSA-N 277.301 2.333 10 20 CECD CCOc1ccc(O)c(CNCCOC2CCC2)c1 742385510 IWHPGRIKXGVYLM-UHFFFAOYSA-N 265.353 2.450 10 20 CECD CCC[C@H](CNC(=O)Nc1ccc(N)cc1)C(=O)OCC 841297047 LTCMDFJDNJHWJU-LLVKDONJSA-N 293.367 2.370 10 20 CECD Cn1cccc1CNC(=S)NCCc1cccs1 743061831 OANLLFJCMMSPTA-UHFFFAOYSA-N 279.434 2.293 10 20 CECD NC[C@H]1CC[C@@H](NCc2c(O)cccc2Cl)C1 841084974 RCQLMGGVADRJTK-VHSXEESVSA-N 254.761 2.263 10 20 CECD CC[C@@H](C)NC(=S)N(C)Cc1ccccc1O 749768398 XNIDSWBUGRTNQS-SNVBAGLBSA-N 252.383 2.497 10 20 CECD CC[C@@H]1OCC[C@H]1NC(=O)NCc1cc(Cl)ccc1O 845259783 VZIOPTLLKQXPCL-YPMHNXCESA-N 298.770 2.412 10 20 CECD CC[C@@H]1OCC[C@H]1N[C@H](C)c1cc(C(=O)OC)ccc1O 840822841 WNSJTUHQKIQUDK-YVLXSGLVSA-N 293.363 2.397 10 20 CECD Oc1c(Cl)cccc1CNC[C@H]1CCCCN1 841032955 KRBCJSJXVNNPNO-LLVKDONJSA-N 254.761 2.277 10 20 CECD Nc1ccc(CCNC(=O)Nc2cnn(CC3CC3)c2)cc1 841134275 UYJFUEKJQLVFIP-UHFFFAOYSA-N 299.378 2.240 10 20 CECD COC[C@H](NCc1cc(F)cc(C(C)=O)c1O)C(C)C 754386092 UEIWGPRYVLYGJY-AWEZNQCLSA-N 283.343 2.495 10 20 CECD C[C@H]1CCN(Cc2cc(Cl)ccc2O)C[C@@H]1CO 857061443 QWDRKKYJFSCVDX-CMPLNLGQSA-N 269.772 2.496 10 20 CECD COc1ccc(O)c([C@H](C)NCCOC[C@@H]2CCOC2)c1 756565808 YTBTVPNPRKDUOP-QWHCGFSZSA-N 295.379 2.105 10 20 CECD CCOC(=O)c1cnc(Sc2nnc(C)n2CC)s1 853253937 SOQDIVVDQTWJPE-UHFFFAOYSA-N 298.393 2.391 10 20 CECD C[C@@H](NCC1(O)CCCC1)c1cc([N+](=O)[O-])ccc1O 756573451 JWFXDKFHRACZFU-SNVBAGLBSA-N 280.324 2.256 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)c1ccccn1 853100592 IWFXFIUAUHUAQS-QGZVFWFLSA-N 285.391 2.279 10 20 CECD CCON(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 753650926 JCJNIBKSDWBDAH-LLVKDONJSA-N 265.357 2.407 10 20 CECD CO[C@H](C(=O)NCc1ccc(N(C)C)cc1)C(C)C 769792410 VVAUDTKWWMDAGR-AWEZNQCLSA-N 264.369 2.040 10 20 CECD CCN(Cc1cc(OC)c(OC)cc1O)C[C@@H]1CCOC1 768448618 SWGIDWCVJWKHLT-LBPRGKRZSA-N 295.379 2.268 10 20 CECD CCC[C@@H]1NC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 761361111 KYQHNSOCRQUVRR-HNNXBMFYSA-N 299.374 2.283 10 20 CECD COc1cccc(O)c1CN(C)[C@H](C)C(=O)OC(C)C 769525612 WZXDGHKNZJLNQU-LLVKDONJSA-N 281.352 2.173 10 20 CECD CCOc1ccc(N2CCN(c3cnccn3)CC2)cc1 1118581330 USDOMBKYXICXPC-UHFFFAOYSA-N 284.363 2.202 10 20 CECD C[C@H](NC(=O)[C@H]1CCCN1C)c1ccc(N(C)C)cc1 773021716 BJOUXAQYAAFXPV-SWLSCSKDSA-N 275.396 2.024 10 20 CECD Cc1cccc(CN2CCC(O[C@H]3CCOC3)CC2)c1O 775727048 GOXHEUKEYCQTMB-INIZCTEOSA-N 291.391 2.471 10 20 CECD CC1=NO[C@@H](CNC(=O)NCc2cc(Cl)ccc2O)C1 875958659 HVQWMSHBQUQMIM-LLVKDONJSA-N 297.742 2.010 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CC[C@@H](C)C2)c1 776477703 UOUKQJZBXQVLHS-MNOVXSKESA-N 263.337 2.453 10 20 CECD CC(=O)N1CCC[C@@H](CNCc2c(C)cccc2O)C1 877491483 ULVAICKSQPQEBW-AWEZNQCLSA-N 276.380 2.049 10 20 CECD CCCS(=O)(=O)CCN1CCCc2cc(OC)ccc21 771617283 BBJPDIITYZNLFS-UHFFFAOYSA-N 297.420 2.273 10 20 CECD Cc1nccn1CCN[C@@H](C)c1c(O)cccc1F 886519034 MOXIIGVIIUCZNV-JTQLQIEISA-N 263.316 2.387 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNC[C@@H]2CCC=CO2)c1 780569243 BYRAWRKSEZSSDV-LBPRGKRZSA-N 264.281 2.083 10 20 CECD COc1cc(C)cc(CNCCc2ccccn2)c1O 894145048 DXIZZRWKZJJADW-UHFFFAOYSA-N 272.348 2.437 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCOC2=O)cc1F 895801884 UYSMMRWDPFFOFV-ZDUSSCGKSA-N 280.343 2.077 10 20 CECD COc1cc(C)cc(CN(C(C)C)C2COC2)c1O 894868525 BDACPBWWJCKWLB-UHFFFAOYSA-N 265.353 2.318 10 20 CECD C[C@H](CCCCN)NC(=O)N[C@H](C)c1ccccc1O 892134965 PIXULAZMYAKCOJ-VXGBXAGGSA-N 279.384 2.270 10 20 CECD CCN(CC)c1ccc(CN[C@H]2C(=O)NCC2(C)C)cc1 895315524 AQSHMNKZGKVDTI-HNNXBMFYSA-N 289.423 2.147 10 20 CECD CCC(=O)N1C[C@H](NCc2ccc(OC)c(C)c2)C[C@@H]1C 987676468 ZTBSDMGQWWSTNG-DZGCQCFKSA-N 290.407 2.493 10 20 CECD CC(=O)NCCC1=CCN(c2ccnc(C(C)C)n2)CC1 1089802133 FZJCEWZKYSOPSW-UHFFFAOYSA-N 288.395 2.263 10 20 CECD CNC(=O)c1cc(=N[C@@H](C)c2ccc(N(C)C)cc2)cc[nH]1 1335482683 OLIOXWPEKNCTIB-LBPRGKRZSA-N 298.390 2.102 10 20 CECD CCOc1cccc(CN[C@H](CCO)C(C)C)c1O 230690044 GSLXKRGLANRWEV-CYBMUJFWSA-N 267.369 2.288 10 20 CECD CS[C@@H]1CC[C@H](NCc2cc3c(cc2O)OCO3)C1 230696813 OXLWITISXQRVJC-WDEREUQCSA-N 281.377 2.495 10 20 CECD C[C@@H]1CC[C@@H](COc2ccc(N(C)C)c(C(=O)O)c2)O1 1594306372 FVAFFYYIFGQOSW-PWSUYJOCSA-N 279.336 2.397 10 20 CECD CCOc1ccc(O)c(CN(CC(=O)O)[C@@H](C)CC)c1 1597130927 ZGEYUDIYCBWJDJ-NSHDSACASA-N 281.352 2.476 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@@H]2C[C@@H]2C(=O)O)c1 1599598000 DDYNSFHDXROPGT-KOVQTIFSSA-N 279.336 2.161 10 20 CECD CCN1CCc2cc(CN[C@]3(C(=O)O)C[C@@H](F)C3)ccc21 1776878010 KYAFRLOAQPZHEV-SAZUREKKSA-N 292.354 2.114 10 20 CECD CCCN1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 156962315 YPPNJHZMJKAMIX-UHFFFAOYSA-N 279.403 2.419 10 20 CECD COC(=O)CCCCN(C)Cc1ccccc1O 859189928 YLXKXVIEDNWXQY-UHFFFAOYSA-N 251.326 2.167 10 20 CECD Cc1ccc(CN[C@H](C)c2nnc3n2CCC3)c(O)c1 877166209 POYOEZZUJSLOLU-LLVKDONJSA-N 272.352 2.089 10 20 CECD C[C@@H]1C[C@H](NCc2cccc(Br)c2O)CO1 402323136 RXKCXNWPYRFNTA-SCZZXKLOSA-N 286.169 2.422 10 20 CECD CC[C@@H](NC)C(=O)N(CC)Cc1ccc(N(C)C)cc1 691991194 WTGAVAAZVQFQRK-OAHLLOKOSA-N 277.412 2.099 10 20 CECD CC(C)OC1CCN(C(=O)c2cccc(O)c2O)CC1 695078008 RQBLLIIFVUGNIK-UHFFFAOYSA-N 279.336 2.127 10 20 CECD CO[C@@H]1CCCC[C@H]1NCc1cc2c(cc1O)OCO2 278723767 LFNGTQKPBQYGGJ-DGCLKSJQSA-N 279.336 2.168 10 20 CECD CC[C@H](COC)NC(=O)NCc1ccc(N(C)C)cc1C 129334843 UKRFIDNOLXXXPH-CQSZACIVSA-N 293.411 2.285 10 20 CECD COc1ccccc1CNC(=O)/C=C/c1ccc(O)c(O)c1 148842068 MBFUFMRRDBQDEW-VQHVLOKHSA-N 299.326 2.436 10 20 CECD CN1CC[C@H]2[C@H](CCCN2Cc2ccccc2O)C1 290565328 SQNQZWXDSZRNDV-HIFRSBDPSA-N 260.381 2.308 10 20 CECD CN(C)c1ccc(CN2CCOC[C@@H]2C2CC2)cc1 93645157 QENJBRLUKCFZNA-MRXNPFEDSA-N 260.381 2.363 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCSC1 336505072 FGBKFLWAEUHWQQ-NSHDSACASA-N 292.404 2.231 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2[C@@H](C3CC3)[C@H]2C)c1 528864858 TZHCVZTZQWBYJY-DFKRKDTASA-N 275.348 2.309 10 20 CECD COCCC1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 530264375 KANLWPLCNPWHLR-UHFFFAOYSA-N 297.326 2.126 10 20 CECD C[C@@H](NCCCS(C)(=O)=O)c1cc(Cl)ccc1O 273587063 OBMBRDJURZHKTB-SECBINFHSA-N 291.800 2.131 10 20 CECD COCC[C@@H](C)N[C@H](C)c1cc(C(=O)OC)ccc1O 273604639 SVGAFULAYKMZBN-GHMZBOCLSA-N 281.352 2.254 10 20 CECD C1=CO[C@H](CNCc2ccc(N3CCOCC3)cc2)CC1 275841023 PXWBCMNTLJADMG-KRWDZBQOSA-N 288.391 2.306 10 20 CECD COCCn1cc(CN[C@@H](C)c2cc(F)ccc2O)cn1 281912935 ABSWQYYRIXGYPX-NSHDSACASA-N 293.342 2.225 10 20 CECD COc1ccc(O)c(CN2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4OC)c1 289774514 RJILRDVHMCGJOU-BNHUKEAWSA-N 289.375 2.256 10 20 CECD CCOc1cccc(CNc2ccc(CO)cn2)c1O 291686408 XOUBBXPLAYOJQJ-UHFFFAOYSA-N 274.320 2.290 10 20 CECD COCC[C@H](CO)N[C@@H](C)c1cc(Cl)cc(C)c1O 808717598 FVRMRDNFTKJKKK-CMPLNLGQSA-N 287.787 2.402 10 20 CECD COC[C@@H](CCO)N[C@@H](C)c1c(C)cc(C)cc1O 293653569 ISOPEZIACHNJDO-QWHCGFSZSA-N 267.369 2.057 10 20 CECD C[C@H]1CCNCC[C@@H]1NCc1ccc(N(C)C)c(F)c1 817900636 PCNBIEYBQFFDSV-WFASDCNBSA-N 279.403 2.369 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)[C@H]3C[C@@H]3C)C2)cc1 819578445 LRJUYDBYUZNHOX-ZENOOKHLSA-N 288.391 2.294 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)c2cccs2)cc1 832292342 FYXUITTVSACVGB-ZDUSSCGKSA-N 289.404 2.244 10 20 CECD CCCN(C)CC(=O)NCc1ccc(N(C)C)cc1C 734557503 GLLNJBISWNLCNG-UHFFFAOYSA-N 277.412 2.019 10 20 CECD O=C(c1cccc(O)c1O)N1CCSC[C@@H]1C1CC1 836857078 WZVLTTIQPIWFRZ-LLVKDONJSA-N 279.361 2.065 10 20 CECD C/C=C\C[C@@H](NC(=O)c1cc(O)cs1)C(=O)OCC 832228394 RCIBXRLIZQTYTL-TZGMSPROSA-N 283.349 2.081 10 20 CECD CC(C)C[C@@H]1C[C@H]1C(=O)NCc1ccc(O)cc1O 910945448 WMYQNYGWLMAGGS-DGCLKSJQSA-N 263.337 2.396 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1=CCN(C)CC1 840935969 FIYZTUCWHXIZHF-UHFFFAOYSA-N 273.424 2.413 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2COCCO2)cc1F 740004727 UIJXSGRZEULUOW-AWEZNQCLSA-N 296.386 2.177 10 20 CECD Cc1cc(N(C)C)ccc1[C@@H]1NC(=O)[C@H]2C[C@H](C)CCN21 840819041 KWKKAJGPVQNUEO-HFBAOOFYSA-N 287.407 2.290 10 20 CECD Oc1ccc(Cl)c(F)c1CNCC1OCCCO1 922278492 AIZCVLJZUZCDQU-UHFFFAOYSA-N 275.707 2.037 10 20 CECD CC[C@H](N[C@@H]1CCN(C(C)=O)C1)c1ccccc1O 857068527 YASQDKHONMHTNM-OCCSQVGLSA-N 262.353 2.054 10 20 CECD CCOc1ccc(CN2CC[C@@H](C)[C@H](CO)C2)c(O)c1 857060667 DIFABNXPOYCYPV-OCCSQVGLSA-N 279.380 2.241 10 20 CECD COC(=O)CN(Cc1c(O)ccc2ccncc12)C1CC1 751954425 WJJYETOSHZHZRC-UHFFFAOYSA-N 286.331 2.078 10 20 CECD CCOC1CC(C(=O)NCc2cc(C)ccc2O)C1 862755364 FTIVLOBRQROZSW-UHFFFAOYSA-N 263.337 2.132 10 20 CECD COc1cccc(O)c1CNc1cnc2c(c1)COCC2 776958167 LIUNZXVRSPSEFF-UHFFFAOYSA-N 286.331 2.481 10 20 CECD Cc1ccc(C(=O)N2CCC(C)(F)CC2)c(O)c1O 871074542 ITKQIHDDJIYBMQ-UHFFFAOYSA-N 267.300 2.370 10 20 CECD Cc1ccc(COC(=O)c2ccc(C)c(O)c2O)nc1 772268805 STIVLCCQGSHSCS-UHFFFAOYSA-N 273.288 2.467 10 20 CECD CCOc1ccc(CN[C@]2(CCOC)CCOC2)c(O)c1 775035362 YYCFALIWQSEUQK-MRXNPFEDSA-N 295.379 2.076 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1nc(Cl)ccc1F 778917124 YCGNWGAFNHQOLP-UHFFFAOYSA-N 296.685 2.215 10 20 CECD CC(C)(C)c1cc(C(=O)NCc2cccc(O)c2O)no1 1123890425 YNEHXLQWFGZTFN-UHFFFAOYSA-N 290.319 2.313 10 20 CECD CCn1cc(CN(C)c2ccc(OC)c(F)c2)nn1 885531520 YUVXJXLIWCEMFV-UHFFFAOYSA-N 264.304 2.082 10 20 CECD CCOc1cccc(CN2CCC[C@H]([C@H](C)O)C2)c1O 780892563 LMXJPXRDSUUMQH-STQMWFEESA-N 279.380 2.384 10 20 CECD COc1cc(C)cc(CNCCN2CCC[C@@H]2C)c1O 894393255 JYSOVJSGVKGKHB-ZDUSSCGKSA-N 278.396 2.283 10 20 CECD COc1cc(C)cc(CN(CCCO)C2CC2)c1O 894019425 CJWRUMHBDQFLSH-UHFFFAOYSA-N 265.353 2.056 10 20 CECD CCc1cccc(CN[C@@H]2CC[C@H](C(=O)OC)C2)c1O 896125526 JQAIHOIVRGQAJV-GXTWGEPZSA-N 277.364 2.386 10 20 CECD Cc1ccc(CN2[C@@H](C)[C@H](C)N(C)C(=O)[C@H]2C)c(O)c1 895923591 WZKKJAPNBFMTAW-RWMBFGLXSA-N 276.380 2.140 10 20 CECD CC[C@H](N[C@@H](CO)C1CCOCC1)c1ccc(F)cc1O 796935886 GYSHUXAUACCRBB-GJZGRUSLSA-N 297.370 2.360 10 20 CECD CC[C@H](NC[C@]1(O)CCSC1)c1ccc(F)cc1O 796786442 CPZOCTUOJCKNRW-GXTWGEPZSA-N 285.384 2.440 10 20 CECD Cc1ccc([C@H](C)N[C@@H](CO)CC(F)F)c(O)c1 717751428 UYWUOXXNKMQHMS-VHSXEESVSA-N 259.296 2.367 10 20 CECD CCN1CCN(C(=O)/C=C\[C@H]2CCCNC2)c2ccccc21 1333335074 AUHZKTVSKLHZMI-FJVVXJACSA-N 299.418 2.415 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@H]12 1348047585 OJJHRDRMQLDWQZ-QNWJLWSRSA-N 273.332 2.006 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@H]1F 1263714213 AEZXWZVKOWKSEZ-ZIAGYGMSSA-N 264.344 2.459 10 20 CECD CN(C)c1ccc(CN[C@H](CC(F)(F)F)C(=O)O)cc1 1350610688 KHPNWORMWKBLNU-LLVKDONJSA-N 290.285 2.248 10 20 CECD O=C(O)C1=NO[C@@H](CSc2ncc(Cl)s2)C1 1608591429 MMSGVVQBCIYAIJ-SCSAIBSYSA-N 278.742 2.118 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cccc3c2CCNC3)c1 1579723833 SPOXKXQVQWBJFU-UHFFFAOYSA-N 296.370 2.276 10 20 CECD CCS(=O)(=O)CCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 230660576 VRDYBWGYNGEUEW-NEPJUHHUSA-N 297.420 2.273 10 20 CECD CC[C@@H](C)OCC(=O)NCc1ccc(N(C)C)cc1C 151877428 RDXXDGZTJABDNH-CYBMUJFWSA-N 278.396 2.492 10 20 CECD CCN(CC)C(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 135127523 JCUYZZLMGUIEQJ-ZDUSSCGKSA-N 277.412 2.272 10 20 CECD CC[C@H](N[C@H](C)c1nncn1C)c1ccccc1O 37016936 QNAIQPLCZIJGER-PWSUYJOCSA-N 260.341 2.323 10 20 CECD Cc1nccn1CCN[C@H](C)c1cc(F)ccc1O 273607977 UWVPRAYAADYADH-SNVBAGLBSA-N 263.316 2.387 10 20 CECD CC(C)N1CC[C@H](N[C@@H](C)c2ccccc2O)C1=O 179895937 SEODMLLVZASLGJ-AAEUAGOBSA-N 262.353 2.052 10 20 CECD Nc1ccc(CC(=O)N2CCC3(CC2)CC3(F)F)cc1 405021150 JFQCVIDONHIIME-UHFFFAOYSA-N 280.318 2.459 10 20 CECD Oc1cccc2c1[C@H](NC[C@@H]1CCN(C3CC3)C1)CC2 313395051 SOJYKKGPVQKIER-SWLSCSKDSA-N 272.392 2.453 10 20 CECD COCc1csc(C(=O)NCCc2ccc(N)cc2)c1 690021039 FCJMFSIBYWZFBV-UHFFFAOYSA-N 290.388 2.449 10 20 CECD C[C@H](CCO)NCc1cc(Br)cc(F)c1O 715719973 HWLBEHWLPBOUSZ-SSDOTTSWSA-N 292.148 2.154 10 20 CECD Cc1ccc(O)c(CNCCCc2cnn(C)c2)c1 113333417 YSGPWZDRRKOPPS-UHFFFAOYSA-N 259.353 2.157 10 20 CECD COc1ccc(O)c(CN(C)CC(=O)OC(C)(C)C)c1 179945755 ILJCFLVVXYFTAL-UHFFFAOYSA-N 281.352 2.174 10 20 CECD COc1cccc(CNC(=O)NCc2ccsc2)c1O 173790105 UQPKSNSPIUUARV-UHFFFAOYSA-N 292.360 2.462 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)C(C)C)C2)cc1 62574815 AMSBYBQCVJJLSA-CYBMUJFWSA-N 276.380 2.294 10 20 CECD CC(C)(CN1CCCC1)NCc1cc2c(cc1O)OCO2 308627011 AYMWBSJPLBCPAM-UHFFFAOYSA-N 292.379 2.085 10 20 CECD c1cc2c(cc1CNCCCOC[C@H]1CCCO1)CCO2 37362874 SEVKHWHJCPTNQT-MRXNPFEDSA-N 291.391 2.297 10 20 CECD CC(C)n1cc(C(=O)NCc2ccc(N(C)C)cc2)cn1 188627677 BNVGAMCAJMFTIL-UHFFFAOYSA-N 286.379 2.460 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CC[C@H](O)CC2)c1 252811656 OTCLOTOGXUKXHS-IJLUTSLNSA-N 265.353 2.355 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCCO1 75159511 ZREAFXIGHXBWPC-OAHLLOKOSA-N 275.348 2.066 10 20 CECD Oc1ccc(F)cc1CN1CCOC2(CCC2)C1 180195143 FASVZANDVLMLRX-UHFFFAOYSA-N 251.301 2.286 10 20 CECD CNC(=O)CC1CCN(Cc2cc(C)c(C)cc2O)CC1 74723633 SHXVFLFQHWJMLX-UHFFFAOYSA-N 290.407 2.357 10 20 CECD C[C@H](N[C@@H]1CC[C@H]1O)c1ccc(Br)cc1O 382327578 VNASZFKZKGIVHR-WHGOUJPWSA-N 286.169 2.329 10 20 CECD CCOc1cccc(CN(C)C[C@H]2CCC[C@@H]2O)c1O 91899242 LWXZFXDKTSYYTR-OCCSQVGLSA-N 279.380 2.384 10 20 CECD COc1cccc(CNC[C@]2(O)CCCC2(C)C)c1O 292908972 HFWUCIPNLNMQLK-MRXNPFEDSA-N 279.380 2.432 10 20 CECD Cc1cccnc1C(=O)N1CCOc2cc(N(C)C)ccc21 267592626 HONXCTQKOUMLAY-UHFFFAOYSA-N 297.358 2.495 10 20 CECD C[C@H](N[C@@H]1CCc2c[nH]nc2C1)c1cc(F)ccc1O 359956884 FZFTVIOIWVGDDL-JOYOIKCWSA-N 275.327 2.463 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCCSC2)c(O)c1O 272772178 SPIUCCHQRZDLAT-VIFPVBQESA-N 267.350 2.032 10 20 CECD CN(CCN1CCOC(C)(C)C1)Cc1cc(F)ccc1O 279355696 GPOUYLPSJGBDMH-UHFFFAOYSA-N 296.386 2.074 10 20 CECD COCC[C@@H](CO)NCc1ccc(N2CCCCC2)cc1 282247665 OKLQFTPDXCROBP-INIZCTEOSA-N 292.423 2.164 10 20 CECD CN(Cc1ccccc1O)c1nnc(-c2cccn2C)n1C 290531642 UNERGOWRUKEBST-UHFFFAOYSA-N 297.362 2.163 10 20 CECD CCNCCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 817952020 MVESDTPSQWGSNJ-KOLCDFICSA-N 252.333 2.279 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)[C@@](C)(CO)C2)c1 827699837 MTPGZEOVMKMTFV-BLLLJJGKSA-N 279.380 2.241 10 20 CECD COc1cc(Cl)cc(CN(C)Cc2nnc(C)o2)c1O 827039104 GWFWSHFCZNEULM-UHFFFAOYSA-N 297.742 2.378 10 20 CECD CN(C)c1ccc(CNC2CC(N)C2)c(C(F)(F)F)c1 906510852 MVIIKWFNGFCYSG-UHFFFAOYSA-N 287.329 2.351 10 20 CECD COc1ccc(N2CCC(N[C@@H]3COC[C@H]3C)CC2)cc1 903394370 AYNUBICSGGMUIH-CXAGYDPISA-N 290.407 2.289 10 20 CECD CO[C@H]1C[C@@H](N(C)C(=O)c2cccc(O)c2O)C12CCC2 837017843 RXDVZMVIXVRNNX-OLZOCXBDSA-N 291.347 2.127 10 20 CECD C[C@H]1CCCN1CCN[C@H]1CCc2cccc(O)c21 834607290 SOAICJUTTUJCBC-JSGCOSHPSA-N 260.381 2.453 10 20 CECD O=C(NCc1ccccc1O)NC[C@@H]1CC1(Cl)Cl 748463516 ULFLIUOIQONKSM-VIFPVBQESA-N 289.162 2.385 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H](C)c1cc(Cl)cc(C)c1O 842911884 OCJPZGZVZCVYSX-ZWKOPEQDSA-N 285.771 2.418 10 20 CECD CC1(C)CC[C@@H](OC(=O)c2cccc(O)c2O)C1=O 840458668 GJZPVSANWGQTGT-SNVBAGLBSA-N 264.277 2.012 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CCN)C(F)F 841072828 AJYJHXSQTSSOPI-CYBMUJFWSA-N 271.355 2.133 10 20 CECD Cn1cc(C(C)(C)NCc2ccc3c(c2)CCO3)cn1 742374396 WJYPWPBAMDXYSS-UHFFFAOYSA-N 271.364 2.380 10 20 CECD CC[C@@H](COC)N[C@@H](C)c1cccc(OC)c1O 846147491 VUZDTHZVUJAPIQ-QWRGUYRKSA-N 253.342 2.476 10 20 CECD CONC(=O)Cn1c2c(c3cc(OC)ccc31)CCCC2 845156090 VNECHTBAOQSGNL-UHFFFAOYSA-N 288.347 2.206 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1 846113546 YMNGKXXDSVGFOS-VXGBXAGGSA-N 269.291 2.488 10 20 CECD COc1cccc([C@H](C)NCCC2CC(O)C2)c1O 846167105 UECVLNDZRFJRHV-UNXYVOJBSA-N 265.353 2.212 10 20 CECD CCOc1ccc(CN[C@H](CN)C2CCCC2)c(O)c1 841085650 AESWGWDTYQIXCF-OAHLLOKOSA-N 278.396 2.398 10 20 CECD CCOCc1cc(CN[C@@H](CN)C2CC2)ccc1OC 841027500 CKJWPYAOIXKFOT-HNNXBMFYSA-N 278.396 2.059 10 20 CECD CC(C)COCCC(=O)NCc1ccccc1O 748345027 GCRHKZLHFFDVSM-UHFFFAOYSA-N 251.326 2.071 10 20 CECD CCc1cccc(CN2C[C@@H]3CCN(C)[C@@H]3C2)c1O 848916512 WERUGDJTWVEKMT-DZGCQCFKSA-N 260.381 2.091 10 20 CECD CO[C@@H]1COC[C@H]1N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 842913309 ZHLNGEOQCZQKJO-IHXVIFPJSA-N 281.327 2.083 10 20 CECD CN(C)c1cc(F)c(CNCCc2cncn2C)cc1F 858195786 CLMUHGLSZYGZRZ-UHFFFAOYSA-N 294.349 2.097 10 20 CECD CO[C@H]1C[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 858322038 LKADKAKPJIGJSV-MGCOHNPYSA-N 286.715 2.221 10 20 CECD Cc1cccc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)c1O 863738377 AFVNTCHWLMXPKR-WCQYABFASA-N 263.337 2.243 10 20 CECD C[C@@H](NCc1ccc(C(N)=O)nc1)c1ccc(N(C)C)cc1 766531593 PGKGHBBOEYHULA-GFCCVEGCSA-N 298.390 2.097 10 20 CECD COCC[C@H](C)CNC(=O)N[C@H](C)c1ccccc1O 868701115 LLCLAOUIRONHPS-NWDGAFQWSA-N 280.368 2.425 10 20 CECD CCCN1CCN(Cc2ccc(OCC)cc2O)CC1 768137076 FRSUNSZPLFHJNX-UHFFFAOYSA-N 278.396 2.319 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCO[C@]2(CCOC2)C1 877132960 SBUOCHRJQMMWKE-XJKSGUPXSA-N 277.364 2.128 10 20 CECD C[C@@H](Cc1ccco1)NC(=O)/C=C\c1ccc(O)c(O)c1 779502364 YPRRPDFEFIBGMW-XOIDGJRKSA-N 287.315 2.451 10 20 CECD Cc1ncccc1CNC(=O)N(C)Cc1ccccc1O 875846083 STVRWVNOBFCFAM-UHFFFAOYSA-N 285.347 2.437 10 20 CECD CN(CCOC(=O)c1cccc(O)c1O)c1ccccc1 776279967 NYIOIYRBOFPRCH-UHFFFAOYSA-N 287.315 2.391 10 20 CECD CCCOc1ccc(CN[C@]2(CO)CCOC2)cc1C 873105435 WCKRYOPIKVFBFO-INIZCTEOSA-N 279.380 2.025 10 20 CECD COC(=O)C1CCN(Cc2ccc(C)cc2O)CC1 876530924 TVMZZSFPODMNJC-UHFFFAOYSA-N 263.337 2.086 10 20 CECD CCN(CC)c1ccc(CNC(=O)C(C)(C)CO)cc1F 776652453 QFJRWSAJSNUYAZ-UHFFFAOYSA-N 296.386 2.307 10 20 CECD C[C@@H](Cc1cccnc1)NCc1cc2c(cc1O)OCO2 897969425 JFAVGJBXDOEPFF-NSHDSACASA-N 286.331 2.237 10 20 CECD CCCCCN(CC(N)=O)Cc1cc(C)cc(OC)c1O 894431646 VPLWZFOKFJPCQE-UHFFFAOYSA-N 294.395 2.187 10 20 CECD CN(C)Cc1cnc(CNCc2ccccc2O)s1 796285001 WCPZZGVTEKPNIE-UHFFFAOYSA-N 277.393 2.200 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN(C3CC3)C2)c1O 894240696 FAFDBJSOKHEXIN-ZDUSSCGKSA-N 276.380 2.036 10 20 CECD Cc1ccc(C(=O)OCc2nc(C(C)C)n[nH]2)c(O)c1O 795375453 UUONPOJGHBMURQ-UHFFFAOYSA-N 291.307 2.005 10 20 CECD C[C@@H](CNCc1c(O)cccc1Br)N(C)C 706863383 FLLVJHCJAPKAAA-VIFPVBQESA-N 287.201 2.194 10 20 CECD COc1ccc(CNC(=O)C[C@H](C)C2CC2)c(O)c1 794381049 IUZVPCRZZVEURD-JTQLQIEISA-N 263.337 2.453 10 20 CECD C[S@@](=O)C1(CNCc2c(O)ccc(Cl)c2F)CC1 799348786 PKMAPPSGSCJDPH-GOSISDBHSA-N 291.775 2.185 10 20 CECD COc1ccc(O)c([C@H](C)NCc2nccc(C)n2)c1 775368775 FGZWKWACDRMQMR-NSHDSACASA-N 273.336 2.350 10 20 CECD COc1cccc(O)c1CN1CCCN2CCC[C@H]2C1 1319814969 KOPCXZWQKHRSIV-ZDUSSCGKSA-N 276.380 2.071 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H](C)CNC 1328725131 MIWYVJSNZZWXHG-CYBMUJFWSA-N 293.411 2.169 10 20 CECD CCOc1cccc(CN(C)C[C@@H]2CCCN2C)c1O 211723288 QVAQCALGBVVIKK-AWEZNQCLSA-N 278.396 2.317 10 20 CECD CCCN(CC)CCNCc1cccc(OC)c1O 223229342 FFGQBBLKNRTLAF-UHFFFAOYSA-N 266.385 2.222 10 20 CECD COc1ccc(O)c(CNC[C@H](O)CC(C)(C)C)c1 224823492 YKXSGTSCEZJMOY-GFCCVEGCSA-N 267.369 2.288 10 20 CECD C[C@@H](NCCc1ccccn1)c1cc(C(=O)O)ccc1O 1609781012 UBYQOTAILVRKGJ-LLVKDONJSA-N 286.331 2.379 10 20 CECD COc1cc(C)c(CN2CCC[C@@](C)(C(=O)O)C2)c(O)c1 1599390926 BJJCWFHTXGUWLD-MRXNPFEDSA-N 293.363 2.396 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCOC(C)(C)C2)c(O)c1O 163697443 JQHZBYFZONQCAH-SNVBAGLBSA-N 279.336 2.094 10 20 CECD CCN(CC)c1ccc(CN2CCC(N)CC2)cc1 32023121 XURXLKVVDWAQIG-UHFFFAOYSA-N 261.413 2.456 10 20 CECD FC(F)COCCNCc1ccc2c(c1)CCCO2 922043556 BVDNWUJOVKQSIZ-UHFFFAOYSA-N 271.307 2.383 10 20 CECD CCOCCOCCN[C@H]1CCc2cccc(O)c21 927088238 YCGYYKZFKOXQRR-ZDUSSCGKSA-N 265.353 2.022 10 20 CECD C[C@@H](NC(=O)[C@@]1(C)CCCOC1)c1ccccc1O 827940829 JBRAUCNAJAKMLJ-ABAIWWIYSA-N 263.337 2.386 10 20 CECD Cc1ccc(CN[C@@H]2c3ccccc3C[C@@H]2O)c(O)c1 876967310 FZYNUAGGOMIEGA-DLBZAZTESA-N 269.344 2.449 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC(=O)NC(C)C 36781632 UCXIIDOUMHZNKF-VXGBXAGGSA-N 276.380 2.363 10 20 CECD C[C@@H]1C[C@H](CNCc2cc3c(cc2O)OCO3)[C@@H](C)O1 686514808 KGCPZTNYTHZTFE-GMTAPVOTSA-N 279.336 2.024 10 20 CECD CN(Cc1ccccc1O)C(=O)COc1ccccc1 383927905 IYHRTBLJFXHHMQ-UHFFFAOYSA-N 271.316 2.430 10 20 CECD C[C@@H](N[C@@H](CCO)C(F)(F)F)c1cc(F)ccc1O 886801138 IHXATXAAHRIXGV-HQJQHLMTSA-N 281.249 2.495 10 20 CECD COc1cc(N(C)Cc2cncn2C)cc(OC)c1OC 177128821 LPRSWLXBNXJGSV-UHFFFAOYSA-N 291.351 2.082 10 20 CECD C[C@H](NCCCO)c1cc(Br)ccc1O 134903663 XTWPUYIDDDCEKJ-QMMMGPOBSA-N 274.158 2.188 10 20 CECD CN(C)c1ccc(CN[C@@]2(C)CCOC2)cc1F 120245130 UWRIAONFCGRMPR-AWEZNQCLSA-N 252.333 2.160 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1cccc(Cl)c1O 180552481 KPRFIRKEEWAAHX-GFCCVEGCSA-N 282.771 2.146 10 20 CECD O=C1NC(=S)S/C1=C\c1ccc(N2CCCC2)nc1 123331400 VUWQRQZDIGYKRL-YFHOEESVSA-N 291.401 2.171 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](C)COC 79116193 LDGGMCDSNYMQKX-ZDUSSCGKSA-N 293.411 2.319 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H](C)N(C)[C@H](C)C2)c1O 135274325 FJFLEWGXKNQYDS-PHIMTYICSA-N 294.370 2.258 10 20 CECD C[C@H]1C[C@H]1c1cc(NC(=O)c2cccc(O)c2O)[nH]n1 192993356 CIUNUGIXUQAUEJ-IONNQARKSA-N 273.292 2.197 10 20 CECD CO[C@H]1CCN(Cc2cccc(Br)c2O)C1 234899888 WHDHJYGUYBCWBJ-JTQLQIEISA-N 286.169 2.375 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)CCCO)c1 94941814 ANWWKFZPSRKPCU-WDEREUQCSA-N 253.342 2.212 10 20 CECD O=C1N[C@H](C2CC2)C(=O)N1Cc1ccc(N2CCCC2)cc1 277257313 IJXQSVGHEHZQMB-OAHLLOKOSA-N 299.374 2.117 10 20 CECD CN(c1ccc(CNC(=O)C(=O)O)cc1)C1CCCCC1 274143035 HBOQPQIWWQHSPU-UHFFFAOYSA-N 290.363 2.156 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(C)(F)F 284142451 SNPXNUYLKBWPEF-UHFFFAOYSA-N 298.333 2.137 10 20 CECD CC(=O)C(=O)COC(=O)c1ccc(OCCC(C)C)cc1 808484040 GZKVYXZDEWQING-UHFFFAOYSA-N 292.331 2.426 10 20 CECD Oc1cccc2c1[C@@H](NCCC1=CCNCC1)CC2 817984919 CCMDRRRGCICXAS-AWEZNQCLSA-N 258.365 2.279 10 20 CECD CCCOc1ccccc1NC[C@H](O)CN(C)C1CC1 819399251 SEHSQTSQTUUAAQ-AWEZNQCLSA-N 278.396 2.342 10 20 CECD COc1cc(Cl)cc(CN(C)C2(CO)CCC2)c1O 827903561 KANBQKWZZVELRA-UHFFFAOYSA-N 285.771 2.401 10 20 CECD Cn1ccc(C(=O)NCc2ccc(N3CCCCC3)cc2)n1 727375633 JZAIWNLGEABBQY-UHFFFAOYSA-N 298.390 2.340 10 20 CECD CN(C)c1ccc(CNCCC(C)(C)S(C)(=O)=O)cc1 840959989 ABFOEOAFVFTDJP-UHFFFAOYSA-N 298.452 2.056 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)[C@H](C)OC)c1O 846168455 CWNGTJZJWXWUBK-MXWKQRLJSA-N 253.342 2.475 10 20 CECD CC1(C)NCC[C@@H]1NCc1c(O)ccc(Cl)c1F 841085506 FIMCFXNIIRYAHB-NSHDSACASA-N 272.751 2.415 10 20 CECD Oc1ccc2ccncc2c1CN1CCCOCC1 748072481 GQVCDTXJYLWEJW-UHFFFAOYSA-N 258.321 2.163 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Cl)cc(F)c2O)CO1 843432996 TUZPDRZHDCLMPA-GMSGAONNSA-N 259.708 2.452 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCn1cccn1 840928694 FPMAKLXUJHIVAU-UHFFFAOYSA-N 272.396 2.437 10 20 CECD C[C@@H]1C[C@@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2O)CO1 842929328 OWTZDUCBHKJVMD-OPRDCNLKSA-N 266.297 2.128 10 20 CECD C[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)CC1 841114883 JAXQYUYMQHICEA-DGCLKSJQSA-N 289.379 2.292 10 20 CECD C[C@H]1C[C@@H](NCCCSc2nccs2)CO1 842684034 VYMLXZNKMXUJOG-VHSXEESVSA-N 258.412 2.392 10 20 CECD CC(C)C(=O)NCCN[C@H](C)c1ccc(Cl)cc1O 841743463 HEQBUSHTWVDINW-SNVBAGLBSA-N 284.787 2.468 10 20 CECD CC(C)O[C@H]1C[C@@H](NC(=O)NCCc2ccc(N)cc2)C1 841916064 XCVQDYOTTQTYCN-GASCZTMLSA-N 291.395 2.067 10 20 CECD CN(C[C@H](O)COc1ccccc1F)c1ccc(N)cc1 923400585 MFWWZQJDSBGGFB-AWEZNQCLSA-N 290.338 2.284 10 20 CECD CCn1nc(C2CC2)cc1C(=O)NCc1ccc(N)cc1 927767612 HXUNCCILFWUTMX-UHFFFAOYSA-N 284.363 2.293 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)C2CC3(CC3)C2)cc1 852791735 LGVLXYGJJPFTLZ-HNNXBMFYSA-N 287.407 2.059 10 20 CECD CNC(=O)CCCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756483581 PADHCWHQIXVZLS-KOLCDFICSA-N 280.343 2.195 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1Cc2ccccc21 762264478 ZUSVKFJQQYKLRL-AWEZNQCLSA-N 283.327 2.096 10 20 CECD CN1CC[C@H]2CN(Cc3ccc(N(C)C)cc3)C[C@H]2C1 931437086 MUJJBXBQTHTRIJ-JKSUJKDBSA-N 273.424 2.136 10 20 CECD CCC1(NCc2cc(OC)c(OC)cc2O)CCOCC1 777505175 KWIAQEKATXLMEV-UHFFFAOYSA-N 295.379 2.458 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)C(F)(F)F 773764275 ZRHHNSYHCQUPJC-HTQZYQBOSA-N 291.269 2.343 10 20 CECD O=C1N[C@H](c2cc(F)ccc2O)N2Cc3ccccc3C[C@@H]12 877867043 RVCZZJKRXFHWMX-HOCLYGCPSA-N 298.317 2.087 10 20 CECD Cc1ccc(CN[C@H](C)C(=O)NCc2ccccc2)c(O)c1 876964539 IOYNKAMAAGDNPK-CQSZACIVSA-N 298.386 2.495 10 20 CECD Cc1nc(C)c(CC(=O)NCCc2ccc(N)cc2)s1 884029060 ZSJRUXMTWROSEA-UHFFFAOYSA-N 289.404 2.244 10 20 CECD C[C@H](N[C@@H](C)c1c(O)cccc1F)c1ncn(C)n1 886596355 COPKXEFIGDJZKL-IUCAKERBSA-N 264.304 2.072 10 20 CECD C[C@H](NCCSCCCO)c1c(O)cccc1F 886524712 PJWBNOHWKWXZGA-JTQLQIEISA-N 273.373 2.298 10 20 CECD O=C(c1cc(O)cs1)N1CCc2ncsc2C1 783933524 JTTHBRXUIHNRQV-UHFFFAOYSA-N 266.347 2.109 10 20 CECD Cc1nc([C@@H](C)NCc2cc(Cl)c(F)cc2O)n[nH]1 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CN(C)c1ccc(/C=C/CN2CCC3(CC2)CNC3)cc1 1578424443 GQNAIJPUBVQCON-ONEGZZNKSA-N 285.435 2.451 10 20 CECD C[C@@H]1CC[C@](NCc2cc([N+](=O)[O-])ccc2O)(C(=O)O)C1 1776629012 YBCJCFZXNKSQDN-YMTOWFKASA-N 294.307 2.033 10 20 CECD CCN(C)c1ccc(CN[C@](C)(COC)C(=O)O)c(C)c1 1776857188 YIPSKOJVDPDWGO-MRXNPFEDSA-N 294.395 2.030 10 20 CECD C[C@@H]1CC[C@](NCc2ccc3c(c2)CCO3)(C(=O)O)C1 1776629586 OZVWTYBQISJRGN-BDJLRTHQSA-N 275.348 2.355 10 20 CECD Nc1ccc(NC(=O)c2snnc2C2CC2)cc1 904925250 FEKOAVOPQITXFJ-UHFFFAOYSA-N 260.322 2.250 10 20 CECD C[C@@H]1CCNCC[C@@H]1NCc1ccc2c(c1)CCO2 817902323 NSXZFWKSCKEYAM-DOMZBBRYSA-N 260.381 2.099 10 20 CECD COC1(CN[C@@H]2CCc3cccc(O)c32)CCOCC1 834689293 MHFGOYZYAGIVQS-CYBMUJFWSA-N 277.364 2.165 10 20 CECD CC(C)[C@@H]1CN(C)CCN1C(=O)Nc1ccc(N)cc1 841296501 UGRLXWLNWBVYDT-AWEZNQCLSA-N 276.384 2.073 10 20 CECD CN(C)[C@@H](CNCc1ccccc1O)c1ccco1 20122156 VGHPRDDZCHQYNU-ZDUSSCGKSA-N 260.337 2.378 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1N 251844402 RCVWGVLGYSHSSQ-GDBMZVCRSA-N 261.413 2.312 10 20 CECD CC[C@H](NCCN1CCCC1=O)c1ccccc1O 405399373 PLGMARNNGAJCAS-ZDUSSCGKSA-N 262.353 2.055 10 20 CECD O=C1N=C(N2CCOCC2)S/C1=C\c1ccsc1 9912552 YXFRECRZCYNIKX-YFHOEESVSA-N 280.374 2.051 10 20 CECD CCC(O)(CC)CNCc1ccc(N(C)C)cc1 69160702 JYJLZWDVIBXKQX-UHFFFAOYSA-N 250.386 2.393 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccncc2)c(O)c1O 177668209 JQXZLLZZKCSDNU-UHFFFAOYSA-N 272.304 2.073 10 20 CECD CCO[C@H]1C[C@](CO)(NCc2cc(C)ccc2O)C1(C)C 186590076 XRBGLKOSUAWNJC-DOTOQJQBSA-N 293.407 2.356 10 20 CECD C[C@H](N[C@@H](C)[C@@H](C)N1CCOCC1)c1ccccc1O 183498154 DRWMFKZCMWEPPH-MELADBBJSA-N 278.396 2.152 10 20 CECD CC[C@]1(CO)CCCN1Cc1cc(OC)c(OC)cc1O 191956893 YFRUSJQNHSCXHP-MRXNPFEDSA-N 295.379 2.146 10 20 CECD Cn1cc([C@H]2CSCCN2Cc2ccccc2O)cn1 191735228 UBRXFEBYCRWTOH-CQSZACIVSA-N 289.404 2.416 10 20 CECD O=C(O)c1ccc(NC(=O)c2cccc(O)c2O)cc1F 236483716 NZBCOBJGIQFHLL-UHFFFAOYSA-N 291.234 2.187 10 20 CECD CCN(CCC(=O)OC)Cc1cc(Cl)ccc1O 92380091 SUMZLXHQUOHPGZ-UHFFFAOYSA-N 271.744 2.431 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)c1 528864699 QWXSPQGNAZSHKJ-VEABSNGSSA-N 293.363 2.077 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cccnc1 264773024 VLYXVWAKNIZVFD-UHFFFAOYSA-N 283.375 2.349 10 20 CECD CCNC(=O)CN(CC)c1ccc(OCC)cc1 269648178 ULMKFHNTMIUAEI-UHFFFAOYSA-N 250.342 2.048 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@@H]2[C@@H]2CCCO2)c1 377709401 YVMQGJYUPPSPBE-ZBFHGGJFSA-N 277.364 2.080 10 20 CECD Cc1ccc(C(=O)N[C@]2(C)CCO[C@@H]2C2CC2)c(O)c1O 273446252 GROCJZPAMUGHEW-GDBMZVCRSA-N 291.347 2.094 10 20 CECD C[C@H](NCc1nncn1C)c1cc(Cl)ccc1O 273407671 OYAAPHKCTXPDCG-QMMMGPOBSA-N 266.732 2.025 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC2CCOCC2)c1 273438494 XTQREHCXYQMXHL-JTQLQIEISA-N 279.336 2.008 10 20 CECD C[C@@H](CF)NC(=O)NCc1ccc2c(c1)CCCN2C 287100881 AHMTZHRDGDRADY-NSHDSACASA-N 279.359 2.226 10 20 CECD CCN1C(=O)/C(=C/c2cn(C(C)C)nn2)SC1=S 287361145 YGRDLFRAYAQJCB-UITAMQMPSA-N 282.394 2.080 10 20 CECD CCc1noc(NC(=O)NCc2ccc(N(C)C)cc2)n1 296700279 IUEUTVNPBSHSAE-UHFFFAOYSA-N 289.339 2.020 10 20 CECD O=S(=O)(CC12CCC(CC1)C2)NCc1ccccc1O 291630139 GHBDZAVCQWXUGM-UHFFFAOYSA-N 295.404 2.392 10 20 CECD CC[C@@H](C)[C@@H](CNC(=O)c1c(F)ccc(O)c1O)OC 295844401 VVVSLEIDLUQMFD-LDYMZIIASA-N 285.315 2.028 10 20 CECD COCCOCCN(C)Cc1cc(Cl)cc(F)c1O 809789926 NTDUKXXAQOTZII-UHFFFAOYSA-N 291.750 2.280 10 20 CECD C[C@@H]1C[C@H](NC[C@@H](N)C2CC2)c2c(O)ccc(F)c21 817964675 DBTBCYLXXNJQFR-FXAINCCUSA-N 264.344 2.407 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)CC[C@H]1O 816574987 YQQODRUZYAVXDW-PRHODGIISA-N 273.735 2.387 10 20 CECD Cc1cc(O)c(CN[C@H]2CC(=O)N(C(C)C)C2)cc1Cl 825291356 KAQQMVIBSRAYNN-LBPRGKRZSA-N 296.798 2.453 10 20 CECD CC(C)n1cc(NC(=O)c2cc(O)cs2)cn1 732284124 JFLRMMCUEXUDIW-UHFFFAOYSA-N 251.311 2.483 10 20 CECD C[C@H](NC(=O)[C@@H]1[C@@H]2CCC(=O)[C@H]21)c1ccc(N(C)C)cc1 907492347 IXDWSWUOWZKZKV-GCOQZVFPSA-N 286.375 2.155 10 20 CECD COC(=O)N1CCC[C@H](N[C@@H]2CCc3cccc(O)c32)C1 834559115 ZPJYWGFEJRMOBR-QWHCGFSZSA-N 290.363 2.200 10 20 CECD COc1cccc([C@@H](C)N[C@H](CO)C(C)C)c1O 846149575 JVNZCMQSJFGSNQ-ZYHUDNBSSA-N 253.342 2.068 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[S@](=O)C[C@H](C)C1 840942154 UHXDWIIHMMMAFR-XCLFUZPHSA-N 294.464 2.261 10 20 CECD CCOc1ccc(CNC(C)(C)CCO)c(O)c1 742380500 OOVUNJBQRXJUKW-UHFFFAOYSA-N 253.342 2.042 10 20 CECD CCc1cccc(CN2CCOC[C@@H]2CCOC)c1O 848913071 NOUWKEJMJQMVQD-HNNXBMFYSA-N 279.380 2.192 10 20 CECD CC(=O)CCC(=O)NCc1cc(Cl)ccc1O 846478668 CUGHXSMEYLXYPJ-UHFFFAOYSA-N 255.701 2.031 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2cc(Cl)ccc2O)CCO1 846473237 KSIVDMOBSPNENI-NXEZZACHSA-N 283.755 2.477 10 20 CECD Cc1cc(NC(=O)NCc2ccccc2O)sn1 749235515 VCQKHIDTBYFSFZ-UHFFFAOYSA-N 263.322 2.479 10 20 CECD Cc1ccc([C@@H](C)N[C@H]2CCCN(C)C2=O)c(O)c1C 756639435 YTEYZUDIKLCTKX-OCCSQVGLSA-N 276.380 2.280 10 20 CECD CN1CCc2cc([C@@H]3NC4(CCCC4)C(=O)N3C)ccc21 751523463 AUSTVVDOWGHJNK-OAHLLOKOSA-N 285.391 2.052 10 20 CECD COc1ccc(N(C)Cc2cc(=O)c(OC)co2)cc1F 760912140 OCJBHPFWXYGIFC-UHFFFAOYSA-N 293.294 2.433 10 20 CECD C[C@@H](c1ccccc1)[C@@H](CO)NC(=O)c1cc(O)cs1 778511504 CCEHNQANRSRQER-GXFFZTMASA-N 291.372 2.348 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)C(F)(F)F 773764279 ZRHHNSYHCQUPJC-YUMQZZPRSA-N 291.269 2.343 10 20 CECD Nc1ccc(CCNC(=O)C2[C@@H]3CCCC[C@@H]23)cc1 132694579 FEUPAWWKXFSJKT-ZIAGYGMSSA-N 258.365 2.364 10 20 CECD O=C1N[C@H](c2cc(F)ccc2O)N2CCc3ccccc3[C@@H]12 877856466 SLQNSYOBYRLCPP-HOTGVXAUSA-N 298.317 2.259 10 20 CECD O=C(N[C@@H](CO)c1cccc(F)c1)c1cc(O)cs1 778510728 MMMWENWZEQLBBT-NSHDSACASA-N 281.308 2.056 10 20 CECD C[C@H](N[C@H](C)[C@H](C)N1CCOCC1)c1c(O)cccc1F 886524040 BMDXNBJHICEKST-AGIUHOORSA-N 296.386 2.291 10 20 CECD COc1cccc(CN2C[C@@H](C)OC(C)(C)C2)c1O 133113865 PHUDOVWOSOFASB-LLVKDONJSA-N 265.353 2.400 10 20 CECD CC1CCN(Cc2cn(-c3ccc(N)cc3)nn2)CC1 887407716 PKWMGWKKMCMWLZ-UHFFFAOYSA-N 271.368 2.081 10 20 CECD COc1ccc(CN[C@H](C)C2(OC)CCC2)c(O)c1OC 894924082 YROALUVFQCJPPL-LLVKDONJSA-N 295.379 2.457 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCN(C)[C@@H](C)C2)c1O 894313000 QCUGOQAKEVVCED-GXTWGEPZSA-N 278.396 2.282 10 20 CECD C[C@@H](C(=O)N1CCCCC1)N(C)Cc1ccccc1O 269673309 XZUQICANMDLDJA-ZDUSSCGKSA-N 276.380 2.225 10 20 CECD C[C@@H](NC(=O)NC[C@@]1(C)CCCNC1)c1ccccc1O 892057744 QLIMMQYFKVQPMD-WBMJQRKESA-N 291.395 2.142 10 20 CECD CC1(C)CN(Cc2c(O)ccc(Cl)c2F)C[C@@H]1O 790936316 AVLMNIXORDGIKD-NSHDSACASA-N 273.735 2.387 10 20 CECD COc1ccc(CNC(=O)/C=C\c2cnccc2C)c(O)c1 794381237 NFZHOBHSMBETKA-XQRVVYSFSA-N 298.342 2.434 10 20 CECD CCOc1cccc(CN2C[C@H](C)S(=O)[C@@H](C)C2)c1O 792191865 CZDIVCHJFPWOAH-RYUDHWBXSA-N 297.420 2.132 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@H](C)S(C)(=O)=O 697589171 NHLZDMLNYZOBSV-WOPDTQHZSA-N 297.420 2.272 10 20 CECD C=Cn1cc(CNCc2ccc3c(c2)CCO3)cn1 774984956 XIRKIKWHMSTODF-UHFFFAOYSA-N 255.321 2.208 10 20 CECD CN(C(=O)[C@@H]1C[C@H]1c1ccncc1)c1ccc(N)cc1 1263168228 HENDXOVVJPBARN-LSDHHAIUSA-N 267.332 2.430 10 20 CECD COc1ccc(O)c(CN2CC[C@H]3CC[C@@H](C2)N3C)c1 217896708 GZQDXYGWMJPVIR-KGLIPLIRSA-N 276.380 2.069 10 20 CECD CC(=O)c1cc(Cl)cc(CNC2(CC(=O)O)CC2)c1O 1609628545 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CN(C)c1ccc(CNC(=O)C2(N)CCCCC2)cc1 40825861 HKXWQOFOVOLXJF-UHFFFAOYSA-N 275.396 2.030 10 20 CECD C[C@@H](NC[C@@](C)(O)C(F)(F)F)c1ccc(F)cc1O 273354407 CHQLDTFAEPFDED-RDDDGLTNSA-N 281.249 2.495 10 20 CECD C[C@H](NC[C@](C)(O)C(F)(F)F)c1cc(F)ccc1O 273478916 LLYQEOFBYVYROF-CPCISQLKSA-N 281.249 2.495 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CO[C@H](C)C2)c1O 402008576 RIYOXBRVZOEFBJ-LDYMZIIASA-N 271.744 2.321 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)CCCO1 708423267 RCUQIOKDONGETG-SECBINFHSA-N 257.280 2.281 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCNCC2(C)C)cc1 388927914 RYEVEZOHZBGLSR-OAHLLOKOSA-N 261.413 2.230 10 20 CECD Cc1cnccc1C(=O)N(C)Cc1ccccc1O 383780824 XBEFZHNSQTYWHA-UHFFFAOYSA-N 256.305 2.368 10 20 CECD CC[C@@H](NCc1cc(OC)ccc1O)C(C)(C)O 394023792 XWDJTEJOGYLMDM-CYBMUJFWSA-N 253.342 2.040 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](CO)C(C)C)c1 394028001 IFBNLBJBWGTOMR-NEPJUHHUSA-N 267.369 2.316 10 20 CECD CN(CC(=O)Nc1ccccc1)Cc1ccccc1O 109771932 GRGFBYJROMZEOA-UHFFFAOYSA-N 270.332 2.463 10 20 CECD COc1cccc(CNC(=O)c2cc(Cl)ccn2)c1O 105651954 IJYLOTJTIIPUGJ-UHFFFAOYSA-N 292.722 2.379 10 20 CECD CCCC(=O)NC[C@@H]1CCCN(Cc2ccc(N)cc2)C1 1345159143 CLEPGVTXFGNPRR-HNNXBMFYSA-N 289.423 2.397 10 20 CECD NC(=O)c1ccc(NCc2cc([N+](=O)[O-])ccc2O)cc1 127783562 JRZCJHFYPYXHBA-UHFFFAOYSA-N 287.275 2.011 10 20 CECD O=[N+]([O-])c1ccc(NCc2ccccc2O)c2nonc12 133740170 WDOCIUVDNRVOJK-UHFFFAOYSA-N 286.247 2.449 10 20 CECD COc1ccc(O)c(CN2CCOCC2(C)C)c1 133545679 IRADVFIDGCXXIC-UHFFFAOYSA-N 251.326 2.012 10 20 CECD CN(C[C@@H]1CC2(CCC2)C(=O)O1)c1ccc2c(c1)OCO2 192131322 JHVZFVHWICRFPD-LBPRGKRZSA-N 289.331 2.337 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)Cn2cccn2)c1O 267471793 YPFOLKREBCZDEI-SNVBAGLBSA-N 291.326 2.109 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1C[C@H]2CC[C@H]1NC2 530247029 VOVZHLPINXGRAA-WQAKAFBOSA-N 266.772 2.276 10 20 CECD CN(CCCCCO)Cc1ccc(N(C)C)c(F)c1 279500124 WAESWVLVSXDJQW-UHFFFAOYSA-N 268.376 2.486 10 20 CECD Cc1ccc([C@H](C)NCc2nnc3n2CCC3)c(O)c1C 273404609 OFWJIWPYQUFTMZ-LBPRGKRZSA-N 286.379 2.398 10 20 CECD COC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@@H]1CCCO1 278932155 XNPDJNHJWLQORD-WPGHFRTFSA-N 295.379 2.245 10 20 CECD COC(=O)[C@H](NCc1cc(C)c(C)cc1O)C1CC1 276451520 JWBWAIXNPGMHJI-CQSZACIVSA-N 263.337 2.050 10 20 CECD CC[C@H](NCCCS(C)(=O)=O)c1ccc(F)cc1O 285935706 FMQZIJTWAYLEAS-LBPRGKRZSA-N 289.372 2.007 10 20 CECD CCOc1ccc(N(CC)CC(=O)N(C)CC)cc1 299360946 CVNSNVILXCUWSP-UHFFFAOYSA-N 264.369 2.390 10 20 CECD CC[C@](C)(NCc1ccc(N(C)C)cc1)C(=O)OC 293105816 JMDSPJKQKDEDLA-HNNXBMFYSA-N 264.369 2.184 10 20 CECD CO[C@H]1COC[C@@H]1N[C@@H](C)c1cc2c(cc1O)CCCC2 290224469 RDOSLZQSGANYEM-KCTSRDHCSA-N 291.391 2.335 10 20 CECD CON1CCC(NCc2ccc(N3CCCC3)cc2)CC1 817418912 KTEVLQDKQKSULV-UHFFFAOYSA-N 289.423 2.402 10 20 CECD C[C@H](N[C@H]1CCC[C@@H](N)C1)c1ccc(F)cc1O 817970509 XTVNDIYGVURCKF-WCQGTBRESA-N 252.333 2.452 10 20 CECD C[C@@H](NC(=O)/C=C/[C@@H]1CCOC1)c1ccccc1O 827952564 XRGJCYUNOGJJFD-BYAJROORSA-N 261.321 2.162 10 20 CECD O=C(c1cc(O)cs1)N1C[C@@H](O)C[C@@H]1c1ccccc1 821161864 JLNUOIIMHNLAPJ-WCQYABFASA-N 289.356 2.402 10 20 CECD COCCCOCCC(=O)N[C@H](C)c1ccccc1O 827952628 ZAIGTHUENOWDSA-GFCCVEGCSA-N 281.352 2.013 10 20 CECD C[C@@H](NC(=O)c1cc2n(n1)CCCC2)c1ccccc1O 827952175 ISUBKDBCCKQMIZ-LLVKDONJSA-N 285.347 2.416 10 20 CECD Cc1ccc(O)c(CN(C)Cc2nnc(C)s2)c1 827806974 YHKVRBYUYMXECD-UHFFFAOYSA-N 263.366 2.493 10 20 CECD O=C1OCCN1[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 826995679 ZDVGYYNVRXUWFK-GFCCVEGCSA-N 296.754 2.072 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CC2(F)F)c1 825736554 CFOYGNQAZVBWMB-XVKPBYJWSA-N 271.263 2.233 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@H](C)c1ccc(C)cc1O 903342993 LVQTXLRGEYTREO-CABCVRRESA-N 292.423 2.462 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCCCN(C)C 734557202 BUOOPKJEMLRURS-UHFFFAOYSA-N 291.439 2.409 10 20 CECD CC(C)CCO[C@@H](C)C(=O)NCc1ccc(O)cc1O 910956781 ZETREEFZPOMRBV-NSHDSACASA-N 281.352 2.165 10 20 CECD CCc1cccc(CN2CCN(c3ncccn3)CC2)c1O 848875975 DJPCRQITDXABIU-UHFFFAOYSA-N 298.390 2.067 10 20 CECD COc1cccc([C@H](C)NCCc2cnc(C)cn2)c1O 846168101 GVMLGCDLIWCJLP-LBPRGKRZSA-N 287.363 2.393 10 20 CECD O=C(NCCc1ccccc1)NCc1ccccc1O 748325608 RGSUXEQWYPMHSU-UHFFFAOYSA-N 270.332 2.434 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)cc1F 843059942 VQTPVOWWXPWHGM-SQWLQELKSA-N 291.414 2.451 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H]([C@H](C)N)C2)c1 843051478 JEGYIHUOXRWQDR-STQMWFEESA-N 278.396 2.350 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCNCC1 846673985 UMDGGQAEYSRKLL-CQSZACIVSA-N 289.423 2.067 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 840827024 ZHLNGEOQCZQKJO-HFHAKLMTSA-N 281.327 2.083 10 20 CECD CNC(=O)C(C)(C)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756782064 MCNPKYNMZFZRJU-KOLCDFICSA-N 294.370 2.441 10 20 CECD O=C1NCC[C@@H]1CCSc1ncc(Cl)s1 850000001 GCGIEXJZTQIIGE-ZCFIWIBFSA-N 262.787 2.415 10 20 CECD Cc1ccc([C@H](C)NCCNc2cnccn2)c(O)c1 756647961 XPNKGKSHYSFMFY-LBPRGKRZSA-N 272.352 2.253 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCOC[C@@H]1C)c1ccccc1O 868604780 RVFATVVBTJMZOP-XQQFMLRXSA-N 292.379 2.425 10 20 CECD CCN(CC(=O)NC)Cc1ccc(N(CC)CC)c(F)c1 768301743 KGLLYVRMEJQWJZ-UHFFFAOYSA-N 295.402 2.240 10 20 CECD CC[C@H](N[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1O 866497480 MRKSBHQDDMEOPJ-YNEHKIRRSA-N 285.771 2.236 10 20 CECD Cc1ccc(CNCc2c(C)nn(C)c2C)c(O)c1 877000902 XEGPJODWEQVGDS-UHFFFAOYSA-N 259.353 2.341 10 20 CECD Cc1nc(C(=O)NCCc2ccc(O)c(O)c2)sc1C 770627807 AHTCACRLOVPGFJ-UHFFFAOYSA-N 292.360 2.144 10 20 CECD C[C@H](CO)CCCNC(=O)N[C@H](C)c1ccccc1O 875430702 NTYJJGLBLLCKMM-NWDGAFQWSA-N 280.368 2.161 10 20 CECD C[C@H](NC(=O)N1CC(F)C1)c1ccc(N(C)C)cc1 776243597 FXFVGNKKSPVBDD-JTQLQIEISA-N 265.332 2.177 10 20 CECD CN(Cc1cccc(O)c1)Cc1cc2c(cc1O)OCO2 771935797 YAPCZYYUGMPRFM-UHFFFAOYSA-N 287.315 2.459 10 20 CECD Cc1nn(C)cc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773015378 OCQKJUWSDBZIKB-NSHDSACASA-N 286.379 2.286 10 20 CECD CC(C)c1cc(NS(=O)(=O)c2ncc[nH]2)ccc1O 882799834 QHGPDFMSWCXYNK-UHFFFAOYSA-N 281.337 2.040 10 20 CECD CC[C@@H](NC[C@]1(O)CCN(C)C1)c1cc(Cl)ccc1O 775555135 JSIPDESVBVVJEE-UKRRQHHQSA-N 298.814 2.153 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)c1 880837885 UTUZZWSMZJJZBQ-CORIIIEPSA-N 275.348 2.132 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@@H]1C(=O)N(C)c1ccc(N)cc1 884441909 SHPNSGSKHSXUKF-ZUZCIYMTSA-N 284.363 2.321 10 20 CECD CCn1cccc(CNCc2cc(C)c(C)cc2O)c1=O 788523821 GYALUTIXOOIWAQ-UHFFFAOYSA-N 286.375 2.480 10 20 CECD CC[C@H]1CN(Cc2ccc(OC)c(OC)c2O)CCO1 891563090 WRVUMULPKNJNRJ-LBPRGKRZSA-N 281.352 2.020 10 20 CECD COc1ccc(CNC[C@H]2C[C@H](NC(C)=O)C2)cc1C 982952797 FBGSELLDCQXWMI-SHTZXODSSA-N 276.380 2.008 10 20 CECD COc1ccc(N(C)CC(=O)OC(C)C)c(OC)c1 1319424644 HIQUSOHMUGQVHZ-UHFFFAOYSA-N 267.325 2.092 10 20 CECD C[C@H](O)[C@@H](C)NCc1ccc(N2CCSCC2)cc1 1325840488 MUQXNLJXWOBCFD-OLZOCXBDSA-N 280.437 2.099 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCCCC(F)F)c1 1332320282 YRWCYWNXOVTTNU-UHFFFAOYSA-N 260.240 2.435 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N[C@@H]1C[C@@H]2CC[C@H]1O2 1256543803 UJYHVILBBLBFGO-DMDPSCGWSA-N 296.754 2.165 10 20 CECD Cc1oc(C(=O)O)cc1COc1ccc(F)cc1C(N)=O 1608039474 XOAGWLZKKNOJTH-UHFFFAOYSA-N 293.250 2.103 10 20 CECD Oc1cccc2c1CN(c1cccc(F)c1-c1nn[nH]n1)C2 1607112054 RVTJDENFZPYIKP-UHFFFAOYSA-N 297.293 2.232 10 20 CECD CN[C@@H]1CCCN(Cc2cc(Cl)cc(OC)c2O)C1 229102695 IYVHGKSWCLCLKN-GFCCVEGCSA-N 284.787 2.238 10 20 CECD Nc1ccc(CCNC(=O)Cc2cc(F)ccc2O)cc1 1580443644 VGALDKAQWOLANU-UHFFFAOYSA-N 288.322 2.015 10 20 CECD C[C@@H](NC[C@H]1CCC=CO1)c1cc(C(=O)O)ccc1O 1593251364 DJKVTMPXKJOUKC-ZYHUDNBSSA-N 277.320 2.434 10 20 CECD O=C(O)CC(F)(F)CNCc1c(O)ccc(Cl)c1F 1777627085 KIRNEXNDXHSSCI-UHFFFAOYSA-N 297.660 2.384 10 20 CECD CCN(C)c1ccc(CN2C[C@@H]3C[C@@]3(C(=O)O)C2)cc1 1776855520 HSUPHXKFHGVCEW-XJKSGUPXSA-N 274.364 2.049 10 20 CECD CC(C)(C)c1cnc(SCC(=O)N2CCNC2=O)s1 164115814 LUPFERNMGDCRDM-UHFFFAOYSA-N 299.421 2.085 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccnc2Cl)c1 155935104 ULRGLDOTLUFJHN-UHFFFAOYSA-N 292.722 2.379 10 20 CECD C[C@@H](CN1CCCC1=O)NCc1cccc(Cl)c1O 124718842 WGNUDLCUEATCEC-JTQLQIEISA-N 282.771 2.146 10 20 CECD COc1ccc(N(C)C[C@@H]2CC3(CC3)C(=O)O2)cc1 844353350 SNVUCUAQOCWWNW-ZDUSSCGKSA-N 261.321 2.227 10 20 CECD CCO[C@H]1CCCN(Cc2cccc(OC)c2O)C1 155437852 FZWNWWSUNKHWBA-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD CC(C)C[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 37801163 JWAVHXARAPYOCF-HNNXBMFYSA-N 277.412 2.084 10 20 CECD C[C@@H]1C[C@H](CNCc2cc(F)ccc2O)[C@@H](C)O1 686507311 SDHNFHQCXZGETN-GMTAPVOTSA-N 253.317 2.434 10 20 CECD Cc1ccncc1NC(=O)c1ccc(C)c(O)c1O 179481562 COWPWUCOHRVLIX-UHFFFAOYSA-N 258.277 2.362 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccccc2O)nc1 134203946 HCBKNCQMUPKBQG-UHFFFAOYSA-N 256.305 2.368 10 20 CECD COc1ccc(N(CC(=O)N(C)C)C(C)C)cc1F 101567543 SUAYFPCTJKHLGU-UHFFFAOYSA-N 268.332 2.137 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccccc2)c1 114540715 WWLLOAFUGBLAOC-UHFFFAOYSA-N 257.289 2.331 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2cscn2)c1 172043656 XSRFMLDMBTVWSU-UHFFFAOYSA-N 292.360 2.106 10 20 CECD Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)on1 174520559 NJHGJMHIZGKGJG-UHFFFAOYSA-N 286.331 2.497 10 20 CECD CC(C)N(C)CC(=O)NCc1c(O)ccc2c1CCCC2 174516611 YLLGWJQXURRUHG-UHFFFAOYSA-N 290.407 2.227 10 20 CECD CCN1CCN([C@H](C)CN[C@H](C)c2ccccc2O)CC1 183418392 AWOMZALDZQTHDF-HUUCEWRRSA-N 291.439 2.069 10 20 CECD CCOC(CN(C)c1ccc2c(c1)OCO2)OCC 184990022 HOBXZFRNAJXSSE-UHFFFAOYSA-N 267.325 2.251 10 20 CECD COc1cccc2c1OC[C@H](NCc1ccccc1O)C2 77412392 MAUBMUCCGMATLG-CQSZACIVSA-N 285.343 2.494 10 20 CECD C[C@H](CN1CCCC1=O)N[C@H](C)c1ccc(N(C)C)cc1 37782526 ZMYGQYWRJQJOJR-ZIAGYGMSSA-N 289.423 2.414 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)[C@H](C)N)cc1F 192111049 YFNATPJORBYRFG-RYUDHWBXSA-N 295.402 2.271 10 20 CECD COc1cccc(CN2CCOC[C@@H]2C2CC2)c1O 93645667 PWBVAJWELBKQIP-CYBMUJFWSA-N 263.337 2.012 10 20 CECD CCCN(C)C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1 236765055 FIUURXQZMIBSHB-OAHLLOKOSA-N 289.423 2.002 10 20 CECD Cc1ccc(C(=O)N(C)C[C@@H]2CCCCO2)c(O)c1O 267599860 PBQAJADFWFDVFO-NSHDSACASA-N 279.336 2.047 10 20 CECD COc1cc(N(C)C[C@@H]2CCOC2)c([N+](=O)[O-])cc1OC 270873779 AGCBKTHVWKVQNB-JTQLQIEISA-N 296.323 2.085 10 20 CECD C[C@]1(CNC(=O)c2c(F)ccc(O)c2O)CCCS1 276617630 UDBVZBSCUWTWBI-CYBMUJFWSA-N 285.340 2.252 10 20 CECD CC(C)(C)[C@@H]1C[C@H](NC(=O)c2cccc(O)c2O)CCO1 279833115 NLPJMUYKDWDPCR-MFKMUULPSA-N 293.363 2.421 10 20 CECD CCc1nn(C)c(Cl)c1C(=O)NCc1ccccc1O 271242367 PJOPKEJQHMDGEP-UHFFFAOYSA-N 293.754 2.272 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H]2CCC[C@@H]2CCO)c1O 279281452 ONLIMJOLNCNUBC-IAQYHMDHSA-N 295.354 2.375 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC2CCOCC2)c1 273576772 LWYVKOJAQXYFQW-LLVKDONJSA-N 293.363 2.256 10 20 CECD CC(C)n1ccc(NC(=O)NCc2ccccc2O)n1 280582472 UXBUQUXLVNRJRE-UHFFFAOYSA-N 274.324 2.491 10 20 CECD C[C@H](CO[C@@H]1CCOC1)N[C@@H]1CCc2cccc(O)c21 297944512 YIKIVNRQKBWCEV-MRVWCRGKSA-N 277.364 2.163 10 20 CECD COCCC1(C(=O)NCc2ccc(N)cc2)CCC1 297351394 ZFFYACNPQMASJE-UHFFFAOYSA-N 262.353 2.092 10 20 CECD COc1ccc(O)c(CNC(=O)c2c(C)nsc2C)c1 815835601 YTVCOZHMOHJJNG-UHFFFAOYSA-N 292.360 2.404 10 20 CECD C[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)c1ccccn1 817942634 QEOAHJROVKVJBC-BBRMVZONSA-N 284.407 2.498 10 20 CECD CCOc1ccc(CN(CC(=O)O)C(C)C)c(O)c1 820386986 GMPCKUZWQMKQKK-UHFFFAOYSA-N 267.325 2.086 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccco2)c1 728983992 JFDWHGYEFUUPCR-SECBINFHSA-N 261.277 2.485 10 20 CECD CN(C)C(=O)c1cccc(NC(=O)c2cc(O)cs2)c1 731867481 LODKMGCHWMDWEQ-UHFFFAOYSA-N 290.344 2.408 10 20 CECD C[C@H](N[C@@H]1C[C@H]2CCCCN2C1=O)c1cc(F)ccc1O 834911814 BDONDGDUFBKQSI-ZKYQVNSYSA-N 292.354 2.335 10 20 CECD Cc1cc(Cn2nnc(C(F)(F)F)n2)ccc1N(C)C 919060543 MDNQUMGYXBQTBJ-UHFFFAOYSA-N 285.273 2.115 10 20 CECD S=C(NCc1ccc(N2CC=CC2)cc1)NC1CC1 740629784 JQHDJHITYREXKO-UHFFFAOYSA-N 273.405 2.189 10 20 CECD C[C@H](COCC1CC1)NCc1cc2c(cc1O)OCO2 846072217 DPFTVRCQDSSYBP-SNVBAGLBSA-N 279.336 2.026 10 20 CECD COc1ccc(CN[C@H]2CCNCC2(C)C)cc1C 841073667 VVRYXEOPIYJGIH-HNNXBMFYSA-N 262.397 2.481 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCC(=O)C1)c1ccc(N(C)C)cc1 843859089 UVBRXGDFGLBUOM-DGCLKSJQSA-N 274.364 2.299 10 20 CECD CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)[C@@H](C)CO1 844733762 XKZOQMQLTPQQKZ-AAEUAGOBSA-N 295.379 2.409 10 20 CECD COc1cc([C@@H](C)NCc2ccc3c(c2)CCO3)on1 924899437 FLWKPYUTCPEREA-SNVBAGLBSA-N 274.320 2.469 10 20 CECD NC[C@@H](NCc1cc(F)ccc1O)C1CCCC1 841087495 QJZNRKOSDLMXGY-CYBMUJFWSA-N 252.333 2.138 10 20 CECD CCn1ncc(C(=O)CSc2ncc(Cl)s2)n1 850002188 VNJJULVEAHYEOE-UHFFFAOYSA-N 288.785 2.383 10 20 CECD CCN(CC)C(=O)CN[C@@H](C)c1cc(F)cc(F)c1O 756455185 IHUQDBHUFAPCPI-VIFPVBQESA-N 286.322 2.189 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1Cc2cccc(O)c2C1 758549165 ZTMXKCQCZFMKAR-ZDUSSCGKSA-N 298.342 2.064 10 20 CECD C[C@H](N[C@@H]1COCC[C@H]1O)c1ccc2ccccc2c1O 866498540 ZCFAZZTXBJPYNT-IUIKQTSFSA-N 287.359 2.346 10 20 CECD CC[C@@]1(O)CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862334090 YLSYKXCRGBZUNH-OAHLLOKOSA-N 284.350 2.378 10 20 CECD C[C@@H](NC(=O)NCCCCCC(=O)O)c1ccccc1O 874403764 SAIIGKIJBCWDBI-LLVKDONJSA-N 294.351 2.397 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@@H]1CCn2ccnc2C1 779192976 RIQHPPHZSRGXBC-LLVKDONJSA-N 295.745 2.486 10 20 CECD C[C@H](NC(=O)[C@@H](O)C(C)(C)C)c1ccc(N(C)C)cc1 775412308 WJBGRLZBVGMTSY-SMDDNHRTSA-N 278.396 2.337 10 20 CECD COc1coc(CN[C@H](C)c2ccccc2O)cc1=O 879648499 RHBHPBQVFZTWCP-SNVBAGLBSA-N 275.304 2.205 10 20 CECD CCc1nnc(Sc2ncc([N+](=O)[O-])s2)o1 882800616 GXQBJKMOCFMYNS-UHFFFAOYSA-N 258.284 2.148 10 20 CECD CCCCCN(CC(N)=O)Cc1ccc(OCC)cc1O 780780361 SHIZRAWVOFNHEE-UHFFFAOYSA-N 294.395 2.268 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCCC[C@@H](C)O 789023588 HUBWIIQFRCSGEM-CYBMUJFWSA-N 293.411 2.021 10 20 CECD COc1ccc(CNCCNC(=O)[C@H]2CC23CC3)cc1C 1134309456 MMGLXRCTXVFCMM-CQSZACIVSA-N 288.391 2.010 10 20 CECD COc1ccc(CN[C@H](C)c2cnccn2)c(O)c1 894638736 TXBNGGVNGISDKU-SNVBAGLBSA-N 259.309 2.042 10 20 CECD O=C(NCCF)NCc1ccc(N2CCCC2)cc1 798057226 JLKGTKJPEIPWTI-UHFFFAOYSA-N 265.332 2.056 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2cc(F)ccc2O)C1=O 722355831 HFARTLFKRFEZTR-GWCFXTLKSA-N 280.343 2.193 10 20 CECD CCN(CC)c1ccc(CNC(=O)/C=C/COC)cc1F 791361874 XBGCZFCLVSMZKF-VOTSOKGWSA-N 294.370 2.491 10 20 CECD CCN(Cc1cccc(OC)c1O)C[C@@H]1CCOC1 768522102 YPRMLNZOHCJMIM-LBPRGKRZSA-N 265.353 2.259 10 20 CECD COc1cccc(O)c1CN[C@H]1CCC[C@@H]1CCO 778216500 OSOQNJZAKWYOBM-YPMHNXCESA-N 265.353 2.042 10 20 CECD CN(C)c1ccc(CN[C@@](C)(C(=O)O)C2CC2)cc1 1777039578 RIQQUWVOLOFADV-OAHLLOKOSA-N 262.353 2.096 10 20 CECD Cc1oc(C(C)C)nc1C(=O)NCc1cccc(O)c1O 1521851274 JEXLYBRVCUXETH-UHFFFAOYSA-N 290.319 2.448 10 20 CECD CCC(CC)(CO)CNCc1cc2c(cc1O)OCO2 120514473 KGBFCPVDDQJZNV-UHFFFAOYSA-N 281.352 2.009 10 20 CECD CCCN(CC(=O)O)Cc1c(O)ccc2ccncc12 1589669734 AVPGVYKAVGOFAO-UHFFFAOYSA-N 274.320 2.237 10 20 CECD CCN1CCc2cc(CN[C@@H]3C=C[C@H](C(=O)O)C3)ccc21 1776877508 OZYXJAYEODGHOI-LSDHHAIUSA-N 286.375 2.188 10 20 CECD CCn1cncc1CNCc1ccc2c(c1)CCO2 841861200 WGVVWUXIEDYEGE-UHFFFAOYSA-N 257.337 2.128 10 20 CECD C[C@H]1CCN(CCN[C@H]2CCc3cccc(O)c32)C1 834611531 MJHJMRIJJLRFKQ-JSGCOSHPSA-N 260.381 2.311 10 20 CECD CCO[C@H]1C[C@@H](NCc2cc(F)cc(F)c2O)C1 883144201 IEMQMUDYURITKJ-PHIMTYICSA-N 257.280 2.328 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)c2ncn(C)n2)c(O)c1 275747641 REHAIFVPOQNDRA-WDEREUQCSA-N 260.341 2.241 10 20 CECD CCN(CC)C[C@H](C)NCc1cc(OC)ccc1O 45691489 GZDNMUMLVJPGKA-LBPRGKRZSA-N 266.385 2.221 10 20 CECD Oc1c(Cl)cccc1CNCCN1CC=CCC1 279776745 KYBFCQFRMOLIJP-UHFFFAOYSA-N 266.772 2.397 10 20 CECD O=C(O)[C@@]12CCC[C@H]1CN(Cc1ccccc1O)C2 701548585 JBADHVNPCHHDQZ-SWLSCSKDSA-N 261.321 2.079 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)CCCO1 708423269 RCUQIOKDONGETG-VIFPVBQESA-N 257.280 2.281 10 20 CECD CCN1C[C@H](N[C@H](C)c2ccc(N(C)C)cc2)CC1=O 391552899 UUYHGPAROUKKCV-TZMCWYRMSA-N 275.396 2.024 10 20 CECD COc1ncc(CNCc2ccccc2O)s1 310303318 UWGWQSZDZIZGBL-UHFFFAOYSA-N 250.323 2.147 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)C(=O)NCc2ccco2)c1 113341285 LEVFDJPQERZJPR-LBPRGKRZSA-N 288.347 2.088 10 20 CECD CCOc1cccc(CNC[C@@](C)(O)c2ccco2)c1O 304277922 DAKWBVDQJYOFBL-MRXNPFEDSA-N 291.347 2.381 10 20 CECD CC1(C)[C@@H](O)C[C@H]1NCc1c(O)cccc1Cl 128335878 NCNRIPJIRZTOBQ-NEPJUHHUSA-N 255.745 2.295 10 20 CECD O=C(Nc1cnc(C2CC2)nc1)c1cccc(O)c1O 188406383 QGBJDRTTYCFZMS-UHFFFAOYSA-N 271.276 2.018 10 20 CECD CCOc1cccc(CN[C@@H](C)C(=O)NC(C)(C)C)c1O 134493438 BDDOORPNGVQSJL-NSHDSACASA-N 294.395 2.184 10 20 CECD COc1ccccc1N(C)C(=O)/C=C/c1cnn(C)c1 48656369 AUGJLMDABFXPBG-CMDGGOBGSA-N 271.320 2.105 10 20 CECD C[C@@]1(CNCc2ccc(N3CCOCC3)cc2)CCCO1 94798388 MKAXGPHYMOMBJE-KRWDZBQOSA-N 290.407 2.182 10 20 CECD CO[C@@H](C)CN(Cc1ccccc1O)C[C@@H]1CCCO1 182333847 IYWJLRSLMXSZHH-ZFWWWQNUSA-N 279.380 2.408 10 20 CECD CC(C)n1cc(CNCc2ccc(N(C)C)c(F)c2)nn1 289537765 CHOAUAKQBGZLMG-UHFFFAOYSA-N 291.374 2.354 10 20 CECD CC[C@@H](CNCc1cc(Cl)cc([N+](=O)[O-])c1O)OC 289795048 LSHSIASFAUEQQT-JTQLQIEISA-N 288.731 2.468 10 20 CECD COCCOCCN(C)Cc1cc2c(cc1O)CCCC2 808237389 ODLDDXBWJPCMLB-UHFFFAOYSA-N 293.407 2.366 10 20 CECD CCOC[C@H](NC(=O)c1c(F)ccc(O)c1O)C(C)C 295568524 YNFBWIUNTANBHS-JTQLQIEISA-N 285.315 2.028 10 20 CECD CCOc1ccc(O)c(CNC[C@H](CO)C(C)C)c1 808422251 ZRJKJPOOUYYYIO-CYBMUJFWSA-N 267.369 2.145 10 20 CECD CCOc1ccc(CN2C[C@H](C(=O)O)CC[C@@H]2C)c(O)c1 817881188 PXPYQAUBFOOFLS-WCQYABFASA-N 293.363 2.476 10 20 CECD CCN(Cc1ccc(N2CCOCC2)cc1)C[C@@H](C)OC 812808777 LSFDUPQGDOKYFT-OAHLLOKOSA-N 292.423 2.380 10 20 CECD C[C@H](NC[C@H]1CCCNC1)c1cc(F)cc(F)c1O 817946280 VEIUSOQIPROIJD-UWVGGRQHSA-N 270.323 2.321 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=S)NC(C)C)c1 728792956 NUMQFKMFAWWCTJ-SECBINFHSA-N 268.382 2.334 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@@H]12 588407486 WOUPWVZQJRJQQT-OHGOIGSHSA-N 285.343 2.272 10 20 CECD C[C@H](NC[C@@H]1CCN1C)c1cc(Cl)ccc1O 903316302 DFDNFRMPFRKSLY-ONGXEEELSA-N 254.761 2.400 10 20 CECD O=C(CCNC(=O)c1cc(O)cs1)NC1CCCCC1 731870545 PQOZQWIAKRPDIQ-UHFFFAOYSA-N 296.392 2.023 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCCN1C 731864094 KVOWDRYHCHIXGG-INIZCTEOSA-N 289.423 2.195 10 20 CECD O=C(COC(=O)c1ccc(F)cc1)c1ccc(O)c(O)c1 916617574 IWYKBUPRXASSSN-UHFFFAOYSA-N 290.246 2.277 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1cc(OC)ccc1O 843427565 RCCUKZYSZLNDCG-YPMHNXCESA-N 267.369 2.288 10 20 CECD C[C@H](NC[C@H](O)c1cnn(C)c1)c1ccc(Cl)cc1O 841748535 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C[C@@H](NC[C@H]1CCCN1C)c1c(O)cccc1F 886513186 WDPZIKQVOBIMKG-GHMZBOCLSA-N 252.333 2.276 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1cccc(C)c1O 83482111 WVWXYFDDXYTENG-ZDUSSCGKSA-N 265.353 2.378 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1COC2(CCCC2)O1 883082286 ATQHAKSNDQEJJX-LBPRGKRZSA-N 299.317 2.446 10 20 CECD C[C@@H]1CC[C@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)C1 784569030 ZLGJWAKPHCMBJL-KOLCDFICSA-N 278.304 2.260 10 20 CECD CO[C@H](C)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 785894372 QBYMUAZNDUXZOX-NEPJUHHUSA-N 279.384 2.148 10 20 CECD COCC1(NCc2ccc(OC)c(OC)c2O)CCCC1 895313139 ZRPGQJBLIQDRFB-UHFFFAOYSA-N 295.379 2.458 10 20 CECD CC[C@@H]1CN(Cc2cc(F)cc(F)c2O)CCO1 708421442 GFCUTMZVTRLNBK-LLVKDONJSA-N 257.280 2.281 10 20 CECD CO[C@H](C(=O)NCCCSc1nccs1)C1CC1 792166222 RNXSHLHPNKMSNF-JTQLQIEISA-N 286.422 2.167 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)c1ccc(C)nc1 795355038 WUHNGAPYLGCBCJ-UHFFFAOYSA-N 292.360 2.459 10 20 CECD COc1cccc(O)c1CNC[C@]1(C)CCCO1 756134887 SKAIQJXPDZZNMA-AWEZNQCLSA-N 251.326 2.060 10 20 CECD CC[C@@H](NC[C@@H]1CCCCS1(=O)=O)c1ccccc1O 694591858 WUQZTIWNNVJSTO-GXTWGEPZSA-N 297.420 2.400 10 20 CECD Cn1nc(C(C)(C)C)cc1NC(=O)Cc1ccc(N)cc1 1218604903 JFXRFGOPODBYMB-UHFFFAOYSA-N 286.379 2.481 10 20 CECD CCOC(=O)[C@@H](CC1CC1)NCc1ccc(N)cc1 1337838933 VXCVXQYOUXYHJE-CQSZACIVSA-N 262.353 2.090 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCC[C@@H](C(=O)O)C1)c1ccccc1O 1607420397 WOMXRXPCVYRHMN-IJLUTSLNSA-N 291.347 2.460 10 20 CECD C[C@@](CO)(Cc1ccccc1F)NCc1ccc(N)cc1 1576036813 LOJBDXVJBYGVEU-KRWDZBQOSA-N 288.366 2.491 10 20 CECD C[C@H](C(=O)O)N(Cc1cc(F)c(F)cc1O)C1CC1 1588597880 VXDQFZJMSOMBGA-SSDOTTSWSA-N 271.263 2.108 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C/c2cccc(O)c2)c1 156406320 IQYGWCDJXQHOAP-VMPITWQZSA-N 299.326 2.436 10 20 CECD Oc1cc2c(cc1CNC1CC(F)(F)C1)OCO2 277763398 XKHBWQPRKQKXRA-UHFFFAOYSA-N 257.236 2.008 10 20 CECD CCOC[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1 113922796 ZMPXYXFXLPNLPJ-LBPRGKRZSA-N 293.363 2.369 10 20 CECD COC(=O)[C@H]1CCCCN1Cc1cccc(C)c1O 179631486 BTELBUGPAZDWSO-CYBMUJFWSA-N 263.337 2.228 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@@H]2CCOC2)cc1 179113307 CUQZIQPBDLTDRG-CQSZACIVSA-N 291.395 2.121 10 20 CECD COc1ccc(O)c(CN2CCOC3(CCC3)C2)c1 180417417 OFTPRJIVACMYIO-UHFFFAOYSA-N 263.337 2.156 10 20 CECD CN(C)c1cccc(NC(=O)/C=C/c2ccc(O)c(O)c2)n1 183955549 SCHSMVVRRAUVLZ-VQHVLOKHSA-N 299.330 2.211 10 20 CECD O=C(O)[C@@H]1[C@@H]2CCC[C@@H]2CN1Cc1ccccc1O 229240190 WMYDXHOLOBUQMB-QKCSRTOESA-N 261.321 2.077 10 20 CECD CC[C@]1(CO)CCCN(Cc2cc(OC)ccc2O)C1 190217173 WXWXYZWBWQMLIO-INIZCTEOSA-N 279.380 2.385 10 20 CECD Cc1[nH]ncc1CCCNCc1ccc2c(c1)CCO2 48400311 OFXNOSYWVDRZDR-UHFFFAOYSA-N 271.364 2.375 10 20 CECD NC(=O)Cc1occc1C(=O)N(CC1CC1)c1ccccc1 354012379 ZLMQDFLIWREXSX-UHFFFAOYSA-N 298.342 2.364 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC[C@@H]2CF)cc1 296674891 WPTQWVMONBKKSR-CQSZACIVSA-N 279.359 2.396 10 20 CECD COC(=O)N1CCC(N[C@H]2CCc3cccc(O)c32)CC1 295962254 MCWOWEPKKXMGEQ-ZDUSSCGKSA-N 290.363 2.200 10 20 CECD CO[C@@H](CN[C@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 293751394 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CC(C)SCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832299808 JEVGGQFIDOQSFF-CQSZACIVSA-N 295.452 2.010 10 20 CECD CCC(=O)[C@@H]1CCCN1C(=O)c1cc(O)cs1 909355596 PIOFHRCVLFXIIQ-VIFPVBQESA-N 253.323 2.037 10 20 CECD C[C@@H](NCC[C@H](O)C1CC1)c1c(O)cccc1F 903411055 LMIHQEVMQFWEPR-SKDRFNHKSA-N 253.317 2.343 10 20 CECD CC(C)[C@H](CO)[C@H](NC(=O)c1cccc(O)c1O)C(C)C 834053059 LQDAPRWLXUMKSF-GXTWGEPZSA-N 295.379 2.117 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)OCCO)cc1 912705798 XONZPVVSMVHIRK-UHFFFAOYSA-N 259.305 2.243 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@@H]2CCC(=O)N2)cc1 844272100 UBSYVTLMSOUIOD-HNNXBMFYSA-N 289.423 2.243 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)c1ncn(C)n1 840939291 MPAFADJQXQXURI-LBPRGKRZSA-N 273.384 2.040 10 20 CECD Cc1cnc(CCNC(=O)NCc2ccccc2O)c(C)c1 847302401 MTRRCOHGCQGFEY-UHFFFAOYSA-N 299.374 2.446 10 20 CECD COc1ccc(N(C)CCN(C)CCSC)cc1 844399769 OHRKFOALLGLDOX-UHFFFAOYSA-N 268.426 2.426 10 20 CECD CCc1cccc(CN[C@H](C)C(=O)N[C@@H](C)CC)c1O 848899388 FOYSAOVVYVTXDT-NWDGAFQWSA-N 278.396 2.347 10 20 CECD CN(C)c1ccc(CN2CCCC[C@@H]2C(=O)O)cc1F 840997826 QGTZLIYWAPQCDM-CQSZACIVSA-N 280.343 2.331 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CC(C)(C)CN 843056605 SBPLGCSYOFHOIJ-UHFFFAOYSA-N 263.429 2.478 10 20 CECD CN(C)c1ccc(CN(C)C2(CN)CCC2)cc1F 843124828 IHSNLGDDPSOYOT-UHFFFAOYSA-N 265.376 2.205 10 20 CECD CCC1CN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 840319135 GXPHMHGQOPHKSL-UHFFFAOYSA-N 266.297 2.458 10 20 CECD COc1ccc(CN[C@H]2CC23CCNCC3)cc1C 841080628 UTFXKZPDMJRIOJ-HNNXBMFYSA-N 260.381 2.235 10 20 CECD CCOc1ccc(CN2CCC[C@@H](CNC)C2)c(O)c1 843044597 KXFPNVPMRWPIMZ-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD O=C1CCCN1[C@@H]1CCCN(Cc2ccccc2O)CC1 840975013 RYGVJURURYRLMA-OAHLLOKOSA-N 288.391 2.369 10 20 CECD COc1cccc(CNCc2ccc(CN)cc2)c1O 843129143 RYWCEURHHRDRBF-UHFFFAOYSA-N 272.348 2.149 10 20 CECD C[C@@H](N[C@H]1CCN(C2CC2)C1)c1cc([N+](=O)[O-])ccc1O 756535570 RFRSZSZFTOTDHX-MNOVXSKESA-N 291.351 2.188 10 20 CECD CO[C@H](CN(C)c1ccc(OCC(=O)O)cc1)C1CCC1 851705510 OHNIDQNUAOHFBK-OAHLLOKOSA-N 293.363 2.401 10 20 CECD Cc1ccc(C(=O)Nc2cc(C3CC3)[nH]n2)c(O)c1O 854952125 GWDVTONEDSYERM-UHFFFAOYSA-N 273.292 2.259 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CCCC[C@H]1O 825062507 YTPVLARYHWMHGZ-WCQYABFASA-N 265.353 2.042 10 20 CECD CCC(=O)CCCOC(=O)c1ccc(C)c(O)c1O 759510144 LPNUCZRDUSQETQ-UHFFFAOYSA-N 266.293 2.322 10 20 CECD N[C@@]12CCC[C@H]1CN(Cc1c(O)ccc(Cl)c1F)C2 857226145 FXGYTODPOUGUTD-LKFCYVNXSA-N 284.762 2.498 10 20 CECD C[S@](=O)[C@@H]1CCC[C@H](NCc2ccc3c(c2)CCO3)C1 850356128 NKIYFLVIUAACNS-MDOVXXIYSA-N 293.432 2.401 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC2(CO)CCCCC2)c1 751510168 OUMJTLUZWKGZPY-UHFFFAOYSA-N 294.351 2.333 10 20 CECD Cc1cccc2c1N(C(=O)/C=C\c1cn(C)cn1)CC2 934133754 XITKYXRROYGFBR-SREVYHEPSA-N 267.332 2.331 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2)c(C)nn1 767161155 BSXAFPKDKQSUGW-UHFFFAOYSA-N 284.363 2.089 10 20 CECD C[C@@H]1OCC[C@H]1CN(C)c1ccc(OCC(=O)O)cc1 872161082 RVKZHYPEJKYRQY-RYUDHWBXSA-N 279.336 2.011 10 20 CECD C[C@H](NC(=O)Nc1cccnn1)c1ccc(N(C)C)cc1 775667896 HSQKMSMLJZRRMB-NSHDSACASA-N 285.351 2.425 10 20 CECD CN(C(=O)[C@H]1CCCC[C@@]1(C)N)c1ccc(N)cc1 877077719 RYYSTDNWEAJENN-UKRRQHHQSA-N 261.369 2.139 10 20 CECD C[C@@H](NC(=O)N[C@]1(C)CCOC1)c1ccc(N(C)C)cc1 776237912 KCCZFGMMZLWGDF-MLGOLLRUSA-N 291.395 2.292 10 20 CECD C[C@H](NC(=O)[C@@H]1CCCN1C)c1ccc(N(C)C)cc1 773021717 BJOUXAQYAAFXPV-WFASDCNBSA-N 275.396 2.024 10 20 CECD CN(C)c1ccc(CNC(=O)N2C[C@H]3C[C@@H]3C2)cc1F 888004988 DVIVYFYZMQVOFT-VXGBXAGGSA-N 277.343 2.053 10 20 CECD Cc1cncc(COC(=O)c2ccc(C)c(O)c2O)c1 785670713 ALIBAIHJTZWLGI-UHFFFAOYSA-N 273.288 2.467 10 20 CECD C[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccc(N(C)C)cc1 704370982 JFLJFPXRXNYNAY-IUODEOHRSA-N 275.396 2.024 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)S(=O)[C@@H](C)C2)c1 792192392 NSNZZGXENNLVQK-RYUDHWBXSA-N 297.420 2.132 10 20 CECD CCOCC1(C(=O)N[C@H](C)c2cc(OC)ccc2O)CC1 799697852 LXWPDOZDLGIHPK-LLVKDONJSA-N 293.363 2.395 10 20 CECD C[S@](=O)CCN(Cc1ccco1)Cc1ccccc1O 1261455876 FIEWTRKEOZXUGI-FQEVSTJZSA-N 293.388 2.366 10 20 CECD CO[C@@H](CN[C@@H](C)c1cc(C(=O)O)ccc1O)C1CC1 1606680139 OKWBVANHFXMXRU-XPTSAGLGSA-N 279.336 2.166 10 20 CECD O=C(O)c1cnc(Sc2ncc(Cl)s2)nc1 1608979116 KHHUHVDUMNWULU-UHFFFAOYSA-N 273.726 2.436 10 20 CECD O=C(O)c1cnc(SCc2cccnc2[N+](=O)[O-])s1 1608979017 DURYELQRRMTNLV-UHFFFAOYSA-N 297.317 2.437 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCCO2)c1 157608050 HFEKNXZAGIQTSG-IINYFYTJSA-N 279.336 2.147 10 20 CECD CC[C@@H](NCCc1cnn(C)c1)c1ccccc1O 128143419 KJSXDSZYMCUBFO-CQSZACIVSA-N 259.353 2.409 10 20 CECD CN1CCCc2cc(CNCc3ccnn3C)ccc21 71138886 FHJMUQRLIWEZNH-UHFFFAOYSA-N 270.380 2.092 10 20 CECD COC[C@H]1CCCCN1Cc1cc(OC)ccc1O 307783673 QXQYHBATLLVWHD-CYBMUJFWSA-N 265.353 2.402 10 20 CECD COc1cccc(CN[C@@H](C)[C@@H](OC)C2CC2)c1O 388240162 QJRJWVJHONMUFP-ZUZCIYMTSA-N 265.353 2.304 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2ccoc2)c1 175545350 ZEPQBCJKYXGZTM-UHFFFAOYSA-N 275.304 2.243 10 20 CECD C[C@H]1CC(=O)N(CN(C)Cc2ccc(N(C)C)cc2)C1 113238686 MAEUOTAWXODXLN-ZDUSSCGKSA-N 275.396 2.010 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1nccn1C 182684090 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809739241 BYFLAJHXLNHILK-UHFFFAOYSA-N 291.303 2.070 10 20 CECD Cn1cc2c(n1)CCC[C@H]2NCCc1ccc(N)cc1 817957096 IWRGFUBBWRKTPB-OAHLLOKOSA-N 270.380 2.212 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@@H](C)C1CNC1 817934687 MYZZEFWILOVWBD-KGLIPLIRSA-N 275.440 2.190 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCCN2)c1 817949866 OMHAWZBAXBPGHZ-NEPJUHHUSA-N 264.369 2.194 10 20 CECD Cc1cc(O)c(CN(C)Cc2nncn2C)cc1Cl 825940321 TVKIDUJPDJXPEN-UHFFFAOYSA-N 280.759 2.115 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CC[C@@H](C2CC2)C1 827562025 HLIXYJLVAOHIRF-SECBINFHSA-N 265.284 2.109 10 20 CECD CN(C)c1ccc(N(C)C(=O)/C=C/c2cnn(C)c2)cc1 728840784 WGVVFPXSOSOKBQ-BJMVGYQFSA-N 284.363 2.162 10 20 CECD C[C@H](Nc1ccc2nncn2n1)c1ccc(N(C)C)cc1 827938808 SYNKMPRHGGQGCY-NSHDSACASA-N 282.351 2.363 10 20 CECD O=C1CC[C@@H]2[C@@H]1[C@@H]2C(=O)NCc1c(O)ccc2c1CCCC2 907059293 IVZWIUZVAZKBOB-OAUYIBNBSA-N 299.370 2.112 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(C)[nH]1 731896797 MDAZDEZMRISKJU-UHFFFAOYSA-N 286.379 2.446 10 20 CECD CC[C@H](CNCc1cc(F)c(N(C)C)cc1F)C(=O)O 900053366 GDXXOLLPUBTVSI-SECBINFHSA-N 286.322 2.231 10 20 CECD CCn1cnc(C(=O)NCc2c(O)ccc3c2CCCC3)c1 830559449 NRPUAVMZEAOCCD-UHFFFAOYSA-N 299.374 2.417 10 20 CECD O=C(O)/C=C/c1ccc(N2CC(C(F)F)C2)c([N+](=O)[O-])c1 833195960 KQWBMPNZYSUMIO-DUXPYHPUSA-N 298.245 2.394 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@H]1CCOC2(CCC2)C1 910956652 MXKDFKYAUOYIKV-NSHDSACASA-N 291.347 2.063 10 20 CECD CCN1C[C@H](N[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)CC1=O 834888905 CXPRBYMGZVZZTN-CKYFFXLPSA-N 292.354 2.290 10 20 CECD CC[C@H](CSc1ncc(C(=O)OC)s1)OC 841671715 ZPGPNKIOVGUVKK-SSDOTTSWSA-N 261.368 2.447 10 20 CECD CCC[C@H]1C[C@@H](C(=O)NCc2ccc(O)cc2O)CCO1 910948802 ANMNSXDOOIUMDB-FZMZJTMJSA-N 293.363 2.309 10 20 CECD CCc1cccc(CN2CCN(C(C)=O)C[C@H]2C)c1O 848887060 MPGNCNRBBFDBSE-GFCCVEGCSA-N 276.380 2.007 10 20 CECD NC[C@H]1CC[C@@H](NCc2c(O)ccc(Cl)c2F)C1 841085222 XBVLPBPKDYZOFL-DTWKUNHWSA-N 272.751 2.402 10 20 CECD COc1ccc(CNC(=O)Cc2occc2C)c(O)c1 846951586 YEYTWOABARSVKO-UHFFFAOYSA-N 275.304 2.161 10 20 CECD O=C(NCCC1(O)CCC1)NCc1cc(Cl)ccc1O 845182136 NGUDCMGAKUNLJZ-UHFFFAOYSA-N 298.770 2.150 10 20 CECD CNC(=O)C(C)(C)CN[C@H](C)c1ccc(Cl)cc1O 841753016 XCGWRGOPERIDMK-SECBINFHSA-N 284.787 2.468 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@H](OC3CCC3)C2)cc1 848432543 JBUCAFPKKWJCEQ-INIZCTEOSA-N 288.391 2.371 10 20 CECD CCOc1cccc(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1O 846113555 YNBMVNUZZLBGJT-GHMZBOCLSA-N 269.291 2.488 10 20 CECD CCN1C[C@@H](CN[C@@H](C)c2ccc(F)cc2O)CC1=O 846210278 WWTBNRJMXCQUTA-WDEREUQCSA-N 280.343 2.050 10 20 CECD Cc1nc(C(C)C)nc(O)c1C(=O)Nc1ccc(N)cc1 843295596 RTHQESAMYLOXQJ-UHFFFAOYSA-N 286.335 2.449 10 20 CECD COc1ccc(N2CCC(NC[C@H]3CCCN3)CC2)cc1 841035015 GNVMJELWZCYZEI-OAHLLOKOSA-N 289.423 2.006 10 20 CECD C[C@@H]1C[C@@H](CNC(=O)NCc2ccccc2O)[C@@H](C)O1 840278116 YSNMGRMSLQWXEJ-WZRBSPASSA-N 278.352 2.005 10 20 CECD CCON(C)C(=O)NCc1ccc(N2CCCC2)cc1 753380249 TVDLKYSHOYCPBT-UHFFFAOYSA-N 277.368 2.380 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCOC[C@H]2CCOC2)c1 756564205 RIQGVGMXKVXKRW-KGLIPLIRSA-N 279.380 2.404 10 20 CECD C[C@@H](NCCN1CCC1)c1cc(Cl)ccc1O 756771063 ZFCTYEGNTLSITJ-SNVBAGLBSA-N 254.761 2.402 10 20 CECD O=C(N[C@H]1CCC[C@H](F)C1)c1cccc(O)c1O 1332485327 NHMLIMGPPPZBRA-IUCAKERBSA-N 253.273 2.108 10 20 CECD Cc1cccc(CN(C)Cc2cc3c(cc2O)OCO3)n1 769480356 NFDNJBOEVSQYSF-UHFFFAOYSA-N 286.331 2.456 10 20 CECD O=C(NCc1ccc(O)cc1O)OC1CCCC1 867416985 KQDZQWTXDVQNKG-UHFFFAOYSA-N 251.282 2.267 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)c3cccn32)c1 862755457 HMBYIUVVQIWLEQ-CQSZACIVSA-N 298.342 2.336 10 20 CECD CO[C@@H](C)c1noc(CN[C@H](C)c2ccccc2O)n1 879648375 LVPYBHBGAIXXME-ZJUUUORDSA-N 277.324 2.333 10 20 CECD Cc1cc(NS(=O)(=O)N2CC[C@H](C)C2)c(C)c(C)c1O 775291909 QVFJAAQSXSDIJN-VIFPVBQESA-N 298.408 2.316 10 20 CECD CCOCCOCCNCc1ccc(N2CCCC2)cc1 1119683483 QTRMBWOKPYYGES-UHFFFAOYSA-N 292.423 2.430 10 20 CECD CCn1[nH]c(C)nc1=NCc1ccc(N2CCCC2)cc1 1117945875 WIYYGDKHQLAUOM-UHFFFAOYSA-N 285.395 2.241 10 20 CECD C[C@@H](NC(=O)COCc1ccncc1)c1ccccc1O 1119108369 DKVZZKQAKCWLIS-GFCCVEGCSA-N 286.331 2.181 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@@H]1C(=O)N(C)Cc1ccccc1O 878277301 QXSUUOIVUJSTLY-MEDUHNTESA-N 299.374 2.440 10 20 CECD COC(=O)[C@@H](COC(C)C)N(C)Cc1cccc(C)c1O 775741368 ODVPPQVSGGZNSL-CQSZACIVSA-N 295.379 2.099 10 20 CECD COC(=O)CCN(Cc1ccc(N)cc1)C(C)C 69318150 VZZQCRUNFAKTEJ-UHFFFAOYSA-N 250.342 2.042 10 20 CECD O=C(NCCOc1ccccc1)c1c(F)ccc(O)c1O 789938336 AOHGVWGCXVOPHH-UHFFFAOYSA-N 291.278 2.046 10 20 CECD CC1(C)CC[C@H](CO)N(Cc2cc3c(cc2O)OCO3)C1 895926115 WIPKGIAAGHCFOO-GFCCVEGCSA-N 293.363 2.104 10 20 CECD COc1ccc(CN[C@@H](C)C2CC2)c(O)c1OC 892449176 OJKROUZMCRIYJX-VIFPVBQESA-N 251.326 2.298 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@@H]([C@@H]2CCCO2)C1 894089068 PRJFQPODGNGMCL-UONOGXRCSA-N 299.317 2.050 10 20 CECD Cc1cccc(CNCC(=O)N2CCc3ccccc32)c1O 895486329 BMWZIRCTOXQOAB-UHFFFAOYSA-N 296.370 2.380 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@@H]2CCO)cc1 189948361 UXEKRKWETWBVGB-ZBFHGGJFSA-N 262.397 2.393 10 20 CECD COc1ccc(CNC(=O)c2ccc(C)c(O)c2)c(O)c1 794384182 WUKQJVQQEAQXDC-UHFFFAOYSA-N 287.315 2.345 10 20 CECD COc1cccc(O)c1CN[C@H]1C[C@H](OC)C1(C)C 753374247 RMNXYMPLMLASPT-KBPBESRZSA-N 265.353 2.304 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCOC(C)(C)C1 754080995 VTUOJQNOWYUHPV-LLVKDONJSA-N 265.353 2.448 10 20 CECD Nc1ccc(CN2CCC(OC[C@H]3CCCO3)CC2)cc1 1335284390 BGMNZGVQSQZDBZ-QGZVFWFLSA-N 290.407 2.429 10 20 CECD NC1(CNCc2ccc(N3CCCC3)cc2)CCC1 1345103662 GWUCRROZOSMVEB-UHFFFAOYSA-N 259.397 2.258 10 20 CECD C[C@@H]1C[C@@H](NCCCCN)c2c(O)ccc(F)c21 1348851881 HBIDVXLWTJCNAH-MWLCHTKSSA-N 252.333 2.408 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C[C@@H]1COCCO1 1350594997 ZDTFUMKWLABRLM-QGZVFWFLSA-N 290.407 2.134 10 20 CECD Nc1ccc(-n2cc(C3CCC(C(=O)O)CC3)nn2)cc1 1608271589 CQBOBDIVIZPXFR-UHFFFAOYSA-N 286.335 2.208 10 20 CECD O=C(O)c1coc(CNCc2cc(F)c(F)cc2O)c1 1602556175 HTBNQGAWMPIACQ-UHFFFAOYSA-N 283.230 2.251 10 20 CECD O=C(NCc1cccc(O)c1O)c1[nH]ccc1C1CC1 1548791514 HZSVKHIJQCUTBO-UHFFFAOYSA-N 272.304 2.233 10 20 CECD C[C@@H](N[C@H]1COC2(CCC2)C1)c1cc(C(=O)O)ccc1O 1593230787 FZMCIBYGUPCTRR-ZYHUDNBSSA-N 291.347 2.453 10 20 CECD O=C(c1cccc(O)c1O)N1Cc2ccccc2C1 126377740 RIGLTJKZWXEFRS-UHFFFAOYSA-N 255.273 2.254 10 20 CECD CC1(C)[C@@H](O)C[C@@H]1NCc1ccc2c(c1)CCCO2 922017128 LOLIRIHJLIELMU-GJZGRUSLSA-N 261.365 2.261 10 20 CECD COc1cc(Cl)cc(CN2C[C@H](C)NC[C@H]2C)c1O 252881637 ZZQLNTRERNIURH-VHSXEESVSA-N 284.787 2.236 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)CN2CCOCC2)c1 36933341 DVJPPXAUASXYHM-UONOGXRCSA-N 278.396 2.072 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](O)C[C@@H]2C)c1O 292520163 WFTRKBLXRFUNDE-ZANVPECISA-N 281.327 2.079 10 20 CECD CCn1ccnc1CN[C@H](C)c1cc(OC)ccc1O 182404224 LKBLMMJBUMPPQJ-LLVKDONJSA-N 275.352 2.468 10 20 CECD C[C@@H]1C[C@H](NCc2ccc3c(c2)CCCN3C)CO1 402373577 ZFRLDFMXJXRDLO-DOMZBBRYSA-N 260.381 2.336 10 20 CECD CCOC(=O)[C@H]1CCCCN1Cc1ccccc1O 4616420 FPBGQOZZSUJTKU-CYBMUJFWSA-N 263.337 2.310 10 20 CECD CC1CCN(C(=O)[C@H](C)N(C)Cc2ccccc2O)CC1 109771878 HGEYRKZSIBIZQE-AWEZNQCLSA-N 290.407 2.471 10 20 CECD COc1cccc(CNC[C@H](C)Cn2ccnc2C)c1O 105442782 PIDVXGMTEAFENB-LBPRGKRZSA-N 289.379 2.332 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccnc1 173205953 YZPSWUYCPJDBSM-UHFFFAOYSA-N 283.331 2.187 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1cccc(OCC)c1O 182325459 KZBUSIYOMWOKQT-MRXNPFEDSA-N 292.379 2.412 10 20 CECD CC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H](C)O1 181067625 YVIDJNXMBVOHNO-HASJVIIQSA-N 291.347 2.137 10 20 CECD C[C@H](C1CC1)N(C)C(=O)/C=C/c1ccc(O)c(O)c1 180649458 PXLPSMJAEDRJMJ-VMKBVTSJSA-N 261.321 2.368 10 20 CECD CC(C)COC[C@@H](O)CN[C@H](C)c1ccc(F)cc1O 185117005 OTZQTMLLTLWDGV-YPMHNXCESA-N 285.359 2.215 10 20 CECD C[C@H](O)CN[C@H](C)c1cc(Br)c(F)cc1O 134899509 NRRYCENOMWBXJN-NKWVEPMBSA-N 292.148 2.325 10 20 CECD CN(C)c1ccc(CN2CCN(CC3CC3)CC2)cc1F 130653836 VVYBPBXAZAHQPM-UHFFFAOYSA-N 291.414 2.419 10 20 CECD Oc1cccc(Cl)c1CNCCCn1ccnc1 83551200 TYJSELLZHWOLEM-UHFFFAOYSA-N 265.744 2.422 10 20 CECD CCOc1cccc(CN2CCCO[C@@H](C)C2)c1O 134159215 FLNNXAHQNAQPFG-LBPRGKRZSA-N 265.353 2.402 10 20 CECD Cc1ccc(O)c(CN2CCC(C3OCCO3)CC2)c1 130110407 SWJLBENLYGUUJW-UHFFFAOYSA-N 277.364 2.286 10 20 CECD COc1ccc(CNCCc2nnc(C)s2)cc1C 289873628 PCUKMZQQJNHPMZ-UHFFFAOYSA-N 277.393 2.496 10 20 CECD CCOC[C@@H](O)CN(CC)c1ccc(OCC)cc1 269583527 GBTHGDFMXUOLFC-AWEZNQCLSA-N 267.369 2.309 10 20 CECD CC(=O)NC1CCC(NCc2cc(C)ccc2O)CC1 264940630 GADGGNHNFHWABX-UHFFFAOYSA-N 276.380 2.238 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[S@@](=O)C1 277434126 JRAZDKYESPOOOZ-FKIZINRSSA-N 298.427 2.092 10 20 CECD Cc1ncsc1CCC(=O)NCc1ccc(O)c(O)c1 298526760 IUFGRJOTAFYWFS-UHFFFAOYSA-N 292.360 2.112 10 20 CECD CC[C@H](CO)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 294677626 AZCQLRNONAOJET-SNVBAGLBSA-N 288.731 2.157 10 20 CECD CC(=O)C(=O)COC(=O)c1ccc2ccccc2c1 808487412 JXFQKTUVGFEQOO-UHFFFAOYSA-N 256.257 2.155 10 20 CECD Cc1cc(CN[C@H](CCO)C2CC2)ccc1N(C)C 815090837 PDHITGBPFHKADV-OAHLLOKOSA-N 262.397 2.312 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCSC2)c1 810403996 AFQUDJNVFXNATF-SNVBAGLBSA-N 281.377 2.160 10 20 CECD Cc1nc(C(C)(C)NCc2ccc3c(c2)CCO3)no1 729854983 NTOWQIYOYBPEAX-UHFFFAOYSA-N 273.336 2.338 10 20 CECD CC[C@@H](CO)N(C)Cc1c(O)ccc(Cl)c1F 824534029 XULZLXOAVMNQHG-QMMMGPOBSA-N 261.724 2.387 10 20 CECD C[C@@H]1C[C@@H](NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)CO1 826532232 STCKQVCXNBNAFX-YRGRVCCFSA-N 291.395 2.290 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)cc1C 824839188 WBORPRPCVKZHBJ-MUIFIZLQSA-N 271.360 2.394 10 20 CECD CC[C@@H]1CN(CC)CCN1Cc1cc2c(cc1O)OCO2 825005353 IGISKNJOOYMOIP-CYBMUJFWSA-N 292.379 2.037 10 20 CECD CC(C)(CNCc1c(O)cccc1Cl)C(=O)O 833458115 DAIXWBSPEPNKLG-UHFFFAOYSA-N 257.717 2.246 10 20 CECD COCCN(C(=O)/C=C/c1cnn(C)c1)c1ccccc1 836968056 LGNRXFAGLZEWHN-CMDGGOBGSA-N 285.347 2.113 10 20 CECD CC(C)[C@@H](C)N(C(=O)C(=O)Nc1ccc(N)cc1)C1CC1 841101334 UCEJBWVDGOOMTL-LLVKDONJSA-N 289.379 2.243 10 20 CECD c1cc(N2CCCCC2)ccc1CN1CC[C@@H]2CNC[C@@H]21 841027146 XPOVXLPXNTYMNN-AEFFLSMTSA-N 285.435 2.471 10 20 CECD C[C@@H](NCc1cnnn1C)c1ccc(Cl)cc1O 841757979 QQHVONQMPBXDLN-MRVPVSSYSA-N 266.732 2.025 10 20 CECD COc1cccc([C@H](C)NC[C@H](C)N(C)C)c1O 846145150 LTAKUNWAHBWLDQ-QWRGUYRKSA-N 252.358 2.002 10 20 CECD COc1cccc([C@H](C)NCCc2cncn2C)c1O 846165074 RZPVVSGPNXLEPW-NSHDSACASA-N 275.352 2.028 10 20 CECD NC[C@@H](NCc1cc(Cl)cc(F)c1O)C1CC1 841027622 DGPMKHHQMHWDGU-LLVKDONJSA-N 258.724 2.012 10 20 CECD CCn1cc(CN[C@@H]2C[C@H](C)c3c(F)ccc(O)c32)nn1 850522521 SUEQVYRHWVLSIX-JOYOIKCWSA-N 290.342 2.481 10 20 CECD CC(C)[C@H]1C[C@@H](C(=O)NCc2ccc(N)cc2)CCO1 927767751 JLBZUBUVVFNGGY-DZGCQCFKSA-N 276.380 2.336 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)CCS(C)(=O)=O)c(O)c1C 756658530 KSZOVJYQDYQOSJ-WCQYABFASA-N 299.436 2.483 10 20 CECD Cn1ncc(C2CC2)c1CNCc1ccccc1O 850113343 CWESOSOKHHUTNL-UHFFFAOYSA-N 257.337 2.293 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@]1(C)CO 852701875 GPJNPSRCEIZMJC-BBRMVZONSA-N 262.397 2.203 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H]([C@H](C)O)C2)c1 768519812 XXIOTZUTVNMXAX-STQMWFEESA-N 279.380 2.384 10 20 CECD Cc1ccc(C(=O)Nc2cnn(C(F)F)c2)c(O)c1O 767917582 KDDVDVQFSIKWJV-UHFFFAOYSA-N 283.234 2.250 10 20 CECD CC[C@H](NCCN1CCC1)c1ccc(N(C)C)cc1 773090906 HSUAQKRHKZAAPC-INIZCTEOSA-N 261.413 2.499 10 20 CECD CC(C)OCCCC(=O)N(C)c1ccc(N)cc1 877075803 HZGMPKMCTOTACK-UHFFFAOYSA-N 250.342 2.437 10 20 CECD O=C1CN(Cc2ccccc2)[C@H](c2cccc(F)c2O)N1 778523758 DDZJVRAJFKJRBQ-MRXNPFEDSA-N 286.306 2.162 10 20 CECD Cc1cc(C(=O)OC[C@@H](C)O)c(C)n1-c1ccccn1 787605422 CGODVFKWQRRGHQ-LLVKDONJSA-N 274.320 2.027 10 20 CECD CC1=NO[C@H](CNCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 895309967 DMCZFGAUALJUCI-JTQLQIEISA-N 299.714 2.208 10 20 CECD CCn1cnc2c1CCN(Cc1ccc(C)cc1O)C2 897333935 XHAQQVNHAZVTEJ-UHFFFAOYSA-N 271.364 2.475 10 20 CECD C[C@H]1[C@@H](C)OCCN1Cc1cc(F)cc(F)c1O 708399235 KIZUTVOZORYKIP-DTWKUNHWSA-N 257.280 2.280 10 20 CECD Oc1c(F)cc(F)cc1CNCC1(O)CCCC1 708436339 LNBNDWXTIXRFOU-UHFFFAOYSA-N 257.280 2.065 10 20 CECD Oc1ccccc1CN(CCF)C[C@H]1CCCO1 759347915 OFGIFWUKUVEEES-CYBMUJFWSA-N 253.317 2.343 10 20 CECD N[C@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1339224739 PJUOHZSTOWLEHW-HNNXBMFYSA-N 259.397 2.210 10 20 CECD Cc1ccc(O)c(CNC(=O)CN(C)Cc2ccccc2)c1 1261842061 LLJNRYYFXXKYPY-UHFFFAOYSA-N 298.386 2.449 10 20 CECD Cc1oc(C(=O)O)cc1COc1ccccc1OCCO 1608038732 GSFRURODZYNZPR-UHFFFAOYSA-N 292.287 2.236 10 20 CECD Cc1cccc(CN2CC[C@H](C)C[C@@H]2C(=O)O)c1O 1607850193 BNEZJTWRXRYXBC-GXFFZTMASA-N 263.337 2.386 10 20 CECD CN1CCC[C@H]2CN(Cc3ccccc3O)CC[C@H]21 228183307 QLPCLSCAAFVWKM-DZGCQCFKSA-N 260.381 2.308 10 20 CECD COC[C@@H](C)CNCc1cc(Cl)cc(OC)c1O 228672582 KJCGVIXZSGPSJS-VIFPVBQESA-N 273.760 2.426 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](C)CN)cc1 1579674357 QPKJTBKMQNRCIQ-LLVKDONJSA-N 271.364 2.171 10 20 CECD O=C(O)c1cc(=NCc2ccc3cccnc3c2O)cc[nH]1 1777667612 XYOAOBJYYNHRDM-UHFFFAOYSA-N 295.298 2.068 10 20 CECD COc1ccc(N2CCC(NC[C@@H](C)CCO)CC2)cc1 151918721 MUNFYKBDKJIFFV-AWEZNQCLSA-N 292.423 2.272 10 20 CECD CCC[C@](C)(CO)NCc1cc(F)cc(F)c1O 883003998 UGXTVIUOLXWUGN-CYBMUJFWSA-N 259.296 2.311 10 20 CECD Nc1ccc(NC(=O)CCCOC2CCOCC2)cc1 40991844 KKMYKEDFKHDJKW-UHFFFAOYSA-N 278.352 2.183 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)CCCO1 281169112 GSBWZTSEOATPLX-CYBMUJFWSA-N 265.353 2.402 10 20 CECD Nc1ccc(CC(=O)Nc2nc3c(s2)CCC3)cc1 49540747 OFJLXCSQUDWPCF-UHFFFAOYSA-N 273.361 2.395 10 20 CECD Cc1ccc(O)c(CNC2CCN(C3CC3)CC2)c1 71407908 GLBHOFRGTRJLLY-UHFFFAOYSA-N 260.381 2.417 10 20 CECD CCc1cccc(CNCc2cnn(CC)c2)c1O 709448580 ZSYPWWBHKDUSRD-UHFFFAOYSA-N 259.353 2.461 10 20 CECD CCOc1cccc(CNCc2conc2C)c1O 397963802 WKZJKCRGVQFRKS-UHFFFAOYSA-N 262.309 2.377 10 20 CECD C[C@@H]1C[C@H](C(=O)O)CN(Cc2ccc(N(C)C)cc2)C1 399026587 WQOCUBOUZKYWFU-OCCSQVGLSA-N 276.380 2.295 10 20 CECD CCN(C)c1ccc([C@H](C)NCCC(=O)N(C)C)cc1 178293099 JQVBVBZUKRTLKB-ZDUSSCGKSA-N 277.412 2.272 10 20 CECD O=C(NCCCSc1nccs1)c1ncccc1O 127065889 QTWDHUBCMHPFOS-UHFFFAOYSA-N 295.389 2.156 10 20 CECD CC[C@H](COC)NC(=O)NCc1ccc(N(C)C)c(F)c1 129148568 HCGOJGNGPDUILQ-GFCCVEGCSA-N 297.374 2.116 10 20 CECD C[C@H](NC[C@@H]1CC[C@H](O)C1)c1ccc(F)c(F)c1O 189335194 NZLIZKLRHUNWMI-AEJSXWLSSA-N 271.307 2.482 10 20 CECD CCOC(=O)[C@@H](C)[C@@H](C)NCc1ccccc1O 185220092 NDLZYQDUEIZHKD-WDEREUQCSA-N 251.326 2.070 10 20 CECD CC[C@@H]1C(=O)NCCN1Cc1ccc(N(CC)CC)cc1 93050724 JLEXEDRQEDRGHX-MRXNPFEDSA-N 289.423 2.243 10 20 CECD COc1ccc(CNCc2ncc(C)s2)c(O)c1 230687328 JGJXYHVPUXXMBC-UHFFFAOYSA-N 264.350 2.456 10 20 CECD COc1cccc(CN(CCO)C2CCCC2)c1O 270978244 CAYQSTVDIXBAMQ-UHFFFAOYSA-N 265.353 2.138 10 20 CECD CC1=CCN(CC(=O)NCc2ccc(N(C)C)cc2)CC1 270338258 NAOKSHZJSWVIPJ-UHFFFAOYSA-N 287.407 2.021 10 20 CECD O=C1Nc2ccccc2[C@]12CCN(Cc1ccccc1O)C2 375299753 MQOCKNOTUVPNGR-GOSISDBHSA-N 294.354 2.488 10 20 CECD CC(C)C[C@H]1OCCC[C@@H]1NC(=O)c1cccc(O)c1O 280408284 HQDXGCHUOTUOAI-GXTWGEPZSA-N 293.363 2.421 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1COc3ccccc3[C@@H]1O)CC2 297217561 HBEICNJLIOQONH-LBTNJELSSA-N 297.354 2.464 10 20 CECD CC[C@@H](C)CONC(=O)NCc1ccccc1O 291956647 UXAUIOWSKBJFFE-SNVBAGLBSA-N 252.314 2.169 10 20 CECD CC1(C)CC[C@H]1NC(=O)c1c(F)ccc(O)c1O 295683479 IKWBZKQHFOOHRY-SECBINFHSA-N 253.273 2.155 10 20 CECD Cc1nccc(CCC(=O)N[C@H](C)c2ccccc2O)n1 827946833 SROFPQFWPRCWAO-LLVKDONJSA-N 285.347 2.301 10 20 CECD CC(C)[C@@H]1C[C@H](C(=O)NCc2ccc(O)cc2O)CCO1 822971200 AEICIUGWNYSZNL-ABAIWWIYSA-N 293.363 2.165 10 20 CECD CN(C)c1ccc(/C=C/CN[C@@H]2CCC[C@H]2O)cc1 835082778 XPXXVZQHCKRRLH-FZZYSBJUSA-N 260.381 2.269 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2CCOC(C)(C)C2)c(O)c1O 837220109 HJMZYPXQPKHJEE-LLVKDONJSA-N 293.363 2.341 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C(=O)NC(C)C 840974522 JZCTYPCLFKWSIH-ZDUSSCGKSA-N 277.412 2.064 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)Cn2cccn2)c1O 846146777 LLENTPHDJSUDAF-NWDGAFQWSA-N 275.352 2.337 10 20 CECD CC(C)(CCNC(=O)C(=O)Nc1ccc(N)cc1)C1CC1 841135849 PYOPTIYNCXILSN-UHFFFAOYSA-N 289.379 2.150 10 20 CECD N[C@@H]1CN(Cc2ccccc2O)C[C@H]1c1ccccc1F 841103787 KXUZOYAHZSQTTF-GOEBONIOSA-N 286.350 2.458 10 20 CECD CCOC1CC(N(C)C(=O)NCCc2ccc(N)cc2)C1 841957027 LLVFOZHSFFZRKQ-UHFFFAOYSA-N 291.395 2.020 10 20 CECD COc1cccc([C@@H](C)NC[C@H](C)CCO)c1O 846149126 VZZVNLFLUAZHNG-GHMZBOCLSA-N 253.342 2.070 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](N)C2CC2)cc1F 841048908 GOWOWOUOCRHNKV-OAHLLOKOSA-N 279.403 2.499 10 20 CECD O=[N+]([O-])CCN(Cc1ccccc1O)C1CCCC1 929635262 IFXNWAXHPBICNP-UHFFFAOYSA-N 264.325 2.414 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](CO)[C@H]2C)c1 840978696 PBTYSTMFUAKEIR-CHWSQXEVSA-N 279.380 2.384 10 20 CECD CCCN1CC(=O)N[C@H]1c1cc(Cl)c(C)cc1O 849182189 DATWGHNFZYWUQP-CYBMUJFWSA-N 268.744 2.194 10 20 CECD O=C(NCc1ccccc1O)NC[C@@H]1CCCCS1 753151105 NAUBPAZYKXWFPN-LBPRGKRZSA-N 280.393 2.477 10 20 CECD C[C@@H]1CCN(C(=O)c2cc(O)cs2)C[C@@H]1n1ccnc1 759469551 LQYUCGXBKDZYHD-PWSUYJOCSA-N 291.376 2.374 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2[nH]c(C)nc2C)c1 857117347 ZNTPUMLCMJTSAV-MRVPVSSYSA-N 289.335 2.232 10 20 CECD COC1(C)CN(Cc2c(O)cccc2Br)C1 862369431 UBYWUDYOVVNUCI-UHFFFAOYSA-N 286.169 2.375 10 20 CECD COc1ccc(O)c(CN[C@H](CO)CCC(C)C)c1 862481118 SHARPPBRMVUJHZ-ZDUSSCGKSA-N 267.369 2.288 10 20 CECD CCN(C)c1ccc(CN2CCO[C@@H]3COCC[C@@H]32)cc1 933966352 MMWAUOVVEFYPSN-DLBZAZTESA-N 290.407 2.132 10 20 CECD O=C(CCc1cn[nH]c1)NCc1c(O)ccc2c1CCCC2 863888040 DPZJVOSYABOHFS-UHFFFAOYSA-N 299.374 2.243 10 20 CECD C[C@H](N[C@@H]1COC[C@@H]1O)c1ccc(Cl)c(Cl)c1O 866420369 OWWPCNURXXSAJR-QUNWWBBNSA-N 292.162 2.109 10 20 CECD CC1(F)CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 871074182 CXBWFKKIBRHKRP-HWKANZROSA-N 279.311 2.462 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCC[C@@H]2CCO)c1 875515518 PYDIRVSXMNMUAH-TZMCWYRMSA-N 292.379 2.051 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](n3ccnc3)C2)c1 775674885 NOUGLGFPFSVKIC-CQSZACIVSA-N 287.363 2.434 10 20 CECD CCCN1CCCN(Cc2c(C)cccc2O)CC1=O 877470250 AEHKOBVEXREXHK-UHFFFAOYSA-N 276.380 2.145 10 20 CECD O=C(NCCSCC(F)(F)F)c1cc(O)cs1 770403856 BQJICNKXXAMTKQ-UHFFFAOYSA-N 285.312 2.479 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1 886573954 FQCUZWJLVSAHFX-UAGQMJEPSA-N 274.408 2.345 10 20 CECD CC(C)(NC(=O)/C=C\c1ccc(O)c(O)c1)C1CC1 779523692 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USTGDMQSACGPHM-VMPITWQZSA-N 299.326 2.436 10 20 CECD COc1ncccc1CN(C)Cc1ccccc1O 193426197 XOMVIGSVNICINE-UHFFFAOYSA-N 258.321 2.428 10 20 CECD COc1cccc(CN[C@H]2CCCC[C@@H]2N(C)C)c1O 1319832595 BMKAFSNIKSBLJS-KBPBESRZSA-N 278.396 2.363 10 20 CECD CC(C)N(C)C(=O)C1CCN(Cc2ccc(N)cc2)CC1 1262487521 WADJPLIEDDGFKU-UHFFFAOYSA-N 289.423 2.348 10 20 CECD CCc1cccc(CN(CC(=O)O)C(C)C)c1O 1603975056 BULPNSLQEYNVJX-UHFFFAOYSA-N 251.326 2.250 10 20 CECD C[C@@H](N[C@@H]1CC=C(C(=O)O)C1)c1c(O)cccc1F 1604331015 SYDYYYVVJALTHI-PSASIEDQSA-N 265.284 2.355 10 20 CECD C[C@@]1(C(=O)NCc2cccc(O)c2O)C[C@@H]2C[C@@H]2C1 1548791494 FGHGMCJUHNEJRW-HBYGRHMLSA-N 261.321 2.150 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2C[C@@H](O)C2(C)C)c1 228847866 OMBBBZUMIWSVCO-QCZZGDTMSA-N 265.353 2.211 10 20 CECD CCCC[C@@H](OC(=O)c1ccc(C)c(O)c1O)C(=O)O 1595645856 VPIAZBMCLXUBEJ-SNVBAGLBSA-N 282.292 2.206 10 20 CECD CN(C)c1ccc(CN[C@@H](CC2CCC2)C(=O)O)cc1 1777039546 HPUBYSWGRWLSNJ-HNNXBMFYSA-N 276.380 2.486 10 20 CECD C[C@H](CNCc1cc(Br)ccc1O)N(C)C 163889068 PPNSKYLRDJPJBO-SECBINFHSA-N 287.201 2.194 10 20 CECD COc1cc(O)c(CN(C)C[C@@H]2CCCOC2)cc1OC 160162793 QEMLRAJTALPQJB-LBPRGKRZSA-N 295.379 2.268 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 156689506 KHHFQEYNAPNFDA-SMDDNHRTSA-N 274.364 2.196 10 20 CECD CCN(C)C(=O)NCCCSc1nccs1 154570323 HPIXXDRKKDPYQX-UHFFFAOYSA-N 259.400 2.287 10 20 CECD CCCN1CCC(NCc2cc(OC)ccc2O)CC1 20190172 DKWWBKAUEHCPKT-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CCOc1cccc(CN2CCC[C@@H]([C@H](C)N)C2)c1O 250517445 PNSSTLQJRWWKIR-QWHCGFSZSA-N 278.396 2.350 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@H]1CN 253202412 YVVYBSYCBBGLND-UKRRQHHQSA-N 261.413 2.169 10 20 CECD CO[C@@H](C)CCNCc1ccc(N2CCOCC2)cc1 313341654 MPDCIGMZMPLBQL-AWEZNQCLSA-N 278.396 2.038 10 20 CECD CCC1(CN[C@H](C)c2cc(OC)ccc2O)COC1 393971422 NCGQDIAFDOCYGZ-LLVKDONJSA-N 265.353 2.478 10 20 CECD COc1ccc2c(c1)CCCN2CN1C(=O)CC1(C)C 1341423993 HZSJMYFRBCXIDI-UHFFFAOYSA-N 274.364 2.416 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H](CO)SC)cc1C 219070419 MJDOZKVMJSMPLJ-SMDDNHRTSA-N 269.410 2.206 10 20 CECD C[C@H]1CN(C)CC[C@@H]1N(C)Cc1cc(F)ccc1O 290599279 VUXCMXPXPHQSAF-FZMZJTMJSA-N 266.360 2.303 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](CO)C2)cc1 92764802 UQOBDTLNNCKDOU-HNNXBMFYSA-N 262.397 2.347 10 20 CECD CN1CC[C@@H]2CCN(Cc3ccc(N(C)C)c(F)c3)[C@@H]2C1 272661927 ROGNXQDOMWYEJP-RHSMWYFYSA-N 291.414 2.418 10 20 CECD CCOC(=O)[C@@H](C)[C@@H](C)NCc1ccc(N(C)C)cc1 283068942 JXUCXVCVBKRJCT-QWHCGFSZSA-N 278.396 2.430 10 20 CECD Nc1ccc(NCc2ccccc2O)c([N+](=O)[O-])c1 804398610 MQCNFKJBMDSSKC-UHFFFAOYSA-N 259.265 2.495 10 20 CECD CC(C)n1cnnc1CN(C)Cc1cc(F)ccc1O 292222746 AINDGAVQMZNAKA-UHFFFAOYSA-N 278.331 2.336 10 20 CECD CC(C)C1(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 294064335 ZHTUZOZUQAUSLT-GQCTYLIASA-N 261.321 2.416 10 20 CECD COc1cccc(CN2CCC[C@H]3CN(C)CC[C@H]32)c1O 290641802 YMXYPIUKZUZQMM-DZGCQCFKSA-N 290.407 2.317 10 20 CECD C[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)[C@@H]1CCCOC1 817942900 RHUPOXDBRBVTNB-YSVLISHTSA-N 291.439 2.157 10 20 CECD CCCC(=O)N(CC(=O)OCC)Cc1ccccc1O 819695217 VJEDKWXXSMLLOZ-UHFFFAOYSA-N 279.336 2.084 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCSC1 813513368 LTIFCJDSEZCXGQ-ZYHUDNBSSA-N 295.404 2.288 10 20 CECD C[C@H](N)C[C@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 817891449 KLWQLXVBCOAMGD-KKUMJFAQSA-N 291.439 2.300 10 20 CECD C[C@@H](CNCc1cc(Cl)cc(F)c1O)N(C)C 824988592 OPOQLNBULSIRFP-QMMMGPOBSA-N 260.740 2.224 10 20 CECD CCN(CC)c1ccc(CNC(=O)Cc2ncc[nH]2)cc1 822607224 FLUULIQTPZJPMT-UHFFFAOYSA-N 286.379 2.115 10 20 CECD C[C@@H](CNC(=O)c1cc(O)cs1)N1CCCC[C@H]1C 732271201 QRFLTHLODUJGOC-MNOVXSKESA-N 282.409 2.446 10 20 CECD O=C(NCCOC1CCCC1)c1cc(O)cs1 732274468 TXLRVFUOJILHLU-UHFFFAOYSA-N 255.339 2.143 10 20 CECD COCC1(C(=O)NCc2cc(OC)ccc2O)CCCC1 837483421 AEZZHTZLYXVVBN-UHFFFAOYSA-N 293.363 2.224 10 20 CECD CC[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)C1 841047599 RJWPNYJYGOLOMD-BXUZGUMPSA-N 289.379 2.292 10 20 CECD CN(C)[C@@H]1CCC[C@H](NC(=O)c2cc(O)cs2)C1 749544853 QBUGMXGGHXGXOT-VHSXEESVSA-N 268.382 2.056 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@]1(C(=O)O)CC=CCC1 846706065 LRTSZZPNZKDNSS-MRXNPFEDSA-N 289.331 2.162 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CS[C@@H](C)C2)c1O 840958573 MVFZRZVMPHVVHY-WCBMZHEXSA-N 298.364 2.293 10 20 CECD O=C(COC(=O)C1CCCCC1)c1ccc(O)c(O)c1 916589887 CGECNPMNBDTBND-UHFFFAOYSA-N 278.304 2.404 10 20 CECD CC(C)CN(C(=O)C(=O)Nc1ccc(N)cc1)C(C)C 841100019 RXUOYQDLVAFEJL-UHFFFAOYSA-N 277.368 2.100 10 20 CECD COc1cccc([C@H](C)NC[C@@H]2CCOC[C@@H]2OC)c1O 846170737 ZFANGVDXMVWEAY-HUBLWGQQSA-N 295.379 2.103 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2Cc3ccccc32)c1 743410748 PBPLAUYFMJRMAM-HNNXBMFYSA-N 283.327 2.357 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H](N)[C@@H](C)C2)c1O 843353771 PSCNPJKPLVRVNW-XPTSAGLGSA-N 296.798 2.417 10 20 CECD COC[C@H](C)CC(=O)NCc1ccc(N(C)C)cc1 755060789 ORBDQJFYMMLWLH-GFCCVEGCSA-N 264.369 2.041 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](C)S(C)(=O)=O)c(O)c1C 756770262 VHQWWBUATGECTC-ZYHUDNBSSA-N 285.409 2.093 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1cc(Cl)ccc1O 759174912 ZTDFIXSNHLWKOU-TZMCWYRMSA-N 285.771 2.329 10 20 CECD CC[C@@H](N[C@H](C)C(=O)N(C)OC)c1ccc(N(C)C)cc1 858586727 JTOREOPWOQPTOA-IUODEOHRSA-N 293.411 2.202 10 20 CECD C[C@H]1COC[C@H]1NCCCSc1nccs1 925101785 JSPHGDNTVKLRTL-VHSXEESVSA-N 258.412 2.250 10 20 CECD CC(=O)NC1CCC(N(C)Cc2ccccc2O)CC1 753590373 MRXDQHDFADJZQT-UHFFFAOYSA-N 276.380 2.271 10 20 CECD CC(C)(O)C(=O)NCc1ccc(N2CCCCC2)cc1 756819353 PLKWOBIYSNRFOR-UHFFFAOYSA-N 276.380 2.064 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2csc(C)n2)c1 862761135 FXIBYDJTTNSIRX-UHFFFAOYSA-N 276.361 2.324 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCCCO)cc1 864927742 ZAGZGQIENBOIKF-UHFFFAOYSA-N 278.396 2.312 10 20 CECD CNC[C@H](C)CNCc1ccc(N2CCCC2)cc1 1117953812 QQLVZDCEQKPLPS-AWEZNQCLSA-N 261.413 2.232 10 20 CECD Cc1ccc(CN2CCC(F)(F)[C@@H](CO)C2)c(O)c1 877541707 LEOMJCNFRPLDFP-GFCCVEGCSA-N 271.307 2.150 10 20 CECD CC(C)Nc1ccccc1NCCCS(C)(=O)=O 871845442 AWXINOVSYRWGLL-UHFFFAOYSA-N 270.398 2.354 10 20 CECD CC[C@@H](OC)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773006727 FHBYZSNZKBXSGS-SMDDNHRTSA-N 264.369 2.355 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H]2CCO)c1 779203153 ZXGSXPLHJBSUDK-CYBMUJFWSA-N 265.353 2.138 10 20 CECD Cc1ccc(CNCCc2nccnc2C)c(O)c1 877552275 MQCORLYMGWHMFU-UHFFFAOYSA-N 257.337 2.131 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)N[C@H](C)c1ccccc1O 879649034 JURGEQLKMRCNIW-TUAOUCFPSA-N 264.369 2.346 10 20 CECD C[C@@H](NCCN1CCSCC1)c1c(O)cccc1F 886526476 MVJRXKVHEWXTIW-LLVKDONJSA-N 284.400 2.231 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCC[C@H](CF)C1 881599555 BVZVSNNQYWNMRY-MRVPVSSYSA-N 271.263 2.059 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CC1)c1c(O)cccc1F 886607131 LMAMVCXKQSSUPX-DYBLOJMWSA-N 271.357 2.093 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(OCC)ccc2O)C1 896962948 UHBKIDBVLHRNCD-LBPRGKRZSA-N 293.363 2.176 10 20 CECD Cc1ncoc1CN1CCOc2cc(N(C)C)ccc21 894472650 ZJMVDPDTIKBMMQ-UHFFFAOYSA-N 273.336 2.448 10 20 CECD Cc1ncccc1CCNCc1cc2c(cc1O)OCO2 898256579 CWRKPIYDZLUONQ-UHFFFAOYSA-N 286.331 2.157 10 20 CECD COc1cc(Cl)cc(CN2C[C@H]3COC[C@H]3C2)c1O 718145072 GSHWCCPPNUVCQJ-PHIMTYICSA-N 283.755 2.132 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1c1ccccn1 790574822 STXOYSBTWOVGEU-ZDUSSCGKSA-N 284.315 2.470 10 20 CECD COCCOCCCCNCc1cc(F)cc(F)c1O 708408015 BSHMEJAFBZEUDR-UHFFFAOYSA-N 289.322 2.203 10 20 CECD CN(C)c1ccc(CN[C@@H](Cc2ccco2)C(=O)O)cc1 1320748790 KNOORDWABBONMT-HNNXBMFYSA-N 288.347 2.131 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H]1CO[C@@H](C)C1 1326784047 PYGDCPFLRSJVNF-JSGCOSHPSA-N 291.395 2.038 10 20 CECD CN(C)[C@H]1CCCC[C@@H]1NC(=O)c1cc(O)cs1 1350552921 JVVMWGOKKCCREG-QWRGUYRKSA-N 268.382 2.056 10 20 CECD CC(C)Cn1cccc(C(=O)NCc2ccc(N)cc2)c1=O 1524018974 PPWZBOHNEBKCOE-UHFFFAOYSA-N 299.374 2.017 10 20 CECD O=C(O)c1coc(CNCc2ccc(F)c(F)c2O)c1 1608989479 NPROVRAOLXNUDJ-UHFFFAOYSA-N 283.230 2.251 10 20 CECD O=C(O)c1cnc(SCC(=O)C2CCC2)s1 1610863022 QCYYSIOCORLVDP-UHFFFAOYSA-N 257.336 2.303 10 20 CECD Oc1ccc(F)cc1CNCCCN1CCCC1 226619137 TURMJKXHUDGTGC-UHFFFAOYSA-N 252.333 2.107 10 20 CECD COc1cccc(CNC2(CC(=O)O)CCCC2)c1O 1599674173 LARBZUIHKJZVBO-UHFFFAOYSA-N 279.336 2.278 10 20 CECD CC[C@H](N[C@@H](C)C1CC1)c1cccc(-c2nn[nH]n2)c1O 1590471365 CZBQKPFQDLHYIH-ZANVPECISA-N 287.367 2.412 10 20 CECD CN(C)c1ccc(CN=c2cc[nH]c(C(=O)O)c2)cc1F 1777040342 NYQUSYIENUAMHX-UHFFFAOYSA-N 289.310 2.019 10 20 CECD C[S@@](=O)C1(CNCc2c(O)cccc2Cl)CCC1 280710185 UAUDVUWIIGRWAF-GOSISDBHSA-N 287.812 2.436 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)[C@H]1CCCCN1 817902848 ZKQSRGFBQONGEZ-IUODEOHRSA-N 260.381 2.242 10 20 CECD C[C@@H](O)CN(Cc1ccccc1)C(=O)Cc1ccc(N)cc1 830290958 GUUMJAOZEIXENK-CQSZACIVSA-N 298.386 2.221 10 20 CECD CCC[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)O 900023379 WQNAQKRRKLCKGE-CYBMUJFWSA-N 263.337 2.355 10 20 CECD Cc1csc(CNC(=O)c2ccc(C)c(O)c2O)n1 177665666 FJTVYICVRSPFMG-UHFFFAOYSA-N 278.333 2.101 10 20 CECD Cc1cccc(N(C)C(=O)/C=C/c2cccnc2)n1 118666191 RDPUMNPUKWMOJC-CMDGGOBGSA-N 253.305 2.461 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(C#N)c1 183463208 IMCHZQZSQONECU-NSHDSACASA-N 296.326 2.330 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2cc(OC)ccc2O)C1 185787881 YTIBJUGELYAXCX-NWDGAFQWSA-N 292.379 2.062 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H](C)c1cc(C)ccc1O 185510842 ASDMJINHUITFHY-JTNHKYCSSA-N 269.410 2.464 10 20 CECD C[C@H](CN[C@H](C)c1ccc(F)cc1O)CN1CCOCC1 185504849 OFELBBKJPNZENZ-CHWSQXEVSA-N 296.386 2.150 10 20 CECD Cc1ccc(C(=O)N[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c(O)c1O 182818818 AMOOOVSWESBBRV-QLFBSQMISA-N 295.338 2.474 10 20 CECD Cc1cnc(NCCc2ccc(O)c(O)c2)c([N+](=O)[O-])c1 85689432 SZAREOASFYBUEC-UHFFFAOYSA-N 289.291 2.364 10 20 CECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 135201707 RUEGBRCWRXPLAD-GDBMZVCRSA-N 290.407 2.038 10 20 CECD c1cc(CCNCc2ccc3c(c2)CCO3)ccn1 48262230 DBSUPLVLTAZPSZ-UHFFFAOYSA-N 254.333 2.349 10 20 CECD CN(C)c1ccc(CNC(=O)C2(N)CCCCC2)cc1F 237081719 JNEVSHSOLPGFDV-UHFFFAOYSA-N 293.386 2.170 10 20 CECD CCc1nc([C@H](C)N[C@H](C)c2ccccc2O)n[nH]1 272863013 NGUIDJMYMNKTCU-ZJUUUORDSA-N 260.341 2.485 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)CC(C)(C)O)c1 295057305 NZELKLBJIGYBBC-NSHDSACASA-N 267.369 2.430 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H](O)c2cnn(C)c2)c(O)c1 294841728 RXRYWQUENNHJCK-DOMZBBRYSA-N 289.379 2.127 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN(C2CC2)C2COC2)c1O 296005058 LCWHJEHTGFDLPZ-UHFFFAOYSA-N 298.726 2.317 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCc3cccnc32)cc1 819810142 ZHIPWLRBQKZAIM-MRXNPFEDSA-N 295.386 2.494 10 20 CECD C[C@H](NC[C@H]1CCCCN1)c1cc(F)ccc1O 817950800 ZGECGCNAYHRQBA-CMPLNLGQSA-N 252.333 2.324 10 20 CECD CCn1cc([C@H](C)NCCc2ccc(N)cc2)cn1 817955916 LESJHHSAMQRNAT-LBPRGKRZSA-N 258.369 2.379 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@@H](C)c1cc(C)ccc1O 724873380 PHPOSPFCSHUDPI-NJZAAPMLSA-N 265.353 2.155 10 20 CECD C[C@@H](NC(=O)C[C@@H](C)n1ccnc1)c1ccccc1O 827952375 PWLZQQSKUFKFQT-VXGBXAGGSA-N 273.336 2.417 10 20 CECD COc1cccc(CNC(=O)/C=C\c2ccc[nH]2)c1O 588549211 HCYZFLAYERXNQC-FPLPWBNLSA-N 272.304 2.059 10 20 CECD CCN(CC)c1ccc(CN[C@H]2C[C@H](N)C2)cc1F 906508770 ZJCFUKIEBFENAH-JOCQHMNTSA-N 265.376 2.251 10 20 CECD C/C=C/C(=O)NCc1ccc(N2CCSCC2)cc1 737803598 DCSKPLMAFWNPRR-NSCUHMNNSA-N 276.405 2.432 10 20 CECD CCOC(=O)CN1CCCc2cc(OC)cc(OC)c21 839655673 VPSSIRKOPDMJIU-UHFFFAOYSA-N 279.336 2.020 10 20 CECD CO[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C12CCC2 834555498 YKJLSXXWQVJXNT-ZIAGYGMSSA-N 292.335 2.348 10 20 CECD O=C(O)CN(Cc1ccccc1O)C(=O)C1=CCCCC1 911485350 YNUUFHJOCNSKFT-UHFFFAOYSA-N 289.331 2.306 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC[C@H]2C[C@H]3CC[C@H]2O3)c1 839162860 DDVAGMCJSZFZEQ-PSOPSSQASA-N 292.335 2.348 10 20 CECD C[C@@H](NCCN1C[C@@H]2CC[C@H](C1)O2)c1cc(F)ccc1O 834892241 QUQDFQSLFZAMOR-BNOWGMLFSA-N 294.370 2.045 10 20 CECD Cc1cccc2c1N(C(=O)/C=C\c1cnn(C)c1)CC2 916406651 KFODLSZGZKISCM-SREVYHEPSA-N 267.332 2.331 10 20 CECD CCCn1cccc1/C=C1/SC(=S)NC1=O 918184258 JFTAKYWDZFGHGK-VQHVLOKHSA-N 252.364 2.387 10 20 CECD C[C@@H]1C[C@H](NCc2cccc(Br)c2O)CCN1 841061543 JYCXQJKCLMUKCL-MWLCHTKSSA-N 299.212 2.385 10 20 CECD CC[C@H](N[C@H](CO)CCF)c1ccc(F)cc1O 846207527 CRSKRGHODKRBLJ-JQWIXIFHSA-N 259.296 2.293 10 20 CECD CC(C)NC(=S)NCc1ccc(N2CC=CC2)cc1 740632480 SPHOTTXPONJDON-UHFFFAOYSA-N 275.421 2.435 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1ccc(N(C)C)c(F)c1 843122058 OTBZKCVWRAHWOI-STQMWFEESA-N 283.366 2.024 10 20 CECD C[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)CCC1(F)F 841956774 HPJYQNGMMWPWSW-LLVKDONJSA-N 297.349 2.498 10 20 CECD CCOc1ccc(CNC[C@@H](C(=O)O)C(C)C)c(O)c1 848639356 IPEINWLARSXSDQ-CYBMUJFWSA-N 281.352 2.237 10 20 CECD CO[C@@H](CC(C)C)C(=O)NCc1ccccc1O 841403780 HTOOQTNESJIFKQ-ZDUSSCGKSA-N 251.326 2.070 10 20 CECD CN(C(=O)C(=O)Nc1ccc(N)cc1)C1CCCCCC1 841012794 FSMQROKBHZJBOU-UHFFFAOYSA-N 289.379 2.389 10 20 CECD CCN(CC)c1ccc(CN(C)CCC(=O)N(C)C)cc1 920207008 SWGVWKHCROYGRE-UHFFFAOYSA-N 291.439 2.443 10 20 CECD CCN(C)c1ccc(CN2CCSC[C@@H]2C(=O)O)cc1 851705513 OIUQCMHFNLYBNO-CQSZACIVSA-N 294.420 2.145 10 20 CECD COc1ccc(O)c(CNC(=O)c2ncccc2C)c1 750236767 SDTAQHWIHRJGEF-UHFFFAOYSA-N 272.304 2.034 10 20 CECD CC(C)(C)N1CC[C@@H](NCc2cc3c(cc2O)OCO3)C1 850350260 ABTBNUJSDSNPNO-GFCCVEGCSA-N 292.379 2.083 10 20 CECD CC(C)(C)OC(=O)C(C)(C)NC(=O)c1cc(O)cs1 863376039 MRLZZVZHTWXKSS-UHFFFAOYSA-N 285.365 2.304 10 20 CECD C[C@@H]1C[C@@H](NCC(F)(F)CO)c2c(O)ccc(F)c21 768285119 DVKWCTYIDNOBGG-VXNVDRBHSA-N 275.270 2.297 10 20 CECD O=C(c1cc(O)cs1)N1CCSC2(CCOCC2)C1 771742279 DEQZAOIZCQKNSB-UHFFFAOYSA-N 299.417 2.192 10 20 CECD CCOC(=O)[C@@H](F)C1CN(Cc2ccc(C)cc2O)C1 877549703 HGJZRBCAAHCXRC-AWEZNQCLSA-N 281.327 2.034 10 20 CECD CC[C@@H](C(=O)N(C)c1ccc(N)cc1)N(CC)CC 877077957 XATLKIAJDNTFNG-AWEZNQCLSA-N 263.385 2.352 10 20 CECD COc1ccc(N(C)Cc2ccn(C)n2)cc1OC 775950326 ZXAWZCHPCQHZSM-UHFFFAOYSA-N 261.325 2.074 10 20 CECD C[C@@H](N[C@@H]1CCCN(CCCO)C1)c1c(O)cccc1F 886615408 FTAVUXBOCIECKW-CHWSQXEVSA-N 296.386 2.029 10 20 CECD C[C@H](N[C@@H]1CCc2n[nH]cc2C1)c1c(O)cccc1F 886551051 ANEYMLQKXCWKKY-GXSJLCMTSA-N 275.327 2.463 10 20 CECD COCCN(C)CCCN[C@H](C)c1c(O)cccc1F 886503044 ZWADWXFPSPYHNM-GFCCVEGCSA-N 284.375 2.150 10 20 CECD COc1ccc(CN2CCC[C@H](F)C2)c(O)c1OC 895192062 WYJLOKAIIXFUGY-NSHDSACASA-N 269.316 2.343 10 20 CECD CC[C@@](C)(CO)NCc1ccc(Br)cc1O 701016559 WISMKHWSZKGNOG-LBPRGKRZSA-N 288.185 2.405 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(N)s1 720156622 WRIDKXIYQXYWNM-UHFFFAOYSA-N 290.392 2.064 10 20 CECD O=C(OC[C@@H]1CCC[C@@H](O)C1)c1cc(O)cs1 795401746 INWUMYSEGAVAKE-RKDXNWHRSA-N 256.323 2.162 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@H]2CCO)cc1 189948402 UXEKRKWETWBVGB-HOCLYGCPSA-N 262.397 2.393 10 20 CECD C[C@H](O)CCNCc1c(O)cccc1Br 706828531 GQMNVDBWHWKGBA-QMMMGPOBSA-N 274.158 2.015 10 20 CECD c1cc(N2CCCC2)ccc1CN1CCn2cncc2C1 1204320867 BRJITJCYJORPTM-UHFFFAOYSA-N 282.391 2.499 10 20 CECD CC[C@H](N[C@H]1CCCN(C)C1=O)c1ccc(C)cc1O 794800016 BFEMEYPHCDPTPZ-KBPBESRZSA-N 276.380 2.362 10 20 CECD CC(C)[C@@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 795767463 HKVVLLFTCWNCMY-MRXNPFEDSA-N 290.407 2.310 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2N[C@H](C)C(=O)N(C)C 1320252537 GVCYOPSCDPAFQH-QJPTWQEYSA-N 276.380 2.315 10 20 CECD CN(C)c1ccc(CNCc2csnn2)cc1F 1329273227 JJNFDFPFHDTAGW-UHFFFAOYSA-N 266.345 2.033 10 20 CECD Cc1nc([C@@H](C)NCc2ccc3c(c2)CCO3)no1 1325733205 HSXIJGKDKPGCMU-SECBINFHSA-N 259.309 2.164 10 20 CECD Cc1cc(C)c(C(=O)NCc2cccc(O)c2O)c(C)n1 1352672304 VAKNMSIZFZCKLT-UHFFFAOYSA-N 286.331 2.348 10 20 CECD Cc1ccc(CN[C@@H](Cc2ccccc2)C(=O)O)c(O)c1 1605278060 YJZBCUZLBJWRHW-HNNXBMFYSA-N 285.343 2.486 10 20 CECD CC[C@H](NC[C@@H](C)C(=O)O)c1ccc(C)cc1O 1603585366 AOAOOFSKGGHCKP-PWSUYJOCSA-N 251.326 2.462 10 20 CECD CC[C@@H](NC[C@@H](C)N1CCN(C)CC1)c1ccccc1O 155687993 LEBVTBTZWHBWSI-GDBMZVCRSA-N 291.439 2.069 10 20 CECD COc1cccc(O)c1CNCCC[C@@H]1CCOC1 825134089 UYQIKOVARYMCQZ-GFCCVEGCSA-N 265.353 2.307 10 20 CECD OCC1(CNCc2ccc3c(c2)CCO3)CCCC1 135067285 RTFNGFQWMYXZBK-UHFFFAOYSA-N 261.365 2.264 10 20 CECD Oc1ccc(Cl)cc1CNC[C@@H](O)C1CCC1 316653298 WEDAOYCYECFGLP-CYBMUJFWSA-N 255.745 2.296 10 20 CECD COC(=O)CCCCN(C)c1ccc(OC)cc1 707502272 XOCKUUDFUFJRND-UHFFFAOYSA-N 251.326 2.475 10 20 CECD Oc1cccc2c1[C@@H](N[C@H]1CCN(C3CC3)C1)CC2 389088050 FYPYJFSWNCJGBK-JSGCOSHPSA-N 258.365 2.206 10 20 CECD C[C@H](N[C@@H](CCO)C(F)(F)F)c1cc(F)ccc1O 886801137 IHXATXAAHRIXGV-CPCISQLKSA-N 281.249 2.495 10 20 CECD CC(C)N(C(=O)CN(C)Cc1ccccc1O)C(C)C 109773393 QULDTGKWMLIDCT-UHFFFAOYSA-N 278.396 2.469 10 20 CECD Oc1ccccc1CNC[C@@H](O)c1ccc(F)cc1 60358328 IOBXNZYMZQFRMR-OAHLLOKOSA-N 261.296 2.355 10 20 CECD C[C@H]1C[C@H]1C(=O)N1CCOc2cc(N(C)C)ccc21 173200837 JKJCRVLNFXDAEW-CMPLNLGQSA-N 260.337 2.134 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1ccn[nH]1 121663734 SLTACDRFFLAAHD-UHFFFAOYSA-N 273.336 2.097 10 20 CECD CCC[C@@H](C)C(=O)NCc1cc(OC)ccc1O 78726258 MOBDBGIYISGUAG-SNVBAGLBSA-N 251.326 2.453 10 20 CECD COc1cc(Cl)cc(CN2CCC(C)(O)CC2)c1O 184695024 SOHFUSOREJJSIR-UHFFFAOYSA-N 285.771 2.401 10 20 CECD COCCN(C)CCN[C@H](C)c1cc(Cl)ccc1O 185314965 YEZTYMBLHPDLHZ-LLVKDONJSA-N 286.803 2.274 10 20 CECD Oc1ccc(F)cc1CN1CC[C@@H]([C@H]2CCOC2)C1 361050583 HRSKWOYHYXLUSD-NEPJUHHUSA-N 265.328 2.390 10 20 CECD CCCN(CC(=O)N(C)C)Cc1cccc(OCC)c1O 133667605 DMUZKYQOXGISRA-UHFFFAOYSA-N 294.395 2.091 10 20 CECD 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CCN1CCN(CCCN[C@H](C)c2ccccc2O)CC1 183416263 UEWZQBPZJUVEJE-OAHLLOKOSA-N 291.439 2.070 10 20 CECD CCC[C@H](NCc1ccc(OC)c(C)c1)C(=O)O 86733431 SSSAWXPGCAEOLI-LBPRGKRZSA-N 251.326 2.347 10 20 CECD CCOc1cccc(CNCCC[C@@H](C)O)c1O 227959759 QIGGKAFDIYPRIF-LLVKDONJSA-N 253.342 2.042 10 20 CECD O=C(NCc1ccccc1O)c1cccc(Cl)n1 134039277 NWSDQFWSHIRYNF-UHFFFAOYSA-N 262.696 2.371 10 20 CECD COc1ccc(O)c(CN[C@]2(C)CCO[C@H]2C)c1 230392184 RNMATMBKPUEZEK-IINYFYTJSA-N 251.326 2.058 10 20 CECD COCCN(Cc1cccc(OC)c1O)CC(F)F 92966219 RKPBQMFKHUKSST-UHFFFAOYSA-N 275.295 2.114 10 20 CECD CCC(=O)N1CCCN(Cc2cc(Cl)ccc2O)CC1 92186985 JYHBWTNZQZRFCQ-UHFFFAOYSA-N 296.798 2.490 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1[C@H]2C=CC[C@H]1CC2 368024813 YBQXQABBQZTSQH-WRQQAGDVSA-N 271.316 2.431 10 20 CECD Cc1n[nH]cc1CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273538223 XRJZJYKIGPGOME-VIFPVBQESA-N 276.296 2.183 10 20 CECD CO[C@@]1(C)C[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1(C)C 276610537 PNLOPYSXZDKXGE-BMIGLBTASA-N 297.326 2.170 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](c3nccn3C)C2)cc1 368133342 IQMKOZPALLAJOR-OAHLLOKOSA-N 284.407 2.476 10 20 CECD Cc1cccc(CN[C@@H]2COc3ccccc3[C@@H]2O)c1O 368133454 URJYARALXSUHDQ-PBHICJAKSA-N 285.343 2.285 10 20 CECD COc1cccc(CNC(=O)c2cc(C3CC3)no2)c1O 281862891 DPLWSNBPLZFLKL-UHFFFAOYSA-N 288.303 2.196 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@H]2[C@H]2CCCO2)c1 377709399 YVMQGJYUPPSPBE-GOEBONIOSA-N 277.364 2.080 10 20 CECD CN(C)CCCN(C)Cc1ccc(N(C)C)c(F)c1 809729838 PPDWJEMDIULBAN-UHFFFAOYSA-N 267.392 2.275 10 20 CECD C[C@H](C(=O)O)N(C)Cc1cc2c(cc1O)CCCC2 819888311 AMRKNHYZMJRLBH-SNVBAGLBSA-N 263.337 2.176 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](O)CSC)cc1 818965036 ODNDLIYPANDELL-OAHLLOKOSA-N 282.453 2.346 10 20 CECD CCc1c(C(=O)NCc2ccc(OC)cc2O)ccn1C 811485023 SZQWAXHUDKAOIA-UHFFFAOYSA-N 288.347 2.232 10 20 CECD CCOC1(C(=O)N[C@H](C)c2ccccc2O)CCOCC1 827956858 PSPDQXDQPFHKPU-GFCCVEGCSA-N 293.363 2.155 10 20 CECD Cc1cc(C)cc(N(C)C(=O)c2c(C)c[nH]c2CC(N)=O)c1 900294965 PUTRAFVQCHLBLJ-UHFFFAOYSA-N 299.374 2.244 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)CNC)cc1 826019450 FPYDJSHGDTXZOA-CQSZACIVSA-N 291.439 2.347 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@H]1CCc2cccc(O)c21 834880484 FWTIHGWCBOWIKO-KCQAQPDRSA-N 277.364 2.021 10 20 CECD C[C@@H](NCC1(N)CC1)c1cc2c(cc1O)CCCC2 902407830 VQJZJHGWOHKFOI-LLVKDONJSA-N 260.381 2.413 10 20 CECD C[C@@H](NC(=O)[C@]1(C(=O)O)CC1(C)C)c1ccccc1O 902516197 BZZFDPYLIWYBBQ-PSLIRLAXSA-N 277.320 2.070 10 20 CECD Cc1nc(COC(=O)c2cc(O)cs2)oc1C 732353980 MPESGVGLKTYYSY-UHFFFAOYSA-N 253.279 2.416 10 20 CECD Cc1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)nn1 839693292 TYQYAKTUWKIVTK-UHFFFAOYSA-N 297.358 2.299 10 20 CECD CN(C)c1ccc(CNCC(C)(C)C(=O)O)cc1F 901507594 ZZRJEIUEAGZPDT-UHFFFAOYSA-N 268.332 2.092 10 20 CECD Nc1ccc(CCNC(=O)c2conc2C2CC2)cc1 832659256 WUDBSYLDGUIGCX-UHFFFAOYSA-N 271.320 2.107 10 20 CECD CCCCCC(=O)OCC(=O)c1ccc(O)c(O)c1 916589896 FFVIKWCJVOEBJI-UHFFFAOYSA-N 266.293 2.404 10 20 CECD CCN(Cc1nc(C(C)(C)N)no1)c1ccc(OC)cc1 843357876 SFBVUBCDBHKLIN-UHFFFAOYSA-N 290.367 2.299 10 20 CECD CN(C)c1ccc(CN2CCCCC[C@H]2CO)cc1 847014461 JOHXXSWFTJHYCE-INIZCTEOSA-N 262.397 2.490 10 20 CECD CNC(=O)CCCN(C)Cc1ccc(N(C)C)cc1C 840917476 PEKXUQGCDSXGOJ-UHFFFAOYSA-N 277.412 2.019 10 20 CECD CCOC(=O)c1coc(NCc2ccc(OC)cc2O)n1 842039185 KWHKVMWSGMNENZ-UHFFFAOYSA-N 292.291 2.178 10 20 CECD COC1CC(C(=O)NCc2ccc(N3CCCC3)cc2)C1 858451798 CHMIORPUYDCPBO-UHFFFAOYSA-N 288.391 2.328 10 20 CECD C[C@H]1COC(C)(C)CN1C(=O)/C=C\c1ccc(O)c(O)c1 754753000 KRCUEKFFXYWWOE-XOIDGJRKSA-N 291.347 2.137 10 20 CECD C[C@H](NCCSCCCO)c1cc(F)cc(F)c1O 756542679 LGUDWILLZAPJOR-VIFPVBQESA-N 291.363 2.437 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nocc1C 935943669 CWCVNXGVRFYFFE-UHFFFAOYSA-N 281.308 2.104 10 20 CECD Cc1ccc([C@H](O)CNCc2c(C)cccc2O)o1 877060306 WTKAUKVAOKOWLS-CQSZACIVSA-N 261.321 2.425 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@@H](c1ccc(O)c(O)c1)N2 877862488 WYHMIJVMHOMKAO-AWEZNQCLSA-N 270.288 2.260 10 20 CECD C[C@H](NCCC(C)(C)O)c1cc(F)cc(F)c1O 775586485 QEHRJYJZYUXESW-QMMMGPOBSA-N 259.296 2.482 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2c(C)cccc2O)C1 877591550 FSQFAUDJUUFDOO-INIZCTEOSA-N 277.364 2.476 10 20 CECD C[C@H](NC(=O)N1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 773615781 YGYOGHZFJNRULQ-OLZOCXBDSA-N 291.395 2.244 10 20 CECD COc1cc(C)cc([C@H]2NC3(CCCC3)C(=O)N2C)c1O 887328391 WJFXWDMJFZHVQC-AWEZNQCLSA-N 290.363 2.082 10 20 CECD COc1ccc(CNC[C@@H]2C=CCC2)c(O)c1OC 895993289 ANQKRERGTYUPHK-LLVKDONJSA-N 263.337 2.465 10 20 CECD C[C@H](O)C[C@H](C)NCc1ccc(N(C)C)c(F)c1 782981111 XXUBWTOMXYGDPR-QWRGUYRKSA-N 254.349 2.141 10 20 CECD COc1ccc(CN2CC[C@@H]3C[C@H]3C2)c(O)c1OC 895432931 GEJCADJJLVEOJE-PWSUYJOCSA-N 263.337 2.251 10 20 CECD CN(Cc1cc(F)ccc1O)[C@@H]1CCCC[C@H]1O 895437334 JLXAIFHDLZOKCL-TZMCWYRMSA-N 253.317 2.267 10 20 CECD COc1ccc(CNC(=O)/C=C/c2ccco2)c(O)c1 794389353 LVJMXRXTTOECNM-VOTSOKGWSA-N 273.288 2.323 10 20 CECD Oc1ccc(Cl)cc1CNCc1cnc2n1CCC2 719818486 OYLHNQHBYIBWEU-UHFFFAOYSA-N 277.755 2.478 10 20 CECD COc1ccc(CN2CCC[C@@H](OC)C2)c(O)c1OC 891692945 URNVKECRFKNOKD-GFCCVEGCSA-N 281.352 2.020 10 20 CECD CCc1cccnc1NC(=O)c1cccc(O)c1O 790903657 KONCRUMSIFBIFX-UHFFFAOYSA-N 258.277 2.308 10 20 CECD Cc1ccc([C@@H](C)NCCCCS(C)(=O)=O)c(O)c1 692842054 LDLRKGQUDSZEEH-GFCCVEGCSA-N 285.409 2.176 10 20 CECD CC[C@H](F)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1335522681 QADBDJPJJUEEIZ-HNNXBMFYSA-N 294.370 2.230 10 20 CECD COC(=O)NCC(=O)Oc1ccc2c(c1)c(C)c(C)n2C 1344480186 DFDIVKCYSFTQHU-UHFFFAOYSA-N 290.319 2.057 10 20 CECD Nc1ccc(CNC(=O)c2cnc3n2CCCCC3)cc1 1356229001 WWUUYTKQYKPPGR-UHFFFAOYSA-N 284.363 2.122 10 20 CECD COc1ccc(O)c(CN(CCN)Cc2ccccc2)c1 220351873 KMMCLTUHVHFYBL-UHFFFAOYSA-N 286.375 2.362 10 20 CECD C[C@@H](NC[C@H]1[C@@H](C(=O)O)C1(F)F)c1ccccc1O 1607422518 ZAYBGJGBDGAQJP-HDBBIHSSSA-N 271.263 2.009 10 20 CECD COC(C)(C)CN[C@H](C)c1cc(C(=O)O)ccc1O 1610223262 SWSVGYFJCOOTCR-SECBINFHSA-N 267.325 2.166 10 20 CECD CCC[C@@H](CCO)CNCc1cccc(OC)c1O 231391906 FDTGMITVKDLDDA-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CN(C)c1ccc(CN[C@]2(C(=O)O)CC[C@@H]3C[C@@H]32)cc1 1777040002 VHPABVXOBMFJNY-IVMMDQJWSA-N 274.364 2.096 10 20 CECD O=C(O)[C@H](CC1CCC1)NCc1ccc2c(c1)CCO2 1777573222 YVQKSVFKCYFOAF-AWEZNQCLSA-N 275.348 2.355 10 20 CECD COc1cccc(CNC(=O)C(C2CC2)C2CC2)c1O 151717993 ZTLCVQGSVZSHAI-UHFFFAOYSA-N 275.348 2.453 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CO)C2)cc1F 154584294 SFBOWQJGQLFEEG-ZDUSSCGKSA-N 266.360 2.096 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1cccn1C 154910312 HPFIVUKQOOOOSD-UHFFFAOYSA-N 271.364 2.490 10 20 CECD C[C@H](Cc1ccco1)NC(=O)c1cccc(O)c1O 126301060 JRKXEWBNNAZOSH-SECBINFHSA-N 261.277 2.052 10 20 CECD C1=CCN(CCNCc2ccc3c(c2)CCCO3)CC1 922081838 OWUVNANZGTZEPO-UHFFFAOYSA-N 272.392 2.363 10 20 CECD C[C@H](N[C@H](C)C(=O)NC(C)(C)C)c1ccccc1O 135719347 XDACWZXBIDJVTG-WDEREUQCSA-N 264.369 2.346 10 20 CECD COc1ccc(O)c([C@@H](C)NC2CCC(N)CC2)c1 51693669 HAVGGDGJWVJCDZ-VOMCLLRMSA-N 264.369 2.321 10 20 CECD O=C(O)[C@@H]1CC12CCN(Cc1ccccc1O)CC2 405432030 ZICHHUMECWBDJB-LBPRGKRZSA-N 261.321 2.079 10 20 CECD Cc1cc(C(=O)N2CC[C@H](O)C2)c(C)n1-c1ccccc1 177367430 HTANPBDAOCXMAW-HNNXBMFYSA-N 284.359 2.301 10 20 CECD C[C@@H](Sc1nccs1)c1nc(-c2nnc[nH]2)no1 174036699 HTVXOKQVTDPILE-RXMQYKEDSA-N 280.338 2.165 10 20 CECD COc1cccc(CNC(=O)c2ccc(Cl)nc2)c1O 68488650 KLVCPNSLCCWBKV-UHFFFAOYSA-N 292.722 2.379 10 20 CECD COCC(C)(C)C(=O)NCc1ccc2c(c1)CCCN2C 124673188 KYKIXAWZMDRGOC-UHFFFAOYSA-N 290.407 2.358 10 20 CECD CN(C)c1ccc(CNC(=O)c2c[nH]nc2C2CC2)cc1 184192656 QZYGDODGNYXCRI-UHFFFAOYSA-N 284.363 2.283 10 20 CECD CN(C)c1ccc(CNC(=O)C2CC=CC2)cc1F 77739932 DYWLOEADOFKCGP-UHFFFAOYSA-N 262.328 2.474 10 20 CECD CN(c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-])C1CC1 37081393 OEGGMMUONISMSA-XVNBXDOJSA-N 262.265 2.291 10 20 CECD COc1ccc(N2CCCN(C[C@@H]3CCCO3)CC2)cc1 76851211 CJUQKUWABPMGMI-KRWDZBQOSA-N 290.407 2.386 10 20 CECD CN(C)c1ccc(CNCc2c(Cl)cnn2C)cc1 130307357 JLXRQWGXPBKGSL-UHFFFAOYSA-N 278.787 2.429 10 20 CECD CC1(C)[C@@H](NCc2cc(Cl)ccc2O)C[C@H]1O 128188295 GTVBHBAFISVKRL-NWDGAFQWSA-N 255.745 2.295 10 20 CECD C[C@H]1CCSCCN1C(=O)/C=C/c1ccc(O)c(O)c1 190063937 NHQLSYIOCANGGA-TZNOJPMFSA-N 293.388 2.465 10 20 CECD C[C@H]1CSCCN(Cc2cc3c(cc2O)OCO3)C1 192177080 BPBDKZGJBKHWJK-SNVBAGLBSA-N 281.377 2.306 10 20 CECD CN1CCCc2cc(CNC[C@H]3COC(C)(C)O3)ccc21 230207053 WKYOVAXLFRSJMO-HNNXBMFYSA-N 290.407 2.310 10 20 CECD CCOCCN(C)c1cc(OC)c(OC)cc1[N+](=O)[O-] 92963192 QXEAZEONBCVRJS-UHFFFAOYSA-N 284.312 2.085 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)C(C)(C)n1cncn1 284125144 NWZSPTIXQIALOL-ZDUSSCGKSA-N 287.411 2.258 10 20 CECD CC(C)[C@@H](O)C(C)(C)CNC(=O)c1c(F)ccc(O)c1O 296613360 UHCNBIMQILZEMP-CYBMUJFWSA-N 299.342 2.010 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2cncs2)c1 815835468 UUKVUIZGHFQRAG-UHFFFAOYSA-N 292.360 2.106 10 20 CECD Cc1cc(O)c(CNCC(C)(C)CO)cc1Cl 825375328 LKTHXMYVCOPLMV-UHFFFAOYSA-N 257.761 2.462 10 20 CECD Cc1nc2n(n1)CCN(Cc1cc(Cl)c(C)cc1O)C2 824819898 VMIXBLXEKXRYEK-UHFFFAOYSA-N 292.770 2.270 10 20 CECD CN(C)c1ccc(CNC2(CC(=O)O)CCC2)cc1 901706182 AXPAIVQTGSSYRB-UHFFFAOYSA-N 262.353 2.240 10 20 CECD CC(C)(O)C(C)(C)CNC(=O)/C=C\c1ccc(O)c(O)c1 837093867 JQNKDDNLMGZVHQ-VURMDHGXSA-N 293.363 2.024 10 20 CECD O=C1CCN(C(=O)c2cc(O)cs2)C2(CCC2)C1 911998579 IWJIHKLPFUPCLE-UHFFFAOYSA-N 265.334 2.182 10 20 CECD C[C@H]1CCN(Cc2cccc(Cl)c2O)C[C@@H]1CN 841101122 OJLIOPZBTSCBJZ-JQWIXIFHSA-N 268.788 2.462 10 20 CECD CCN1C[C@H](CN[C@@H](C)c2cc(F)cc(F)c2O)CC1=O 846207812 GCOHLAXSCJDYMA-UWVGGRQHSA-N 298.333 2.189 10 20 CECD Cc1ccc(CN(C)c2ccc(OCC(=O)O)cc2)nc1 846279409 CMODDLBDCZGRFI-UHFFFAOYSA-N 286.331 2.490 10 20 CECD COc1ccc(O)c(CN[C@H]2CCNC3(CCC3)C2)c1 841090462 YLWILUIWCXKAQJ-ZDUSSCGKSA-N 276.380 2.165 10 20 CECD CC[C@H](NC[C@H]1CCCNC1=O)c1ccc(C)cc1O 840825807 MOTWYCXWAWUPDL-OCCSQVGLSA-N 276.380 2.268 10 20 CECD CCNCCNCc1cc(Cl)cc(Cl)c1O 841037768 VGOQBHQNYRYJHL-UHFFFAOYSA-N 263.168 2.398 10 20 CECD CCc1cccc(CN(CC)CCC(=O)OC)c1O 848883418 NDPLCJRUTIDRKK-UHFFFAOYSA-N 265.353 2.340 10 20 CECD C[C@H](CCO)N(C)Cc1c(O)ccc(Cl)c1F 846111001 LXCVWNUWWSMSFV-MRVPVSSYSA-N 261.724 2.387 10 20 CECD CCN(CC)c1ccc(CNCc2cnnn2CC)cc1 841858239 OONFGVJDDUPTIX-UHFFFAOYSA-N 287.411 2.434 10 20 CECD NCC[C@H]1CCCCN1Cc1cccc(F)c1O 843123224 JBPHLBBTWHZGNV-GFCCVEGCSA-N 252.333 2.235 10 20 CECD Cc1ccc(N(C)C(=O)/C=C/c2cnn(C)c2)cc1 751216746 IRTXAAIAGJCSFB-RMKNXTFCSA-N 255.321 2.405 10 20 CECD OC[C@H](C[C@@H]1CCCO1)NCc1ccc2c(c1)CCCO2 922341573 SEYRQVJKKMUDJF-HOTGVXAUSA-N 291.391 2.031 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC[C@H]1CCOC1 751277586 HOAHHWQLBIWVMX-AWEZNQCLSA-N 290.407 2.494 10 20 CECD C[C@@H](NCC1(O)CCC1)c1cc(F)cc(F)c1O 756565672 XTJXUEFAIUPBOO-MRVPVSSYSA-N 257.280 2.236 10 20 CECD CC(=O)N1CC[C@@H](N[C@H](C)c2cc(Cl)ccc2O)C1 857084575 WFGGQZXZGHUBGG-BXKDBHETSA-N 282.771 2.317 10 20 CECD C[C@@H]1C[C@H]1C(=O)NCc1cccc(Br)c1O 765754801 WRFQPSXVZUWNDO-VXNVDRBHSA-N 284.153 2.427 10 20 CECD CC(=O)c1cc(Cl)cc(CN(CCO)C2CC2)c1O 50158201 FBPLWDNUXODBPZ-UHFFFAOYSA-N 283.755 2.205 10 20 CECD Cc1nnc(C(=O)N[C@H](C)c2ccccc2O)s1 866161119 KBQNUUHWZJEZCM-SSDOTTSWSA-N 263.322 2.043 10 20 CECD CCOc1ccc(CN2CCC[C@H](C(=O)O)C2)c(O)c1 874044572 FUIIINFQGTVPPX-LBPRGKRZSA-N 279.336 2.088 10 20 CECD CCCc1nc(C(=O)NCCc2ccc(N)cc2)co1 876528007 OGWJRIBNULGMCP-UHFFFAOYSA-N 273.336 2.182 10 20 CECD C[C@@H]1CCN2[C@H](C1)C(=O)N[C@H]2c1cc(Cl)cc(F)c1O 777900106 ZOWGPXKKXHJDIX-TWPQKTAQSA-N 298.745 2.414 10 20 CECD Cc1ccc(CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)nc1 789865538 PXFQUJJKERBWFU-VMPITWQZSA-N 298.342 2.473 10 20 CECD Cc1ccc(CNC(=O)NCCc2ccc(N)cc2)o1 892038363 DUOOKEMYHLJONW-UHFFFAOYSA-N 273.336 2.212 10 20 CECD COC(=O)[C@]12CCC[C@H]1CN(Cc1c(C)cccc1O)C2 895584709 ZQBRRTAJLYPINQ-GUYCJALGSA-N 289.375 2.476 10 20 CECD Oc1c(CNCCO[C@H]2CCOC2)ccc2ccccc12 897201957 OSLGJOIRZWITPR-HNNXBMFYSA-N 287.359 2.441 10 20 CECD CCN1CCC[C@H](N[C@H](C)c2cc(F)ccc2O)C1=O 722355840 HFARTLFKRFEZTR-MFKMUULPSA-N 280.343 2.193 10 20 CECD COc1ccc(CNCc2cnc3ccccn23)c(O)c1 793388678 RHPIAYFICZHQQW-UHFFFAOYSA-N 283.331 2.338 10 20 CECD Nc1ccc(CN2CCCC3(CCNCC3)C2)cc1 1204743051 YOHWTNIOVSZHOZ-UHFFFAOYSA-N 259.397 2.234 10 20 CECD CC1(CCN[C@@H]2CCc3cccc(O)c32)OCCO1 716044961 OVICDUYKGQRABI-GFCCVEGCSA-N 263.337 2.122 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)[C@H](C)CN1 1326236314 HINMFBDXNNGTRR-HUUCEWRRSA-N 273.424 2.469 10 20 CECD C[C@@H]1SCCN(C(=O)NCc2ccc(N)cc2)[C@@H]1C 1262603190 AGIXUUBCYTZYMM-MNOVXSKESA-N 279.409 2.304 10 20 CECD C[C@@H](NCCCCC(=O)O)c1cc(F)ccc1O 1603248542 GTHYFTPKXFQKMD-SECBINFHSA-N 255.289 2.437 10 20 CECD C[C@@H]1[C@H](C(=O)O)CCN1Cc1c(O)ccc(Cl)c1F 1604636628 OHOTZTZMABRHJC-HTQZYQBOSA-N 287.718 2.480 10 20 CECD CN(Cc1cccc(F)c1O)C(C)(C)CC(=O)O 1606165076 ZHSWXAVXWRSGFT-UHFFFAOYSA-N 255.289 2.216 10 20 CECD C[C@H](CN(C)Cc1c(O)ccc(Cl)c1F)C(=O)O 1604158634 HNPFAEKISHLDQO-SSDOTTSWSA-N 275.707 2.337 10 20 CECD CC[C@@H](NCC1(C)CC1)c1cccc(-c2nn[nH]n2)c1O 1590464425 OLSZTKDFLKBKMS-GFCCVEGCSA-N 287.367 2.413 10 20 CECD CCC[C@@H](NCc1c(C)cc(OC)cc1O)C(=O)O 1596001751 XATZRGBMNXZTQJ-GFCCVEGCSA-N 267.325 2.052 10 20 CECD COc1ccc(N(C)Cc2ccc(-c3nn[nH]n3)o2)cc1 1591606387 BLNXKFHCQLVYFM-UHFFFAOYSA-N 285.307 2.105 10 20 CECD CCN1CCc2cc(CNc3nc(C(=O)O)co3)ccc21 1776878032 QKTPPUBJIGPTJI-UHFFFAOYSA-N 287.319 2.367 10 20 CECD CCOC(=O)CN(Cc1cc(C)cc(OC)c1O)C1CC1 164243888 GHEDSWRBBGVRNX-UHFFFAOYSA-N 293.363 2.237 10 20 CECD C[C@@H](NC(=O)C1(C)CCOCC1)c1ccccc1O 827930335 GZQDTYYZPWPHDA-LLVKDONJSA-N 263.337 2.386 10 20 CECD COc1cccc(CNCc2cnccc2C)c1O 162629453 GVQMNEYAWQIMON-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CN(C)C(=O)c1ccc(NCc2ccccc2O)nc1 163772055 CVHHOXDIHKBEHJ-UHFFFAOYSA-N 271.320 2.101 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](O)C2CCC2)c1 315761468 CLDDRFCIQRJQJZ-MEBBXXQBSA-N 265.353 2.212 10 20 CECD Cc1nocc1CN1CCCc2cc(CN)ccc21 713485409 KAVOXEDKOVMAKE-UHFFFAOYSA-N 257.337 2.395 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccccc2O)ccn1 383756179 QWNYAAPCJBPCNX-UHFFFAOYSA-N 256.305 2.368 10 20 CECD Cn1cnc(NCc2cc(Cl)cc(Cl)c2O)n1 814255557 UBAVHAPRFCABBT-UHFFFAOYSA-N 273.123 2.440 10 20 CECD OCC[C@@H](NCc1cc(Cl)ccc1O)C(F)(F)F 886371050 CYIOPARMURUIDI-SNVBAGLBSA-N 283.677 2.449 10 20 CECD COc1ccc(CNCc2ccc3c(c2)CCO3)nc1 892793419 MHTJKFOQXZABIB-UHFFFAOYSA-N 270.332 2.315 10 20 CECD CC(C)C[C@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 178711189 FTFSLOLRVMSDBX-INIZCTEOSA-N 289.423 2.276 10 20 CECD CCN(CC)c1ccc(CN2CCS(=O)CC2)cc1F 119400630 WOYAXDWORNDYHN-UHFFFAOYSA-N 298.427 2.236 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cn[nH]c1C 172327375 UUTGDHXARHNFOT-UHFFFAOYSA-N 273.336 2.476 10 20 CECD COc1ccc(OC)c(NC(=O)c2cccc(O)c2O)c1 126207724 PUUYQCNXMKAFNE-UHFFFAOYSA-N 289.287 2.367 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ccc(C#N)cn1 183599468 GGHCHMCRSXJDFU-JTQLQIEISA-N 269.304 2.408 10 20 CECD Cc1ccc(C(=O)NC2Cc3ccccc3C2)c(O)c1O 183599357 XJKRCFQOWKSORZ-UHFFFAOYSA-N 283.327 2.303 10 20 CECD C[C@H]1[C@H](C)CCN1C(=O)/C=C/c1ccc(O)c(O)c1 181159428 LAIKIUNKBCDKQU-MRUFAENASA-N 261.321 2.368 10 20 CECD CCOCc1cc(CN[C@@H]2C[C@H](O)C2(C)C)ccc1OC 189328120 NCCGSAJJAKZNGH-CVEARBPZSA-N 293.407 2.481 10 20 CECD C[C@@H]1[C@@H](C(=O)N2CCOc3cc(N(C)C)ccc32)C1(F)F 336579646 SLFGMHGGGMPOAK-RNCFNFMXSA-N 296.317 2.379 10 20 CECD COC[C@H](C)NC(=O)NCc1c(C)c2ccccc2n1C 349815225 ZWZWNCRJGQBIOX-NSHDSACASA-N 289.379 2.321 10 20 CECD O=C(NCCSC(F)(F)F)c1c(F)ccc(O)c1O 276629200 SHMYQJAJZLGAMC-UHFFFAOYSA-N 299.245 2.220 10 20 CECD Cc1ccc(O)c(CN2CCO[C@@]3(CCO[C@@H]3C)C2)c1 279709354 SHXYKRFMWVMQMO-CJNGLKHVSA-N 277.364 2.080 10 20 CECD Cc1cccc(CN(CCCO)CC(F)(F)F)c1O 271723682 KQTJWCGGQFELOV-UHFFFAOYSA-N 277.286 2.447 10 20 CECD CC[C@H](N[C@H](C)C(=O)NCCF)c1ccc(F)cc1O 287333299 GBKDTULKGSIIMW-SKDRFNHKSA-N 286.322 2.046 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCc3c[nH]nc3C2)c1 378109231 JUAAANWDKYWSRX-CYBMUJFWSA-N 257.337 2.071 10 20 CECD Oc1cccc2c1[C@@H](NCCc1nnc3ccccn13)CC2 390126106 GHRAQHYKIQDONU-ZDUSSCGKSA-N 294.358 2.255 10 20 CECD C[C@@H](C1CCC1)N1C(=O)CN(Cc2ccccc2O)C1=O 819168025 KZTHQWHYDZKFCI-NSHDSACASA-N 288.347 2.345 10 20 CECD CCOc1cccc(CN(C)[C@H]2CC(C)(C)OC2=O)c1O 814179464 CTRNWNTXIASJIT-LBPRGKRZSA-N 293.363 2.317 10 20 CECD C[C@H](CN)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 817963440 UXOKONIUMDJKLR-KKZNHRDASA-N 252.333 2.264 10 20 CECD CC(=O)C1(C(=O)NCCCSc2nccs2)CC1 815591022 SSOHPLKVSJLTJB-UHFFFAOYSA-N 284.406 2.111 10 20 CECD CN1CCCc2cc(CNC3C[C@@H]4CC[C@H](C3)N4)ccc21 817900921 RCVSJRDOLIRIGF-SJPCQFCGSA-N 285.435 2.442 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@@]1(C)CO 827699085 DXFQZMJEGNKYCH-HZMBPMFUSA-N 269.772 2.496 10 20 CECD Cc1ccncc1/C=C/C(=O)N(C)c1cccnc1 492427583 PPQGBBDHAILDAL-AATRIKPKSA-N 253.305 2.461 10 20 CECD CCO[C@@H](C)C(=O)N[C@H](C)c1cc(OC)ccc1O 728977560 AFAANLYQNKESMH-ZJUUUORDSA-N 267.325 2.003 10 20 CECD CCc1nnc([C@H](C)OC(=O)c2ccc(C)c(O)c2O)o1 732334614 AUGWLHIBXIITMH-QMMMGPOBSA-N 292.291 2.270 10 20 CECD COCC(C)(C)NCc1ccc(N(C)C)c(F)c1 733327026 LCXHDFXZMIOYRI-UHFFFAOYSA-N 254.349 2.406 10 20 CECD O=C(NCCCSc1nccs1)NOC1CCC1 838513326 HJECKDJMWXEOFD-UHFFFAOYSA-N 287.410 2.409 10 20 CECD COCCN1CCCc2cc(OC)cc(OC)c21 839654219 MIVYYVFPXIQDLV-UHFFFAOYSA-N 251.326 2.103 10 20 CECD COC(=O)CCCN1CCCc2cc(OC)cc(OC)c21 839656402 KBYDOFHISIUXCK-UHFFFAOYSA-N 293.363 2.410 10 20 CECD COc1ccc(O)c([C@@H](C)NC/C=C(/C)C(=O)O)c1 833733168 AXPGVAXJJFCZMA-ABRRARGCSA-N 265.309 2.082 10 20 CECD Cc1ncoc1C(=O)NCc1ccc(N(C)C)c(F)c1 747214819 FSGCXYUFLUUJIQ-UHFFFAOYSA-N 277.299 2.118 10 20 CECD CC[C@H](C[C@H](C)CO)NCc1cccc(OC)c1O 743499640 LKMNZKXEPWSJTC-WCQYABFASA-N 267.369 2.288 10 20 CECD C[C@H]1C[C@H](CN2CCCc3cc(CN)ccc32)CCN1 843058191 OFRIANREGZQVIK-DZGCQCFKSA-N 273.424 2.286 10 20 CECD CC1(C)CCC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)C1 841114038 BHGWMVCNZWEWRY-ZDUSSCGKSA-N 289.379 2.292 10 20 CECD CCC(N)(CC)CNCc1ccc(N(C)C)c(F)c1 841030667 JXMVMGSBBGFKKZ-UHFFFAOYSA-N 267.392 2.499 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@@H](C)CCN)cc1 841719225 GPRHFDZFUORNCK-ZDUSSCGKSA-N 292.427 2.069 10 20 CECD C[C@@H](NCCN1CCOC[C@H]1C)c1cc(Cl)ccc1O 756535702 PUYJDHVVGCDDSJ-VXGBXAGGSA-N 298.814 2.417 10 20 CECD COc1cc(CN2CCC[C@H]2c2ncon2)c(O)cc1C 768444594 MPAWSOKDFFMJHI-LBPRGKRZSA-N 289.335 2.429 10 20 CECD CCCCOC(=O)CN(C)c1ccc(OC)cc1 49970463 OXECQROWUWRATF-UHFFFAOYSA-N 251.326 2.475 10 20 CECD CCC[C@@H](OCC)C(=O)NCc1ccccc1O 860232649 CMYJWNZEIVDNNR-CYBMUJFWSA-N 251.326 2.214 10 20 CECD C[C@@H]1[C@H](O)CCN1Cc1c(O)cccc1Br 862388017 ULRGGKCDJQTREM-LDYMZIIASA-N 286.169 2.110 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H]1c1nncn1C 876780675 ICRQWWPWJQDUGU-ZDUSSCGKSA-N 272.352 2.166 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCO[C@H](C)C1 776326167 YZAXVVNTVAHNIN-ZIAGYGMSSA-N 290.407 2.492 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC(F)(F)C2)c1O 775049634 ARALSMXUHZRBCY-UHFFFAOYSA-N 288.250 2.150 10 20 CECD CCCOc1ccc(CNCC(=O)N(C)CC)cc1C 873108052 CBKIPGGQPHIWJH-UHFFFAOYSA-N 278.396 2.352 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1ccc(C)cc1O 877380882 WVYUCIFGCHDLTE-CYBMUJFWSA-N 263.337 2.228 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NOCCO)c2C)c1 776578281 AUUTUMBPLWTPDJ-UHFFFAOYSA-N 288.347 2.056 10 20 CECD CCC1(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)COC1 773009693 QAJMZZQNUJPQFV-LBPRGKRZSA-N 276.380 2.356 10 20 CECD O=C1[C@@H]2CCCN2C(=O)N1CCCSc1nccs1 777651240 UBNWRLSZSXTWLY-VIFPVBQESA-N 297.405 2.052 10 20 CECD CCN(C)C(=O)CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 775586847 PRTAFHCSDOPOCE-ONGXEEELSA-N 280.343 2.148 10 20 CECD O=C(COC(=O)c1cccc(O)c1O)c1ccccc1 776282505 SHLFFVDNOIPQDD-UHFFFAOYSA-N 272.256 2.138 10 20 CECD Oc1c(Cl)cccc1CN1CCc2c[nH]nc2C1 775713998 PETAUNYRRKOZBE-UHFFFAOYSA-N 263.728 2.327 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)[C@H](O)c1ccc(F)cc1 777525951 OKGIRASJRPIPNB-OQPBUACISA-N 295.335 2.445 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)Cc2cccnc2)c(O)c1O 889667034 JOVGWSTWYKYKGH-NSHDSACASA-N 286.331 2.162 10 20 CECD Nc1ccc(CN2CCC([C@H]3CCNC3)CC2)cc1 1120268794 JIOGDWYUMQGYQI-HNNXBMFYSA-N 259.397 2.090 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H]2C[C@@H](N)C2(C)C)c1O 883442913 VWHJRZDGMIUNNC-OLZOCXBDSA-N 296.798 2.464 10 20 CECD COc1ccc(CNC[C@@H]2CCCC[C@H]2O)c(O)c1OC 894749987 FMBRDDJYHOVSSO-WCQYABFASA-N 295.379 2.050 10 20 CECD COc1ccc(CN[C@H](C)C[C@@H](C)NC(C)=O)cc1C 1133431897 LQTHRYNXIAOGRY-CHWSQXEVSA-N 278.396 2.396 10 20 CECD CCC[C@H](NCc1ccc2c(c1)CCO2)C(=O)OCC 743474269 JRPVEXJUPRBWQS-AWEZNQCLSA-N 277.364 2.443 10 20 CECD CC[C@@H](C)[C@H](OC)C(=O)NCc1cccc(OC)c1O 793689088 JCXBTSKXBZCKDY-YGRLFVJLSA-N 281.352 2.078 10 20 CECD CCCCSCC(=O)NCCc1ccc(O)c(O)c1 762268601 NVIKEILFKYSEBU-UHFFFAOYSA-N 283.393 2.290 10 20 CECD Cc1cc(CNCc2cccc(Cl)c2O)ncn1 776254443 WJEQRAXNYHHUNG-UHFFFAOYSA-N 263.728 2.434 10 20 CECD CCN(CC)CCO[C@@H]1CCN(Cc2ccc(N)cc2)C1 1335288925 KHKLFEUEENDEGP-QGZVFWFLSA-N 291.439 2.202 10 20 CECD CN(C)c1ccc(CN2[C@H]3CC[C@H]2CC(=O)C3)cc1 217682557 YGBKSWOFGWHBFC-GJZGRUSLSA-N 258.365 2.449 10 20 CECD Cc1cc(O)c(CNc2c(C(=O)O)ccnc2O)cc1C 1607699247 IMUYZEBGDMODSB-UHFFFAOYSA-N 288.303 2.420 10 20 CECD C[C@@H](N[C@H]1CC[C@H](CO)CC1)c1cc(C(=O)O)ccc1O 1609786470 NFSGCSHCDGELQE-NQBHXWOUSA-N 293.363 2.292 10 20 CECD CNCCN(C)C(=O)c1sccc1-n1c(C)ccc1C 1578703894 HNJIFXXBOZSCCU-UHFFFAOYSA-N 291.420 2.447 10 20 CECD CC(C)[C@@H](C(=O)O)C(=O)NCc1cccc(Cl)c1O 1588807898 KSYVOXVNGWRQIJ-SNVBAGLBSA-N 285.727 2.019 10 20 CECD COc1cc(O)c(CNCCCCCC(=O)O)cc1OC 1599445332 CSCOFMHSKLHCHV-UHFFFAOYSA-N 297.351 2.144 10 20 CECD C[C@@H](N[C@H]1CCn2ccnc21)c1cc(C(=O)O)ccc1O 1593232112 MHCUYNPZGOLOKA-SKDRFNHKSA-N 287.319 2.083 10 20 CECD CN(Cc1cc(F)ccc1O)C[C@@H]1CCCN1C 234313734 CQZTUJKXGJSAKP-ZDUSSCGKSA-N 252.333 2.057 10 20 CECD CCc1cccc(CNC[C@@H](O)[C@H](C)CC)c1O 848894403 FAPGMTFAARWJQB-BXUZGUMPSA-N 251.370 2.451 10 20 CECD Oc1ccc(Cl)cc1CN1C[C@@H]2CCNC[C@@H]2C1 904420808 GVSKWGXICCOYAW-CMPLNLGQSA-N 266.772 2.087 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCCC1 61804092 UANLLYVXYNMUIY-UHFFFAOYSA-N 289.423 2.197 10 20 CECD O=C(NC[C@@H]1[C@H]2Cc3ccccc3[C@@H]21)c1cccc(O)c1O 193138277 HGFLDTDVMMWBPT-FMKPAKJESA-N 295.338 2.414 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H](O)C(F)(F)F)c1 230659185 QRJSPHPXBIVDQR-LDYMZIIASA-N 263.259 2.274 10 20 CECD CCN(CCn1cc([N+](=O)[O-])cn1)c1ccc(OC)cc1 266928129 RRERAZMUZZOKRE-UHFFFAOYSA-N 290.323 2.326 10 20 CECD Cc1ccc(C(=O)N[C@@]2(C)CCO[C@@H]2C2CC2)c(O)c1O 273446256 GROCJZPAMUGHEW-ZBFHGGJFSA-N 291.347 2.094 10 20 CECD CC[C@@H](NCC1([S@@](C)=O)CC1)c1ccc(F)cc1O 287500348 NRNFHCKEWIFVRV-CWTRNNRKSA-N 285.384 2.483 10 20 CECD Cc1cc(C)c([C@H](C)NCC(=O)NC(C)C)c(O)c1 284162728 PXXRMOZKSABISR-LBPRGKRZSA-N 264.369 2.184 10 20 CECD CC[C@H](NC[C@@]1(O)CCN(C)C1)c1cccc(Cl)c1O 806159854 MVJRQEBCEVXBHJ-ZFWWWQNUSA-N 298.814 2.153 10 20 CECD COc1cc(O)c(CNCCCOC(F)F)cc1OC 802657259 XTQQXRUHQSXFRJ-UHFFFAOYSA-N 291.294 2.128 10 20 CECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc(N)cc1 394278906 FGFWJTKLDJMSHR-CABCVRRESA-N 288.395 2.359 10 20 CECD C[C@H](CCCN)N[C@H](C)c1cc(F)cc(F)c1O 817977255 FQCVEMUFUAJRFJ-RKDXNWHRSA-N 258.312 2.448 10 20 CECD C[C@H](N)C[C@@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 817891452 KLWQLXVBCOAMGD-ZNMIVQPWSA-N 291.439 2.300 10 20 CECD CC(C)(C)OCC[C@H](NCc1ccccc1O)C(=O)O 901762902 PVZVKKGLTXFTMK-LBPRGKRZSA-N 281.352 2.140 10 20 CECD CCOc1cccc(CNC2(CO)CCSCC2)c1O 839177436 KXUMGJDVMSUUGG-UHFFFAOYSA-N 297.420 2.139 10 20 CECD CCn1cccc(CN[C@H]2CCc3cccc(O)c32)c1=O 834786896 DMTMQPKOTMNYHQ-AWEZNQCLSA-N 284.359 2.351 10 20 CECD CC[C@@](C)(CNC(=O)NCc1cc(OC)ccc1O)OC 838474501 LDFGQOHXMBIVHF-HNNXBMFYSA-N 296.367 2.015 10 20 CECD Cc1cc(O)c(CN(C)[C@@H]2CCN(C)C2=O)cc1C(C)C 738264538 DNVWJPXVTCYYTA-OAHLLOKOSA-N 290.407 2.487 10 20 CECD COc1cccc(CN[C@H]2C[C@@H](OC(C)C)C2)c1O 839148058 VZCKFTXMZABKIU-BETUJISGSA-N 265.353 2.446 10 20 CECD Cc1cc(O)c(CNC2(CC(=O)O)CCC2)cc1C 833746992 NMYDWGZILQKEQF-UHFFFAOYSA-N 263.337 2.496 10 20 CECD C[C@H]1[C@@H](C)NCCN1Cc1cccc(Br)c1O 843056857 AZMBWBPQWOXUGE-ZJUUUORDSA-N 299.212 2.337 10 20 CECD CC(C)CCO[C@H](C)C(=O)NCc1ccccc1O 748347114 VPZBEUMQYRXDSF-GFCCVEGCSA-N 265.353 2.460 10 20 CECD CCOC(=O)CN(CC)Cc1cccc(CC)c1O 848882940 DRNGHYWXVBQVPT-UHFFFAOYSA-N 265.353 2.340 10 20 CECD COc1cccc([C@@H](C)NCCCc2nc(C)no2)c1O 846150320 YOWAVYXWUOSGLO-SNVBAGLBSA-N 291.351 2.376 10 20 CECD CC1(C)NCC[C@H]1NCc1cc(Br)ccc1O 841085430 CFKFAANQALHRGS-GFCCVEGCSA-N 299.212 2.385 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@H](C)N1 843049200 JDWNVFMQFWRKHM-IUCAKERBSA-N 272.751 2.367 10 20 CECD CN[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 843045772 VYBVCZNMUFHYDG-MRXNPFEDSA-N 273.424 2.471 10 20 CECD COC(=O)[C@@H](CNC(=O)c1cc(O)cs1)CC(C)C 743630235 QICMELIVTOVUIO-SECBINFHSA-N 285.365 2.019 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C[C@H](O)C(F)(F)F 840948234 FWRUPWGCMCSOCM-ZDUSSCGKSA-N 290.329 2.416 10 20 CECD CNC[C@@H]1CCCN1Cc1cccc(Br)c1O 843055358 IAIGMKSYIJRBPT-NSHDSACASA-N 299.212 2.339 10 20 CECD CN(C)c1ccnc(NC(=O)/C=C\c2ccc(O)c(O)c2)c1 753012858 BLEVMGULWQUGQN-XQRVVYSFSA-N 299.330 2.211 10 20 CECD CCOc1ccc(O)c(CNCc2cc(C)ncn2)c1 756991779 WIHWYCNHZYZUAT-UHFFFAOYSA-N 273.336 2.179 10 20 CECD C[C@H](N[C@@H](CCO)C1CC1)c1cc([N+](=O)[O-])ccc1O 756740788 UHRQBLJSJVFNQQ-ZANVPECISA-N 280.324 2.112 10 20 CECD CC(=O)CN(CC(C)C)C(=O)c1cc(O)cs1 854955868 CJNNJAFNAGTARG-UHFFFAOYSA-N 255.339 2.141 10 20 CECD O=C(NCc1ccccc1O)c1cc2occc2[nH]1 750924448 RDUHNPWAYUONMU-UHFFFAOYSA-N 256.261 2.397 10 20 CECD CCN(C(=O)/C=C/c1cn(C)cn1)c1ccccc1OC 931085887 DHGCELZYWMKESU-MDZDMXLPSA-N 285.347 2.495 10 20 CECD CCCn1cc(C(=O)NCc2cc(C)ccc2O)cn1 862757174 KAGPQOVXSPWXJF-UHFFFAOYSA-N 273.336 2.237 10 20 CECD CCn1ccc(CNC(=O)N[C@H](C)c2ccccc2O)n1 868702113 IRZUOIJNAKCSMR-LLVKDONJSA-N 288.351 2.169 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCS1 768465620 JCRAVYHGFYBPGT-SMDDNHRTSA-N 295.404 2.145 10 20 CECD CCON(CC)C(=O)NCc1ccc(N(C)C)c(F)c1 875179574 BTONGSKDNNJYAI-UHFFFAOYSA-N 283.347 2.375 10 20 CECD CCC(C)(C)[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1118260764 OHNYYRVDPCFJTI-LBPRGKRZSA-N 296.323 2.279 10 20 CECD CC[C@H](CCO)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776146160 GNROOBRYRIPKGR-GXTWGEPZSA-N 293.411 2.274 10 20 CECD C[C@@H](NC(=O)COCC1CC1)c1ccc(N(C)C)cc1 773024578 MCSFAJHHYVSALQ-GFCCVEGCSA-N 276.380 2.356 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)[C@H](O)c1ccc(F)cc1 777525952 OKGIRASJRPIPNB-SDBXPKJASA-N 295.335 2.445 10 20 CECD C[C@H](N[C@@H]1C[C@@H]2CCCCN2C1=O)c1c(O)cccc1F 886623312 ARNSBIDPOSIYCK-GMXVVIOVSA-N 292.354 2.335 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@H](C(F)F)C1 894675417 FSDMRMLPDJJHLM-JTQLQIEISA-N 279.233 2.136 10 20 CECD CN(C)c1ccc([C@@H](CNC2CCOCC2)N(C)C)cc1 898449400 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CCCNC(=O)CCNCc1cc(Cl)c(F)cc1O 816537439 FODUWUAROBNOQG-UHFFFAOYSA-N 288.750 2.191 10 20 CECD C[C@H](N[C@H](C)CN)c1cc(Br)c(F)cc1O 817966586 QNDSMZWLMLDLEB-RQJHMYQMSA-N 291.164 2.292 10 20 CECD C[C@H](NC[C@@H]1CCCNC1)c1cc(F)ccc1O 817946004 PNWUHPNYMLVSKK-WDEREUQCSA-N 252.333 2.182 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@]1(C)CO 827699049 DIPJBUOXBAQTFC-QMTHXVAHSA-N 269.772 2.496 10 20 CECD CCCCC[C@H](O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 828884946 PDFZJGCWCVUYEU-RISCZKNCSA-N 295.379 2.086 10 20 CECD COC[C@H]1COCCN1Cc1cc2c(cc1O)CCCC2 902562773 WQDHQEXVFZGPCU-INIZCTEOSA-N 291.391 2.118 10 20 CECD C/C=C\C[C@H](NC(=O)c1cc(O)cs1)C(=O)OCC 832228391 RCIBXRLIZQTYTL-ATPLWMGHSA-N 283.349 2.081 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cn(C3CC3)nn2)c1 906287519 MAHRQLFBHAHVIA-SNVBAGLBSA-N 288.351 2.178 10 20 CECD O=C(NCCn1cnc2ccccc21)c1cc(O)cs1 732276414 JGJFKHAIESGTEE-UHFFFAOYSA-N 287.344 2.233 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)CCCC3)C[C@@H]1C(=O)O 833630865 XUKSYJQVBSRZHI-NHYWBVRUSA-N 289.375 2.424 10 20 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10 20 CECD CCN1CCC[C@H](NCc2cccc(Cl)c2O)C1=O 722351548 CUXFFBUXPCXHBM-LBPRGKRZSA-N 282.771 2.146 10 20 CECD CCc1cccc(CNCCCn2ccnc2)c1O 691511527 KVRHGVHNVFRBFR-UHFFFAOYSA-N 259.353 2.331 10 20 CECD CCN(CCC(=O)O)Cc1ccc(Cl)cc1O 1596314699 CCWSXFATUMSUPR-UHFFFAOYSA-N 257.717 2.342 10 20 CECD COC(=O)C[C@@H](NCc1ccc(OC)c(C)c1)C1CC1 1351284483 SDWZYBDZFZRTLZ-CQSZACIVSA-N 277.364 2.435 10 20 CECD C[C@H](C(=O)NCc1ccc(N)cc1)N1CCCCCC1 1515331984 GTGDDHCOJTVGCH-CYBMUJFWSA-N 275.396 2.150 10 20 CECD O=C(O)Cc1ccc(CNCc2cccc(F)c2O)cc1 1602122214 NZWWEKNHJJGNPA-UHFFFAOYSA-N 289.306 2.448 10 20 CECD O=C(O)c1coc(C(=O)NCc2cccc(Cl)c2O)c1 1608986464 JPPSVUKSRRBILE-UHFFFAOYSA-N 295.678 2.267 10 20 CECD Cc1ccn2ncc(C(=O)NCc3ccc(N)cc3)c2c1 1579810947 MVBLYUOJZXPDOB-UHFFFAOYSA-N 280.331 2.155 10 20 CECD COc1cc(C)c(CN2CC[C@H](C(=O)O)[C@@H](C)C2)c(O)c1 1574182032 NBJUYHIHQWHXHV-AAEUAGOBSA-N 293.363 2.252 10 20 CECD C[C@H](N[C@H]1CO[C@H](C2CC2)C1)c1cc(C(=O)O)ccc1O 1593234330 YLXJJIGWTKGJBX-UAKXVISKSA-N 291.347 2.309 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3C[C@]3(C(=O)O)C2)cc1 1776855516 HSUPHXKFHGVCEW-CJNGLKHVSA-N 274.364 2.049 10 20 CECD Nc1ccc(CCNC(=O)CSC(F)(F)F)cc1 152498288 ONBSZRGXFDUBLH-UHFFFAOYSA-N 278.299 2.181 10 20 CECD CCn1nc(C)c(C(=O)N(C)c2ccc(N)cc2)c1C 877078166 GTUBJHWMAZLWIO-UHFFFAOYSA-N 272.352 2.379 10 20 CECD COCCOCCCN[C@@H](C)c1ccc(N(C)C)cc1 37237439 VWSIUHVPGAKZLP-AWEZNQCLSA-N 280.412 2.456 10 20 CECD CN(Cc1ccccc1O)C(=O)CCOCC(F)F 276672989 DWQUWHWVXCZRFI-UHFFFAOYSA-N 273.279 2.022 10 20 CECD C[C@@H](NCCN1CC=CCC1)c1ccc(F)cc1O 281241922 VHAVPPFUQCYNNJ-GFCCVEGCSA-N 264.344 2.444 10 20 CECD CCOC[C@H](NCc1cc2c(cc1O)OCO2)C(C)C 188858685 AXHAEENENKLKKJ-LBPRGKRZSA-N 281.352 2.272 10 20 CECD COc1cccc(CN2CCCOC(C)(C)C2)c1O 311609118 FFWUYQBHGNQRQO-UHFFFAOYSA-N 265.353 2.402 10 20 CECD CN1CC[C@H]1CNCc1ccc(N2CCCCC2)cc1 712546504 IKINHKGZYKXQGI-KRWDZBQOSA-N 273.424 2.471 10 20 CECD COc1ccc(CN[C@@H]2C[C@H](C)O[C@@H]2C)c(O)c1 384542040 FAFGOTCUDYTRMO-OPQQBVKSSA-N 251.326 2.056 10 20 CECD COc1cccc(CN[C@@H]2CS[C@@H](C)C2)c1O 397976658 PIJHWWZXFHOLGM-ONGXEEELSA-N 253.367 2.384 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](N3CC=CC3)C2)cc1C 172932420 RFQONASROUICKU-MRXNPFEDSA-N 272.392 2.455 10 20 CECD CO[C@H]1CCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O 1262636855 BYDCQIHNCPKMEW-OSMZGAPFSA-N 263.337 2.385 10 20 CECD COc1ccc(O)c([C@H](C)Nc2cc(C)nc3ncnn23)c1 301199395 OVMAZBMSVCDWLO-JTQLQIEISA-N 299.334 2.320 10 20 CECD C[C@H](NC[C@H](O)COCC1CC1)c1ccc(N(C)C)cc1 129855127 DFLFUXDFKJEHOH-GUYCJALGSA-N 292.423 2.191 10 20 CECD O=C(O)c1ccccc1CNCc1ccccc1O 236459898 IIWBDRKYGSKTQL-UHFFFAOYSA-N 257.289 2.380 10 20 CECD Cc1cc(CN[C@@H](C)CC(N)=O)c(C)n1-c1ccccc1 136099601 LPUHOANRMRSMDV-LBPRGKRZSA-N 285.391 2.448 10 20 CECD COc1ccc(N2CCN(CCC(C)(C)O)CC2)cc1F 84866346 ZMAKWSHUEAGBTQ-UHFFFAOYSA-N 296.386 2.117 10 20 CECD COc1ccc(CN[C@H](C)CCN(C)C)cc1C 49554269 OYZZFWQJDDIPJW-CYBMUJFWSA-N 250.386 2.433 10 20 CECD CC(C)(CCCO)CNC(=O)/C=C/c1ccc(O)c(O)c1 272620412 IUHQBHQUYBZCTO-FNORWQNLSA-N 293.363 2.026 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@]12CCOC2 368096223 CWXZHOOIXKDDNL-RDJZCZTQSA-N 288.391 2.138 10 20 CECD Cc1ccc([C@H](C)N[C@H](CO)c2cnn(C)c2)c(O)c1C 273498527 PTWZNTVAUBHNOX-SWLSCSKDSA-N 289.379 2.127 10 20 CECD Oc1ccc(F)cc1CNc1cnccc1-n1ccnn1 377703885 WOMWSRJKSFBBDQ-UHFFFAOYSA-N 285.282 2.119 10 20 CECD Cc1cnccc1C(=O)N1CCOc2cc(N(C)C)ccc21 472328199 PWVFVCBRXUZOLX-UHFFFAOYSA-N 297.358 2.495 10 20 CECD CCOc1cccc(CN2CCC[C@@H](CO)CC2)c1O 293868067 CJMJTZHRUUPYCS-CYBMUJFWSA-N 279.380 2.385 10 20 CECD Cc1ccc([C@@H](C)NCC2(CC(N)=O)CC2)c(O)c1 817585190 CCEIJCUDHNQXCE-LLVKDONJSA-N 262.353 2.007 10 20 CECD C[C@@H]1CCNC[C@H]1NCc1ccc2c(c1)CCCN2C 817900440 MTNMALYYXADGKL-CZUORRHYSA-N 273.424 2.157 10 20 CECD Nc1ccc(NC(=O)c2coc(C3CCOCC3)n2)cc1 818556551 ZRCMAHWTABBYDS-UHFFFAOYSA-N 287.319 2.403 10 20 CECD CC1(C)CC(CNC(=O)c2c(F)ccc(O)c2O)C1 829728651 PVCZNDINKYAJBD-UHFFFAOYSA-N 267.300 2.403 10 20 CECD Cc1ccc(C(=O)OCC(=O)C(C)(C)C)c(O)c1O 727005520 RVVJULSFDFUSJF-UHFFFAOYSA-N 266.293 2.178 10 20 CECD CCOC(=O)NCCCC(=O)N[C@H](C)c1ccccc1O 827941139 NQDFRLUHGSHTOH-LLVKDONJSA-N 294.351 2.096 10 20 CECD CCOC(=O)[C@H](C(=O)N(C)Cc1ccccc1O)C(C)C 820878595 KXUMKZVNIWRMLT-AWEZNQCLSA-N 293.363 2.186 10 20 CECD CCOc1ccc(N(C)C[C@@H]2CCNC(=O)CC2)cc1 827873179 PJLWMSARAUABEZ-ZDUSSCGKSA-N 276.380 2.438 10 20 CECD C[C@@H](NC[C@H]1CCN1C)c1ccc(Cl)cc1O 903317821 VHUGYORTPYMBSP-MWLCHTKSSA-N 254.761 2.400 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CCOC2(CCC2)C1 901133867 ZGORVQSGSBCANI-LBPRGKRZSA-N 291.347 2.063 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@]2(C)CCC(=O)N2)c1 834910343 WMPZDSWORBROLB-XHDPSFHLSA-N 262.353 2.020 10 20 CECD C[C@H]1COCCN1CCN[C@H](C)c1ccc(Cl)cc1O 841745738 ACAPMDFTYQNGHX-NWDGAFQWSA-N 298.814 2.417 10 20 CECD COc1ccc(N(C)Cc2cc(=O)c(OC)co2)cc1 844353037 OVZOGPJHSRPKSD-UHFFFAOYSA-N 275.304 2.293 10 20 CECD COC(=O)c1cnc(S[C@@H](C)c2n[nH]c(C)n2)s1 840209961 JBUDPIQNTOXABT-YFKPBYRVSA-N 284.366 2.210 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@H](CN)C2)cc1F 841083263 ADYBKTAOQAIBAD-DGCLKSJQSA-N 265.376 2.109 10 20 CECD CCc1cccc(CN2CC(=O)N[C@@H]3CCCC[C@H]32)c1O 848886196 UXCHVBCAZLZLEQ-HUUCEWRRSA-N 288.391 2.198 10 20 CECD COC(=O)[C@H](CNC(=O)c1cc(O)cs1)CC(C)C 743630236 QICMELIVTOVUIO-VIFPVBQESA-N 285.365 2.019 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCNC2(C)C)cc1F 841085975 JZMNKCHEGYGZRL-CQSZACIVSA-N 265.376 2.122 10 20 CECD Nc1ccc(NC(=O)[C@@]2(C(=O)O)CC=CCC2)cc1 849364812 QBRGIHXPGPOEEN-CQSZACIVSA-N 260.293 2.018 10 20 CECD COC[C@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 743474195 RJTCWQMLXODVLG-KBPBESRZSA-N 278.396 2.209 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(O)CCC1 840556016 UJLWFNKNJHEOCA-ZDUSSCGKSA-N 290.407 2.023 10 20 CECD COCCOc1ccccc1/C=C1\SC(=S)NC1=O 751444111 WAZLKQIPWQUQDE-FLIBITNWSA-N 295.385 2.201 10 20 CECD CCNC(=O)C1(CNCc2ccc(OC)c(C)c2)CCC1 752930519 JCBLAJDCUUPVHX-UHFFFAOYSA-N 290.407 2.400 10 20 CECD O=C1NC2(CCN(Cc3cccc(Cl)c3O)CC2)CO1 753586884 LOUUVIMQDPLCRA-UHFFFAOYSA-N 296.754 2.120 10 20 CECD C[C@@H]1C[C@@H](NCCC(=O)N(C)C)c2c(O)ccc(F)c21 756517982 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1356083503 QBKQDISWONBABU-LSDHHAIUSA-N 296.436 2.056 10 20 CECD CS[C@@H](CO)[C@@H](C)NCc1ccc(N2CCCC2)cc1 219077192 BSPSVACXIPBTIX-CJNGLKHVSA-N 294.464 2.489 10 20 CECD Cc1nc(N[C@H](C)c2ccccc2O)ccc1-c1nn[nH]n1 1606077955 GPSKNEQQILQLDY-SECBINFHSA-N 296.334 2.449 10 20 CECD COC(=O)CCCN(C)c1ccc(OC)c(F)c1 121827463 CUCCGEBOYMIYPB-UHFFFAOYSA-N 255.289 2.224 10 20 CECD COc1cc(Cl)cc(CNCC2(C)COC2)c1O 228674102 MHKANQUZTPMPFX-UHFFFAOYSA-N 271.744 2.180 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@H]2C(=O)O)cc1F 1573991480 KGHOQJZFNQDDQG-LBPRGKRZSA-N 284.306 2.080 10 20 CECD O=C(O)[C@H]1CCC[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1 1777660407 DNLHGIKFYPIXRW-GXSJLCMTSA-N 294.307 2.033 10 20 CECD COc1cc(O)c(CN2CCO[C@H](C)[C@H]2C)cc1OC 160431989 BCNOQCBPZBMSJE-GHMZBOCLSA-N 281.352 2.019 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C[S@](C)=O)cc1 168215678 GLUYKHMCAPUWFL-ORAYPTAESA-N 282.453 2.389 10 20 CECD COc1cccc(O)c1CNC[C@]1(O)CCC[C@@H]1C 815160154 REFUBIURYZWWTE-XHDPSFHLSA-N 265.353 2.042 10 20 CECD CCOCCOCCN[C@@H](C)c1cc(OC)ccc1O 927088007 UADXIYJFLVMIJG-LBPRGKRZSA-N 283.368 2.105 10 20 CECD Cc1ccc(O)c(CNCC2([S@@](C)=O)CCC2)c1 280642429 NFXQAQAWICJYJW-GOSISDBHSA-N 267.394 2.091 10 20 CECD CCc1nnc(CNCc2cc(F)ccc2O)s1 290766094 BVUKLUMWHJNTMY-UHFFFAOYSA-N 267.329 2.235 10 20 CECD COc1ccc(O)c(CNC2CC(SC)C2)c1 708316200 KFMOUDPBRCNHQL-UHFFFAOYSA-N 253.367 2.384 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(NC=O)cc2)cc1 174439724 XHEJDNSBHXCADH-UHFFFAOYSA-N 297.358 2.251 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)c1cc[nH]c1 68238173 PPBVTVVNCGQBNF-UHFFFAOYSA-N 299.374 2.124 10 20 CECD COCCN1CCC(N[C@H](C)c2cc(F)ccc2O)CC1 185145289 QUZCRKYCZXXKGQ-GFCCVEGCSA-N 296.386 2.293 10 20 CECD C[C@H](NCCCOC[C@@H]1CCOC1)c1ccccc1O 183525317 YSWSEWDWNTZPGL-KBPBESRZSA-N 279.380 2.486 10 20 CECD CC(C)N(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 70944394 BLVJWMSQBNYGAF-UHFFFAOYSA-N 277.412 2.051 10 20 CECD CSCCCNC(=O)N(C)Cc1ccccc1O 77621324 JMIWUPMBUWDLFO-UHFFFAOYSA-N 268.382 2.287 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C1=CCCCO1 74191361 UDAZIVHPSOMDDB-UHFFFAOYSA-N 288.347 2.172 10 20 CECD CC[C@@]1(CO)CCCN1Cc1ccc(N(C)C)cc1 191957794 PMKJCSBDOIBRLO-INIZCTEOSA-N 262.397 2.490 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1ccc(C)c(C)c1O 273581532 MTLGGLRZRUQPDU-CJNGLKHVSA-N 281.396 2.447 10 20 CECD COc1cccc(CN2CCC[C@@H](N(C)C)CC2)c1O 277442602 KECHOUQDZGDQPD-CQSZACIVSA-N 278.396 2.317 10 20 CECD O=C1CCC[C@@H]1[C@@H]1COCCN1Cc1cc(F)ccc1O 373752172 VQYBIOAJZRSSJX-KGLIPLIRSA-N 293.338 2.101 10 20 CECD COc1cccc(O)c1CN1CC[C@H](N2CCCC2)[C@@H]1C 809724187 GBPSQPZUAYCSQL-ZFWWWQNUSA-N 290.407 2.459 10 20 CECD CCCCN1CC(=O)N[C@H]1c1ccc(OCCC)cc1O 298795599 SRMYJZZJOYCPMC-MRXNPFEDSA-N 292.379 2.412 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C)CC(C)(C)O)c1 296371896 JGJQQLNIVFZWCN-QWRGUYRKSA-N 295.379 2.379 10 20 CECD CCO[C@H](CCNC(=O)c1c(F)ccc(O)c1O)C(C)C 294794703 BAKSBWQYFPJUMD-GFCCVEGCSA-N 299.342 2.418 10 20 CECD COc1cccc(CN2CCC[C@H](CCO)CC2)c1O 817419369 UTPRPBBXMLIZSV-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD C[C@H](NCC[C@H]1CCNC1)c1ccc(F)cc1O 817955006 OFRHNLUFYNEXMY-WDEREUQCSA-N 252.333 2.182 10 20 CECD Oc1c(Br)cccc1CN1CC2(CCOC2)C1 816670069 LCIAEWPDWUQXFW-UHFFFAOYSA-N 298.180 2.377 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)C[C@@H](CC)O1 817640664 RHOWOHFMVKCUGV-TXEJJXNPSA-N 293.363 2.436 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCc2nc(C)ncc2C1 725847434 MGJPJGKQJGPSGQ-CYBMUJFWSA-N 299.374 2.146 10 20 CECD CCOCCCC(=O)N[C@@H](C)c1cc(OC)ccc1O 728977971 JGJWAKYPXCDXCX-NSHDSACASA-N 281.352 2.395 10 20 CECD Cc1cc(O)c(CNC[C@H](C)N(C)C)cc1Cl 825425548 BTFZGMROEJHVOG-JTQLQIEISA-N 256.777 2.394 10 20 CECD CON(C)Cc1c(O)ccc(C(=O)c2ccccc2)c1O 728194489 MBMDPCOIWNFARU-UHFFFAOYSA-N 287.315 2.322 10 20 CECD OCCOCCN(Cc1cccc(Cl)c1O)C1CCC1 827204375 SRVGASLYEXMSPU-UHFFFAOYSA-N 299.798 2.409 10 20 CECD COC(=O)c1cnc(SCc2nc(C)cc(O)n2)s1 829680721 DHURDIAPZSTTKN-UHFFFAOYSA-N 297.361 2.026 10 20 CECD CN(C)c1ccc(CNC[C@](C)(O)C2CC2)cc1F 733326503 HEHOPIVUPDPNSD-HNNXBMFYSA-N 266.360 2.142 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCC[C@@H]1CCOC1 837063876 FEBJKXPOCFRBOQ-DIECRNLCSA-N 291.347 2.044 10 20 CECD C[C@H](NC[C@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 834908149 HGCWGJGBVGRLJR-LRDDRELGSA-N 275.396 2.072 10 20 CECD COC(=O)CCN(CC(C)C)C(=O)c1cc(O)cs1 732274112 KQAOTJOFKDWBRQ-UHFFFAOYSA-N 285.365 2.115 10 20 CECD C[C@H](N)C[C@@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 902519209 XYWGMOCLUSVOQX-JJRVBVJISA-N 292.471 2.071 10 20 CECD O=C1[C@@H](NCc2cccc(Cl)c2O)C[C@@H]2CCCCN12 835075660 ZLUYKQGAFLDRRI-AAEUAGOBSA-N 294.782 2.289 10 20 CECD CCN(C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 732922774 ZNZKXJPABYMYCB-ZDUSSCGKSA-N 291.395 2.246 10 20 CECD COC(=O)N1CCC[C@@H](NCc2c(O)cccc2Cl)C1 733327565 VGQYSAOLFBRBTR-SNVBAGLBSA-N 298.770 2.366 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2C[C@H]2C(C)C)c(O)c1 838767975 SKPQVOZJKZYBOQ-QWHCGFSZSA-N 278.352 2.245 10 20 CECD CC(C)CS(=O)(=O)NCc1cc(Cl)ccc1O 845998678 POOJQZNJWPVSBK-UHFFFAOYSA-N 277.773 2.121 10 20 CECD CCN(CC(=O)Nc1ccon1)c1ccc(OC)cc1 746109723 USDLCPUYAQIJGU-UHFFFAOYSA-N 275.308 2.148 10 20 CECD COc1ccc(N2CCN(c3ccccn3)CC2)c(OC)c1 846745891 SYOJPJGEIVNFRL-UHFFFAOYSA-N 299.374 2.425 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@@H]1CCCNC1 841043585 UHLMKCNKMQCXDY-SNVBAGLBSA-N 258.724 2.026 10 20 CECD COc1cccc([C@H](C)NCC(C)(C)N(C)C)c1O 846136122 GYIQZNUZEHFGPM-NSHDSACASA-N 266.385 2.392 10 20 CECD NC[C@@H]1CC[C@H](NCc2cc(Br)ccc2O)C1 841084524 KFPXFGAKUOIWCZ-SKDRFNHKSA-N 299.212 2.372 10 20 CECD Cc1cc(C(=O)NC2([C@H](C)O)CC2)c(C)n1-c1ccccn1 856132171 WXOBHQZDSOVOAT-ZDUSSCGKSA-N 299.374 2.132 10 20 CECD CN(C)c1ccc(CNC(=S)NCC(F)(F)F)cc1 750979942 GDJRYSYPYIKRGC-UHFFFAOYSA-N 291.342 2.279 10 20 CECD CCN(C)c1ccc(CN(C)C[C@H]2C[C@@H](O)C2)cc1 859971938 UQIJNKUYUOZCFX-FZNQNYSPSA-N 262.397 2.345 10 20 CECD CCC[C@@H](CCO)N[C@H](C)c1cc(C(=O)OC)ccc1O 866415600 ZMFFCQAHLCMVIH-YPMHNXCESA-N 295.379 2.381 10 20 CECD CCNc1nc(C(=O)NCc2ccccc2O)cs1 769002961 YWIYXNIJVUZFAT-UHFFFAOYSA-N 277.349 2.211 10 20 CECD COC(C)(C)CC(=O)NCc1cc(C)ccc1O 862755009 AQGNJCPLKQRMCK-UHFFFAOYSA-N 251.326 2.132 10 20 CECD CC[C@H](C)[C@H](NCc1cc(F)cc(F)c1O)C(=O)O 1119545518 ZAKCOFXJLAZHJA-CPCISQLKSA-N 273.279 2.259 10 20 CECD CC(=O)NC[C@H]1CCCCN1Cc1cc(C)ccc1O 877676076 XVFHZKVEZXJMCC-OAHLLOKOSA-N 276.380 2.191 10 20 CECD CC(=O)c1cc(F)cc(Cn2cc(C3CC3)nn2)c1O 880994469 BRDHWRMMTOOOFY-UHFFFAOYSA-N 275.283 2.251 10 20 CECD C[C@@H](NCCCNC(=O)C1CCC1)c1c(O)cccc1F 886549909 PBWXZYTWYCEANZ-LLVKDONJSA-N 294.370 2.488 10 20 CECD C[C@H]1CCN(C(=O)NCc2ccc(N)cc2)C[C@@H]1C 1120677162 LWPKPMBKQIAQRH-RYUDHWBXSA-N 261.369 2.456 10 20 CECD COc1ccc(CN[C@@H](C)c2csnn2)c(O)c1OC 894926573 UFDHLOMCQJQTBE-QMMMGPOBSA-N 295.364 2.112 10 20 CECD COC[C@]1(C(F)(F)F)CCN(CCN=[N+]=[N-])C1 409435925 XIVHPMKDESJTOU-QMMMGPOBSA-N 252.240 2.198 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CC[C@H](C)C2)c(O)c1 793066087 KNIMNXRUEYWWTO-JQWIXIFHSA-N 278.352 2.389 10 20 CECD O=C(NCc1cc(Cl)ccn1)c1cccc(O)c1O 790912135 NVTUZSWJOMOHST-UHFFFAOYSA-N 278.695 2.076 10 20 CECD O=C(N[C@@H](CCO)Cc1ccccc1)c1cc(O)cs1 799853857 KXRMRPOTHTUGPW-LBPRGKRZSA-N 291.372 2.177 10 20 CECD COc1ccc(N2CCN(CCSC)CC2)cc1 194671080 YSTJBSIAVSPCIW-UHFFFAOYSA-N 266.410 2.180 10 20 CECD C[C@@H](CCNCc1cc(Cl)ccc1O)N(C)C 697835602 FVBOLESPLHAELQ-JTQLQIEISA-N 256.777 2.475 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](CF)C1 1339816836 AUQNKLADZYQAQG-TXNVCOODSA-N 279.311 2.319 10 20 CECD CCN(C)c1ccc(Cn2cc(CCCOC)nn2)cc1 1333535560 GZEORQPDCCSCRX-UHFFFAOYSA-N 288.395 2.362 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CC[C@H]1[C@H](O)C3)CCC2 1349959443 WTPMPCSKGJGLLS-XNJJOIOASA-N 273.376 2.226 10 20 CECD C[C@H](NCCN1CCSCC1)c1ccc(N(C)C)cc1 223464598 HRQNFVWCDLWEPN-AWEZNQCLSA-N 293.480 2.452 10 20 CECD CC[C@@H](C)N(CC(=O)O)Cc1ccc(F)c(F)c1O 1604961484 QWABGSMPDXLSPP-MRVPVSSYSA-N 273.279 2.356 10 20 CECD COc1cccc(O)c1CNCCC1(OC)CCC1 815145668 BPFCSJNMDZFWIV-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Cc1cc(C)nc(NC(=O)c2cccc(O)c2O)c1 157116436 RKIYIMQNLDDKTR-UHFFFAOYSA-N 258.277 2.362 10 20 CECD CCOc1cccc(CNCc2snnc2C)c1O 291710750 LITMJEADLGDEBR-UHFFFAOYSA-N 279.365 2.241 10 20 CECD CN(CCS(C)(=O)=O)Cc1c(O)ccc2ccccc12 76265712 KZLVWRGQGIKDLK-UHFFFAOYSA-N 293.388 2.022 10 20 CECD CC(C)(C)c1cc(NC(=O)Cc2ccc(N)cc2)[nH]n1 82284210 RQCHADAGKWPXHT-UHFFFAOYSA-N 272.352 2.471 10 20 CECD CC[C@H](NC(COC)COC)c1ccccc1O 388407203 UNGZXJAFVACBPC-ZDUSSCGKSA-N 253.342 2.094 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](C)[C@H](O)C2)c1O 388201524 SETBJLIDWUZGBW-ISVAXAHUSA-N 283.755 2.061 10 20 CECD CCCc1cc(C(=O)N(C)Cc2ccccc2O)[nH]n1 174949291 NZGZHYKXGIMBAE-UHFFFAOYSA-N 273.336 2.340 10 20 CECD O=C(C[C@H]1CCCN1)NCc1ccc(N2CCCC2)cc1 178711102 UOVRIRVFOBYDJQ-OAHLLOKOSA-N 287.407 2.045 10 20 CECD CN(C)[C@H](CNCc1c(O)cccc1Cl)C1CC1 113324822 RXZLECYOKXTTGL-CYBMUJFWSA-N 268.788 2.475 10 20 CECD Cc1ccc(O)c(CNCc2c(O)nnc(C)c2C)c1 1341792772 GQWDSNKUGGSRRZ-UHFFFAOYSA-N 273.336 2.103 10 20 CECD O=Cc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)[nH]1 175142131 XOJWYWPSGSUUTB-UHFFFAOYSA-N 297.358 2.357 10 20 CECD CCN(C)C(=O)[C@@H](C)NCc1cc(Cl)ccc1O 188488090 WPTGEBOOXWTZFC-SECBINFHSA-N 270.760 2.002 10 20 CECD COCCCNCc1cccc(Br)c1O 42411804 LHQFYSFOKHPHAD-UHFFFAOYSA-N 274.158 2.281 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(F)ccc2O)C[C@@H]1C 188110297 PROSPMZMKCZJPE-GWCFXTLKSA-N 281.327 2.162 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H]2CO)c1O 184683502 CGBASZPPZJIMSF-NSHDSACASA-N 271.744 2.011 10 20 CECD CNC(=O)c1cccc(CN(C)Cc2ccccc2O)c1 72964107 KTRKJTIBYUKBOE-UHFFFAOYSA-N 284.359 2.384 10 20 CECD CC(C)[C@@H](CO)NCc1cccc(Br)c1O 86120699 BTIGHVCPEWUWCF-LLVKDONJSA-N 288.185 2.261 10 20 CECD Cc1nc(C)c(C(=O)NCc2ccccc2O)s1 221542496 PDGAAEIUQATZNH-UHFFFAOYSA-N 262.334 2.396 10 20 CECD CCOCC(C)(C)NCc1cc2c(cc1O)OCO2 293079504 WDYDYLPDSISAKT-UHFFFAOYSA-N 267.325 2.026 10 20 CECD CCOC(=O)CN(Cc1cccc(OCC)c1O)C1CC1 91773064 WJUVOJUQJYQTRL-UHFFFAOYSA-N 293.363 2.318 10 20 CECD CC(C)Nc1ncccc1C(=O)NCCc1ccc(N)cc1 262587956 XSWHIQIXUXSKSL-UHFFFAOYSA-N 298.390 2.457 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)CC[S@@](=O)C1 277362005 FHFZDAFSIHIBNN-XTZNXHDOSA-N 287.812 2.246 10 20 CECD CCNC(=O)C1(CNCc2ccc3c(c2)CCO3)CCC1 277444508 OSKFWVIUTZVEFN-UHFFFAOYSA-N 288.391 2.018 10 20 CECD Cc1ccc(C(=O)N2CC[C@H](C3CC3)C2)c(O)c1O 370360077 QYNQGTDHNXLWDH-NSHDSACASA-N 261.321 2.278 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCC2(CCC2)C1 295089834 JGTVZVIVYAVNQF-UHFFFAOYSA-N 265.284 2.253 10 20 CECD CC(C)(C)CC(=O)COC(=O)c1cccc(O)c1O 805531163 BOEVKBNSLPGSGH-UHFFFAOYSA-N 266.293 2.260 10 20 CECD C[C@@H](N[C@H](CN)C1CC1)c1cc(Cl)ccc1O 817959427 FWPAWXKWAIFRKX-PRHODGIISA-N 254.761 2.434 10 20 CECD c1cc2c(cc1CNCCO[C@H]1CCCCO1)CCO2 813334093 WUOBMASDMLOLAN-INIZCTEOSA-N 277.364 2.254 10 20 CECD COC[C@]1(CN[C@@H](C)c2ccc(N(C)C)cc2)CCCN1 817974209 JKIWGHGFFOIEOQ-WMLDXEAASA-N 291.439 2.172 10 20 CECD C[C@@H](NCCNC1CC1)c1cc(F)cc(F)c1O 817952369 FAOPWBVSJSNCMZ-MRVPVSSYSA-N 256.296 2.073 10 20 CECD C[C@@H](NC[C@H](N)c1ccc(N(C)C)cc1)c1ccncc1 817939167 AAPDPVRLNKBLQB-DYVFJYSZSA-N 284.407 2.498 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)c3ccc[nH]3)C2)cc1 819580371 IQSLSJKNGJKGIT-CYBMUJFWSA-N 299.374 2.280 10 20 CECD CO[C@H]1COCC[C@H]1CNCc1cccc(Cl)c1O 824708917 LHLNRNMUPVCHRA-GWCFXTLKSA-N 285.771 2.187 10 20 CECD O=C(c1cc(O)cs1)N1CCOC[C@H]1c1ccco1 735125981 QEVBNPKMIGFMMO-JTQLQIEISA-N 279.317 2.260 10 20 CECD CC(C)(N)CCNCc1cccc(Br)c1O 903938541 FPUPJSCAZWGIMI-UHFFFAOYSA-N 287.201 2.372 10 20 CECD Fc1cc(CNCC2CC2)cc(F)c1N1CCOCC1 839146843 XIIADONFSSWZHD-UHFFFAOYSA-N 282.334 2.301 10 20 CECD COC1([C@@H](C)NCc2ccc3c(c2)CCO3)CCOCC1 834555531 ZOTDJFJGLIWYRT-CYBMUJFWSA-N 291.391 2.295 10 20 CECD Cc1cccc2nc(CNC(=O)c3cc(O)cs3)cn12 732290824 DBBOVQJGEMRBBJ-UHFFFAOYSA-N 287.344 2.340 10 20 CECD CCc1cccc(CN2C[C@H](C)S(=O)[C@@H](C)C2)c1O 848905468 IBKUNVIVORYZJV-RYUDHWBXSA-N 281.421 2.296 10 20 CECD O=C(NCc1ccc(O)cc1O)C1[C@H]2CCCC[C@H]12 910951831 VZKXZDLUKHCWMB-RYUDHWBXSA-N 261.321 2.150 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC([C@@H](C)N)CC2)c1O 843348737 OUOXARFYWKNDDF-SNVBAGLBSA-N 294.370 2.293 10 20 CECD CSC[C@@H]1CCCN1C(=O)NCCc1ccc(N)cc1 841960307 LTNXZRCJXIUBFG-AWEZNQCLSA-N 293.436 2.348 10 20 CECD CC[C@H]1C[C@@H](CC(=O)NCc2ccc(O)cc2O)CCO1 910949362 KHXKUARQNIEDDI-FZMZJTMJSA-N 293.363 2.309 10 20 CECD CCc1cccc(CNC[C@H]2CCOC[C@H]2OC)c1O 848915846 MNOXDLDWXXMIGO-UKRRQHHQSA-N 279.380 2.096 10 20 CECD Cc1cc(CN(CC(=O)O)C(C)C)ccc1N(C)C 846267642 VIKJEBGAPKSGDU-UHFFFAOYSA-N 264.369 2.356 10 20 CECD COc1ccc(N(C)CCN(C)C[C@H](O)C(C)C)cc1 844402957 YBSRLWQWDKPDRW-INIZCTEOSA-N 280.412 2.080 10 20 CECD COc1cccc([C@H](C)NCc2nnc(C)s2)c1O 846166490 XUUVLRSHHIGPFU-QMMMGPOBSA-N 279.365 2.412 10 20 CECD C[C@H](C[C@H]1CCOC1)NC(=O)Nc1ccc(N)cc1 841299737 JHTAAPHFTLVWDS-GHMZBOCLSA-N 263.341 2.205 10 20 CECD CC[C@H](C)C[C@@H](CO)NCc1cc(OC)ccc1O 843427557 RCCUKZYSZLNDCG-AAEUAGOBSA-N 267.369 2.288 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCC(=O)O 740118390 DCDVHRQGWJOJCT-UHFFFAOYSA-N 292.360 2.360 10 20 CECD COc1cccc([C@@H](C)NC[C@H](O)C2CCC2)c1O 846170298 WKVRVXZNYISYRH-MFKMUULPSA-N 265.353 2.212 10 20 CECD CCc1cccc(CN2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)c1O 848905804 OKRVOMPNYNQXHA-NWANDNLSSA-N 288.391 2.040 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)c1cc(CO)on1 925081020 ORJBVQKMHPYQMB-GFCCVEGCSA-N 289.379 2.392 10 20 CECD COc1ccc(N(C)CC[C@H]2CCOC2=O)cc1OC 753844100 QNHJTPXLBODAAS-NSHDSACASA-N 279.336 2.093 10 20 CECD CCn1cc(CN[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)nn1 850522522 SUEQVYRHWVLSIX-SKDRFNHKSA-N 290.342 2.481 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCCCO2)c1 858278576 DGRUHVBEJAWMOO-ZDUSSCGKSA-N 278.352 2.069 10 20 CECD CCOc1ccc(CN2CC[C@H](C(=O)O)[C@H](C)C2)c(O)c1 863740561 XREQEGMGYBCZHH-RISCZKNCSA-N 293.363 2.334 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)[C@@H](C)C2)c1 862757914 IDRQCFWBGHNGGW-RYUDHWBXSA-N 275.348 2.322 10 20 CECD COC(=O)c1cnc(SC[C@H]2CCO[C@H]2C)s1 865368915 GKBCAUAUBAIFRN-JGVFFNPUSA-N 273.379 2.447 10 20 CECD CCCOc1ccccc1NC[C@@H](O)CN1CCCC1 863556215 OVCMBBQQJQDZMO-CQSZACIVSA-N 278.396 2.344 10 20 CECD CCN(CC)CCO[C@H]1CCN(Cc2ccccc2O)C1 779025976 RTTNGQCBZIXMPC-INIZCTEOSA-N 292.423 2.325 10 20 CECD C[C@H](CC(=O)N(C)c1ccc(N)cc1)[C@@H]1CCCNC1 877079229 VLXODPLIDVOSDL-CHWSQXEVSA-N 275.396 2.257 10 20 CECD C[C@@H](CCO)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776248399 ZMACGGOBHFAQPF-STQMWFEESA-N 293.411 2.131 10 20 CECD CC(C)[C@@H](O)C(C)(C)CNC(=O)NCc1ccc(N)cc1 1120592435 WXVJHUKZXDLVAR-CQSZACIVSA-N 293.411 2.111 10 20 CECD COc1cccc(CNC(=O)C(C)(C)C(F)F)c1O 792237424 DAKVVGXHHBCDFV-UHFFFAOYSA-N 273.279 2.308 10 20 CECD CCOC(=O)c1cnc(S[C@H](C)[C@@H](C)O)s1 390476026 JDDJOKCVKSRRSX-RNFRBKRXSA-N 261.368 2.181 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2ccc(OCC)cc2O)C1 896962001 HJORTIPBFCCUDL-CYBMUJFWSA-N 293.363 2.176 10 20 CECD CCc1nncn1CCN[C@@H](CC)c1ccc(F)cc1O 796779503 DMZHHXZNERREGM-ZDUSSCGKSA-N 292.358 2.426 10 20 CECD CN(CCc1ccncc1)C(=O)NCc1ccc(N)cc1 1337017966 FVKZZOSXBYEBBK-UHFFFAOYSA-N 284.363 2.048 10 20 CECD C[C@H]1CCN(Cc2cc(F)ccc2O)[C@H](C(=O)O)C1 1594424436 SPONXXLBSLFSBP-CABZTGNLSA-N 267.300 2.216 10 20 CECD CCCONC(=O)N[C@@H](C)c1cc(OC)ccc1O 1345767495 VDVBUMXQNGVRIQ-VIFPVBQESA-N 268.313 2.103 10 20 CECD CCNC(=O)CN(C)Cc1c(O)ccc2ccccc12 109744955 KTZWLYBZIRVACH-UHFFFAOYSA-N 272.348 2.113 10 20 CECD C[C@H](NC[C@@H]1CCCC[C@H]1O)c1cc(C(=O)O)ccc1O 1609780233 NPYIJZMWZBANHF-VHRBIJSZSA-N 293.363 2.292 10 20 CECD CC(C)CNC(=O)[C@H](C)N[C@H](C)c1ccccc1O 135719080 DPKJLZQKCCVJHP-NEPJUHHUSA-N 264.369 2.204 10 20 CECD CCOc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3)c1O 156278511 SQHIBVHRJOSNKO-KGLIPLIRSA-N 276.380 2.117 10 20 CECD Nc1ccc(CNC(=O)[C@H]2COc3ccccc32)cc1 70389774 MIQYDRBEJJKXQW-AWEZNQCLSA-N 268.316 2.061 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](O)C2CCC2)c1 315761464 CLDDRFCIQRJQJZ-BMIGLBTASA-N 265.353 2.212 10 20 CECD C[C@H](NCCCn1cncn1)c1ccc(N(C)C)cc1 381798136 PEJSORKMPLNQDU-ZDUSSCGKSA-N 273.384 2.085 10 20 CECD COCC[C@H](C)NC(=O)N(C)Cc1ccc(N(C)C)cc1 101613520 JBUPBQKFZMPREF-ZDUSSCGKSA-N 293.411 2.319 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CC(C)(C)CN 1340319655 KZDXKJRMYCLTPT-UHFFFAOYSA-N 291.439 2.476 10 20 CECD CC1(C)[C@@H]2CC[C@@]1(C(=O)NCc1ccccc1O)C(=O)C2 1346452952 ZUVOCTQMPMAGTQ-PXAZEXFGSA-N 287.359 2.404 10 20 CECD C[C@H](NCCCO[C@H]1CCOC1)c1cc(F)ccc1O 185705614 QWDDTBJWKLMDEW-AAEUAGOBSA-N 283.343 2.378 10 20 CECD Cc1ncsc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183466032 CWGHBHFOGAIGEP-QMMMGPOBSA-N 292.360 2.224 10 20 CECD CN(C)c1ccc(CN2CCCN3CCC[C@@H]3C2)cc1 378348977 HQNXDPLJEZLGPB-QGZVFWFLSA-N 273.424 2.423 10 20 CECD CCCSCC(=O)N(C)Cc1ccccc1O 80133802 SDDBXPMMTZTYLB-UHFFFAOYSA-N 253.367 2.494 10 20 CECD COc1ccc(O)c(CNCc2cnc(C)s2)c1 40997572 AIKNZAXQVTXORE-UHFFFAOYSA-N 264.350 2.456 10 20 CECD CC[C@@H](O)CCNCc1cccc(Br)c1O 131682019 IGUGLUBSQFZVOJ-SNVBAGLBSA-N 288.185 2.405 10 20 CECD CN(C)c1ccc(CN2CCC[C@@]2(C)C(=O)O)cc1 86816077 UWQHPRTXRDOLHI-HNNXBMFYSA-N 262.353 2.192 10 20 CECD CCN(CC)c1ccc(CNC(=O)Cn2cccn2)cc1 193747479 IUDGDKCSEBIIJK-UHFFFAOYSA-N 286.379 2.046 10 20 CECD CCOC(=O)CN(Cc1cccc(OC)c1O)CC(C)C 91789887 WXCJUJQVPDWSLN-UHFFFAOYSA-N 295.379 2.422 10 20 CECD Cc1noc(/C=C/c2ccc(N3CCOCC3)cc2)n1 264977378 FLLDOODAPJCUJR-QPJJXVBHSA-N 271.320 2.385 10 20 CECD O=C1OCC[C@@]12CCCN2Cc1c(O)ccc(Cl)c1F 365234454 NTGLUXUCFXCBHG-AWEZNQCLSA-N 299.729 2.466 10 20 CECD Oc1ccc(F)cc1CN1CCN(C2CCC2)CC1 272236092 FODMEHSFHGONAY-UHFFFAOYSA-N 264.344 2.201 10 20 CECD Oc1ccccc1CNCC1CCN(C2CC2)CC1 278468214 GNQRZURQANXQQN-UHFFFAOYSA-N 260.381 2.356 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC(C)(C)CCO)c1 273566865 JUFQTBHZABRLNK-NSHDSACASA-N 295.379 2.238 10 20 CECD CC[C@@H](NCC(=O)NC(C)C)c1ccc(C)cc1O 279975998 DIITUHXCTHOMNP-CYBMUJFWSA-N 264.369 2.266 10 20 CECD O=C(c1cccc(O)c1O)N1CCC([C@H]2CCCO2)CC1 276364415 ZLPOIEALNZJSPL-CQSZACIVSA-N 291.347 2.129 10 20 CECD CC(C)OC[C@H]1CN(Cc2cc(F)ccc2O)CCO1 372123957 GRCJXIBKOMHWRU-CQSZACIVSA-N 283.343 2.157 10 20 CECD C[C@H]1C[C@@H](C)O[C@H]1C(=O)N(C)Cc1ccccc1O 282558103 SMGVPBBDKRAVNN-MISXGVKJSA-N 263.337 2.164 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@]2(CCOC2)O1 280254012 LIZAENSJEZJFJV-RHSMWYFYSA-N 290.407 2.132 10 20 CECD Cc1nccnc1NCc1ccc(N2CCOCC2)cc1 290681192 SLKRVQFPAJYPKG-UHFFFAOYSA-N 284.363 2.234 10 20 CECD CC[C@H](NCCCc1cnn(C)n1)c1ccc(F)cc1O 293791785 UJCAWULWQILXLW-AWEZNQCLSA-N 292.358 2.333 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCO[C@@H](C)C1 819761687 ZIEAGLHXBIDFEL-RYUDHWBXSA-N 298.379 2.309 10 20 CECD Cc1cc(Br)cc([C@H](C)N[C@H](C)CN)c1O 817966749 VBHDUXMXQCNFIH-BDAKNGLRSA-N 287.201 2.461 10 20 CECD COc1cccc(CNCc2cc(C3CC3)nn2C)c1O 824382630 FTBRNURWCSHSII-UHFFFAOYSA-N 287.363 2.302 10 20 CECD CCC[C@@H](C)CS(=O)(=O)NCc1ccccc1O 739963756 ZYPUJILWKHDKLD-LLVKDONJSA-N 271.382 2.248 10 20 CECD CC[C@H]1CN(CC)CCN1Cc1cc(OC)ccc1O 825005911 VHKHPYXDJZXSCM-AWEZNQCLSA-N 278.396 2.317 10 20 CECD CN(C)c1ccc(CN[C@](C)(CC(=O)O)C2CC2)cc1 901951607 ZDCOYKGEXJHMBS-MRXNPFEDSA-N 276.380 2.486 10 20 CECD COC[C@@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 837145932 QOOYUUWAEQESFT-NSHDSACASA-N 279.336 2.047 10 20 CECD COc1ccc(CNC(=O)/C=C(\C)Cl)c(O)c1 907925726 IFKDKJHRDZORBR-VMPITWQZSA-N 255.701 2.160 10 20 CECD Oc1cccc2c1[C@@H](N[C@H]1CCN(CC3CC3)C1)CC2 834575885 PHUNMUDISQIDFU-GJZGRUSLSA-N 272.392 2.453 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 843058486 UIAHEKIYZLQXAF-VHSXEESVSA-N 254.761 2.215 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@H](CO)COC(C)C 840945734 WMFTXBKKIXYHIJ-QGZVFWFLSA-N 294.439 2.279 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@]2(C)CCOC2)c1 756570919 CGPASPDWLRXGLC-BDJLRTHQSA-N 293.363 2.256 10 20 CECD COc1cc(C)cc(CN2CC[C@H](CN(C)C)C2)c1O 754742254 UVMNKSSOFXGHNK-CYBMUJFWSA-N 278.396 2.093 10 20 CECD CCc1nnc(NC(=O)NCc2cc(C)ccc2O)s1 860264413 UHHKTYBTHADHKG-UHFFFAOYSA-N 292.364 2.436 10 20 CECD CC(=O)c1cc(Cl)cc(CN(CCO)C(C)C)c1O 50158094 KZNHCVJLMBIICW-UHFFFAOYSA-N 285.771 2.451 10 20 CECD Cc1cncc(NC(=O)/C=C\c2ccc(O)c(O)c2)c1 779531819 YVOJSJIBKOTHNZ-HYXAFXHYSA-N 270.288 2.453 10 20 CECD Cc1cc(CN[C@H]2C[C@H](O)C2(C)C)ccc1N(C)C 779414353 XTCDKBXTMKXRIO-GJZGRUSLSA-N 262.397 2.310 10 20 CECD Cc1ccc(CN2CCO[C@H](C(F)F)C2)c(O)c1 877502576 MTSKODVLXXUWND-LBPRGKRZSA-N 257.280 2.167 10 20 CECD CCN(C)c1ccc(CN(CCCO)C2CC2)cc1 773752774 JXLMNYMLGQARDE-UHFFFAOYSA-N 262.397 2.490 10 20 CECD Cc1ncc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)[nH]1 773020758 VKVMCIUWRYOLLA-SNVBAGLBSA-N 272.352 2.275 10 20 CECD CN(Cc1cccc(CN)c1)Cc1ccccc1O 1578493188 JCJOJMXDATXHBU-UHFFFAOYSA-N 256.349 2.483 10 20 CECD CC[C@H](NCCN1CCOC[C@H]1C)c1ccc(F)cc1O 796751595 AGLMHVBVFUJKMA-DOMZBBRYSA-N 296.386 2.293 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CC[C@@H]1O 1204324531 MSXZQWZZOHQIMI-PBHICJAKSA-N 274.408 2.490 10 20 CECD CCN(CCCO)Cc1c(O)ccc(Cl)c1F 792166884 VDOYGWWNVQFBBW-UHFFFAOYSA-N 261.724 2.389 10 20 CECD CCN(Cc1cc2c(cc1O)OCO2)C[C@@H]1CCCO1 98052450 BWCSXGOSOVTPHZ-LBPRGKRZSA-N 279.336 2.122 10 20 CECD COc1cccc(O)c1CN1CC[C@H]([C@@H]2CCOC2)C1 769517202 ZXLJKGMAUNJUFW-QWHCGFSZSA-N 277.364 2.259 10 20 CECD COc1cccc(O)c1CN[C@H]1CCC[C@H]1CCO 778216488 OSOQNJZAKWYOBM-AAEUAGOBSA-N 265.353 2.042 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H](C)C(=O)NCCF 1322652766 PWUSZINSXXQVGA-IJLUTSLNSA-N 294.370 2.313 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCC[C@@H]3OCC[C@H]32)cc1 1337016681 UNCLVQXNWWVPSQ-ZNMIVQPWSA-N 289.379 2.026 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H]1C[C@H]2C=C[C@H]1C2 1334816024 PBYSJNNZGJFKSE-MXFADWRWSA-N 285.343 2.439 10 20 CECD CCC1(N[C@@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 1604092150 MMSRIZZWEFTCAE-VIFPVBQESA-N 273.340 2.166 10 20 CECD Cc1nnsc1COc1ccc(N(C)C)c(C(=O)O)c1 1600802478 CLGYOXQGMRADDX-UHFFFAOYSA-N 293.348 2.190 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)Cn2cccn2)c1O 228670950 SPPVDJZQYBLEKM-SNVBAGLBSA-N 295.770 2.429 10 20 CECD O=C(CO)Nc1sc(-c2ccccc2)cc1C(=O)O 1574300649 TWPKCXVMMLPCRV-UHFFFAOYSA-N 277.301 2.044 10 20 CECD C[C@@H](NC/C=C\C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589961140 ARMXLHSGBLONTP-UMBAGQNISA-N 285.351 2.189 10 20 CECD C[C@@](CCF)(NCc1cc(Cl)ccc1O)C(=O)O 1592506277 JTWFTHVDEMPDNQ-LBPRGKRZSA-N 275.707 2.338 10 20 CECD CC(=O)N[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 158065077 ATDCNNDJSJGMFQ-ZDUSSCGKSA-N 282.771 2.146 10 20 CECD Cc1cccc(O)c1CNCc1nn(C)cc1Cl 877564807 LSZJRSWMMKLDEP-UHFFFAOYSA-N 265.744 2.377 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCC(=O)N(C)C 37751635 OYYOYODILRPBDJ-RYUDHWBXSA-N 276.380 2.317 10 20 CECD COc1cc(Cl)cc(CNCCC2(CO)CC2)c1O 395870316 ZZNWXVYUJLWXFH-UHFFFAOYSA-N 285.771 2.306 10 20 CECD COc1cccc(CNC(=O)[C@H]2Cc3ccccc3O2)c1O 175930123 WOXIWLYGNBKZBV-OAHLLOKOSA-N 299.326 2.021 10 20 CECD C[C@@H](NCCO)c1ccc(N2CCCCC2)c(F)c1 20550959 CSNUVCYQFLZUMO-GFCCVEGCSA-N 266.360 2.459 10 20 CECD COc1ccc(O)c(CNc2ccc([N+](=O)[O-])cn2)c1 301284278 NQWWYEYJMJIOIG-UHFFFAOYSA-N 275.264 2.316 10 20 CECD Oc1cc2c(cc1CNCCCOCC1CC1)OCO2 42879555 SXRIWNVNWONMHR-UHFFFAOYSA-N 279.336 2.027 10 20 CECD Oc1ccccc1CNC[C@@]1(O)CCc2ccccc21 132108406 FPVNSADWQZDMAU-KRWDZBQOSA-N 269.344 2.316 10 20 CECD O=C(O)[C@H](Cc1ccccc1)NCc1ccc2c(c1)CCO2 262691286 GLZMEPGLHNMCEB-INIZCTEOSA-N 297.354 2.407 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@@H]1C[C@H]2CC[C@H]1NC2 530245766 DJDHBNBHQFJSNK-BZHVJNSISA-N 284.762 2.415 10 20 CECD CCN(CCN1CCCC1=O)c1ccc(OC)cc1 299393845 SHIIFRBMZWIXHK-UHFFFAOYSA-N 262.353 2.144 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2ccc(N(C)C)c(C)c2)C1 292720582 FRRIWLKMRPFLQU-QGZVFWFLSA-N 290.407 2.446 10 20 CECD CC1(C(=O)NCc2cc(Cl)cc(Cl)c2O)COC1 807839478 FPUBTFUEVBXZIQ-UHFFFAOYSA-N 290.146 2.352 10 20 CECD COc1ccc(N(C)C[C@@H]2CCNC(=O)CC2)c(OC)c1 294914582 INRSOIGMSORBCI-LBPRGKRZSA-N 292.379 2.056 10 20 CECD Cc1ccc2c(c1)/C(=C/c1cn(C)cn1)C(=O)N2C 811701548 ZODKGHFUOZETAX-QPEQYQDCSA-N 253.305 2.246 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1=COCC1 727766444 TZIHEQOPGCZCAY-UHFFFAOYSA-N 260.337 2.015 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@]1(C)CO 827699282 GGMGMJJCNLNUQR-WBMJQRKESA-N 280.387 2.342 10 20 CECD CCOc1ccc(CN(C)CC(C)(C)CO)c(O)c1 824630585 OSWGGPFDMJHKND-UHFFFAOYSA-N 267.369 2.241 10 20 CECD CO[C@@]1(C)C[C@H]1NCc1cc(Cl)cc(F)c1O 827715781 OXLGBTDEAPCCGA-PWSUYJOCSA-N 259.708 2.452 10 20 CECD CCOCC1(C(=O)N[C@H](C)c2ccccc2O)CC1 827946572 MOSCNSSHFQCDAA-LLVKDONJSA-N 263.337 2.386 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)c(F)c2)no1 733325726 QZPUETIUDXKNQE-UHFFFAOYSA-N 263.316 2.478 10 20 CECD CCn1nc(C)c(CNC(=O)c2cc(O)cs2)c1C 732284048 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775509666 OGAZRLRUMZKZDR-AAEUAGOBSA-N 287.787 2.484 10 20 CECD C[C@@H](Cc1ccco1)NC(=O)NCc1ccc(N)cc1 1120570673 IEVNVTWTCMPFHA-NSHDSACASA-N 273.336 2.292 10 20 CECD CCN(C)c1ccc(CN(CCO)C(C)C)cc1 773745444 BZRVPFQBUMXPQM-UHFFFAOYSA-N 250.386 2.345 10 20 CECD CCn1nccc1C(=O)N(C)Cc1ccc(N(C)C)cc1 772863616 IZQLCTXAIXVWFO-UHFFFAOYSA-N 286.379 2.241 10 20 CECD COc1cc(O)c(CN[C@H]2CC[C@@H](CO)CC2)cc1OC 776250302 GENFNCITGGZWHE-BJHJDKERSA-N 295.379 2.050 10 20 CECD CCN1C(=O)/C(=C\c2ccc(OC)nc2)SC1=S 780149189 UPBJCLQPOBXBLF-RMKNXTFCSA-N 280.374 2.311 10 20 CECD CCOC(=O)CN(Cc1cc(C)cc(OC)c1O)C(C)C 893967326 JWJPALXERUXUJD-UHFFFAOYSA-N 295.379 2.483 10 20 CECD C[C@@H](Cn1ccnc1)N[C@H](C)c1cc(F)ccc1O 94617559 GNYIBNMUYZJYDL-WDEREUQCSA-N 263.316 2.467 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCC(CO)CC2)c1 1325340842 SGKHLPCWEADKRC-AWEZNQCLSA-N 292.423 2.056 10 20 CECD O=C(O)CC1(CNCc2ccc3c(c2)CCO3)CCC1 1324574120 ATPVHEQNNPUQSO-UHFFFAOYSA-N 275.348 2.356 10 20 CECD C/C=C\C[C@H](CO)NCc1cc(F)c(N(C)C)cc1F 1261787925 FZIJIQUSLNMKRL-QMAVJUDZSA-N 284.350 2.448 10 20 CECD CC[C@@H]1OCC[C@H]1N[C@@H](C)c1cc(C(=O)O)ccc1O 1605754518 RPGJJTJKPMVROE-BHYNMZESSA-N 279.336 2.309 10 20 CECD O=C(CCc1ccccc1C(=O)O)NCc1ccccc1O 1608318515 UUSZNKWJLQBRER-UHFFFAOYSA-N 299.326 2.339 10 20 CECD O=C(O)C[C@@H]1CC[C@H](NCc2ccc(F)c(F)c2O)C1 1602112980 WQMQTOKOWPEJME-SCZZXKLOSA-N 285.290 2.403 10 20 CECD C[C@H]1[C@@H](C(=O)O)CCN1Cc1c(O)ccc(Cl)c1F 1604636645 OHOTZTZMABRHJC-YUMQZZPRSA-N 287.718 2.480 10 20 CECD NC(=O)Cc1ccc(NCc2cc(F)ccc2O)cc1 226580678 CXWJDWJYGTVQRI-UHFFFAOYSA-N 274.295 2.171 10 20 CECD CCN(C)c1ccc(CN(CC)[C@@H](C)C(=O)O)cc1 1573875608 VKLAHTZILKHESL-LBPRGKRZSA-N 264.369 2.438 10 20 CECD CCN(CC)[C@H]1CCN(Cc2cc(OC)ccc2O)C1 134060283 UFXRWXYSUZCYON-AWEZNQCLSA-N 278.396 2.317 10 20 CECD Cc1cc(C)c(O)c(CN(C)Cc2cnn(C)c2)c1 163997822 HVTBOQCFLRPMQS-UHFFFAOYSA-N 259.353 2.375 10 20 CECD Cc1cccc(CN[C@@H]2CCNC3(CCC3)C2)c1O 841089614 OUNBQLFSOHXYSQ-CQSZACIVSA-N 260.381 2.465 10 20 CECD C[C@@H](NCC1(CO)CCC1)c1ccc(F)cc1O 186547002 WNZNJVMHASNRGU-SNVBAGLBSA-N 253.317 2.345 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2C[C@H]2C(F)(F)F)cc1 868163170 NGTHTXHSEFTYRH-RKDXNWHRSA-N 259.231 2.341 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)NCC(F)F 173992778 YJJLBYKFAYZKNR-UHFFFAOYSA-N 283.322 2.351 10 20 CECD CO[C@@H]1CCN(Cc2cc(Br)ccc2O)C1 300046368 UIMQLFUPAVSHCN-LLVKDONJSA-N 286.169 2.375 10 20 CECD Cc1cccc(CN2CC[C@@H]3CC[C@@H](C2)N3C)c1O 124608201 YXYJEXHUUGDMNQ-GJZGRUSLSA-N 260.381 2.369 10 20 CECD COC1(CNCc2cc(Cl)ccc2O)CCOCC1 123128202 OTHXALUINJXOQZ-UHFFFAOYSA-N 285.771 2.331 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@H]1C 188115594 IIFVBKSXUCDAOR-CJNGLKHVSA-N 290.407 2.384 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCCc2cn[nH]c21 272561918 BYKGZWSUZJGVIN-HOSRBBHYSA-N 299.330 2.028 10 20 CECD O=C(NC[C@H]1OCCc2ccccc21)c1cccc(O)c1O 366163187 VUEJZWUSKIPAAD-OAHLLOKOSA-N 299.326 2.142 10 20 CECD O=C(NC[C@@H]1OCCc2ccccc21)c1cccc(O)c1O 366162170 VUEJZWUSKIPAAD-HNNXBMFYSA-N 299.326 2.142 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCOC3(CCC3)C2)c(O)c1O 272731173 KBCUMBYUWISBSZ-LLVKDONJSA-N 291.347 2.238 10 20 CECD Cc1cc(C)c([C@@H](C)NCC(F)(F)CO)c(O)c1 285087015 JUTUEDLYOJXLQN-SNVBAGLBSA-N 259.296 2.287 10 20 CECD CS[C@@H]1CCN(C(=O)NCc2ccc(N(C)C)cc2)C1 296268944 MAWXIIQNBYKMJB-CQSZACIVSA-N 293.436 2.400 10 20 CECD Cc1cc(C)c([C@@H](C)Nc2cnn(CCO)c2)c(O)c1 815608950 RVHFHNSJPDSYBR-GFCCVEGCSA-N 275.352 2.371 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CCCSC2)c1O 810328073 HQHXLJBITYYWRU-LLVKDONJSA-N 281.377 2.160 10 20 CECD CCn1ccnc1[C@@H](C)NCc1cc(OC)ccc1O 825006108 YDRYLIJAONSXJA-LLVKDONJSA-N 275.352 2.468 10 20 CECD CC[C@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(N(C)C)cc1 834906876 IRMJHVOAVOLQAY-LZWOXQAQSA-N 289.423 2.447 10 20 CECD COc1cc(O)c(CN[C@@H]2CCS[C@@H]2C)cc1OC 843435095 QFIRXEZOUVVNTI-MWLCHTKSSA-N 283.393 2.393 10 20 CECD CCN(CC)c1ccc(CNC[C@](C)(O)COC)cc1F 740007027 RFQMMBVLJSLFTI-INIZCTEOSA-N 298.402 2.159 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCCN[C@@H]2C)c1 841065683 SUGRHIZUSPZEMO-BXUZGUMPSA-N 264.369 2.021 10 20 CECD CCOCc1cc(CN[C@@H](C)COC)ccc1OC 747855100 ZXZONKLWQZBYCQ-LBPRGKRZSA-N 267.369 2.356 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCNC2(C)C)c1O 841086466 OGZDGACGZYTTTE-LBPRGKRZSA-N 284.787 2.284 10 20 CECD COc1ccc(N(C)CCN(C)c2nccnc2C)cc1 845671035 YPAIUSDSASTREK-UHFFFAOYSA-N 286.379 2.366 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]3CNC[C@H]32)cc1F 841027040 IXVCQCGUUKMTNG-XJKSGUPXSA-N 277.387 2.076 10 20 CECD COC(=O)c1cnc(SCc2cnsn2)s1 848439661 UGCWAVSWAWZXBU-UHFFFAOYSA-N 273.364 2.074 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CC[C@@H](O)C2)c1O 846165009 KDYDLIHQGJXIOL-SDDRHHMPSA-N 265.353 2.212 10 20 CECD O=C(NCc1ccccc1O)NC[C@@H]1CCCS1 756956543 QXKQTVDEOOGDCB-NSHDSACASA-N 266.366 2.087 10 20 CECD CCN(CC)CCOCCNCc1cc(C)ccc1O 757945814 IEPORENQBOBLCX-UHFFFAOYSA-N 280.412 2.149 10 20 CECD CCN(Cc1ccc(N(C)C)c(C)c1)[C@@H](C)C(=O)O 923253484 KXPPCNWMXZRFLW-LBPRGKRZSA-N 264.369 2.356 10 20 CECD CC(C)C1(C(=O)N(C)Cc2ccc(N(C)C)cc2)COC1 929532919 OMYBFGNEQSMTRR-UHFFFAOYSA-N 290.407 2.384 10 20 CECD CC[C@H](N[C@@H](C)C(=O)N(C)OC)c1ccc(N(C)C)cc1 858578520 JTOREOPWOQPTOA-WFASDCNBSA-N 293.411 2.202 10 20 CECD Cc1ccc(O)c(CNC(=O)c2coc(C3CC3)n2)c1 862757188 KPZAZCFIXQZOEV-UHFFFAOYSA-N 272.304 2.496 10 20 CECD C[C@H]1C[C@H](NC[C@H]2C[C@H](O)C2)c2c(O)ccc(F)c21 872127363 VHCGOZYDJTZSCO-GMOBBJLQSA-N 265.328 2.440 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@@H]1C(=O)NCc1ccccc1O 878559678 NVTVKEGJGNJCJV-ZUZCIYMTSA-N 285.347 2.098 10 20 CECD COc1cc(/C=C2/SC(=S)NC2=O)ccc1[N+](=O)[O-] 770568030 IVVSAWUXZFKKSH-WEVVVXLNSA-N 296.329 2.092 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCNc1ccccc1 779519506 OVZGMTVDSDXDTE-VQHVLOKHSA-N 298.342 2.339 10 20 CECD COc1ccc(CNCCNC(=O)CC2CCC2)cc1C 1125281412 MBXOGCSQTKELRO-UHFFFAOYSA-N 290.407 2.400 10 20 CECD CO[C@H](CNC(=O)NCc1ccc(N)cc1)C(C)(C)C 1120677528 RNWAYZLIMITFKF-CYBMUJFWSA-N 279.384 2.129 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CC[C@@H]2C[C@H]2C1 1121366873 VPMPNEYOTVPACE-BDAKNGLRSA-N 276.365 2.095 10 20 CECD CC[C@H](C(=O)NCc1ccc2c(c1)CCCN2C)[C@H](C)O 789964083 SHTLYKSSXAAYIJ-WFASDCNBSA-N 290.407 2.092 10 20 CECD COc1ccccc1CONC(=O)c1cc(O)cs1 799203751 SJCGTWMXQADDPS-UHFFFAOYSA-N 279.317 2.324 10 20 CECD COC(=O)[C@@H]1CC[C@H](N[C@H](C)c2cc(OC)ccc2O)C1 790762184 OPLQBBVUSVXUJV-UTUOFQBUSA-N 293.363 2.393 10 20 CECD CCN(c1nnc(-c2sccc2O)n1C)C(C)C 1519503912 CHGHUBOFGFKVFQ-UHFFFAOYSA-N 266.370 2.484 10 20 CECD CCCCN(Cc1ccccc1O)[C@H](C)C(=O)O 1609970222 FPBMANLCLTUQIX-LLVKDONJSA-N 251.326 2.467 10 20 CECD COc1cccc(O)c1CN1CCC2(CC1)C[C@H]2C(=O)O 1607326890 VRSUCVSPPGLDEY-LBPRGKRZSA-N 291.347 2.088 10 20 CECD Nc1ccc(CC(=O)Nc2cnc(F)c(F)c2)cc1 1580442909 LCFVNTIHMWYNKA-UHFFFAOYSA-N 263.247 2.123 10 20 CECD O=C(C[C@H]1CNc2ccccc21)NCc1cc(O)ccc1O 1580517243 JCTVZKYAAZGQPX-NSHDSACASA-N 298.342 2.313 10 20 CECD O=C(O)/C=C\c1cc(C(=O)N2Cc3cccc(O)c3C2)co1 1594966414 NRVAJUDPSQRSSS-PLNGDYQASA-N 299.282 2.239 10 20 CECD COCCN(C(=O)Cc1ccc(N)cc1)C1CCCC1 843416986 NGLWROOZPWQFFF-UHFFFAOYSA-N 276.380 2.229 10 20 CECD Cc1ccc(CNCC2([S@@](C)=O)CCC2)c(O)c1 877496843 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280.324 2.211 10 20 CECD CCOc1ccc(CN(C)C[C@@H](C)C(=O)OC)c(O)c1 768882771 WPCGZPZGHLGPCP-LLVKDONJSA-N 281.352 2.032 10 20 CECD Nc1ccc(-n2cc(C3CCC(=O)CC3)nn2)cc1 864620521 QQUGAEVXMWTEAU-UHFFFAOYSA-N 256.309 2.076 10 20 CECD Cc1cccc(NC(=O)NCc2ccccc2O)n1 765273525 YROGHVUWINEFFB-UHFFFAOYSA-N 257.293 2.417 10 20 CECD CCOc1ccc(N(C)CC[C@H]2CCS(=O)(=O)C2)cc1 760845899 WVOSMIRBLFNXEY-ZDUSSCGKSA-N 297.420 2.346 10 20 CECD Cc1cccc(O)c1CN1CCC(C)(C)S(=O)(=O)CC1 877481570 LKWNFYQQFLBTBR-UHFFFAOYSA-N 297.420 2.100 10 20 CECD CC1(NC(=O)NCc2ccc(N3CC=CC3)cc2)CC1 1116116488 NYXVIKQWEUTJBU-UHFFFAOYSA-N 271.364 2.415 10 20 CECD Cc1noc(CCCNCc2c(C)cccc2O)n1 877023944 KUTRXSYGUFGIGC-UHFFFAOYSA-N 261.325 2.114 10 20 CECD CC[C@](C)(O)CNCc1cc(Cl)cc(F)c1O 775890656 HEGATTIYSZWQKX-LBPRGKRZSA-N 261.724 2.435 10 20 CECD CCN(C)c1ccc(CN2CC[S@@](=O)C[C@@H](C)C2)cc1 773889519 WNXFRKSTYPLHRQ-VBKZILBWSA-N 294.464 2.343 10 20 CECD O=C(NCc1cccc(Br)c1O)[C@@H]1C[C@@H]1F 1123754966 RTUBHAJKCABZFD-APPZFPTMSA-N 288.116 2.129 10 20 CECD Cc1cc(C)c(CNC(=O)NCc2ccc(N)cc2)cn1 1120626204 NXERJVPTHOTNQE-UHFFFAOYSA-N 284.363 2.280 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2CC2(Cl)Cl)c(O)c1O 780879640 RSHMQEFVGLQROV-ZETCQYMHSA-N 290.146 2.330 10 20 CECD COc1ccc(CNCC2(CO)CCCC2)c(O)c1OC 893659449 AYLQEVGHKJUBKC-UHFFFAOYSA-N 295.379 2.052 10 20 CECD CC(C)n1ncnc1CN(C)c1ccc2c(c1)OCO2 789300229 IWWVOEYOBIYYAX-UHFFFAOYSA-N 274.324 2.224 10 20 CECD C[C@H]1C[C@H](NCc2cc3c(cc2O)OCO3)CS1 397819826 DLXAKJUHAPULHC-WPRPVWTQSA-N 267.350 2.105 10 20 CECD CCN(CC)c1ccc(CNC[C@](C)(O)COC)cc1 69912566 MWUJQCPNYVSFPF-INIZCTEOSA-N 280.412 2.020 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1c(O)ccc(Cl)c1F 790986789 VFLIXGWTQTXCOJ-HTQZYQBOSA-N 261.724 2.434 10 20 CECD CN1CCN(c2ccc(CN[C@H]3C=CCC3)cc2F)CC1 1327253665 GWCUWSVHBWKJEO-HNNXBMFYSA-N 289.398 2.386 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(NC)CCC2)cc1 1357363421 XLYRKOBEJHEURE-UHFFFAOYSA-N 289.423 2.291 10 20 CECD O=C(O)[C@H](CF)NCc1ccc(N2CCCCC2)cc1 1601650919 SAVDAPQUGCHBNM-AWEZNQCLSA-N 280.343 2.189 10 20 CECD CS[C@@H](C)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1610380021 CZTQOGYQAUKIDU-IUCAKERBSA-N 269.366 2.493 10 20 CECD COCCN(C(=O)/C=C/[C@@H]1CCCNC1)c1ccccc1 1579026998 MBQYTGPFWZMADD-FEAKQIBJSA-N 288.391 2.222 10 20 CECD COc1cc(CN(C[C@H](C)C(=O)O)C2CC2)c(O)cc1C 1599406656 JTUHFZYEHKCHQL-NSHDSACASA-N 293.363 2.394 10 20 CECD O=C1NC(=S)S/C1=C/c1cccc(F)c1F 206403917 WMXHLSFCSBHDNT-QPJJXVBHSA-N 257.286 2.454 10 20 CECD COc1ccc(O)c(CNC(=O)CCCn2cccc2)c1 156412131 ZTFDWUZOAQUAES-UHFFFAOYSA-N 288.347 2.299 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C1=Cc2ccccc2OC1 159077868 TXSGTTLYTQEVRZ-UHFFFAOYSA-N 297.310 2.190 10 20 CECD CCOCCOCCN[C@H](C)c1cc(F)ccc1O 927087415 NQHRQQSJKGZBPC-LLVKDONJSA-N 271.332 2.235 10 20 CECD Cc1c(CN[C@@H](C)c2cc(F)ccc2O)cnn1C 186188466 JMGVXVUDFOICGM-VIFPVBQESA-N 263.316 2.424 10 20 CECD CN1CCCC[C@@H](CNCc2cc(F)ccc2O)C1 700787820 NSHYAQPZHATIFH-LBPRGKRZSA-N 266.360 2.353 10 20 CECD C[C@H](NCC1(N(C)C)CC1)c1cc(F)ccc1O 397848863 GHRNNDBUCIBZBD-JTQLQIEISA-N 252.333 2.276 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@H](C)O)c1O 51822182 AXJYQAFYFWRKFQ-QMMMGPOBSA-N 271.744 2.061 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCSCC1 115854292 FUPFPKHOPQMICI-UHFFFAOYSA-N 293.436 2.319 10 20 CECD Oc1ccc(F)cc1CN1CCN(CC2CC2)CC1 179940509 AZSWWROYEJRTKR-UHFFFAOYSA-N 264.344 2.059 10 20 CECD O=C(C[C@@H]1C=CCCC1)NCc1cccc(O)c1O 1349078564 ITEVMBPFOWRFIJ-LLVKDONJSA-N 261.321 2.460 10 20 CECD COc1cccc(CN(C)C(=O)c2cccc(O)c2O)c1 126281787 ATJHUHFJNRUMDE-UHFFFAOYSA-N 287.315 2.379 10 20 CECD CNC(=O)CN(C)c1ccc(OCc2ccccc2)cc1 189646603 YLONTEAEEGFPRY-UHFFFAOYSA-N 284.359 2.448 10 20 CECD c1cc(N2CCCC2)ccc1OCCC1OCCO1 120278118 NTNRCCRVUFIXSM-UHFFFAOYSA-N 263.337 2.429 10 20 CECD CN(C)c1ccc(CN[C@](C)(C(N)=O)c2ccccc2)cc1 193420935 BASHASSNGWAMCZ-SFHVURJKSA-N 297.402 2.243 10 20 CECD Cc1cc(O)c(CN2CCS(=O)(=O)CC[C@H]2C)cc1C 191344329 RSROAFSJDSOXCG-CYBMUJFWSA-N 297.420 2.018 10 20 CECD Nc1ccc(CCNS(=O)(=O)CC2CCCCC2)cc1 49043219 RXZINJUMTCUSRM-UHFFFAOYSA-N 296.436 2.311 10 20 CECD CNC(=O)CN(Cc1ccccc1)c1ccc(OC)cc1 96982113 YIFUFJWIXPTYBD-UHFFFAOYSA-N 284.359 2.448 10 20 CECD C[C@@H]1CN(C(=O)c2cccc(O)c2O)CCC1(F)F 290753306 APDRIFZQQYYVQE-MRVPVSSYSA-N 271.263 2.215 10 20 CECD CC[C@H](NC[C@H]1COCCN1)c1cccc(Cl)c1O 530227847 WIABLARZVLYOSI-GWCFXTLKSA-N 284.787 2.075 10 20 CECD CCc1nnc(C)cc1C(=O)N(C)Cc1ccccc1O 273680451 KHQIUVJNRISSSR-UHFFFAOYSA-N 285.347 2.325 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@](C)(O)C1CC1 286911754 KEVRRTZCQLJUSO-QGZVFWFLSA-N 290.407 2.262 10 20 CECD COC(=O)CCN(Cc1ccc(N(C)C)cc1)C1CC1 298742260 XSTNXMJJZDWKGJ-UHFFFAOYSA-N 276.380 2.280 10 20 CECD CCn1nnc(C)c1CSc1ncc(C(=O)OC)s1 829677897 QOAAHABPTOLJBN-UHFFFAOYSA-N 298.393 2.142 10 20 CECD C[C@@H](NC(=O)c1cc(N(C)C)ccn1)c1ccccc1O 827930152 DBDPFBYQWQTXBK-LLVKDONJSA-N 285.347 2.344 10 20 CECD CCC[C@](C)(O)C(=O)N[C@H](C)c1ccccc1O 827940573 GCPVCPYXNAPNGT-YGRLFVJLSA-N 251.326 2.121 10 20 CECD CO[C@@]1(CNCc2cc(Cl)c(C)cc2O)CCOC1 825519913 PMZVIAAXCYPVLN-CQSZACIVSA-N 285.771 2.249 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C[C@H](C)C(=O)O 901596575 HSIQLNNZPGTCHB-LBPRGKRZSA-N 264.369 2.214 10 20 CECD COC[C@H](C)CNC(=O)NCc1ccc(N(C)C)cc1C 734527401 SPBRBFGLSBNILE-GFCCVEGCSA-N 293.411 2.143 10 20 CECD CCN1C[C@H](N[C@H](C)c2ccc(C)c(C)c2O)CC1=O 834892370 VCRDIIYKSRMFAF-CHWSQXEVSA-N 276.380 2.280 10 20 CECD O=C(/C=C\c1ccc(O)cc1)NCc1ccc(O)c(O)c1 588468896 UCFIAPQNFRUJTK-YWEYNIOJSA-N 285.299 2.133 10 20 CECD CN(C)c1ccc(CNC(=O)NCCCCCCN)cc1 831093843 GILQXMHKTWIOBI-UHFFFAOYSA-N 292.427 2.071 10 20 CECD O=C(C[C@@H]1OC(=O)c2ccccc21)NCc1ccccc1O 748346059 LIXYICDMUSBGKN-HNNXBMFYSA-N 297.310 2.310 10 20 CECD C[C@@H](NCc1nc([C@@H]2CCCO2)n[nH]1)c1ccccc1O 848557410 JSOCVNZBEIDQRM-MFKMUULPSA-N 288.351 2.213 10 20 CECD COc1cccc(O)c1CNC[C@H](N)c1ccccc1 841034322 CKBJMSVZMKVFFG-AWEZNQCLSA-N 272.348 2.190 10 20 CECD CC(=O)c1cc(F)cc(CN(CC(=O)O)CC2CC2)c1O 844837107 FYYHCTYBYRYHEL-UHFFFAOYSA-N 295.310 2.031 10 20 CECD C[C@@H]1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CCO1 845086049 FCBKLVOEACOHDU-SKDRFNHKSA-N 298.770 2.412 10 20 CECD CCOc1cccc(CN[C@H](C)C[C@@H](C)N)c1O 843129639 RBGYRMFNYGOBER-GHMZBOCLSA-N 252.358 2.006 10 20 CECD CCO[C@@H](C(=O)NCc1ccc(N(C)C)cc1C)C1CC1 859419482 NRUXAMBAOXTPGA-MRXNPFEDSA-N 290.407 2.492 10 20 CECD CC(C)[C@@H](O)CN[C@@H](C)c1cc(F)cc(F)c1O 756586861 VPHHSCAFYPDUOQ-UFBFGSQYSA-N 259.296 2.338 10 20 CECD O=C(NCc1cccc(Br)c1O)OCCF 859136004 YNCZFWSZBOFAOI-UHFFFAOYSA-N 292.104 2.350 10 20 CECD C[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C(C)(C)O 756818842 PZKPSDWOAOFCJI-BDAKNGLRSA-N 268.313 2.110 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@@H]2CCO)cc1F 862333810 WEWDMEHLKWUJLQ-GFCCVEGCSA-N 284.350 2.378 10 20 CECD Cc1cc(Br)c(O)c(CN(C)C[C@@H](C)N)c1 863651377 HEGQVKUFLHMJMB-SECBINFHSA-N 287.201 2.242 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1cccc(Cl)c1O 761222217 JCJPYBZWUSGKCB-CHWSQXEVSA-N 285.771 2.329 10 20 CECD CCN(C(=O)/C=C\c1cn(C)cn1)c1cccc(OC)c1 930064540 CJQZIHBHWRHVBX-HJWRWDBZSA-N 285.347 2.495 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2ccc(N3CCCC3)cc2)C1 1118602716 GCRMPWRTEIBUBZ-GASCZTMLSA-N 288.391 2.328 10 20 CECD O=C(O)[C@H]1C[C@@H](NCc2c(O)ccc(Cl)c2F)C1 874046226 REUKMAQDAVZWJV-KNVOCYPGSA-N 273.691 2.138 10 20 CECD C[C@H](NC(=O)[C@@H](O)c1cccnc1)c1ccc(N(C)C)cc1 775406922 QIKNJDBYWZVFMC-LRDDRELGSA-N 299.374 2.058 10 20 CECD C[C@@H](NC(=O)c1csnn1)c1ccc(N(C)C)cc1 773006745 FQRSJZSRASQGFQ-SECBINFHSA-N 276.365 2.095 10 20 CECD NC(=O)[C@@H]1CCCCN1Cc1cc(Cl)cc(F)c1O 775643197 OJYOCJPEUSTAEQ-NSHDSACASA-N 286.734 2.025 10 20 CECD COc1cc(C)cc(CN[C@H]2CC[C@H](O)CC2)c1O 894358793 JMXLNYYHDVMISG-JOCQHMNTSA-N 265.353 2.102 10 20 CECD COc1cc(C)cc(CN[C@@H](C)CCN(C)C)c1O 894211263 NBSUGIORCLTKBR-LBPRGKRZSA-N 266.385 2.139 10 20 CECD CCC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)CCO1 892068069 DHGZCIRTHZLWHM-CYBMUJFWSA-N 295.379 2.410 10 20 CECD CSC1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCC1 787511886 ZLJCVWRFXOXWFD-JTQLQIEISA-N 295.404 2.431 10 20 CECD Cc1cc(Br)cc([C@H](C)N[C@@H](C)CO)c1O 187259475 WSIIXGHUUHXWOV-IUCAKERBSA-N 288.185 2.495 10 20 CECD CO[C@H](CNCc1cc(F)cc(F)c1O)C(C)C 708519917 PHUXSWOHBGHZNV-GFCCVEGCSA-N 259.296 2.431 10 20 CECD CCc1cccc(CN(C)[C@H](C)C[S@@](C)=O)c1O 709309429 UXZMZKNDDCWIPR-ADLMAVQZSA-N 269.410 2.153 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCC[C@@H]2CN)cc1 89140410 FYWWFQBIXFDRBJ-ZBFHGGJFSA-N 261.413 2.360 10 20 CECD COc1cc(CN2CCCN3CCC[C@@H]3C2)c(O)cc1C 1323286399 WUHMAAFGVQBWSY-OAHLLOKOSA-N 290.407 2.379 10 20 CECD CCCn1ncc(C(=O)NCc2ccccc2O)c1C 1335821256 XCMLJELJLALXKT-UHFFFAOYSA-N 273.336 2.237 10 20 CECD CC[C@](C)(CC(=O)OC)NCc1ccc(N)cc1 1334774063 DHKMNHDJXVPGSQ-CQSZACIVSA-N 250.342 2.090 10 20 CECD CC(C)CN1CCC[C@@H]1C(=O)NCc1ccc(N)cc1 1342698617 GJQWREBOUWCYQL-OAHLLOKOSA-N 275.396 2.005 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CC[C@@H](C(=O)O)C2)c1 1607277636 LYYMRWQAUDIAIK-MXWKQRLJSA-N 279.336 2.305 10 20 CECD C[C@@H](NCC1(C(=O)O)CCOCC1)c1c(O)cccc1F 1603247552 LSXGKWQZJVKADE-SNVBAGLBSA-N 297.326 2.063 10 20 CECD Cc1ccc(C(=O)Nc2cccc(C(=O)O)c2)c(O)c1O 1600344121 VZNVETPVZAVSJB-UHFFFAOYSA-N 287.271 2.357 10 20 CECD C[C@H](NC(=O)[C@H]1C[C@@H](C(=O)O)C1)c1ccc(N(C)C)cc1 1593141776 YEZGMEFPDBRCCL-WCFLWFBJSA-N 290.363 2.041 10 20 CECD O=C(O)[C@@H]1C[C@@H]2C[C@H](NCc3cc(F)cc(F)c3O)[C@@H]2C1 1777608917 BNUOCHKCVSWXPR-HSJGXTKPSA-N 297.301 2.259 10 20 CECD C[C@@H](NC[C@@H]1CCCO1)c1ccc(N2CCOCC2)cc1 153050186 PFFSGGUUADISCA-PBHICJAKSA-N 290.407 2.353 10 20 CECD Cc1c(CNCc2ccc3c(c2)CCCO3)cnn1C 921933858 AOZGLFMMNMVAHW-UHFFFAOYSA-N 271.364 2.343 10 20 CECD CC[C@H]1C[C@@H](NCc2cccc(OC)c2O)CCO1 824383928 WMCRKCJNSVSJNL-STQMWFEESA-N 265.353 2.448 10 20 CECD COc1ccccc1NC[C@@H](O)COCC(C)C 37874541 BLPDEIGRKSNKLW-GFCCVEGCSA-N 253.342 2.141 10 20 CECD CNc1nc(C(=O)N(C)Cc2ccccc2O)cs1 154684640 XFTOMXPVEYVGMM-UHFFFAOYSA-N 277.349 2.163 10 20 CECD Cc1ccc([C@@H](C)NCC2([S@@](C)=O)CC2)c(O)c1 282187387 GAUHKKWQJCDNPA-ADLMAVQZSA-N 267.394 2.262 10 20 CECD COc1cccc(CN2CCC[C@@H](C)[C@H]2CCN)c1O 404429498 NTDWOENJCGIRKU-TZMCWYRMSA-N 278.396 2.350 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CCCCS2(=O)=O)c(O)c1 694591107 RLFWRPMCWZGMAS-STQMWFEESA-N 297.420 2.319 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@](C)(CN)C2)c1O 388370373 KPVWDMYWJKDANJ-AWEZNQCLSA-N 284.787 2.225 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCCc2ccc(O)cc2)c1 28285352 BAGDJHKEKPMBKE-UHFFFAOYSA-N 288.303 2.338 10 20 CECD CC[C@@H](C)CS(=O)(=O)NCc1ccc(N(C)C)cc1 113274668 GIGDGLDMVVFKNK-GFCCVEGCSA-N 284.425 2.218 10 20 CECD COC[C@@H](NCc1cc(OC)ccc1O)c1ccco1 182531264 YJLYVXFGAAYKLO-CYBMUJFWSA-N 277.320 2.471 10 20 CECD O=C(c1cccc(O)c1O)N1CCCC[C@@H]1c1ncc[nH]1 187049115 WKLFDXDGLCCBEG-LLVKDONJSA-N 287.319 2.188 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)[C@@H]1CCOC1=O 127210448 ACBVJIXORQTBLR-MRXNPFEDSA-N 288.391 2.424 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2cc(F)ccc2O)C1 185788947 PQJVQZARQCIGCA-PWSUYJOCSA-N 280.343 2.193 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC1CCC1 183461464 JLRFOYBZWRTAET-JTQLQIEISA-N 263.337 2.335 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)C(=O)NCC(C)C)c1 135727382 SPCHUVYPIXIMSN-VXGBXAGGSA-N 294.395 2.212 10 20 CECD O=C(NCc1ccccc1O)c1cnc2ccccc2n1 225107688 VRMPVPGTIHUXGZ-UHFFFAOYSA-N 279.299 2.265 10 20 CECD C[C@@H](CCO)CN[C@@H](C)c1ccc(N(C)C)cc1 97436154 NZZXUXNTTYJURT-STQMWFEESA-N 250.386 2.422 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCSC1 336505070 FGBKFLWAEUHWQQ-LLVKDONJSA-N 292.404 2.231 10 20 CECD CN(C)Cc1cccc(CNC(=O)Cc2ccc(N)cc2)c1 237057080 YBVVROULYHNOMD-UHFFFAOYSA-N 297.402 2.189 10 20 CECD COc1cccc(CN[C@@H]2CCCc3cn[nH]c32)c1O 268871100 VFXHCNQTZKLAEJ-GFCCVEGCSA-N 273.336 2.291 10 20 CECD Cc1ccc(C(=O)N2CCO[C@@H](C(C)(C)C)C2)c(O)c1O 279753968 LITCDEXUJBFBQW-GFCCVEGCSA-N 293.363 2.293 10 20 CECD CCCNC(=O)NCc1cccc(Br)c1O 278450604 ULRGYYIULOIKAD-UHFFFAOYSA-N 287.157 2.364 10 20 CECD COCCn1cc(CN(C)c2ccc(OC)c(F)c2)cn1 272490848 DWOWPTXCTDYESR-UHFFFAOYSA-N 293.342 2.314 10 20 CECD C[C@@H](CN1CCOCC1)N(C)Cc1c(O)cccc1Cl 279498203 VSAKCEISARXCML-LBPRGKRZSA-N 298.814 2.198 10 20 CECD C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCCCO1 272639786 LLDYRDKHMDVZGH-VWEULIBQSA-N 291.347 2.185 10 20 CECD CCn1cnc2c(N(C)Cc3ccccc3O)ncnc21 270457313 KHZMMGPOMLPPPY-UHFFFAOYSA-N 283.335 2.188 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@@H]1CO 276748440 LIUHBYCGGRJQAB-XHDPSFHLSA-N 266.360 2.094 10 20 CECD CCOC1CC(CCNC(=O)c2c(F)ccc(O)c2O)C1 295405530 MLLUPNAUAKSZOS-UHFFFAOYSA-N 297.326 2.172 10 20 CECD Cc1c(C)n(C)c2ccc(OC(=O)CCn3ccnn3)cc12 817760335 ANTLKIAQTWFUOK-UHFFFAOYSA-N 298.346 2.382 10 20 CECD O=C(O)[C@@H]1CCCN1Cc1cccc(Cl)c1O 821509297 MZDYPRNHMDYXQR-JTQLQIEISA-N 255.701 2.095 10 20 CECD Cc1cc(O)c(CN2CCNC(=O)[C@@H]2C(C)C)cc1Cl 824709913 QRNWTTDHUBDZLK-AWEZNQCLSA-N 296.798 2.310 10 20 CECD Cc1cccc(CN[C@H](Cc2ccccc2)C(=O)O)c1O 821111995 FBEDBGWUGSOMOZ-OAHLLOKOSA-N 285.343 2.486 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](CC(N)=O)C2)cc1Cl 824895414 WRBDNKDXVVPFIX-LLVKDONJSA-N 296.798 2.441 10 20 CECD C[C@H]1CCCCN1C(=O)COC(=O)c1cc(O)cs1 731910919 WSZSKUQCGCKYDN-VIFPVBQESA-N 283.349 2.012 10 20 CECD C[C@](O)(CNCCCSc1nccs1)C(F)F 905112868 XRBHEMIXDIJWSX-JTQLQIEISA-N 282.381 2.231 10 20 CECD CC[C@@H](N[C@H](C)CC(=O)NC)c1ccc(C)cc1O 834898660 ATVNGDOAAKENNX-DGCLKSJQSA-N 264.369 2.266 10 20 CECD CC1=NO[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 830559749 UZZRGTFFOKWCRE-OAHLLOKOSA-N 288.347 2.052 10 20 CECD CC1CCC(NC(=O)COC(=O)c2cc(O)cs2)CC1 731911016 YPQSAIWJPZQOHN-UHFFFAOYSA-N 297.376 2.305 10 20 CECD CC(C)[C@@](C)(CC(=O)O)NCc1ccccc1O 901818664 KIJAPPRRYRLWEH-CQSZACIVSA-N 251.326 2.371 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1C=CCC1 914282107 IMZZBTMGGJNHKJ-WMADIVHISA-N 259.305 2.193 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H]2CCC(=O)N(C)C2)cc1 846921293 RRLJIWISUIVMQL-MRXNPFEDSA-N 289.423 2.195 10 20 CECD CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@H](C)CO1 846434528 RKKAZEREPGOYHV-BVKQBWKVSA-N 291.347 2.137 10 20 CECD CCc1cccc(CN[C@H](CCO)C2CCOCC2)c1O 848902908 JMLXHHWNEZRVHI-MRXNPFEDSA-N 293.407 2.222 10 20 CECD CC[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)C1 841959685 ZPMGGMJNCZZYSD-GFCCVEGCSA-N 261.369 2.253 10 20 CECD CCOc1ccc(CN[C@H](C)C[C@H](C)N)c(O)c1 843129872 SHIIGFHECYENIL-WDEREUQCSA-N 252.358 2.006 10 20 CECD Cc1nccn1CCCN(C)C(=O)c1cc(O)cs1 747617611 SEBGVLFJHNAJOI-UHFFFAOYSA-N 279.365 2.121 10 20 CECD CN(C)c1ccc(OC[C@H]2CCNC(=O)CC2)cc1 842043692 OEVMCXBBYBQEDU-GFCCVEGCSA-N 262.353 2.048 10 20 CECD CN(C)c1ccc(CN(CCc2cnn[nH]2)C2CC2)cc1 851732153 KIRJDSSBSCYYNQ-UHFFFAOYSA-N 285.395 2.078 10 20 CECD O=C(c1cc(O)cs1)N1C[C@H](CO)Cc2ccccc21 854577989 LXZJNZQALSZUNY-SNVBAGLBSA-N 289.356 2.265 10 20 CECD C[C@@H]1C[C@H](NCC(C)(C)C(N)=O)c2c(O)ccc(F)c21 756782955 XAJUINANMLSZLO-SCZZXKLOSA-N 280.343 2.181 10 20 CECD N[C@]12CCC[C@@H]1CN(Cc1cc(Cl)cc(F)c1O)C2 857225951 BOTLBDKHQQBFFF-YGRLFVJLSA-N 284.762 2.498 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)COC(F)(F)F 935944724 ZVUBVTIGTYVFOC-UHFFFAOYSA-N 298.257 2.031 10 20 CECD C[C@@H](N[C@H](CO)C1CCOCC1)c1cc(Cl)ccc1O 757659869 STOOKDJTGSCQHR-QMTHXVAHSA-N 299.798 2.484 10 20 CECD CCCn1c(C)nnc1COC(=O)c1cc(O)cs1 763693697 WUNDHQSVMWUUNI-UHFFFAOYSA-N 281.337 2.121 10 20 CECD Cc1cn2nc(N(C)Cc3ccccc3O)sc2n1 760263433 UBTVBJWTJDCJFQ-UHFFFAOYSA-N 274.349 2.441 10 20 CECD CO[C@]1(CN[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)CCOC1 763570480 FEFZJCSOYIJWJQ-XAGWURHQSA-N 295.354 2.475 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@H]1CNCCCO1 1118122140 PUSYVMWWCQJUSB-MGPQQGTHSA-N 290.407 2.217 10 20 CECD Oc1ccc2c(c1)CN(Cc1cc3c(cc1O)OCO3)CC2 768869222 RMZCNMLWXAIQAQ-UHFFFAOYSA-N 299.326 2.385 10 20 CECD CNC(=O)c1cccc(CCNCc2ccc(C)cc2O)c1 877059022 POERCAKDAKQZRP-UHFFFAOYSA-N 298.386 2.393 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1ccccc1O 776000795 NPSCOCLQEKDHNZ-YPMHNXCESA-N 263.337 2.166 10 20 CECD C[C@@H](NC(=O)N[C@H]1CCCOCC1)c1ccccc1O 875463696 XHVUYPWLAALZGO-NEPJUHHUSA-N 278.352 2.322 10 20 CECD CC[C@@H](NCc1nnc(C)n1C)c1ccc(C)cc1O 1116890588 ZFTPUUPRTYNFQS-CYBMUJFWSA-N 274.368 2.378 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@@H]1F 1121112387 XYMWXVQIXMEYBN-OLZOCXBDSA-N 250.317 2.035 10 20 CECD CCn1cccc(CNCc2cc(C)ccc2O)c1=O 788523893 IRAMICDKLHSERN-UHFFFAOYSA-N 272.348 2.172 10 20 CECD Oc1ccc(F)cc1CNCc1ncnn1-c1ccccc1 787296819 VVZNTOIHQMTUEB-UHFFFAOYSA-N 298.321 2.402 10 20 CECD CC(C)(C)c1cnc(Sc2cc(C(N)=O)ncn2)s1 882088930 DXTAOJSOFPNXEY-UHFFFAOYSA-N 294.405 2.481 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)Cc1ncnn1CC 785634272 YXAWACJNMFNMBS-UHFFFAOYSA-N 287.411 2.386 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)C[C@@H](CO)C2)c1O 895033192 GYSZGFZUNXHJQR-CHWSQXEVSA-N 279.380 2.160 10 20 CECD COc1ccc(CN2CCOC(C)(C)[C@@H]2C)c(O)c1OC 892068845 UTPVJMMOSMFHEY-NSHDSACASA-N 295.379 2.409 10 20 CECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)C1CC1 798637969 HXYLDBUHTQOUGW-HMVTZJNGSA-N 276.288 2.022 10 20 CECD CO[C@H]1CCN(Cc2ccc(Br)cc2O)C1 691781589 WMKFNTDCRWRFFF-NSHDSACASA-N 286.169 2.375 10 20 CECD CC(C)CNC(=O)CN[C@@H](C)c1ccc(Cl)cc1O 1348549919 CROABBLRJTXIAS-JTQLQIEISA-N 284.787 2.468 10 20 CECD CCn1c(-c2cocn2)nnc1N(C)Cc1ccccc1O 1352750447 FEVZSVHGKPYTAF-UHFFFAOYSA-N 299.334 2.295 10 20 CECD COC(=O)[C@H]1C[C@H]2CC[C@H]1N(Cc1ccc(N)cc1)C2 1352788093 BNJFUTYNXSNJLB-VHDGCEQUSA-N 274.364 2.042 10 20 CECD Cc1cc(O)c(CN(CC(=O)O)C2CC2)c(Cl)c1 1600286781 VOBNPNZGMHWBND-UHFFFAOYSA-N 269.728 2.403 10 20 CECD O=C(O)c1ccccc1CC(=O)N1Cc2cccc(O)c2C1 1608945387 QOJRJHXSPFGQSV-UHFFFAOYSA-N 297.310 2.175 10 20 CECD CCN(CC)C[C@@H](C)NCc1cc(F)ccc1O 226607196 KFTKWDKXDMIOIZ-LLVKDONJSA-N 254.349 2.351 10 20 CECD Cn1cc(N2CCC[C@H](Sc3nccs3)C2=O)cn1 150918596 CVHYCUORNPLMLY-JTQLQIEISA-N 294.405 2.164 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCc2cnn(C)c2)c1 128119629 WNVYOIFFEFVXDG-GFCCVEGCSA-N 259.353 2.327 10 20 CECD CN(Cc1ccccc1O)c1ncccc1C(=O)O 1777076909 NPPDUWOXFXFDQN-UHFFFAOYSA-N 258.277 2.122 10 20 CECD COc1cccc(CNCCOC2CCSCC2)c1O 898442302 LXTXVFMRUGOSGY-UHFFFAOYSA-N 297.420 2.403 10 20 CECD OCCCCN(Cc1ccccc1O)C[C@H]1CCCO1 264647752 ZFCCZHPEUDGWTC-OAHLLOKOSA-N 279.380 2.146 10 20 CECD Oc1cc2c(cc1CNC1[C@H]3[C@H]4CC[C@@H](C4)[C@H]13)OCO2 300558925 BAMVKWXTBLVPDU-DMAMZFHHSA-N 273.332 2.255 10 20 CECD CCN1CCN(Cc2cc(F)cc(F)c2O)C[C@@H]1C 708397967 DQPHJUPGPOCJOB-JTQLQIEISA-N 270.323 2.196 10 20 CECD CC(=O)N(C)C1CCN(Cc2cc(C)c(C)cc2O)CC1 52085407 UKEMPFBHPLPXKO-UHFFFAOYSA-N 290.407 2.452 10 20 CECD CC(=O)c1cc(F)cc(CN2CCSCC2)c1O 50133102 IBDMOTNZICCSRP-UHFFFAOYSA-N 269.341 2.283 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC(N)CC2)c1O 50158321 SXJRHNFPPSZJEB-UHFFFAOYSA-N 282.771 2.171 10 20 CECD C[C@@H](NCc1cc(Cl)ccc1O)c1nncn1C 37017392 QXMGXZSKWQNYIU-MRVPVSSYSA-N 266.732 2.025 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cncc(Cl)n1 189149072 DMAWSDLEVHWBFG-UHFFFAOYSA-N 277.711 2.108 10 20 CECD CC(C)CN1CCO[C@H](CN[C@@H](C)c2ccccc2O)C1 183385164 HSXGHLZSOFBXKJ-LSDHHAIUSA-N 292.423 2.400 10 20 CECD Cc1ccc(OCC(=O)NCc2ccc(N(C)C)cc2)nc1 123592049 MHNTYCMPWXPZSQ-UHFFFAOYSA-N 299.374 2.151 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)CN2CCOCC2)c(O)c1C 273379303 HVOUXOVEEPISAC-ZFWWWQNUSA-N 292.423 2.380 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](O)c2cnn(C)c2)c(O)c1C 273555407 GUCYPLAFKLUZET-SWLSCSKDSA-N 289.379 2.127 10 20 CECD CN(Cc1ccccc1O)C(=O)c1occ2c1CCOC2 376062190 PMDZRWADAJIDHP-UHFFFAOYSA-N 287.315 2.330 10 20 CECD O=C(NCCCC(F)(F)F)c1c(F)ccc(O)c1O 294874557 HCCUVPNIOBLRLE-UHFFFAOYSA-N 281.205 2.309 10 20 CECD Cn1nnc(COc2ccc3c(c2)c2c(n3C)CCCC2)n1 647164441 VSVSEKNIQHUAAS-UHFFFAOYSA-N 297.362 2.160 10 20 CECD OC[C@H]1CN(Cc2cc3c(cc2O)OCO3)c2ccccc21 293981891 RIXZZTRBFQVXTN-GFCCVEGCSA-N 299.326 2.217 10 20 CECD Cc1cccc(CN2CC[C@H](C(=O)N3CCCC3)C2)c1O 290553975 RZKVGAJYSBTRML-HNNXBMFYSA-N 288.391 2.145 10 20 CECD CCC[C@H](CNC(=O)NCc1ccccc1O)OC 297012777 VSFOFIIAEVVQNA-GFCCVEGCSA-N 266.341 2.007 10 20 CECD CCOc1cccc(CN2CCOC[C@H]2CCOC)c1O 291302232 QSHFXBPUYCDLLQ-CQSZACIVSA-N 295.379 2.028 10 20 CECD CO[C@H](C)CN(C)C(=O)NCc1ccc(N(C)C)cc1C 806820831 GUOUCSWLZGJSIC-CYBMUJFWSA-N 293.411 2.237 10 20 CECD CC(C)[C@@H](CO)CNCc1ccc(N(C)C)c(F)c1 808421660 OZQDQJVVPDMADY-CYBMUJFWSA-N 268.376 2.246 10 20 CECD C[C@@H](CNCc1ccc2ccccc2c1O)S(C)(=O)=O 816558564 DHUDHYXXGNXQMW-NSHDSACASA-N 293.388 2.068 10 20 CECD C[C@H]1C[C@H](NCCc2ccc(N)cc2)CN1C1CC1 817955936 LTIUMFAXFLNWCA-WFASDCNBSA-N 259.397 2.026 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CC(C)=NO2)cc1 822603496 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2.079 10 20 CECD C[C@@H]1C[C@H](N)CCN1Cc1cc(Cl)ccc1O 131512245 VEINKGLCXFLPLA-BXKDBHETSA-N 254.761 2.357 10 20 CECD COC(=O)Cc1cccc(NCc2cc(F)ccc2O)n1 191626106 DJCCWLHUFUXQGR-UHFFFAOYSA-N 290.294 2.254 10 20 CECD CO[C@]1(C)C[C@@H](NC(=O)Cc2ccc(N)cc2)C1(C)C 237267247 QPEAZPVFBJYTRP-CZUORRHYSA-N 276.380 2.131 10 20 CECD CC1(C)C[C@@H](NC(=O)NCc2ccccc2O)CCO1 269984317 JDRGFRHUYLCLBX-LBPRGKRZSA-N 278.352 2.149 10 20 CECD Cc1cc(CC(=O)NCc2c(C)c3ccccc3n2C)n[nH]1 352121244 PPXGADYUXYBQHP-UHFFFAOYSA-N 296.374 2.377 10 20 CECD CN(C)[C@H]1CCC[C@@H](NC(=O)NCc2ccccc2O)C1 267285085 ARKAWQZTMHRCTE-KGLIPLIRSA-N 291.395 2.064 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC[C@H]2OCC[C@H]12 268507144 WSAGFBSXMSZQIV-UMVBOHGHSA-N 290.363 2.149 10 20 CECD CCCn1ncnc1CN(C)c1ccc(OC)cc1OC 279031554 DNSSZKNPGQGLIB-UHFFFAOYSA-N 290.367 2.342 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@@]3(CCOC3)C2)c1 280357242 UCGLWXMXWQMMNH-BBRMVZONSA-N 277.364 2.080 10 20 CECD COc1cccc(CN2CCCC23CCN(C)CC3)c1O 375469501 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O=C(NCc1ccccc1O)Nc1cccc(F)n1 768092464 ZLFNGPIBGMJLES-UHFFFAOYSA-N 261.256 2.248 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](F)C(F)(F)F)c1 862756972 CFXGGGOWJSTLQW-SECBINFHSA-N 265.206 2.217 10 20 CECD CC[C@@H](SC)C(=O)NCc1cc(C)ccc1O 862757654 BAOMUZMPQNTWSD-GFCCVEGCSA-N 253.367 2.458 10 20 CECD Cc1cccc(O)c1CN[C@H]1C[C@H](C)N(C2CC2)C1 877094163 NRNNIQPPLJLADC-STQMWFEESA-N 260.381 2.415 10 20 CECD Cc1ccc(CNC(C)(C)CCS(C)(=O)=O)c(O)c1 877070781 VUDUUWPROSOKRT-UHFFFAOYSA-N 285.409 2.004 10 20 CECD COc1cccc2c1O[C@@H](c1cccc(F)c1O)NC2=O 877841812 ANIYVGBAFVCVNL-HNNXBMFYSA-N 289.262 2.361 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC1(C2CC2)CC1 779532386 NTZAKWRXWKTBSS-QHHAFSJGSA-N 259.305 2.170 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1c2ccccc2C[C@@H]1O 882917149 FKSWKNCFRWXFTN-LSDHHAIUSA-N 291.297 2.418 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCCON 1120255690 LXQVHAAPRGTCTF-GHMZBOCLSA-N 250.342 2.119 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@H](C(=O)N(C)c2ccc(N)cc2)C1 884441939 SQCVZKGYYKGAQR-IINYFYTJSA-N 284.363 2.321 10 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COc1ccc(CN[C@H]2CC[C@@H](OC)C2)c(O)c1OC 1333716892 HGKJNXWOFRVRNR-NWDGAFQWSA-N 281.352 2.067 10 20 CECD CSC[C@](C)(O)CNCc1ccc(N2CCCC2)cc1 217865777 OXXJBTPMHOGFII-MRXNPFEDSA-N 294.464 2.490 10 20 CECD C/C(=C/c1ccccn1)C(=O)NCc1ccc(N)cc1 1574980233 QTYXCQIWXHGRQF-BENRWUELSA-N 267.332 2.384 10 20 CECD COc1cc(C)cc(CN2CCC[C@]2(C)C(=O)O)c1O 1594054512 QYGKEYKDYZWKAR-OAHLLOKOSA-N 279.336 2.148 10 20 CECD CO[C@]1(CN[C@@H](C)c2cc(C)ccc2O)CCOC1 123156840 ONORRWYVXNLKIO-WFASDCNBSA-N 265.353 2.157 10 20 CECD COCc1ccc(CNCc2ccc(C(=O)O)cc2O)o1 1777235904 OOTIYPUFXDJWJB-UHFFFAOYSA-N 291.303 2.120 10 20 CECD CCN(CC)c1ccc(CNc2nncn2C)cc1F 162071718 WOYSVTOUOUMLMD-UHFFFAOYSA-N 277.347 2.413 10 20 CECD C[C@@H](NCC(=O)OC(C)(C)C)c1ccccc1O 164048787 UMFHOEFCUPTVLI-SNVBAGLBSA-N 251.326 2.385 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(O)c(O)c2)no1 157851233 ISRZBOPZUMSMOR-UHFFFAOYSA-N 290.319 2.182 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)Cc1cc[nH]n1 156850695 UQPICQXQSJRGLI-UHFFFAOYSA-N 258.369 2.498 10 20 CECD O=C(Nc1nc2c(s1)CCC2)c1cccc(O)c1O 126317529 IGPODNJTAQRSJU-UHFFFAOYSA-N 276.317 2.295 10 20 CECD Cc1cccc(O)c1CNCCOCC(F)(F)F 876910431 ZTAYXASUWPESES-UHFFFAOYSA-N 263.259 2.369 10 20 CECD COCC[C@@H](C)n1cc(COc2ccc(N)cc2)nn1 881321881 QDZBOSPOLCKHPQ-LLVKDONJSA-N 276.340 2.037 10 20 CECD OCC1(NCc2ccc3c(c2)CCO3)CCCCC1 53096687 ZMJOUFWHTMFNTK-UHFFFAOYSA-N 261.365 2.406 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)C[C@H](C)O1 179855135 JEUQCFWQYVHOTK-WCQYABFASA-N 265.353 2.400 10 20 CECD C[C@@]1(CN)CCN(Cc2cc(Br)ccc2O)C1 310104945 ZRULGBGDJHFWLT-ZDUSSCGKSA-N 299.212 2.325 10 20 CECD O=S(=O)(Nc1ccc(O)cc1F)c1ccccc1F 85203907 YDVQOKUYWMMATO-UHFFFAOYSA-N 285.271 2.471 10 20 CECD CC(C)(C)N1CCN(Cc2cc3c(cc2O)OCO3)CC1 108252810 PJPGEJCMNKMGQX-UHFFFAOYSA-N 292.379 2.037 10 20 CECD CC(C)C(=O)NC[C@H]1CCCN(Cc2ccccc2O)C1 179565706 KWCZNHKCVNFCJA-CQSZACIVSA-N 290.407 2.376 10 20 CECD CCCCO[C@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183486712 LMKHLZRHTIYWGI-VXGBXAGGSA-N 295.379 2.350 10 20 CECD 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Fc1cc(CN2CCCC2)ccc1N1CCOCC1 727465403 DZXAJGARVUGQAN-UHFFFAOYSA-N 264.344 2.258 10 20 CECD O=C1CC[C@H]2CN(Cc3c(O)cccc3Cl)CC[C@@H]2N1 827133906 XUHDXGXXWROJPD-GWCFXTLKSA-N 294.782 2.146 10 20 CECD COc1cc(Cl)cc(CN[C@H]2C[C@@H](C(=O)OC)C2)c1O 827500555 COZUMBBPZLWQMZ-DKTWLAJQSA-N 299.754 2.095 10 20 CECD CC(C)C1(C(=O)NCc2cc(Cl)ccc2O)COC1 823987511 SQUWWAOCTFIMJV-UHFFFAOYSA-N 283.755 2.334 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@]1(C)CO 827699280 GGMGMJJCNLNUQR-LRDDRELGSA-N 280.387 2.342 10 20 CECD COc1ccc(O)c(CNC(=O)CCC(C)(F)F)c1 734018725 GRGMVHWBSNZEEG-UHFFFAOYSA-N 273.279 2.452 10 20 CECD CC[C@H](CNCc1cc(C)c(C)cc1O)C(=O)O 903705135 HTBFBICPCAKBAS-LLVKDONJSA-N 251.326 2.209 10 20 CECD C[C@H](CNC(=O)Cc1ccc(N)cc1)c1ccncc1 831057540 KSKMSRILONTSEV-GFCCVEGCSA-N 269.348 2.126 10 20 CECD Cc1ccc(NC(=O)Cc2ccc(N)cc2)c(O)c1 586736987 WRLNAYBBDCHKBI-UHFFFAOYSA-N 256.305 2.464 10 20 CECD Cc1cc(N(C)C)ccc1CNC(C)(C)CN(C)C 840953590 VPNQAXGRGOCNLO-UHFFFAOYSA-N 263.429 2.491 10 20 CECD 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COC/C=C\C(=O)N[C@H](C)c1ccc(N(C)C)cc1 867504722 ZDGJJQPQAXOEGR-FOQNGQEVSA-N 262.353 2.132 10 20 CECD CCOc1ccc(CN2CCC[C@H]2CC(=O)OC)c(O)c1 769483441 NFVJDWWEMYHYDL-ZDUSSCGKSA-N 293.363 2.318 10 20 CECD COCCN(C(=O)c1cc(O)cs1)C1CCCC1 762556288 YPAWVNWLACZWBD-UHFFFAOYSA-N 269.366 2.485 10 20 CECD Oc1cc2c(cc1CN1CCC3(CCC3)C1)[C@@H](O)CO2 768463330 HAZWBFNNGRJTBO-AWEZNQCLSA-N 275.348 2.194 10 20 CECD CC(=O)N[C@@H](c1nc(Cc2ccc(N)cc2)no1)C(C)C 863656163 NIDMNFXXFHHJGN-CQSZACIVSA-N 288.351 2.076 10 20 CECD Cc1cn2ccnc(C(=O)N(C)Cc3ccccc3O)c2n1 762047678 FOVVLGJNPZUNFE-UHFFFAOYSA-N 296.330 2.016 10 20 CECD CCOC(=O)C1CCN(Cc2c(O)cccc2OC)CC1 768138475 WZOVGUKQMGIELY-UHFFFAOYSA-N 293.363 2.176 10 20 CECD CSCC[C@@H](O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775409471 GGZSHESKMRLNTH-SMDDNHRTSA-N 296.436 2.044 10 20 CECD CCc1nncn1CCN[C@@H](CC)c1ccccc1O 775511107 BIVFDWWILFHTFX-ZDUSSCGKSA-N 274.368 2.287 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(N(C)C)cc1 773012349 XJZQBJHTVDQHOQ-AEAUEXCSSA-N 288.391 2.497 10 20 CECD C[C@H](NC[C@H](CO)Cc1ccco1)c1ccccc1O 783520000 OFKYTAASNHPGRR-QWHCGFSZSA-N 275.348 2.487 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](CC(=O)O)C2)c1 86757387 QQEGRXUJERMMIY-GFCCVEGCSA-N 263.337 2.387 10 20 CECD COC(=O)COc1ccc(N(C)CCC2CC2)cc1 784563366 GXJMMKYINFRRHQ-UHFFFAOYSA-N 263.337 2.475 10 20 CECD CO[C@]1(CN[C@H](C)c2c(C)cc(C)cc2O)CCOC1 788748760 AJRKNGIZHQTDNV-CJNGLKHVSA-N 279.380 2.465 10 20 CECD COc1ccc(CN2CC[C@@H](OC(C)C)C2)c(O)c1OC 895083655 VZJOVVXAQLSECJ-CYBMUJFWSA-N 295.379 2.409 10 20 CECD C[C@@H]1[C@@H](CO)CCCN1Cc1cc(F)cc(F)c1O 895014928 QJNCKICSWFGQKT-NXEZZACHSA-N 271.307 2.263 10 20 CECD COCC[C@@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898449381 DDDNPSSWSDFRHW-PBHICJAKSA-N 293.455 2.370 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCC(=O)C[C@H]2C)c(O)c1 794373843 NBNVFWYBEBYVAY-QMTHXVAHSA-N 291.347 2.022 10 20 CECD CC[C@@H](N[C@H](C)CC(N)=O)c1ccc(C)cc1O 794810580 LWONYQYUTMRRJN-ZYHUDNBSSA-N 250.342 2.005 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CCc2c[nH]nc2C1 792166574 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2.497 10 20 CECD C[C@@H]1CN(Cc2cc(F)c(F)cc2O)CC[C@@H]1C(=O)O 1589399466 QZLYUTXYPBYLLK-SCZZXKLOSA-N 285.290 2.213 10 20 CECD NC[C@@H]1CC[C@@H](NCc2ccc3c(c2)CCCO3)C1 904354126 ARAUOTDNQGSCOX-IUODEOHRSA-N 260.381 2.229 10 20 CECD Nc1ccc(NC(=O)NCC2(O)CCCCCC2)cc1 841300543 RNBCJAZMEQCLCU-UHFFFAOYSA-N 277.368 2.476 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)CN2CCCC2=O)c1 37782913 XPBWAIIYNGMFKI-QWHCGFSZSA-N 276.380 2.362 10 20 CECD CC[C@H]1COC(C)(C)CN1C(=O)c1cccc(O)c1O 403861848 ZLPIVOKNYQIQDP-JTQLQIEISA-N 279.336 2.127 10 20 CECD CCONC(=O)c1cc(C)n(-c2ccccn2)c1C 59018298 NWNVWLVWZRDXNM-UHFFFAOYSA-N 259.309 2.170 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@@H]2CCCO2)cc1 32246897 QVLHVVLTVJTXBT-HNNXBMFYSA-N 276.380 2.328 10 20 CECD Cc1cc(NS(=O)(=O)C[C@@H]2CCCO2)c(C)c(C)c1O 187061119 NMGZYOWCKDQSBV-LBPRGKRZSA-N 299.392 2.238 10 20 CECD O=C(O)CCNCc1cc(Cl)cc(Cl)c1O 32224176 RMWLHKIHJOASSQ-UHFFFAOYSA-N 264.108 2.263 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc2c(c1)CNCC2 121014684 VUBGCECLMBLPDX-UHFFFAOYSA-N 296.370 2.310 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccc(F)cc2C1 193142016 MZVOVOFZHLSLHT-UHFFFAOYSA-N 287.290 2.435 10 20 CECD Oc1ccccc1CN[C@@H]1CCOC2(CCOCC2)C1 133964817 CMCCUNZCMHRFMW-CQSZACIVSA-N 277.364 2.210 10 20 CECD Oc1ccccc1CNCc1nccn1C(F)F 134229943 SJRQVUDLVVIJGE-UHFFFAOYSA-N 253.252 2.274 10 20 CECD CN(Cc1cnn(CC(F)F)c1)Cc1ccccc1O 295236883 DMHBPEITLIEPJQ-UHFFFAOYSA-N 281.306 2.486 10 20 CECD COCC[C@](C)(O)CN[C@@H](C)c1ccc(C)c(C)c1O 273581531 MTLGGLRZRUQPDU-BBRMVZONSA-N 281.396 2.447 10 20 CECD CCOc1cccc(CN2CC[C@@](O)(C3CC3)C2)c1O 373321606 GLKZITBUBQLQKD-INIZCTEOSA-N 277.364 2.138 10 20 CECD CC[C@H](NC[C@]1(O)CCO[C@@H]1C)c1ccc(C)cc1O 280277971 YGPSQPAXCNQPHK-IVMMDQJWSA-N 279.380 2.281 10 20 CECD Cc1cc[nH]c1C(=O)NCc1ccc(N2CCOCC2)cc1 280774378 OTLBRGZWUZEHMC-UHFFFAOYSA-N 299.374 2.090 10 20 CECD COC(=O)[C@H]1CC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1 296258701 BNUZYGDGHGSDHP-YNEHKIRRSA-N 275.348 2.311 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCOC1 802261610 SZDFGWONTWTTRK-CQSZACIVSA-N 292.379 2.493 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@](C)(CN)C2)c1O 380339567 YENFRCJTHWFYQU-HNNXBMFYSA-N 296.798 2.419 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H]2COC[C@@H]2OC)cc1 290311681 ZVTWRWXYVSXHGR-RCBQFDQVSA-N 278.396 2.207 10 20 CECD CC[C@@H](N[C@H](C)c1cc(C(=O)OC)ccc1O)C(C)(C)O 294982604 KSTKVORORXLEND-QMTHXVAHSA-N 295.379 2.379 10 20 CECD Cc1cc(C)c([C@H](C)N[C@@H](C)C[S@@](C)=O)c(O)c1 815615271 MNVZUYNCYRQNMK-OAVHHTNSSA-N 269.410 2.427 10 20 CECD O=C(Nc1cccc2nc(O)oc12)c1cccc(O)c1O 811596332 JDOOTVIMDHNVBK-UHFFFAOYSA-N 286.243 2.197 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCc2c[nH]nc2C1 816513829 DBIUCEIDBGWZGT-UHFFFAOYSA-N 281.718 2.466 10 20 CECD C[C@@H](NCCC1=CCNCC1)c1cc(F)ccc1O 817985450 KDZTXUMEKWIMCS-LLVKDONJSA-N 264.344 2.492 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@]2(C)CCCNC2)c1 817966869 XFKMNWZYEBMCJH-MLGOLLRUSA-N 278.396 2.441 10 20 CECD C[C@@H]1CCCN([C@H](C)CNC(=O)c2cc(O)cs2)C1 731869554 LMTLJUPCRFSHMZ-GHMZBOCLSA-N 282.409 2.304 10 20 CECD O=C1[C@H](N[C@H]2CCc3cccc(O)c32)C[C@H]2CCCCN12 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C[C@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@@H](C)S1 841955246 XCTVBAZMOABQIU-TXEJJXNPSA-N 293.436 2.347 10 20 CECD CO[C@@H](C)[C@H](C)NC(=O)NCc1cc(Cl)ccc1O 845141053 ZMQHGXSXDDYZAD-IUCAKERBSA-N 286.759 2.268 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC2(O)CCCC2)c1 756574567 NCTRKHRHKCRCPQ-NSHDSACASA-N 293.363 2.135 10 20 CECD CCC[C@H](O)CC(=O)NCc1c(O)ccc2c1CCCC2 750422899 BCCRUAOSJNPBJN-ZDUSSCGKSA-N 291.391 2.438 10 20 CECD O=C(CCCF)NCc1ccc(N2CCC(O)CC2)cc1 856209022 DYUOESYEOJKCCG-UHFFFAOYSA-N 294.370 2.014 10 20 CECD O=C(COC(=O)c1cccc(O)c1O)c1cccc(F)c1 758571491 DZPNCGRAOJXKHX-UHFFFAOYSA-N 290.246 2.277 10 20 CECD CCC[C@@H](O)CN[C@H](C)c1cc(F)cc(F)c1O 756576131 JYDQYJQVOWMQDW-PSASIEDQSA-N 259.296 2.482 10 20 CECD CN1CCCc2cc(CNC[C@@](C)(O)C(F)F)ccc21 698616261 LVCJWOUHHAHOIR-OAHLLOKOSA-N 284.350 2.175 10 20 CECD CC[C@@H]1COC[C@H]1NCc1ccc(N2CCOCC2)cc1 850382101 NJHXVVDRCDMCHH-NVXWUHKLSA-N 290.407 2.038 10 20 CECD C[C@@H](N[C@H](C(N)=O)c1ccccc1)c1ccc(F)cc1O 756380288 GRDCNQWIGYEZNL-BMIGLBTASA-N 288.322 2.409 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)c(O)c1 877045115 QDMODHQCBQBQPY-UKRRQHHQSA-N 290.407 2.437 10 20 CECD CCCCNC(=O)CCN[C@H](C)c1ccccc1O 879648473 QOUZMSSUVFMBKL-GFCCVEGCSA-N 264.369 2.349 10 20 CECD Cc1ccc(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c(O)c1 876755294 JECUGWJJHBRUOC-SOZUMNATSA-N 267.394 2.042 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H](C)S(C)(=O)=O)cc1 773104974 PMHJKATVJIKPPW-CHWSQXEVSA-N 298.452 2.226 10 20 CECD COCc1cc(CNCc2ccc3c(c2)CCO3)no1 882954884 XWLPRPLTEQHAIK-UHFFFAOYSA-N 274.320 2.046 10 20 CECD Cc1ccc(C(=O)OCC[C@@H]2CCCO2)c(O)c1O 787679933 ATKFELMFODTAAM-JTQLQIEISA-N 266.293 2.132 10 20 CECD Cc1ccc(CN[C@H](C)c2c(O)cccc2F)c(=O)n1C 886600754 ANENCURQPYNWQZ-LLVKDONJSA-N 290.338 2.389 10 20 CECD C[C@@H]1C[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)CO1 784312044 JOMLDRQSYASELD-OCCSQVGLSA-N 276.380 2.136 10 20 CECD COc1ccc2c(c1)CCCN2Cc1ncnn1CCF 799295079 XPDUWCIZJPMEMC-UHFFFAOYSA-N 290.342 2.209 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)CCS(C)(=O)=O)c(O)c1 185791315 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Nc1ccc(CNCc2ccc(C(=O)NC3CC3)cc2)cc1 1580446972 MRMCZSIYIPSKLF-UHFFFAOYSA-N 295.386 2.451 10 20 CECD C[C@H](N[C@H]1CC[C@H]1C)c1cccc(-c2nn[nH]n2)c1O 1589955087 KBHPKQGPHYJBKS-PTRXPTGYSA-N 273.340 2.021 10 20 CECD CN1C(=O)/C(=C/c2cccc(C(=O)O)c2)SC1=S 208722510 QPJHOJVJMWLSPK-TWGQIWQCSA-N 279.342 2.216 10 20 CECD COCC1CCN(Cc2cccc(OC)c2O)CC1 156034834 OSGBEBYGUNLWRZ-UHFFFAOYSA-N 265.353 2.259 10 20 CECD CC(C)S(=O)(=O)CCN[C@H](C)c1cc(F)ccc1O 290313180 NUOFAUDYMNXMNC-SNVBAGLBSA-N 289.372 2.005 10 20 CECD CC[C@@H](C)C[C@@H](N)C(=O)N(C)Cc1ccccc1O 400891238 HMOGLDVWEKELDP-DGCLKSJQSA-N 264.369 2.114 10 20 CECD C[C@@H](NCCN1CCCC1=O)c1ccc(N(C)C)cc1 405445688 SGFYASKZKYNZDS-CYBMUJFWSA-N 275.396 2.026 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)CCN1C 90720997 PCOSUZSMJNLATG-HIFRSBDPSA-N 261.413 2.325 10 20 CECD C[C@@H]1CCCC[C@@H]1NC(=O)CN(C)c1ccc(N)cc1 702070218 XMIMHYMHEDGCNZ-DOMZBBRYSA-N 275.396 2.400 10 20 CECD C[C@H](CCO)CCNCc1cc(F)cc(F)c1O 708485754 NFWSGWPPNLBWQB-VIFPVBQESA-N 259.296 2.169 10 20 CECD COCC(COC)N[C@H](C)c1ccc(N(C)C)cc1 388509839 QKLHJSDKAYPKBC-GFCCVEGCSA-N 266.385 2.065 10 20 CECD COc1cccc(CNCCc2nccs2)c1O 60942177 YRBAVPVOQIRHDR-UHFFFAOYSA-N 264.350 2.190 10 20 CECD CC(C)[C@H](Sc1nccs1)C(=O)N1CCOCC1 64661909 FQJAYXZZLWUCOX-JTQLQIEISA-N 286.422 2.119 10 20 CECD CCCCOCCCNC(=O)c1ccc(C)c(O)c1O 177664273 BMKDQUNUGKTDLE-UHFFFAOYSA-N 281.352 2.343 10 20 CECD C[C@H](O)C[C@@H]1CCCCCN1C(=O)c1cccc(O)c1O 126645031 ISWNNDCOUCXOFK-RYUDHWBXSA-N 293.363 2.254 10 20 CECD COCc1ccccc1CNC(=O)Cc1ccc(N)cc1 37762886 QHRRYMZBYATJDW-UHFFFAOYSA-N 284.359 2.274 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1cnns1 75160071 FGEPMTYVFSAIEP-UHFFFAOYSA-N 289.360 2.053 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC1(C2CC2)CC1 180875703 FMXUOCWRXHIUJC-QHHAFSJGSA-N 273.332 2.417 10 20 CECD CCO[C@H]1C[C@@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 185716733 GUSSLHRGMOMTSE-OLZOCXBDSA-N 293.363 2.373 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CCCS(=O)(=O)C2)c(O)c1 287128178 RNOVYVBSQJIANP-STQMWFEESA-N 297.420 2.176 10 20 CECD COc1cccc(CNC[C@]2(C)CCCO2)c1O 94797973 KCGGKRUAOXAREH-AWEZNQCLSA-N 251.326 2.060 10 20 CECD Oc1ccc(Cl)cc1CNCCn1ccnc1 41119176 TYIUTDXQTXQGPE-UHFFFAOYSA-N 251.717 2.032 10 20 CECD CCOCCC1(CNC(=O)NCc2ccccc2O)CC1 269796536 POAJXPRPDWRYAI-UHFFFAOYSA-N 292.379 2.398 10 20 CECD Cc1nccn1CCN1CCOc2cc(N(C)C)ccc21 271671712 IGZZKDRLSDQKGV-UHFFFAOYSA-N 286.379 2.157 10 20 CECD CC(C)OC[C@H]1CN(Cc2ccc(N(C)C)cc2)CCO1 372117895 XLNLQLSOEWLQBN-QGZVFWFLSA-N 292.423 2.378 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccccc2O)[C@@]12CCCO2 272650474 FKXSDGITPSEBCV-XHSDSOJGSA-N 277.364 2.208 10 20 CECD C[C@H](N[C@H]1C[C@H](O)C1(C)C)c1cc([N+](=O)[O-])ccc1O 275335894 NVPXGEDFJHARPQ-HJIKLVIJSA-N 280.324 2.110 10 20 CECD CO[C@H](C)CN(C)C(=O)NCc1ccc(N(C)C)c(F)c1 287193713 LCWMYIBTYPHCGL-LLVKDONJSA-N 297.374 2.068 10 20 CECD CCOc1cccc(CN2CCC[C@H](O)CC2)c1O 293999740 MENXVLHOIRDAGH-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD COc1cc(NC(=O)NCc2ccccc2O)ccn1 806663192 UAEXQTVGIANBTB-UHFFFAOYSA-N 273.292 2.118 10 20 CECD 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10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H]2CCCN2CCCO)c1 834850033 IUKVSVDGOLKZPF-CABCVRRESA-N 292.423 2.198 10 20 CECD C[C@@H](NC(=O)NC(CF)CF)c1ccc(N(C)C)cc1 836405273 BRVNSLQRZCWKQM-SNVBAGLBSA-N 285.338 2.420 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC[C@@H]1C[C@H]2CC[C@H]1O2 837586630 FITHIZAWUPPDGV-GOKMBWGASA-N 290.315 2.222 10 20 CECD COc1ccc(O)c(CNCc2nc(C(C)(C)C)n[nH]2)c1 839171375 ZYXQCUNSRIZCGQ-UHFFFAOYSA-N 290.367 2.106 10 20 CECD C[C@@H]1CN(CN(C)Cc2ccc(N(C)C)cc2)C(=O)[C@@H]1C 839954283 UQBYESSGUKYGBH-ZIAGYGMSSA-N 289.423 2.256 10 20 CECD COc1cc(O)c(CN2CC[C@@H]3OCC[C@@H]3C2)cc1OC 842627258 UYHVLIVEBMTBSE-RISCZKNCSA-N 293.363 2.020 10 20 CECD C[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)CC2(CCC2)O1 844151943 ACOGNPIRCVYJNP-VIFPVBQESA-N 295.310 2.021 10 20 CECD C[C@@H]1CCN(Cc2cccc(F)c2O)C[C@H]1C(=O)O 843039082 AHMVCPMIVRPQJL-MWLCHTKSSA-N 267.300 2.074 10 20 CECD CNCCC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 843484983 GANADUAHPRQTPQ-UHFFFAOYSA-N 277.412 2.099 10 20 CECD COCC[C@@H](C)CNC(=O)N(C)Cc1ccccc1O 840403579 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NEDHTESTHVKVKJ-UHFFFAOYSA-N 285.347 2.138 10 20 CECD O=C1NCCc2ccc(NCc3cc(F)ccc3O)cc21 779122324 HNLCWQLGEDPXLH-UHFFFAOYSA-N 286.306 2.429 10 20 CECD COc1cccc(O)c1CN1CCC(C(C)(C)O)CC1 877754046 SNWXJBOFYSUMOX-UHFFFAOYSA-N 279.380 2.384 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H]1CCCO1 775791382 HCYCYUQDAGZZCF-SNVBAGLBSA-N 259.708 2.453 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)CCO1 775645333 JUHAEXODTPCLIV-MRVPVSSYSA-N 259.708 2.405 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCC[C@H]2OC)c1 776256928 SVRJSFMMSRENEG-IAQYHMDHSA-N 265.353 2.306 10 20 CECD C[C@@](O)(CNCc1cc(F)cc(F)c1O)c1ccco1 883018580 IQRZXOZDAJZIIO-CQSZACIVSA-N 283.274 2.261 10 20 CECD CC(C)Cc1ncc(NC(=O)c2cccc(O)c2O)cn1 792622012 XUXADUYRQCVDBL-UHFFFAOYSA-N 287.319 2.339 10 20 CECD C[C@@H]1CN(Cc2ccc3ccccc3c2O)C[C@H]1N 1206070528 MTYVAFXWUAXMQG-IAQYHMDHSA-N 256.349 2.324 10 20 CECD COc1ccc(CNC(=O)[C@H]2CC2(Cl)Cl)c(O)c1 794381367 LLNDTICGNLAAGH-SECBINFHSA-N 290.146 2.211 10 20 CECD CN(CCCCCCN)Cc1cc(F)ccc1O 710750494 LWKODACAVMVAMZ-UHFFFAOYSA-N 254.349 2.482 10 20 CECD COc1ccc(CNCCN2CC[C@@H](C)C2)cc1C 744450236 PDCKIMCNYDFXLR-CYBMUJFWSA-N 262.397 2.435 10 20 CECD Cc1cnc(CNCc2cc(Cl)ccc2O)[nH]1 693513264 SYJWCXCVUADZCC-UHFFFAOYSA-N 251.717 2.367 10 20 CECD C[C@@H](Cn1cccn1)N[C@@H](C)c1cc(F)ccc1O 94617553 OTZZSGFVYDPKCF-QWRGUYRKSA-N 263.316 2.467 10 20 CECD Oc1ccc(Cl)cc1CN=c1nc[nH]n1CC1CC1 1337907004 MTQNUSDVANEPRJ-UHFFFAOYSA-N 278.743 2.081 10 20 CECD COc1cccc(CNC(=O)NCCCC(F)F)c1O 1335193708 OTSUGLHVAWOBPX-UHFFFAOYSA-N 288.294 2.245 10 20 CECD CC[C@H](C)C[C@@H](N)C(=O)NCc1ccc(N(C)C)c(F)c1 1340839043 NGOMQEVLYOMALO-SMDDNHRTSA-N 295.402 2.271 10 20 CECD CN1CCCc2cc(CN[C@@H]3CC[C@@H](C(=O)O)C3)ccc21 1606230090 PWGGUBGKEJPCJK-HUUCEWRRSA-N 288.391 2.412 10 20 CECD O=C(O)c1cc2ccccc2c(CN2CCO[C@H]3C[C@@H]32)c1O 1608866057 URCLPXYJYMWADY-GJZGRUSLSA-N 299.326 2.217 10 20 CECD CCN1CCC(CCNCc2ccc(N)cc2)CC1 1577760487 WBDPBISZHZKTKB-UHFFFAOYSA-N 261.413 2.480 10 20 CECD C[C@@H]1OC[C@]2(CC[C@@H](CNCc3ccc(N)cc3)O2)[C@H]1C 1576902583 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111608348 BUKXNJYYCAGFJS-SECBINFHSA-N 260.293 2.220 10 20 CECD CC(C)CC(=O)NCc1ccc(N2CCN(C)CC2)cc1 49740611 CRNBQNCMXSXNHP-UHFFFAOYSA-N 289.423 2.101 10 20 CECD CONC(=O)c1sccc1-n1c(C)ccc1C 48622085 ZLKDZIYWAGRSPQ-UHFFFAOYSA-N 250.323 2.447 10 20 CECD CN(CCNC(=O)NCc1ccccc1O)C1CCCC1 264309671 PZJCQNXIMKPEDN-UHFFFAOYSA-N 291.395 2.066 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC[C@@H](C)OC)c1 273575701 LTHSBAYEHIHWBO-GHMZBOCLSA-N 281.352 2.254 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC2CCSCC2)c1O 278942952 XZGLQMPKPVDHQD-UHFFFAOYSA-N 298.364 2.294 10 20 CECD CC(=O)Nc1ccc(CNCc2ccc(N(C)C)cc2)cn1 278740501 VLKMWIYUPZTMHV-UHFFFAOYSA-N 298.390 2.396 10 20 CECD CC[C@@H](NCCCN1CCOCC1)c1ccc(F)cc1O 285858562 YIKMIAOJXZTKRV-OAHLLOKOSA-N 296.386 2.294 10 20 CECD COc1cccc(CN(CC2CCC2)[C@@H](C)CO)c1O 289347220 IPOMDWJPEOVSLL-LBPRGKRZSA-N 279.380 2.384 10 20 CECD CC[C@H](NC[C@H](O)C1CCOCC1)c1ccc(F)cc1O 286004639 HTNHXDJCVLWTIH-HOCLYGCPSA-N 297.370 2.360 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)C(=O)c1ccc[nH]1 297346707 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CC[C@@](C)(OC)C(=O)NCc1cc(C)ccc1O 862756211 UAEPKQARVRBTEH-CQSZACIVSA-N 251.326 2.132 10 20 CECD Cc1nocc1NC(=O)NCc1ccc(N(C)C)cc1 866108420 SMWMXUJYLJCEQI-UHFFFAOYSA-N 274.324 2.371 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@H]2CC2(C)C)c1O 775014034 XVNYGAIRTYVTFC-SNVBAGLBSA-N 280.324 2.445 10 20 CECD O=C1N[C@H](c2cccc(F)c2O)N2CCc3ccccc3[C@H]12 877856664 TVLZBNVGOAZZQK-ZBFHGGJFSA-N 298.317 2.259 10 20 CECD CC(=O)NCC[C@H]1CCCN(Cc2c(C)cccc2O)C1 877530925 ZHXMNPPZZQTHBY-OAHLLOKOSA-N 290.407 2.439 10 20 CECD COC(=O)[C@@H](NCc1ccc2c(c1)CCO2)c1cccnc1 771898862 VRUBKUIBBWLHJA-INIZCTEOSA-N 298.342 2.020 10 20 CECD CN(Cc1ccoc1)C(=O)/C=C\c1ccc(O)c(O)c1 779500439 SCQLAMXHMJBRBD-HYXAFXHYSA-N 273.288 2.363 10 20 CECD C[C@H](NC(=O)N(C)CC(C)(C)O)c1ccc(N(C)C)cc1 776250524 UWCSEKADEDQJEK-LBPRGKRZSA-N 293.411 2.226 10 20 CECD Cc1cc(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)no1 775406906 QASNLUMKBCDAAX-LBPRGKRZSA-N 287.363 2.469 10 20 CECD CC[C@@H](NCc1cn(CC)nn1)c1ccccc1O 404457474 NTXIVITWMHICQA-CYBMUJFWSA-N 260.341 2.245 10 20 CECD COc1ccc(CNCc2ncccc2F)c(O)c1OC 893182341 IXJQGGGDICOIDO-UHFFFAOYSA-N 292.310 2.233 10 20 CECD COc1ccc(CNC(=O)[C@H]2CC23CCC3)c(O)c1 794378613 ZTYNVSHHTLNQBD-GFCCVEGCSA-N 261.321 2.207 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CO)C(C)C 1325582611 QWYFOGIJYHIFIE-OAHLLOKOSA-N 250.386 2.168 10 20 CECD C[C@@H](NC(=O)N[C@H]1CCCC[C@@H]1CN)c1ccccc1O 1332544894 VXBTXDRHSVYFHT-BZPMIXESSA-N 291.395 2.270 10 20 CECD COc1cccc(CNCCOC2CCCC2)c1O 111607863 WFUBEHMORTYIFY-UHFFFAOYSA-N 265.353 2.450 10 20 CECD CCOc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1 158932315 JBWFVUOXPSCVLM-UHFFFAOYSA-N 287.315 2.427 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)[C@@H]2CCOC2)c1O 163076342 QPLCXMDQVCOHQC-MWLCHTKSSA-N 281.327 2.249 10 20 CECD C[C@H]1C[C@@H](C(=O)O)CN(Cc2cc(F)cc(F)c2O)C1 708090175 PANVFOMRVBENCZ-WCBMZHEXSA-N 285.290 2.213 10 20 CECD Oc1cccc(Cl)c1CN1C[C@@H]2CCNC[C@@H]2C1 904420935 JGDKEWFFCXHQNI-WDEREUQCSA-N 266.772 2.087 10 20 CECD Cc1csc(CNC(=O)c2cccc(O)c2O)c1 393472744 AMWWKFQGVNVZKW-UHFFFAOYSA-N 263.318 2.398 10 20 CECD C[C@@H]1C[C@H](C(=O)O)CN(Cc2cc(F)ccc2O)C1 398830132 HEZBHUGZPMUYKJ-KOLCDFICSA-N 267.300 2.074 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c(O)c1 834906521 FYYCSNMJBMOBDI-GRYCIOLGSA-N 262.353 2.005 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c1 834907266 MPAGOWKLYYXREG-GRYCIOLGSA-N 262.353 2.005 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CC=CCC2)c1 77600093 QLIANIXULAZLAH-GFCCVEGCSA-N 276.336 2.309 10 20 CECD Cn1nccc1NC(=O)NCCCSc1nccs1 124957827 PTVYESOKZCLSOI-UHFFFAOYSA-N 297.409 2.181 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)N(C)Cc1ccccc1O 171937406 YDLASLMHDCAUCL-VXGBXAGGSA-N 264.369 2.127 10 20 CECD COCCO[C@H]1CCN(Cc2cc(C)cc(C)c2O)C1 188921316 JDISFHPRYREHET-HNNXBMFYSA-N 279.380 2.246 10 20 CECD O=C(Cc1ccc(F)c(F)c1)NCc1ccc(O)c(O)c1 182550654 XWCPDDCWXRGFGN-UHFFFAOYSA-N 293.269 2.235 10 20 CECD CCCCOCCNC(=O)/C=C/c1ccc(O)c(O)c1 180985926 CGNQOFSICPEGQV-FNORWQNLSA-N 279.336 2.044 10 20 CECD CC(C)C[C@@H]1C(=O)NCCN1Cc1cccc(Cl)c1O 188918350 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Cc1nn(C)cc1[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1 373041300 ZPDWYNFTWGQNHU-INIZCTEOSA-N 298.390 2.217 10 20 CECD CC(C)SCCOC(=O)c1cccc(O)c1O 803441127 ZGIVSNSHFYEGPJ-UHFFFAOYSA-N 256.323 2.396 10 20 CECD NC(=O)c1ccc(NCc2ccc(N3CCCC3)cc2)nc1 298489841 XPBPCLWLSLPDPP-UHFFFAOYSA-N 296.374 2.393 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCC(=O)NCC(F)F 393675366 WAIDVUFBLMVMHI-UWVGGRQHSA-N 298.333 2.220 10 20 CECD Cc1nc([C@H](C)OC(=O)c2ccc(C)c(O)c2O)no1 811113034 YQOQQVXNOHITBN-ZETCQYMHSA-N 278.264 2.016 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCN[C@@H](C)C2)c1 817970771 DWGUFMMGPJRVTO-SDDRHHMPSA-N 264.369 2.192 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CCCNC2)c2c(O)ccc(F)c21 817942163 XMPJMWMKSLIYNG-FOGDFJRCSA-N 264.344 2.421 10 20 CECD C[C@@H](CN)N[C@H](C)c1cc(Br)ccc1O 817969993 JJEIALHNBHFEFZ-JGVFFNPUSA-N 273.174 2.153 10 20 CECD C[C@H](NC[C@H](C)CN)c1cc(Br)ccc1O 817962009 GKGAEOKDJSLNAJ-BDAKNGLRSA-N 287.201 2.400 10 20 CECD CC[C@@H](NC[C@H]1CCCN1CCCO)c1ccccc1O 824564301 IKGCEUZATPBFRM-GDBMZVCRSA-N 292.423 2.280 10 20 CECD N[C@H](CC(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 827004800 OOISBJXWUDJPGB-MRXNPFEDSA-N 287.407 2.030 10 20 CECD CO[C@H](C1CC1)[C@H](C)NC(=O)NCc1ccccc1O 836642881 WATMPYOMROLONS-HZMBPMFUSA-N 278.352 2.005 10 20 CECD CCN(C[C@H]1CCCO1)C(=O)/C=C\c1ccc(O)c(O)c1 588406216 VTIJJNWYJVIFCJ-FWPCIQOSSA-N 291.347 2.139 10 20 CECD CO[C@@H]1COC[C@H]1N[C@H](C)c1cc(Cl)ccc1O 842909547 IRLIDWRZDORRDB-XTWCZFFVSA-N 271.744 2.110 10 20 CECD Nc1ccc(NC(=O)[C@@H]2CC(c3ccccc3)=NO2)cc1 746478733 XBFLDVYZWCURLS-HNNXBMFYSA-N 281.315 2.401 10 20 CECD CC(=O)NCCCN[C@@H](C)c1ccc(Cl)cc1O 841744218 MWEVGTTZFHEODS-VIFPVBQESA-N 270.760 2.222 10 20 CECD COCC1(C(=O)NCc2cc(Cl)ccc2O)CCC1 846476397 LNZWOQHLWTUSDA-UHFFFAOYSA-N 283.755 2.479 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2COC[C@H]2OC)cc1F 842751934 DAYZJDDBFWNTCT-GDBMZVCRSA-N 296.386 2.175 10 20 CECD CC[C@@H](NCCN1CCCC1=O)c1ccc(C)cc1O 846207177 ZJKPWZVJEVNCEZ-CQSZACIVSA-N 276.380 2.364 10 20 CECD CC[C@H]1CO[C@H](CC)CN1C(=O)c1ccc(C)c(O)c1O 846373849 FYPCBRCAESRBBO-NWDGAFQWSA-N 293.363 2.436 10 20 CECD CCc1cccc(CN(C)CCNC(=O)C(C)C)c1O 848888863 BRTZBMIQHUXCJH-UHFFFAOYSA-N 278.396 2.159 10 20 CECD Oc1ccc(Cl)c(F)c1CNCCO[C@@H]1CCOC1 922940386 NFBHSTMXYPYEFO-SECBINFHSA-N 289.734 2.080 10 20 CECD COc1cccc([C@H](C)N[C@H](C)[C@@H](C)OC)c1O 846168456 CWNGTJZJWXWUBK-OUAUKWLOSA-N 253.342 2.475 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@]2(C)CCOC2)c1 756570925 CGPASPDWLRXGLC-MEDUHNTESA-N 293.363 2.256 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)c(F)c2)ncn1 756991834 YOCJBUJIGIKRDF-UHFFFAOYSA-N 274.343 2.280 10 20 CECD COc1cc(CN[C@H](C)CO)c(O)c(C(C)(C)C)c1 850071682 CYXGMLKZGXNLMD-SNVBAGLBSA-N 267.369 2.169 10 20 CECD CCOc1ccc(CN[C@H]2C[C@H](OC)C2)c(O)c1 858322368 UYSGPDOHWZLTBV-AULYBMBSSA-N 251.326 2.058 10 20 CECD O=C(c1cccc(O)c1O)N1CCC2(CCCC2=O)CC1 856016417 HRCLLQFZZMUWJS-UHFFFAOYSA-N 289.331 2.073 10 20 CECD CC(C)[C@H](C)N(C)Cc1cc2c(cc1O)OC[C@@H]2O 768439323 KITJRTKQHZJKIA-HZMBPMFUSA-N 265.353 2.294 10 20 CECD Cc1ccc(O)c(CNC(=O)CSC2CC2)c1 862754628 HRMPCVKDVBYEAG-UHFFFAOYSA-N 251.351 2.212 10 20 CECD O=C1N[C@H](c2cccc(F)c2O)N2Cc3ccccc3C[C@@H]12 877866343 RWJHPBVWJBRFQB-HOCLYGCPSA-N 298.317 2.087 10 20 CECD C[C@@H]1C[C@H]1CNCc1ccc(N2CCN(C)CC2)cc1 775991134 KPYXNGZKLTVJSE-ZBFHGGJFSA-N 273.424 2.184 10 20 CECD CCOCCO[C@H]1CCN(Cc2c(O)cccc2OC)C1 770383153 CHICRUVDXXCTAZ-ZDUSSCGKSA-N 295.379 2.028 10 20 CECD O=C(O[C@H]1Cc2ccccc2C1=O)c1cc(O)cs1 770014914 LPVKQKXVOIBIPU-NSHDSACASA-N 274.297 2.418 10 20 CECD C[C@@H]1CC[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 781617094 ACSMKLQXRWAKLX-ZOZIERIHSA-N 261.321 2.416 10 20 CECD COc1cc(C)cc(CN2CC[C@H](CCCO)C2)c1O 894956739 LAOZJFPFFQFHMQ-ZDUSSCGKSA-N 279.380 2.304 10 20 CECD COc1ccc(CNCc2csc(C)n2)c(O)c1OC 892511230 BKROSQIBODFXLS-UHFFFAOYSA-N 294.376 2.464 10 20 CECD CC[C@H](CCO)NCc1ccc(Br)cc1O 691455401 OXGYAXYLDQZKEJ-LLVKDONJSA-N 288.185 2.405 10 20 CECD CN1CCCN(Cc2ccc(Br)cc2O)CC1 691682368 QDXIJBGFGWAFRE-UHFFFAOYSA-N 299.212 2.292 10 20 CECD COc1ccc(CNCCCNC(=O)[C@H]2C[C@@H]2C)cc1C 1154309689 RONPOVYYBBHOAY-WFASDCNBSA-N 290.407 2.256 10 20 CECD COCC1(CNCc2ccc(OC)c(OC)c2O)CCC1 1335051985 TUPLJYZRZHWSFF-UHFFFAOYSA-N 295.379 2.316 10 20 CECD C[C@](CC(=O)O)(NCc1ccccc1O)c1ccncc1 1604089276 DYIDENAAXAKOPI-MRXNPFEDSA-N 286.331 2.267 10 20 CECD Cc1cc(CN2CC[C@](F)(C(=O)O)C2)ccc1N(C)C 1607638127 NPNGVPREWZDTNB-OAHLLOKOSA-N 280.343 2.060 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@@H]1[C@H](C(=O)O)C1(F)F 1610122360 QRRZRMZQPGTWHV-CHWSQXEVSA-N 298.333 2.150 10 20 CECD Nc1ccc(CNC(=O)Nc2ccc3c(c2)C(=O)OC3)cc1 1580445584 LJPIPYWMTLTLTI-UHFFFAOYSA-N 297.314 2.261 10 20 CECD Oc1c(Cl)cccc1CNC[C@H]1CC(F)(F)CN1 1580885543 DNZXZEHKIBSCCW-SECBINFHSA-N 276.714 2.132 10 20 CECD C[C@@H](NCC[C@H]1CCCNC1)c1cc(C(=O)O)ccc1O 1593264718 MDLFJYJRNDAKMW-VXGBXAGGSA-N 292.379 2.131 10 20 CECD COc1cc(C)cc(CN(C2CC2)[C@H](C)C(=O)O)c1O 1594054428 HHPAGCQMDOXNFA-SNVBAGLBSA-N 279.336 2.147 10 20 CECD CCN(CC)CCN[C@H](C)c1cc(C(=O)O)ccc1O 1596268589 CTZUYTGWEJELHA-LLVKDONJSA-N 280.368 2.083 10 20 CECD CN(C)c1ccc(CNC2CC3(C2)C[C@@H]3C(=O)O)cc1 1777040016 ZUQMWHZSORHGPT-CXOJTPOUSA-N 274.364 2.096 10 20 CECD CCOC(=O)CN(Cc1cc(OC)c(C)cc1O)C1CC1 160063371 ZSVRAYOUUZSXQN-UHFFFAOYSA-N 293.363 2.237 10 20 CECD CC[C@H](NCCCN1CCC(O)CC1)c1ccccc1O 155280292 CVAKHGFATHGFKO-INIZCTEOSA-N 292.423 2.280 10 20 CECD C[C@@H](NC[C@@](C)(O)C(F)(F)F)c1cc(F)ccc1O 273478920 LLYQEOFBYVYROF-RDDDGLTNSA-N 281.249 2.495 10 20 CECD CC[C@H](N[C@H](C)C(=O)N(C)CC)c1ccccc1O 188487561 JPRWAYBNVUQSBQ-YPMHNXCESA-N 264.369 2.300 10 20 CECD COCCN(C)Cc1cc(Br)ccc1O 132707773 WINQCKICQRXBQI-UHFFFAOYSA-N 274.158 2.233 10 20 CECD CCCNC(=O)C1CCN(Cc2ccccc2O)CC1 179573240 MMSYVSNIKQKYJA-UHFFFAOYSA-N 276.380 2.130 10 20 CECD COc1ccc(O)c(CNC(=O)NC2CCSCC2)c1 172073909 BJUAEAJAGRMDEY-UHFFFAOYSA-N 296.392 2.096 10 20 CECD C[C@H](CO)N[C@H](C)c1cc(Br)cc(F)c1O 134913885 OEWSZEMGQZUQTB-RNFRBKRXSA-N 292.148 2.325 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(F)c(F)c1O 189412311 QAVQWWOZQSWLPO-RKDXNWHRSA-N 286.322 2.188 10 20 CECD CC(C)CONC(=O)NCc1ccc(N(C)C)cc1 136725377 XPAYKLJDQJQCHN-UHFFFAOYSA-N 265.357 2.139 10 20 CECD CCc1c[nH]c(Sc2ncc([N+](=O)[O-])s2)n1 190336795 OQYDLBIDQFNSHV-UHFFFAOYSA-N 256.312 2.488 10 20 CECD CC(=O)c1c[nH]c(C(=O)N(C)Cc2ccccc2O)c1 48606755 ICSJCJMFLOBOOF-UHFFFAOYSA-N 272.304 2.195 10 20 CECD CCCOc1ccc(CN2CCC[C@H]2CO)c(O)c1 92455922 JSJZHYKPWLJJDL-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD CCCOc1ccc(CN(C)CC[C@@H](C)O)c(O)c1 93481693 YAPXTLCBEZVANN-GFCCVEGCSA-N 267.369 2.384 10 20 CECD COc1ccc(N2CCC(NCCCCO)CC2)cc1 365357510 MABDXHDYSKEXEM-UHFFFAOYSA-N 278.396 2.026 10 20 CECD C[C@@H](NCc1nc(C2CC2)n[nH]1)c1ccccc1O 273213408 GYYHMVOMIZCHPH-SECBINFHSA-N 258.325 2.239 10 20 CECD C[C@H](NC[C@@H](CO)[C@H]1CCOC1)c1ccc(N(C)C)cc1 280912518 QMTOJYQPHBVYFE-BPUTZDHNSA-N 292.423 2.048 10 20 CECD C[C@H](NC[C@H](C)CCCO)c1cc([N+](=O)[O-])ccc1O 296530974 QKVUKDOHZMALHM-MNOVXSKESA-N 282.340 2.360 10 20 CECD COc1cccc(CN2C[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c1O 394635061 CBXHRBFLQFUVIH-UHTWSYAYSA-N 291.347 2.086 10 20 CECD C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cc2c(cc1O)CCCC2 817977136 CFWCUDXGSHRKQU-MGJUMRQLSA-N 272.392 2.139 10 20 CECD COc1cccc(CNC(=O)[C@@]2(C)CC2(F)F)c1O 817549645 NPSBPVGHFUGVCN-GFCCVEGCSA-N 271.263 2.062 10 20 CECD CCn1nnc(C)c1CNCc1ccc2c(c1)CCCN2C 823730421 WGJKMKGPAOSXRK-UHFFFAOYSA-N 299.422 2.279 10 20 CECD Cc1nc(C)c(CCNC(=O)c2cc(O)cs2)s1 732290078 HRDZOMOZNJBOFJ-UHFFFAOYSA-N 282.390 2.500 10 20 CECD O=C(NCc1ccccc1O)c1c[nH]nc1-c1cccnc1 730422765 BIIFHUQAUULSDS-UHFFFAOYSA-N 294.314 2.107 10 20 CECD CC(C)C[C@H](C)C(=O)NCc1ccc(O)cc1O 910948102 UFVYPLUMIWXWMN-JTQLQIEISA-N 251.326 2.396 10 20 CECD C[C@H](CO)N(CC1CCC1)C(=O)c1cc(O)cs1 832557418 FBBWYCUKWFGHLW-SECBINFHSA-N 269.366 2.077 10 20 CECD O=C(O)c1coc(COC(=O)c2cc(O)cs2)c1 740270636 NVRROWSIGPIXAG-UHFFFAOYSA-N 268.246 2.102 10 20 CECD COc1cccc([C@H](C)N[C@H](C)CCN(C)C)c1O 846142346 RROJXYKURJRRJR-NEPJUHHUSA-N 266.385 2.392 10 20 CECD Cn1ccnc(NCc2ccc(N3CCCCC3)cc2)c1=O 742398402 VIXIVRDNXDBLKQ-UHFFFAOYSA-N 298.390 2.383 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H]2CCNC2)cc1F 843049148 GTNDEQYXBIUNMN-AWEZNQCLSA-N 279.403 2.466 10 20 CECD CC(C)[C@H](Sc1ncc(Cl)s1)C(N)=O 849998666 HUGQBWONUFATKN-LURJTMIESA-N 250.776 2.399 10 20 CECD CCN(CC1CC1)C(=O)NCCc1ccc(N)cc1 841953907 FTYFDGQODWPXQL-UHFFFAOYSA-N 261.369 2.253 10 20 CECD Cc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)ncn1 756777416 XLGAMRJOGIXRFU-SNVBAGLBSA-N 288.307 2.250 10 20 CECD C[C@@H]1C[C@H](N[C@H]2CCOC2)c2c(O)ccc(F)c21 756768102 JKRBQEIVVNALIN-YWVKMMECSA-N 251.301 2.458 10 20 CECD Oc1ccccc1CN[C@@H]1Cc2cccc(O)c2C1 758560555 MRPGFZHGPXUWLX-CYBMUJFWSA-N 255.317 2.355 10 20 CECD CCOc1ccc(CN2CC[C@](C)(C(=O)OC)C2)c(O)c1 769528742 ZBOFWHLVRKQREF-INIZCTEOSA-N 293.363 2.176 10 20 CECD CC(=O)NC[C@H]1CCCCN1Cc1cccc(C)c1O 877673709 HJKZHDAPXLLSFA-OAHLLOKOSA-N 276.380 2.191 10 20 CECD C[C@H](C[C@H]1CCCC(=O)N1)NCc1ccc2c(c1)CCO2 876996617 XBIWTTIPYFBICO-IUODEOHRSA-N 288.391 2.158 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@]2(F)CCOC2)cc1 1117525289 IQMOUSARRCASEF-MRXNPFEDSA-N 294.370 2.278 10 20 CECD C[C@@H](N[C@H]1CCCC[C@@H]1O)c1cc([N+](=O)[O-])ccc1O 779083170 IPKNBTBSRWOXOZ-LQJRIPTKSA-N 280.324 2.255 10 20 CECD COCCOC[C@H](C)NCc1ccc2c(c1)CCCN2C 892733849 UXFMPGZNPAXSQU-AWEZNQCLSA-N 292.423 2.210 10 20 CECD COc1cc(C)cc(CNCC[C@@H](C)CCO)c1O 894870536 MMSVQQSCLCQFSQ-LLVKDONJSA-N 267.369 2.207 10 20 CECD CN(Cc1cc(F)cc(F)c1O)C1(CO)CCC1 895356787 CNUAIMRLCPAIDI-UHFFFAOYSA-N 257.280 2.017 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)NCc1ccccc1O 793679004 BNWATEJOOAZBSV-GXFFZTMASA-N 251.326 2.070 10 20 CECD CCCN1CCN(Cc2cc(F)cc(F)c2O)CC1 708402216 VTDADACKVUIHHW-UHFFFAOYSA-N 270.323 2.198 10 20 CECD COc1cc(N2CCC(OC)CC2)c([N+](=O)[O-])cc1OC 1337682969 PCRVAYJSCLGUJG-UHFFFAOYSA-N 296.323 2.227 10 20 CECD COC[C@H](NCc1cc(C)cc(OC)c1O)C1CC1 1331564735 DJHGFZGESDUIJH-ZDUSSCGKSA-N 265.353 2.224 10 20 CECD Nc1ccc(CNC(=O)NCC[C@@H]2C[C@H]3CC[C@H]2O3)cc1 1346453873 RMDQOPBKHGBKPA-BPLDGKMQSA-N 289.379 2.026 10 20 CECD O=C(CC[C@@H]1CCCCO1)NCc1cccc(O)c1O 1350300612 UZZFJMAWNMETAU-LBPRGKRZSA-N 279.336 2.063 10 20 CECD NC(=O)c1ccc(CSc2ncc(C(=O)O)s2)cc1 1601166635 RGRNZCRIROVSCV-UHFFFAOYSA-N 294.357 2.233 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C(=O)O)oc2C)c1 1600464418 BOYPWEQBDRROSO-UHFFFAOYSA-N 289.287 2.230 10 20 CECD Cc1nc(C2CC2)oc1C(=O)NCc1cccc(O)c1O 1548791656 XIKHEUJBUWGTSN-UHFFFAOYSA-N 288.303 2.202 10 20 CECD CC1CCN(C[C@H](C)NCc2ccc(N)cc2)CC1 1576729612 SXHWDMXRXIDSOL-AWEZNQCLSA-N 261.413 2.479 10 20 CECD Oc1c(CN2CCO[C@]3(CCNC3)C2)ccc2ccccc12 1580885861 PDOGZGWZIKURPZ-SFHVURJKSA-N 298.386 2.110 10 20 CECD CCN1CCCc2cc(CNCC[C@H](F)C(=O)O)ccc21 1776875590 TUQJURNGLDKMJM-AWEZNQCLSA-N 294.370 2.362 10 20 CECD CN(C)c1ccc(CNCc2cc(C(=O)O)ccn2)cc1 1777040056 VXDINHDCBPWTGS-UHFFFAOYSA-N 285.347 2.136 10 20 CECD CN(C)c1ccc(CNC(=O)NO[C@H]2CCCCO2)cc1 152826311 NROCBQFZIOVPOF-AWEZNQCLSA-N 293.367 2.010 10 20 CECD C[C@H]1CC(=O)CC[C@H]1C(=O)NCc1ccc(N(C)C)cc1 159143381 RTZNABKGNLBPBI-BLLLJJGKSA-N 288.391 2.374 10 20 CECD C[C@@H](NCC12CC(CO1)C2)c1ccc(F)cc1O 527983165 UGPLBSJRZXWKEO-NAUIOFCNSA-N 251.301 2.361 10 20 CECD CN(C)C1(CNCc2ccc(N3CCCC3)cc2)CC1 397890554 PMKCBSXUMSEFEY-UHFFFAOYSA-N 273.424 2.471 10 20 CECD COC[C@@H](NCc1cc2c(cc1O)OCO2)c1ccco1 177572996 KBYDZMDOGFCCAA-LLVKDONJSA-N 291.303 2.191 10 20 CECD CCOC[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(C)C 188863444 PBEVRLOEDSRIKO-ZDUSSCGKSA-N 282.340 2.451 10 20 CECD CC1(C)[C@@H](O)C[C@H]1NCc1cccc(Cl)c1O 128179165 LAPNKKFRBOQTLP-MNOVXSKESA-N 255.745 2.295 10 20 CECD CCC[C@@](C)(NCc1cccc(OC)c1O)C(=O)OC 184048461 ZWPWPGQZYDZDER-OAHLLOKOSA-N 281.352 2.222 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(S(C)(=O)=O)CCC2)c1 281236565 VAVZKDVZAIVZLM-GFCCVEGCSA-N 297.420 2.319 10 20 CECD CNC[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 40592979 XXKVRSMLPSZEDG-NSHDSACASA-N 268.788 2.477 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2cc(F)ccc2C1 193151723 YBSGOPLNMRMXFB-UHFFFAOYSA-N 287.290 2.435 10 20 CECD Cc1ccc(O)c(CN2CCN(C)C[C@@H]2C(C)C)c1 184739895 YFJYPZWSSQFCPS-OAHLLOKOSA-N 262.397 2.473 10 20 CECD CC[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@H]1O 271993496 SEWYZFPIQKAXKG-BXKDBHETSA-N 255.745 2.248 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](O)C(C)(C)C2)c1O 275450833 LUSPCBUZRUVSFJ-AWEZNQCLSA-N 295.354 2.327 10 20 CECD COC[C@@H](NCc1cccc(Cl)c1O)[C@@H]1CCCO1 279440080 PDBDBPLHZGJZPA-OLZOCXBDSA-N 285.771 2.329 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCCN1CCCC1 800186653 GKYGLNXBVZWBMM-FNORWQNLSA-N 291.347 2.140 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1c(O)cccc1OC 814301479 UPMKYSKACLZTRR-LBPRGKRZSA-N 294.395 2.043 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@](C)(OC)C2CC2)c1 812497675 ANRHCCHUPLKBEW-QLJPJBMISA-N 293.363 2.393 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1[C@@H]1CC=CCC1 819167804 HYROSFYLDGSOKN-CYBMUJFWSA-N 286.331 2.265 10 20 CECD CCN(C)c1ccc(CN2CC[C@](F)(CO)C2)cc1 815111454 LYGCXNHUCZPHBB-OAHLLOKOSA-N 266.360 2.049 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](O)[C@H]2C)c1O 825104486 YAIXXJGCVAEGSG-LDYMZIIASA-N 271.744 2.009 10 20 CECD CCOc1ccc(O)c(CNCCC2(CO)CC2)c1 825040493 LIENJXIUGVKUTB-UHFFFAOYSA-N 265.353 2.043 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(Br)CC2)c1 824904566 RFEDUEYWJWYDEV-UHFFFAOYSA-N 284.153 2.244 10 20 CECD CCc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)no1 907272139 FESJJDGZFWIJHF-SECBINFHSA-N 290.319 2.009 10 20 CECD CN(CCc1ccccn1)C(=O)/C=C\c1ccc(O)c(O)c1 588404134 OYVPAFWBBGEUHV-VURMDHGXSA-N 298.342 2.207 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CC(C)=NO1 830145644 CSGMFJHADMKDMC-AWEZNQCLSA-N 276.336 2.296 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCCCO1 837521084 UMQPBGUJUVOMQN-MEDUHNTESA-N 293.363 2.104 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(F)CC1 914430713 JBFWAXCTUYSRSG-RQOWECAXSA-N 265.284 2.072 10 20 CECD NCC[C@H](NCc1cccc(Cl)c1O)C(F)(F)F 841091277 WQYCAMQCWIPOLV-VIFPVBQESA-N 282.693 2.415 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](C)[S@@](=O)[C@H](C)C1 840941811 MREMCYGPNSLNNA-IKDJWVMYSA-N 294.464 2.402 10 20 CECD C/C(=C(\F)C(=O)NCc1ccc(O)cc1O)C1CC1 910957674 UZZXXKIPSRNQSK-MDWZMJQESA-N 265.284 2.368 10 20 CECD CCn1nncc1/C=C1/C(=O)N(C)c2ccc(C)cc21 841486470 GIDFOUUEDHKMIR-MDWZMJQESA-N 268.320 2.123 10 20 CECD Cc1noc(CCCc2nc(Cc3ccc(N)cc3)no2)n1 843160532 ZEGIHVNSUQTUKK-UHFFFAOYSA-N 299.334 2.109 10 20 CECD COC/C(C)=C/C(=O)NCc1cc(Cl)ccc1O 846476200 KADCOPKMKDDOSX-WEVVVXLNSA-N 269.728 2.255 10 20 CECD CCN1C[C@@H](CNCc2cccc(Cl)c2O)CC1=O 846097243 OHVYPAZWDRYYDA-SNVBAGLBSA-N 282.771 2.004 10 20 CECD Cc1cc(CN2CCC[C@@H]2[C@H](C)O)ccc1N(C)C 852558042 FBWMDUBUGQGQPQ-XJKSGUPXSA-N 262.397 2.406 10 20 CECD COc1ccc(CNC(=O)C2(c3ccccn3)CC2)c(O)c1 867955424 AKIIPIISCCFYCL-UHFFFAOYSA-N 298.342 2.144 10 20 CECD C[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1cnn(C)c1 868301869 BMVFHRPCGCHUER-GHMZBOCLSA-N 288.351 2.247 10 20 CECD CC[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768440115 SQUNGPIHHUTTGV-NHYWBVRUSA-N 277.364 2.440 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@H]2COCCO2)cc1 765251976 QNJDPNJXUJFXGC-CJNGLKHVSA-N 278.396 2.209 10 20 CECD CCC(C)(C)N[C@@H](C)C(=O)NCc1cc(C)ccc1O 862757497 WLTYWHODOMAARG-LBPRGKRZSA-N 278.396 2.484 10 20 CECD CO[C@@H](C(=O)NCc1ccc(N(C)C)cc1C)C(C)C 769949151 UZLYIVVMKQAQCD-OAHLLOKOSA-N 278.396 2.348 10 20 CECD C[C@@H](C1CC1)N(C)S(=O)(=O)N[C@H](C)c1ccccc1O 867833879 FCGKUMXUHGCDKH-MNOVXSKESA-N 298.408 2.018 10 20 CECD CC(C)n1cnc(C(=O)NCCc2ccc(N)cc2)c1 876527926 MWXTZLHLUZELKZ-UHFFFAOYSA-N 272.352 2.019 10 20 CECD COc1cccc(O)c1CNC[C@@H]1COC2(CCCC2)O1 773415171 LVRGYMMQOUUNBW-GFCCVEGCSA-N 293.363 2.176 10 20 CECD COC(=O)[C@H]1C[C@@H](C)CCN1Cc1cc(OC)ccc1O 775997075 BFOLWVYQZHUHKZ-SMDDNHRTSA-N 293.363 2.174 10 20 CECD C[C@H](N[C@H](C)CCS(C)(=O)=O)c1c(O)cccc1F 886541185 ROTGVAPVXGNQTF-ZJUUUORDSA-N 289.372 2.005 10 20 CECD Nc1ccc(CN2CC[C@@]3(C2)C(=O)Nc2ccccc23)cc1 1120370947 KMMPKJCGAQKMKG-SFHVURJKSA-N 293.370 2.365 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1c2ccccc2C[C@@H]1O 883034740 FKSWKNCFRWXFTN-GJZGRUSLSA-N 291.297 2.418 10 20 CECD COc1cc(O)c(CN2CCCCC[C@H]2CO)cc1OC 895150306 JSHHSJCLCQMMNL-ZDUSSCGKSA-N 295.379 2.146 10 20 CECD COCC1(C(=O)N[C@H](C)c2cc(OC)ccc2O)CCC1 786411758 YBBBPLJDXKEPIC-LLVKDONJSA-N 293.363 2.395 10 20 CECD COc1ccc(CN[C@H]2CCS[C@@H]2C)c(O)c1OC 895126119 SHIUKNHIKIFECM-KOLCDFICSA-N 283.393 2.393 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)CSC)c(O)c1 794387820 MKICYILCSXNMKD-VIFPVBQESA-N 269.366 2.016 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](C(=O)O)[C@@H](C)C2)c1 388663104 OQGALDINENZMJD-AAEUAGOBSA-N 263.337 2.243 10 20 CECD Oc1c(F)cc(F)cc1CN1CCN(CC2CC2)CC1 893962568 NHCYXEDEISBOHV-UHFFFAOYSA-N 282.334 2.198 10 20 CECD CCC[C@H](C)C(=O)NCc1ccc(OC)cc1O 794389712 CJYCPJCJCBKHGS-JTQLQIEISA-N 251.326 2.453 10 20 CECD CCC[C@H](NCc1cc(F)cc(F)c1O)C(=O)O 708214565 CFOSFKMRZSJFIC-JTQLQIEISA-N 259.252 2.013 10 20 CECD CC(C)(O)CCNCc1ccc(Br)cc1O 691453562 ISDARAVZFRKRPI-UHFFFAOYSA-N 288.185 2.405 10 20 CECD COc1ccc(CNC[C@H]2CCCCS2(=O)=O)cc1C 694591069 QUBLLVKNXSCBEG-CQSZACIVSA-N 297.420 2.061 10 20 CECD CN(C)[C@@H]1CCCC[C@H]1NC(=O)NCc1ccccc1O 1318428043 VQLAWYPXINLAKW-ZIAGYGMSSA-N 291.395 2.064 10 20 CECD C[C@]1(CO)CCCN(Cc2cc(F)ccc2O)C1 1325026755 KFAYHVFHBVJMRF-AWEZNQCLSA-N 253.317 2.126 10 20 CECD CN(C)c1ccc(CN(Cc2nc[nH]n2)C2CC2)cc1 1327538449 SFHGRNOZVVSVSN-UHFFFAOYSA-N 271.368 2.035 10 20 CECD CN(C)c1ccc(CN[C@@H](CC(=O)O)C2CC2)cc1 1321924048 GPWCUNLERCOVBT-AWEZNQCLSA-N 262.353 2.096 10 20 CECD CN(Cc1ccccc1O)c1nnnn1C1CCCC1 1340289269 CYOQLYHJLUQTSO-UHFFFAOYSA-N 273.340 2.130 10 20 CECD CC[C@H]1CN(C(=O)NCc2ccc(N)cc2)CCS1 1357791008 HFNSVSVPAPGWNZ-ZDUSSCGKSA-N 279.409 2.306 10 20 CECD COc1ccc(O)c(CNc2cccc(C(=O)O)n2)c1 1611051229 VKDFFVYPZODOMF-UHFFFAOYSA-N 274.276 2.106 10 20 CECD Cc1ccc(CN[C@H]2C[C@H]3CC[C@@H](N3)[C@@H]2C)c(O)c1 1579696903 LUZZPJXHHIBPME-MYPMTAMASA-N 260.381 2.319 10 20 CECD N[C@H]1CCCCCN(Cc2ccc(F)c(F)c2O)C1 1580182174 FLGRORGHUMFCDT-NSHDSACASA-N 270.323 2.374 10 20 CECD O=C(C[C@H]1NCc2ccccc21)N1Cc2cccc(O)c2C1 1580522531 JPGBLTGLMPURHR-MRXNPFEDSA-N 294.354 2.469 10 20 CECD COc1cccc(CNc2cc(C(=O)O)ccn2)c1O 1594129168 AVPHGGZKDPPZAJ-UHFFFAOYSA-N 274.276 2.106 10 20 CECD OC[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 154597425 ADIQKCAZCFJNSG-JTQLQIEISA-N 255.745 2.250 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)[C@H]1CCCNC1 841032870 GPABYYXFIZNBHE-DOMZBBRYSA-N 260.381 2.099 10 20 CECD COc1cccc(CNC[C@@H](O)c2ccccc2)c1O 35601310 CKEKXRPSXALJQJ-CQSZACIVSA-N 273.332 2.224 10 20 CECD C[C@@H](NCc1cc2c(cc1O)OCO2)c1cccnc1 42879456 LNICXYFYIJHQAP-SNVBAGLBSA-N 272.304 2.367 10 20 CECD Cc1ccc([C@H](C)NCC(=O)NCC(F)(F)F)c(O)c1 185179561 UKKIMWYERLKQOO-VIFPVBQESA-N 290.285 2.030 10 20 CECD COc1cccc(CNc2cncc(Cl)n2)c1O 91479156 FQKYNHAHUZHNNM-UHFFFAOYSA-N 265.700 2.456 10 20 CECD CC(C)CC[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1 704430764 XGCXJQKJFJSBMO-OAHLLOKOSA-N 277.412 2.132 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=S)NC 7500762 MQLCVEGMYYFFKH-UHFFFAOYSA-N 251.399 2.079 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)CSC)c1 114543908 GUQGCRVWUPIHQU-VIFPVBQESA-N 269.366 2.016 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C(C)C)[nH]n2)c1 114540527 OPIFWAUCYMCLCV-UHFFFAOYSA-N 289.335 2.177 10 20 CECD CCCNC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 62575086 JHLNOLORTBJFOO-ZDUSSCGKSA-N 291.395 2.231 10 20 CECD COc1ccc(O)c(CNc2ncc(Cl)cn2)c1 301476660 BIKCGPDZRTWZCZ-UHFFFAOYSA-N 265.700 2.456 10 20 CECD CC(C)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 122010608 QIUBCRBWDCNDAN-UHFFFAOYSA-N 264.369 2.136 10 20 CECD CCOCCC1(CNC(=O)c2cccc(O)c2O)CCC1 187194844 XESOTZOANOJIGI-UHFFFAOYSA-N 293.363 2.425 10 20 CECD CC[C@@H]1CN(C(=O)c2cccc(O)c2O)CCS1 126565367 ANGTZYSFEKHOGN-SECBINFHSA-N 267.350 2.065 10 20 CECD CCNC(=O)C(C)(C)CNCc1c(O)cccc1Cl 120930047 WECQRASCKJFWSU-UHFFFAOYSA-N 284.787 2.298 10 20 CECD CCOc1cccc(CNC2CCOCC2)c1O 36319437 DPROLRRFHDIWFC-UHFFFAOYSA-N 251.326 2.060 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)cc1F 70810689 BCXSRNKOFWRBPM-JMSVASOKSA-N 292.354 2.075 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](CCO)C2)c1O 79436154 GHOHVALJQCCHRI-GFCCVEGCSA-N 295.354 2.328 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](N(C)C)C2)cc1F 130142275 ITTHGDRWVQMISZ-AWEZNQCLSA-N 279.403 2.418 10 20 CECD CC(C)C[C@@H](CO)NCc1ccc(N2CCOCC2)cc1 40774856 QILSDMXORYHPHU-INIZCTEOSA-N 292.423 2.020 10 20 CECD CCc1[nH]nc(NCc2cc3c(cc2O)OCO3)c1C 134024673 WVFJPVBTMZQIBX-UHFFFAOYSA-N 275.308 2.327 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)c2ccccc2)c1 194477570 CFCOOSDKAPWART-LLVKDONJSA-N 299.326 2.461 10 20 CECD COC[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H](C)O1 275876570 ATGVBTCDJBRBAD-QWRGUYRKSA-N 285.771 2.281 10 20 CECD CC[C@H](N[C@@H](C)C(=O)N(C)C)c1ccc(C)cc1O 280054239 JTNGOXHZLIKEGC-AAEUAGOBSA-N 264.369 2.218 10 20 CECD COc1ccc(N(C)Cc2ncnn2CCF)cc1F 281546892 YDFLTVPUAZLAAH-UHFFFAOYSA-N 282.294 2.032 10 20 CECD COc1cccc(CN2CCC[C@H]2c2nc(C)no2)c1O 289762413 JXOXXCRQJOIYNX-LBPRGKRZSA-N 289.335 2.429 10 20 CECD COc1ccc(O)c(CN2CCN(C3CC3)C[C@@H](C)C2)c1 296082224 QPRHJGATHHYWFS-ZDUSSCGKSA-N 290.407 2.317 10 20 CECD CC[C@H](O)CN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 293275454 CNPXLJGHJUHRLR-JSGCOSHPSA-N 296.386 2.084 10 20 CECD COc1cccc(CN2C[C@@H](CO)c3ccccc32)c1O 294064894 YCXAHBHADLHASU-ZDUSSCGKSA-N 285.343 2.497 10 20 CECD Cc1ccc(O)c(CN2CCC[C@@H](S(C)(=O)=O)CC2)c1 800534013 IUJSGMNKCHTQSD-CQSZACIVSA-N 297.420 2.100 10 20 CECD CCC[C@H](O)CSc1ncc(C(=O)OC)s1 298152411 DKYVQHAIQHIVNZ-ZETCQYMHSA-N 261.368 2.183 10 20 CECD CC(=O)C(=O)CSc1ncc(-c2ccc(F)cc2)[nH]1 808019275 WKAKTEHDBRHKIJ-UHFFFAOYSA-N 278.308 2.466 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@@H](C)CC 819692676 DSGYWURGOMZMTI-LBPRGKRZSA-N 293.363 2.330 10 20 CECD CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)Nc1ccc(N)cc1 818556520 YKVUJJOPNPZUFM-CYBMUJFWSA-N 289.379 2.244 10 20 CECD CCC[C@@H]1C[C@H]1C(=O)NCc1ccc(OC)cc1O 812561063 BFAJZEZGOWTINV-ZWNOBZJWSA-N 263.337 2.453 10 20 CECD C[C@H](N[C@H]1CCCC[C@@H]1CN)c1cc([N+](=O)[O-])ccc1O 817959851 JREXJMCJCDWLFS-WDMOLILDSA-N 293.367 2.469 10 20 CECD O=C(Nc1cc2c(cn1)CCC2)c1cccc(O)c1O 818983177 RQOBXIXNXGAZJW-UHFFFAOYSA-N 270.288 2.234 10 20 CECD CCO/C=C\C(=O)N(C)Cc1ccc(N(C)C)cc1 816822879 YWGPGFJKRZWBAK-KHPPLWFESA-N 262.353 2.261 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC2(N)CCC2)cc1 827340672 HOFXAYYMGOEFOJ-UHFFFAOYSA-N 289.423 2.421 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C[C@H](CC)OC 823576313 MNGYABJLCHSJLS-AWEZNQCLSA-N 295.379 2.182 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2C=CCC2)c1O 826940756 FPSALFWSAYTTRW-SNVBAGLBSA-N 264.281 2.117 10 20 CECD Cc1ncc(NCc2ccc(N3CCN(C)CC3)cc2)cn1 902206925 XLHUWKVOSTUSTJ-UHFFFAOYSA-N 297.406 2.149 10 20 CECD C[C@@H]1SCC[C@@H]1NC(=O)NCc1ccc(N(C)C)cc1 825602881 OHJWREXXECQWIX-FZMZJTMJSA-N 293.436 2.446 10 20 CECD Cc1noc(C)c1C[C@@H](C)NC(=O)c1cc(O)cs1 738545808 QGXJTPHCGZAWIC-SSDOTTSWSA-N 280.349 2.420 10 20 CECD CCOC[C@H](O)CN(CC1CC1)c1ccc(OC)cc1 831587728 IQARMNUZMPLUBQ-OAHLLOKOSA-N 279.380 2.309 10 20 CECD Cc1cnc([C@H](C)CNC(=O)Cc2ccc(N)cc2)s1 832032344 MWBWSOZZNJBYBB-SNVBAGLBSA-N 289.404 2.496 10 20 CECD CNC(=O)Nc1cccc(NC(=O)c2cc(O)cs2)c1 732266519 FGAAEYBSSWAQIH-UHFFFAOYSA-N 291.332 2.457 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@@H](C)c1cc(C)ccc1O 834880807 ROJLTCSPXNBOSX-HEHGZKQESA-N 279.380 2.403 10 20 CECD Cc1cc(O)c(CN2CCC(C(=O)O)CC2)cc1C 740088255 GDDXTRJTTSWCJI-UHFFFAOYSA-N 263.337 2.306 10 20 CECD CC[C@H](NCc1cccc(OC)c1O)[C@H](O)C(C)C 840968130 VTOWULYUKAARKP-GXTWGEPZSA-N 267.369 2.286 10 20 CECD COc1cccc([C@H](C)N[C@H](C)CO[C@@H]2CCOC2)c1O 846150908 SVIYNGDIBDEYIP-FRRDWIJNSA-N 295.379 2.245 10 20 CECD CCN1C[C@H](CNCc2ccc(N(C)C)cc2C)CC1=O 846096282 GANIVPAWKSHRTH-AWEZNQCLSA-N 289.423 2.019 10 20 CECD C[C@@H](NCC(F)(F)CO)c1ccc(Cl)cc1O 841751225 GFEPPBSCEAJADI-SSDOTTSWSA-N 265.687 2.324 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCC=CO1 843810124 CVGLYSRLHIGCBV-AWEZNQCLSA-N 288.347 2.171 10 20 CECD C[C@@H]1C[C@@H](NC[C@@H]2CCCNC2=O)c2c(O)ccc(F)c21 840826180 RYEILTMQNIMCPC-JFGNBEQYSA-N 292.354 2.195 10 20 CECD CCCC[C@@H](CN)NC(=O)NCc1ccc(N(C)C)cc1 841654082 MQRVWRFDMWFMTQ-AWEZNQCLSA-N 292.427 2.069 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)Cc1nccn1C 840935885 BRSJSBXCRISFRR-UHFFFAOYSA-N 272.396 2.427 10 20 CECD NC[C@H]1CC[C@H](CNCc2cccc(F)c2O)CC1 841081930 GACHBEMGPYJRBQ-HAQNSBGRSA-N 266.360 2.386 10 20 CECD Cc1cc(N)cc(CNCc2cc3c(cc2O)OCO3)c1 841071284 MIRNKGCBULCTFP-UHFFFAOYSA-N 286.331 2.301 10 20 CECD Cc1ccc(C(=O)N2C[C@H](C)OC3(CCC3)C2)c(O)c1O 844099715 AYBDZONNFPMWLU-NSHDSACASA-N 291.347 2.190 10 20 CECD C[C@@H]1C[C@H](NCCN2CCCC2=O)c2c(O)ccc(F)c21 846205115 FAVAIJPBWWLUNQ-PWSUYJOCSA-N 292.354 2.292 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H](O)C1CC1 854474775 NUQMIKJQYOGUEY-LLVKDONJSA-N 290.146 2.086 10 20 CECD COc1cc(NCc2cc(F)c(N(C)C)cc2F)[nH]n1 858231508 SPXGRJZDWCHCGD-UHFFFAOYSA-N 282.294 2.375 10 20 CECD CO[C@@H]1CCC[C@H]1CNC(=O)NCc1cc(C)ccc1O 858346555 OQWCDIGUBAJKPX-SWLSCSKDSA-N 292.379 2.315 10 20 CECD C[C@@H]1C[C@@H](N[C@@H]2CCOC2)c2c(O)ccc(F)c21 756768099 JKRBQEIVVNALIN-FXPVBKGRSA-N 251.301 2.458 10 20 CECD COC(=O)N(C)CCN[C@@H](C)c1ccc(C)c(C)c1O 850547458 GJEJJAQFSGGYFJ-LBPRGKRZSA-N 280.368 2.358 10 20 CECD CCOc1cccc(CNC2COC(C)(C)OC2)c1O 758012665 TVNIBCVJQDPJJN-UHFFFAOYSA-N 281.352 2.032 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](n3cncn3)C2)cc1 773848975 QVVGHPZGQCACIN-INIZCTEOSA-N 285.395 2.181 10 20 CECD CN(C(=O)C1CCN(CC(F)F)CC1)c1ccc(N)cc1 877075500 DUIKLBJKYPRFTQ-UHFFFAOYSA-N 297.349 2.209 10 20 CECD Cc1cc(Br)cc(CNC2(C)COC2)c1O 877691585 SIFPSCXYYILPOW-UHFFFAOYSA-N 286.169 2.342 10 20 CECD CC(C)COCCC(=O)N(C)c1ccc(N)cc1 877080055 FLLCWIPXTCZXBO-UHFFFAOYSA-N 250.342 2.294 10 20 CECD COc1cccc(O)c1CN(C)C[C@H]1CCCC[C@H]1O 779152979 IQENZDYLVIXXGS-TZMCWYRMSA-N 279.380 2.384 10 20 CECD CC[C@H](N[C@@H](C)[C@H]1CN(C)CCO1)c1ccccc1O 775522020 HMRPHOBZEAUHGV-DUVNUKRYSA-N 278.396 2.152 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCCO1)c1ccc(N(C)C)cc1 774018182 RINJIGCLTFQTIC-IUODEOHRSA-N 291.395 2.292 10 20 CECD COc1cccc(O)c1CN[C@H](CO)CC1CCC1 883126536 RUKFJVDXPYEKNR-LBPRGKRZSA-N 265.353 2.042 10 20 CECD CC[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H](C)O 789950587 RLOWAFPYLCRGNC-SWLSCSKDSA-N 278.396 2.118 10 20 CECD COCCCOCCN(C)Cc1cc(F)cc(F)c1O 894424408 DNUBDLZXDZTVHV-UHFFFAOYSA-N 289.322 2.155 10 20 CECD COc1cc(C)cc(CN[C@H](C)[C@H](C)OC)c1O 894796308 ZSVRAGJLHUOGCA-MNOVXSKESA-N 253.342 2.222 10 20 CECD O=C(O)C1(NCc2c(O)ccc(Cl)c2F)CCC1 789902471 PBSFHNHXAIPMOK-UHFFFAOYSA-N 273.691 2.282 10 20 CECD CC[C@@](C)(CCO)NCc1ccc(OC)c(OC)c1O 893120169 VQZSANAEJITRIX-HNNXBMFYSA-N 283.368 2.050 10 20 CECD CO[C@H]1CCN(Cc2c(O)cccc2Br)C1 707129485 AFORGOOKHAQVNE-VIFPVBQESA-N 286.169 2.375 10 20 CECD COc1ccc(O)c(CN[C@@H](CO)c2ccccc2)c1 62999661 UNVHTYNLWOTNTQ-HNNXBMFYSA-N 273.332 2.224 10 20 CECD Cc1cc(C)c(O)c(CN2CC(OC(F)F)C2)c1 797821484 VUQRBAJZIWEWGU-UHFFFAOYSA-N 257.280 2.432 10 20 CECD C[C@@H](CNCc1ccccc1O)CC1(C)OCCO1 716006175 KTDVBHIZXZSMMM-GFCCVEGCSA-N 265.353 2.271 10 20 CECD c1cc(N2CCCC2)ccc1CN1C[C@@H]2CCNC[C@@H]2C1 1337838166 JECHCXNZNJOEHS-DLBZAZTESA-N 285.435 2.328 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C(=O)O)C[C@@H](C)C2)c1O 1604695474 ZMSJBBPZWHOHDE-YPMHNXCESA-N 293.363 2.252 10 20 CECD O=C(N[C@@H](C(=O)O)c1ccccc1F)c1cc(O)cs1 1601399743 OPYSSGLGKWIQLC-LLVKDONJSA-N 295.291 2.149 10 20 CECD O=C(O)[C@H]1[C@H](CNCc2cccc(Cl)c2O)C1(F)F 1601751195 LIACUPXEHIECFA-IONNQARKSA-N 291.681 2.101 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H]1COC(C)(C)N1 1577527099 MHXDJPLRKSNWSE-CQSZACIVSA-N 278.396 2.329 10 20 CECD O=C([C@H]1CNCc2ccccc21)N1Cc2cccc(O)c2C1 1580486629 GHHTXEBFLTUHLY-HNNXBMFYSA-N 294.354 2.121 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(N)CCCCC1 169104062 JSSJQEZHOVTWRY-UHFFFAOYSA-N 289.423 2.339 10 20 CECD COCCCNC1CCN(c2ccc(OC)cc2)CC1 151664895 SQRGEYKZDHAVQR-UHFFFAOYSA-N 278.396 2.290 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@H](C)CO)cc1 151726637 ODLNYJAEZWABNF-OLZOCXBDSA-N 250.386 2.422 10 20 CECD CCCC[C@@H](NCc1cc(OC)ccc1O)C(=O)OC 154619461 YGJVCTVTTIFGNQ-CYBMUJFWSA-N 281.352 2.222 10 20 CECD CCCN(Cc1ccccc1O)[C@@H]1CCN(CC)C1=O 851792413 OGEPNHIDFLPZJM-CQSZACIVSA-N 276.380 2.225 10 20 CECD Cc1ccc(CN[C@H](CCO)C(F)(F)F)c(O)c1 894853184 XRCWLZOHRBAYAR-LLVKDONJSA-N 263.259 2.104 10 20 CECD O=C(O)CCCNCc1ccc(N2CCCC2)cc1 37417784 UIXCXZRKLSIPGE-UHFFFAOYSA-N 262.353 2.241 10 20 CECD CC[C@H](N[C@H](C)CN1CCCC1=O)c1ccccc1O 37782114 WGCDHYYFCQWVOX-OCCSQVGLSA-N 276.380 2.444 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCN(C3CC3)C2)c1 44684594 KKJKXXVIDBPJAT-VXGBXAGGSA-N 276.380 2.288 10 20 CECD CNC(=O)C[C@H](C)N[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 322947873 QXVJMQDCKWVWOI-WOPDTQHZSA-N 276.380 2.363 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@@H](CF)C2)cc1 711413519 GFPFAZWWBMZQFU-LBPRGKRZSA-N 250.317 2.019 10 20 CECD CCCN1CC[C@@H](NCc2ccc3c(c2)CCO3)C1 389412729 SLLWGCWPKBQZCA-OAHLLOKOSA-N 260.381 2.195 10 20 CECD Cc1ccc(O)c(CN2C[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c1 394786108 WMNWATROPNVPQG-UBHSHLNASA-N 275.348 2.386 10 20 CECD COCCOCCCNCc1cccc(Cl)c1O 124675453 FJFCVMMFHKZKIA-UHFFFAOYSA-N 273.760 2.188 10 20 CECD COC[C@@H]1CN(Cc2cc3c(cc2O)CCCC3)CCO1 179444965 HHNLQXXCGOIRFA-INIZCTEOSA-N 291.391 2.118 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@H]3CCCCO3)ccc21 121357705 NZMSMLNEYYDUAN-INIZCTEOSA-N 288.391 2.254 10 20 CECD COCC1(C(=O)N(C)Cc2ccccc2O)CCC1 285412602 WOQGFJDGPNNNSB-UHFFFAOYSA-N 263.337 2.167 10 20 CECD CCOC(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 45687953 PPTUCAKGDAHMKD-LBPRGKRZSA-N 264.369 2.356 10 20 CECD COc1cccc(CN(C)[C@@H](C)C(=O)OC(C)C)c1O 93773211 ZSLLAHXSDQNXOE-NSHDSACASA-N 281.352 2.173 10 20 CECD CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)CC(C)(C)O 93414500 NQZLTEHAOGOHKT-UHFFFAOYSA-N 288.731 2.157 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)NCc1ccccc1O 266646749 YVOOLWFMEIFONQ-NSHDSACASA-N 280.368 2.395 10 20 CECD Oc1ccccc1CNc1cnc2c(c1)COCC2 375043225 VGOWXPANZTZHDE-UHFFFAOYSA-N 256.305 2.472 10 20 CECD C[C@H]1CN(Cc2cc(F)ccc2O)C[C@@]2(CCCOC2)O1 373634443 FAWQULBBIYKYFV-BLLLJJGKSA-N 295.354 2.301 10 20 CECD CCOc1ccc(N(CC)C[C@H](O)CN(C)C2CC2)cc1 289402692 SUAFLRLJSGTPJY-MRXNPFEDSA-N 292.423 2.367 10 20 CECD CC[C@H](NCC(=O)NC(C)C)c1ccc(F)cc1O 285551608 GQHQOKXCWFKBFG-LBPRGKRZSA-N 268.332 2.097 10 20 CECD CC[C@H](NC[C@@H](COC)OC)c1ccc(F)cc1O 286010762 IBUKDFSYDQULHP-AAEUAGOBSA-N 271.332 2.233 10 20 CECD CC[C@@H](NC[C@]1(O)CCOC1)c1cccc(Cl)c1O 287277827 BHZBZNGUVSUQDP-TZMCWYRMSA-N 285.771 2.238 10 20 CECD CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)Nc4ccc(N)cc4)[C@@H]1[C@H]3C2 394289074 MLIRXMBPMQQJLZ-WDZICOIVSA-N 287.363 2.156 10 20 CECD OC/C=C/CNCc1ccc(N2CCCCC2)cc1 717575874 GGWFQMKHONLPSO-GORDUTHDSA-N 260.381 2.315 10 20 CECD C[C@H](NC(N)=O)c1noc(-c2ccc(-n3cccc3)cc2)n1 813339550 PPHDESZFGUSYHB-JTQLQIEISA-N 297.318 2.257 10 20 CECD CCOc1ccc(CNc2ccc(CO)cn2)c(O)c1 811501129 FQSXEEDKJOBZLQ-UHFFFAOYSA-N 274.320 2.290 10 20 CECD CC[C@@H](CNC/C=C/c1ccc(N(C)C)cc1)C(=O)O 903709135 CMKUEZDPDFKWPJ-GJBLVYBDSA-N 276.380 2.466 10 20 CECD CN(C)c1ccc(CN[C@@](C)(CCF)C(=O)O)cc1F 901915231 JWPHJZGGNKWQPA-AWEZNQCLSA-N 286.322 2.184 10 20 CECD CCN1C[C@H](N[C@@H](C)c2c(C)cc(C)cc2O)CC1=O 834892231 UQVITIHEEFPJFF-QWHCGFSZSA-N 276.380 2.280 10 20 CECD C[C@@H](O)C[C@@H]1CCCCN1C(=O)c1cc(O)cs1 834740833 YSMKRNBAQRUJBK-ZJUUUORDSA-N 269.366 2.219 10 20 CECD Cc1cc(O)c(CN2CCCC[C@@H]2C(=O)O)cc1C 833746683 GIVYGFASELOWPS-CYBMUJFWSA-N 263.337 2.448 10 20 CECD CC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)[C@H](C)CO1 846434530 RKKAZEREPGOYHV-HHQZKXIDSA-N 291.347 2.137 10 20 CECD CC1=CCN(C(=O)NCCc2ccc(N)cc2)CC1 841960286 KSXVCJHFFYPMOP-UHFFFAOYSA-N 259.353 2.173 10 20 CECD CN(Cc1ccco1)C(=O)NCCc1ccc(N)cc1 841962794 SSYYZZHDLCJVCH-UHFFFAOYSA-N 273.336 2.246 10 20 CECD Cc1cccnc1CN(C)c1ccc(OCC(=O)O)cc1 846280231 VRZQUKZQGZJBMF-UHFFFAOYSA-N 286.331 2.490 10 20 CECD COc1cccc(O)c1CN1CCC([C@@H](C)CO)CC1 846058105 LGSAITWFLMJQSM-LBPRGKRZSA-N 279.380 2.241 10 20 CECD COc1cccc([C@H](C)NCCSCCCO)c1O 846143360 DZTWWFLHGCGDTH-NSHDSACASA-N 285.409 2.167 10 20 CECD NC[C@H]1CC[C@H](NCc2cccc(Br)c2O)C1 841085054 SVYIYKRXSMRIKO-ONGXEEELSA-N 299.212 2.372 10 20 CECD CCCN(CC(=O)O)Cc1cc(C)c(C)cc1O 840997804 KDCXRVHXSICSQV-UHFFFAOYSA-N 251.326 2.306 10 20 CECD O=C(OCCOCC1CCC1)c1cc(O)cs1 842075717 SVZGENOZKILWCI-UHFFFAOYSA-N 256.323 2.427 10 20 CECD Cc1cc(O)c(CN[C@H](CN)CC(C)C)cc1C 841037624 BQHQMTHIXUASBH-AWEZNQCLSA-N 250.386 2.472 10 20 CECD CC[C@@H](CCO)N[C@H](C)c1cccc(OC)c1O 846145516 OGOXGPFQPBBZAZ-MNOVXSKESA-N 253.342 2.212 10 20 CECD CCOC(=O)C1(C(=O)NCc2cc(Cl)ccc2O)CC1 846474715 AQUCXEMWPGCXKQ-UHFFFAOYSA-N 297.738 2.005 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCCNCC1 841058311 PITOJKMTNLKPRD-HNNXBMFYSA-N 261.413 2.293 10 20 CECD CCOc1ccc(CN[C@H](C)[C@@H]2CCCNC2)c(O)c1 841033068 KABMCBQLZKZCAK-CHWSQXEVSA-N 278.396 2.269 10 20 CECD COc1ccc(O)c(CN(C)[C@H](C)c2nc(C)no2)c1 848925951 OETYUFRNBXOXSZ-SECBINFHSA-N 277.324 2.285 10 20 CECD CCN(Cc1ccc(N(C)C)c(C)c1)[C@H]1CCNC1 923424897 IHJMGQWIZNUBFQ-HNNXBMFYSA-N 261.413 2.245 10 20 CECD Nc1ccc(CCNC(=O)NC[C@H]2CC=CCC2)cc1 841743472 HKSOTNTXLOGFTD-AWEZNQCLSA-N 273.380 2.467 10 20 CECD C[C@H](Nc1cnn(CCO)c1)c1cc(Cl)ccc1O 756855713 LYZDSVQOUMPYOG-VIFPVBQESA-N 281.743 2.408 10 20 CECD C[C@@H](N[C@H](C)C1(CO)CC1)c1cc(F)cc(F)c1O 850513639 AHKCJEYYLXZVQG-RKDXNWHRSA-N 271.307 2.482 10 20 CECD C[C@H]1COC[C@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 922640483 FAZSVLKCNAAAOJ-OIBJUYFYSA-N 286.715 2.078 10 20 CECD COc1cc(C)cc(CN2CCCOC[C@@H]2C)c1O 754742082 WYXBFUSLFLMFMO-LBPRGKRZSA-N 265.353 2.320 10 20 CECD CN(C)c1cc(F)c(CNC[C@@H](O)C2CCC2)cc1F 858174531 TUTYTVGQBKQFOE-OAHLLOKOSA-N 284.350 2.281 10 20 CECD Cc1ccc(CC(=O)N(C)Cc2ccccc2O)o1 754076774 UDRXXKPJLFQTPH-UHFFFAOYSA-N 259.305 2.495 10 20 CECD CCOCCCC(=O)NCc1cc(C)ccc1O 862759923 NBWLBQGNRSHCDC-UHFFFAOYSA-N 251.326 2.134 10 20 CECD C[C@H]1[C@H](N(C)C)CCN1Cc1ccc(N(C)C)cc1 931041063 GILQFVXMMBUDJS-XJKSGUPXSA-N 261.413 2.277 10 20 CECD C[C@H](N[C@@H](CCO)C1CCOCC1)c1cc(F)ccc1O 763559463 QPGNUPFHWGBXJE-NHYWBVRUSA-N 297.370 2.360 10 20 CECD CCCNC(=O)[C@@H]1CCCN(Cc2c(C)cccc2O)C1 876657519 GRYYQLQRYCCDMC-CQSZACIVSA-N 290.407 2.439 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@H](C)[C@H](C)O 1118090653 NHPFTURLSGYTCR-MJBXVCDLSA-N 264.413 2.351 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCC[C@H](C(=O)N(C)C)C1 877044973 MXTJDRUKESKTIK-KBPBESRZSA-N 290.407 2.437 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H](F)Cc1ccccc1 778930613 WAUFINIQXPOLED-ZDUSSCGKSA-N 289.306 2.295 10 20 CECD CC(C)(NCc1cc2c(cc1O)OCO2)C1CCOCC1 785607738 RNTAXLMNAOLFOY-UHFFFAOYSA-N 293.363 2.416 10 20 CECD Cc1cc(C)c(C(=O)NCc2ccccc2O)c(O)n1 706285433 OJEZYHQGOMLWSD-UHFFFAOYSA-N 272.304 2.040 10 20 CECD CC(=O)c1ccc(O)c(NC(=O)c2cccc(O)c2O)c1 790919555 QEAMMRLIRFNPEK-UHFFFAOYSA-N 287.271 2.258 10 20 CECD CC(C)N(C)CCNCc1cc(F)cc(F)c1O 708443519 OVXFZAJIEJNOSB-UHFFFAOYSA-N 258.312 2.100 10 20 CECD CC[C@](C)(NCc1ccc(N(C)C)cc1)C(=O)O 1609897110 JYVASAMCVUCZQE-AWEZNQCLSA-N 250.342 2.096 10 20 CECD COc1ccc(N2CC[C@@H](CNc3cc(N)ncn3)C2)cc1 1337907040 ODGLWKAVJVDXIZ-LBPRGKRZSA-N 299.378 2.006 10 20 CECD CC(C)(C)CN(CCCO)C(=O)NCc1ccc(N)cc1 1337018520 KZOKQOJLPQTYCW-UHFFFAOYSA-N 293.411 2.209 10 20 CECD CC[C@@H](C)[C@H](CNC(=O)c1cc(O)cs1)OC 1351011639 AQNDANFWWHBAEL-SCZZXKLOSA-N 257.355 2.245 10 20 CECD CC1=NO[C@@](C)(C(=O)NCCCSc2nccs2)C1 1357913988 PUFQEFOSLADXRU-GFCCVEGCSA-N 299.421 2.296 10 20 CECD CCCc1nc(C)c(C(=O)NCc2cccc(O)c2O)o1 1350299556 DIWIARQEERWMCA-UHFFFAOYSA-N 290.319 2.277 10 20 CECD CC(C)[C@H](CO)CN[C@H](C)c1cc(C(=O)O)ccc1O 1604332944 MVJWDKPCBLOXPB-PWSUYJOCSA-N 281.352 2.006 10 20 CECD Nc1ccc(CN2Cc3ccccc3[C@@H](C(=O)O)C2)cc1 1601215565 FOQSENOAKPXGBQ-INIZCTEOSA-N 282.343 2.453 10 20 CECD CC(C)(NCc1cc(Cl)cc(F)c1O)C(=O)O 1590870327 AAVZRRQYFCFPAG-UHFFFAOYSA-N 261.680 2.138 10 20 CECD Cc1ccc(O)c(CNc2nc(C)ccc2-c2nn[nH]n2)c1 1592186131 LSILNCORRPLVRZ-UHFFFAOYSA-N 296.334 2.196 10 20 CECD CCN1CCc2cc(CN[C@@H]3CC=C(C(=O)O)C3)ccc21 1776877457 KWGBTQKOIINJQR-OAHLLOKOSA-N 286.375 2.332 10 20 CECD CCN1CCc2cc(CN[C@@H](CC3CC3)C(=O)O)ccc21 1776877621 IJLOGMRYYIHGPX-HNNXBMFYSA-N 288.391 2.412 10 20 CECD COCCOC[C@H]1CCN(Cc2cc(C)cc(C)c2O)C1 164419934 RJTOSHFBVOLVDC-HNNXBMFYSA-N 293.407 2.494 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1cccc(Cl)c1O 124714804 VOXULECYIASFFO-SNVBAGLBSA-N 284.787 2.440 10 20 CECD CC(C)S(=O)(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 275016086 SPQCXPSKEWDFKK-ZDUSSCGKSA-N 298.452 2.226 10 20 CECD C[C@H](NCc1cc(F)ccc1O)[C@H]1CCCOC1 388733970 CGYHEYBMXXXAJW-QWRGUYRKSA-N 253.317 2.436 10 20 CECD CCOCCO[C@H]1CCN(Cc2cc(F)ccc2O)C1 180284712 ZVWYPKMWCSNKIQ-AWEZNQCLSA-N 283.343 2.159 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(N3CCOCC3)cc2)CCO1 219887608 QVRPSKLSRLVJNF-ZBFHGGJFSA-N 290.407 2.180 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2cc(F)ccc2O)C1 183243455 IISKKMNJWMIFSX-NSHDSACASA-N 281.327 2.306 10 20 CECD COc1ccc(O)c([C@H](C)NCC(=O)N[C@H](C)C(C)C)c1 182406083 MTXOGXRCCGHPTO-NEPJUHHUSA-N 294.395 2.212 10 20 CECD Oc1ccccc1CN1CCC(NCC2CC2)CC1 130180649 JPFACPGYVSIYPX-UHFFFAOYSA-N 260.381 2.356 10 20 CECD COCCCNC(=O)NCc1c(C)c2ccccc2n1C 349105353 UZGUKJOQOKSGMF-UHFFFAOYSA-N 289.379 2.322 10 20 CECD C[C@@](O)(CNCc1ccccc1O)c1cccs1 265802926 TWFHBAPJNHKNMO-CQSZACIVSA-N 263.362 2.451 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC[C@@H]1CCCO1 274919692 KYYQKEQBXLWVSD-AAEUAGOBSA-N 293.363 2.104 10 20 CECD CCOc1cccc(CN2CC[C@@H](n3cccn3)C2)c1O 365840124 XCLIBDNFBMAOBG-CQSZACIVSA-N 287.363 2.434 10 20 CECD C[C@H]1C[C@@H](CCNCc2cc3c(cc2O)OCO3)CCO1 273076500 PPSPDNFXPXACHD-RYUDHWBXSA-N 293.363 2.416 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1CCCc2cn[nH]c21 272242694 AWDAFGNSUGVBEV-GFCCVEGCSA-N 261.300 2.422 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@]2(O)CCO[C@@H]2C)c(O)c1 285447665 ZHXVNIJRWSBLMV-ZENOOKHLSA-N 279.380 2.200 10 20 CECD Cc1cc(O)c(CN2CC[C@H](OC(=O)N(C)C)C2)cc1C 295183598 WEZOVKKNGUCWAN-AWEZNQCLSA-N 292.379 2.282 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1(O)CCCC1 299237264 UDLYONZXGVXRDQ-UHFFFAOYSA-N 276.380 2.016 10 20 CECD CCCN(CC(N)=O)Cc1ccc2ccccc2c1O 816617162 PTCMGMRHBOEDLY-UHFFFAOYSA-N 272.348 2.243 10 20 CECD C[C@@H]1C[C@H](O)CN(Cc2c(O)cccc2Cl)C1 825311435 KCSJBDISBGNCGO-ZJUUUORDSA-N 255.745 2.248 10 20 CECD CC[C@H](C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 839513357 XDMMPFFWSDFQJF-ZDUSSCGKSA-N 277.412 2.099 10 20 CECD Cc1ccc(C(=O)OC[C@H]2C[C@H]3CC[C@H]2O3)c(O)c1O 837491155 XFRIGJRRCLSYLC-CKYFFXLPSA-N 278.304 2.131 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1cccc(CC)c1O 848902936 KQELWIOKQLCUDV-CQSZACIVSA-N 277.364 2.482 10 20 CECD Cc1cccc2c1N[C@H](c1cccc(O)c1O)NC2=O 914579558 GNYGOIMOIVXNOI-AWEZNQCLSA-N 270.288 2.260 10 20 CECD Nc1ccc(CC(=O)N2CCO[C@H](c3ccco3)C2)cc1 846686394 IKVGOXQUFNWLIT-HNNXBMFYSA-N 286.331 2.004 10 20 CECD CC[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)[C@@H](C)O 842234011 MXCGYBNUWHVFQA-DGCLKSJQSA-N 291.391 2.294 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)c1 843060222 YEJMOBGIXJVJQV-VBNZEHGJSA-N 290.407 2.350 10 20 CECD CC(C)[C@@H](N)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 841882092 WFYUYNYUMASYFS-DOMZBBRYSA-N 292.427 2.096 10 20 CECD C[C@H]1C[C@H](NCc2ccc3c(c2)CCCN3C)c2ncnn21 924868719 CYTWQZPKXUOOBG-WFASDCNBSA-N 297.406 2.456 10 20 CECD CN1CCN(c2ccc(CN[C@@]34CCC[C@@H]3C4)cc2)CC1 923023162 NEUKXNVYRLLFJX-SJLPKXTDSA-N 285.435 2.471 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@H](O)C1CC1 854374252 QZIWWVAEEWKPGP-OAHLLOKOSA-N 277.364 2.292 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccc3c2CNC3)cc1 852775654 ZMNPSIRVIBNZOA-UHFFFAOYSA-N 295.386 2.286 10 20 CECD CC(=O)[C@@H]1CCCCN1C(=O)/C=C/c1ccc(O)c(O)c1 854731507 BGPQFECNNSATON-CFNZNRNTSA-N 289.331 2.081 10 20 CECD Cc1cc(C)n(CCCC(=O)NCc2ccccc2O)n1 934934801 AGPUMSHMXPEUNO-UHFFFAOYSA-N 287.363 2.302 10 20 CECD Cc1ccc(O)c(CN2CCC(OCCN(C)C)CC2)c1 769384585 RGZNALVXRNNPJZ-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CC(=O)N1CCC[C@H](CNCc2ccc(C)cc2O)C1 877490634 BENSILCJIZGAHZ-CQSZACIVSA-N 276.380 2.049 10 20 CECD C[C@H]1CC[C@H](CNC(=O)N[C@H](C)c2ccccc2O)O1 875656930 NIYQOWJLJDYQEM-QJPTWQEYSA-N 278.352 2.320 10 20 CECD Cc1nc(COC(=O)c2cccc(O)c2O)oc1C 776282677 UPOQVIPVCVUMBZ-UHFFFAOYSA-N 263.249 2.060 10 20 CECD CN(C)c1ccc(CN(Cc2nncn2C)C2CC2)cc1 771791281 LLJMCNYFFAIWSJ-UHFFFAOYSA-N 285.395 2.046 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@@H](C)c1c(O)cccc1F 886619077 RSHLMESLSKJBFU-COPLHBTASA-N 283.343 2.233 10 20 CECD Cc1cnc(CCNCc2cc(F)cc(F)c2O)cn1 883140552 XCVDNDYRCZLGPB-UHFFFAOYSA-N 279.290 2.101 10 20 CECD Oc1c(F)cc(Cl)cc1CNCCO[C@@H]1CCOC1 897200704 AKJKOWMFSSUGSY-LLVKDONJSA-N 289.734 2.080 10 20 CECD CCOc1ccc(N2CCN(C[C@H]3CCOC3)CC2)cc1 1202528401 CYYFAVLNBPUOBK-OAHLLOKOSA-N 290.407 2.244 10 20 CECD C[C@@H]1CSCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 792724731 DCTGVPFECBYCFP-HZMBPMFUSA-N 295.404 2.003 10 20 CECD COc1ccc(CNCCNC(=O)C[C@H]2C[C@H]2C)cc1C 1133357360 XEJDDESSABZSTA-IUODEOHRSA-N 290.407 2.256 10 20 CECD C[C@H]1COCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 796498607 XSEVWSCJWJKBQM-QWRGUYRKSA-N 280.324 2.063 10 20 CECD CCC(C)(C)n1nnnc1N(C)Cc1ccccc1O 1340341973 AIWFLXBLBKYSLI-UHFFFAOYSA-N 275.356 2.160 10 20 CECD CC[C@H](C)[C@@](C)(O)CNCc1ccc(OC)c(OC)c1O 1342948323 VYLRNIUPTHVUOV-ZBEGNZNMSA-N 297.395 2.296 10 20 CECD CCNC(=O)[C@H](C)N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 218322778 PTYSOXLZSQRZSA-GRYCIOLGSA-N 276.380 2.363 10 20 CECD O=C(O)CC1(NCc2cccc(Cl)c2O)CC1 1601936400 YPGXBFOXBASZSX-UHFFFAOYSA-N 255.701 2.143 10 20 CECD CCN(Cc1oncc1C(=O)O)c1ccc(OC)cc1 1605463311 QTZHDIBZWLMAPT-UHFFFAOYSA-N 276.292 2.408 10 20 CECD Cc1ccc(CN(C[C@@H](C)C(=O)O)C2CC2)c(O)c1 1600410870 OPSOSTZAWFQXMJ-LLVKDONJSA-N 263.337 2.386 10 20 CECD COc1cccc([C@@H](C)NCC2(C(=O)O)CCC2)c1O 1594123623 SKPMCVRGDNYNOT-SNVBAGLBSA-N 279.336 2.306 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cnn(C)c1C 161356950 OCHABVFHHXTIHN-UHFFFAOYSA-N 287.363 2.487 10 20 CECD CCN1CC[C@@H](CNCc2ccc3c(c2)CCCO3)C1 921547056 KUTPMORIHLSWDF-HNNXBMFYSA-N 274.408 2.443 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCOC1CC1 930127039 NDTHXGOQKSVXPI-UHFFFAOYSA-N 262.353 2.130 10 20 CECD c1cn2c(n1)[C@@H](NCc1ccc3c(c1)CCO3)CCC2 848526381 YHPZXPUZQAAKDX-AWEZNQCLSA-N 269.348 2.443 10 20 CECD C[C@@H](NC(=O)CCCCC(=O)O)c1ccccc1O 868461427 FFZMJCJKJDFCMG-SNVBAGLBSA-N 265.309 2.214 10 20 CECD CC[C@@H](NCCCC(=O)N(C)C)c1ccccc1O 155386839 YZDBWMOTJZWMNQ-CYBMUJFWSA-N 264.369 2.301 10 20 CECD Cc1ccc(O)c(CN2CC[C@]3(CCN(C)C3)C2)c1 292752730 IPVDHQDPPHVIQZ-INIZCTEOSA-N 260.381 2.228 10 20 CECD CCn1cc(CN[C@@H]2CCc3cccc(O)c32)cn1 296890245 OMAWLXMOPZDXEM-CYBMUJFWSA-N 257.337 2.386 10 20 CECD Cc1ccc([C@@H](C)NCC(=O)NCC(F)(F)F)c(O)c1 185179542 UKKIMWYERLKQOO-SECBINFHSA-N 290.285 2.030 10 20 CECD OCC1(CCNCc2cccc(Cl)c2O)CC1 395892678 IBFOSVHTKBSIDR-UHFFFAOYSA-N 255.745 2.298 10 20 CECD CCc1ccnc(C(=O)NCCc2ccc(N)cc2)c1 818544806 OVJMUGKRCMWSKI-UHFFFAOYSA-N 269.348 2.199 10 20 CECD Cc1nn(C)c(C)c1C(=O)N[C@H](C)c1ccccc1O 827923244 MOHACZUMCPMCOJ-SECBINFHSA-N 273.336 2.234 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1C[C@H]2CC[C@H]1C2 246412966 ABOAHXXFXVICIF-RWMBFGLXSA-N 275.348 2.193 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CSCCS1 175199044 SNOZOHCEWKTBPR-GFCCVEGCSA-N 283.418 2.199 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C(C)C)N(C)C 115489892 QLECWVFUNSBLCG-MRXNPFEDSA-N 291.439 2.263 10 20 CECD CCCCOCC(=O)N1CCOc2cc(N(C)C)ccc21 173187755 LDLGJMPCTHUIJX-UHFFFAOYSA-N 292.379 2.295 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)cc1 402937461 MSFWBDWKJQTOND-OSAQELSMSA-N 256.349 2.487 10 20 CECD C[C@H](NCCCNC(=O)C1CCC1)c1ccc(F)cc1O 186091610 GFFUKXHGVQBJAA-NSHDSACASA-N 294.370 2.488 10 20 CECD CSC[C@@H](CCO)N[C@@H](C)c1cc(F)ccc1O 185531013 KVNLZPVSELAXLC-GXSJLCMTSA-N 273.373 2.296 10 20 CECD COc1cccc(CNC(=O)Nc2cccc(C)n2)c1O 181839576 ORMRIIDPARCAHM-UHFFFAOYSA-N 287.319 2.426 10 20 CECD CCOC(C)(C)CNC(=O)/C=C/c1ccc(O)c(O)c1 188387430 FANYDUFRRRKEFM-SOFGYWHQSA-N 279.336 2.042 10 20 CECD C[C@@H]1[C@@H](C(=O)NCCc2ccc(O)c(O)c2)[C@@H]1C1CC1 528856510 AXSFQUUGGHQLLD-ULKVUYOBSA-N 275.348 2.049 10 20 CECD Nc1ccc(CNC(=O)c2cc3c(s2)CCOC3)cc1 297129450 HELYRDMKIAHYJM-UHFFFAOYSA-N 288.372 2.333 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C)CCN(C)C)c1 273363270 AUFQVJNPHHBURH-RYUDHWBXSA-N 294.395 2.170 10 20 CECD COC[C@H](CO)NCc1cc(-c2ccccc2)ccc1O 279762518 JGVQDUJHCXARNW-INIZCTEOSA-N 287.359 2.156 10 20 CECD Cc1ccc([C@H](O)CNCc2cc(F)ccc2O)o1 272366170 FXWOOCTVCDDYRT-CYBMUJFWSA-N 265.284 2.256 10 20 CECD Cn1nccc1[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 802649130 DHFKUDYOFSCYNS-SNVBAGLBSA-N 291.376 2.207 10 20 CECD CCOc1ccc(N(CC)Cc2cnn(C)n2)cc1 809957094 JAQWGXMHVNHDPD-UHFFFAOYSA-N 260.341 2.240 10 20 CECD COc1cccnc1CC(=O)NCc1ccc(N(C)C)cc1 806317767 MFOLQTZFLRVZPM-UHFFFAOYSA-N 299.374 2.015 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1CCCC1CC1 819168855 ULEVZYYKLYZVLZ-UHFFFAOYSA-N 288.347 2.347 10 20 CECD Oc1c(CN2C[C@H]3CNC[C@@H]3C2)ccc2ccccc12 816522373 WCDHJCHOOZGXMI-HUUCEWRRSA-N 268.360 2.197 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](n2cccn2)C1 812780852 VPYJZXVBZHFQLQ-GFCCVEGCSA-N 273.336 2.044 10 20 CECD Cc1cc(O)c(CN[C@@H]2CC(=O)N(C(C)C)C2)cc1Cl 825291354 KAQQMVIBSRAYNN-GFCCVEGCSA-N 296.798 2.453 10 20 CECD CSCCNC(=O)NCc1ccc(N(C)C)c(F)c1 726250429 WMNZNVNYGJAPFN-UHFFFAOYSA-N 285.388 2.054 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN[C@@H]1C 828144363 DAECABJXORRNFX-TZMCWYRMSA-N 276.380 2.129 10 20 CECD Cc1nc(CN(C)Cc2cc(C)c(C)cc2O)no1 827891175 CCMGFBGHCDRSJA-UHFFFAOYSA-N 261.325 2.332 10 20 CECD COc1cccc(O)c1CNc1cccc(-c2nn[nH]n2)c1 826217301 HAZIWCYCJQDEGP-UHFFFAOYSA-N 297.318 2.193 10 20 CECD CN(C)c1ccc(OCCCc2cncn2C)cc1 902358270 GGCBQXVUEACBRC-UHFFFAOYSA-N 259.353 2.498 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 839759060 JJRYWZHBUBREOI-CHWSQXEVSA-N 292.335 2.186 10 20 CECD COCC(C)(C)CN(C)c1ccc(OCC(=O)O)cc1 902014201 CAIBMSKWPYHYQK-UHFFFAOYSA-N 281.352 2.259 10 20 CECD COCc1cc(CN(C)c2ccc(OC)c(OC)c2)no1 839011927 SLXRYYJNBGZKGJ-UHFFFAOYSA-N 292.335 2.475 10 20 CECD CC[C@H](NC[C@@]1(C)CCC(=O)N1)c1ccccc1O 834908863 MJHMPXJNDGTMFB-SWLSCSKDSA-N 262.353 2.102 10 20 CECD CC[C@H](N[C@H](C)CC(=O)NC)c1ccc(F)cc1O 834901414 UTKCCROPHCWPSK-SKDRFNHKSA-N 268.332 2.097 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@]2(CCCN2)C1 841104928 AWCMIWTVQPBMGK-QGZVFWFLSA-N 273.424 2.389 10 20 CECD Nc1ccc(CCNC(=O)c2cnn(C3CCC3)c2)cc1 911783079 QILDYXFEGNZLAL-UHFFFAOYSA-N 284.363 2.163 10 20 CECD Cc1c[nH]cc1C(=O)NCc1ccc(N2CCOCC2)cc1 919765829 LLWVXIRDHOPBDI-UHFFFAOYSA-N 299.374 2.090 10 20 CECD COc1cccc(CN[C@@H]2CCCC(F)(F)[C@H]2O)c1O 840971270 KVNDHEGQWXYXDO-MFKMUULPSA-N 287.306 2.039 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)C[C@H](C)S1 743728760 WJLWLTNRXXZISF-YUMQZZPRSA-N 257.380 2.420 10 20 CECD COc1cccc([C@@H](C)NC[C@@](C)(O)C2CC2)c1O 846148261 YUUDXNJBGPZWAO-MEBBXXQBSA-N 265.353 2.212 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1ccc(N(C)C)c(F)c1 843065149 JSIQEACUURGUCC-TXEJJXNPSA-N 265.376 2.074 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@H]2CCOC2)c1 740082119 LQKDCRBOJFQZET-WDEREUQCSA-N 279.336 2.005 10 20 CECD C[C@@H](N)CN1CCCc2cc(OC(F)F)ccc21 843358794 OXSVWGJXVCGUNN-SECBINFHSA-N 256.296 2.388 10 20 CECD COc1cccc([C@@H](C)NCC2(O)CCCC2)c1O 846148140 XGDUQXABWMHXOD-LLVKDONJSA-N 265.353 2.357 10 20 CECD Nc1ccc(CCN[C@@H]2CCC[C@@H]2[C@@H]2CCCN2)cc1 841038231 HXCMDTFWQAYKKN-BBWFWOEESA-N 273.424 2.322 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1ccccn1 857547031 OMRMAYDJZYEMQV-UHFFFAOYSA-N 262.696 2.371 10 20 CECD CC(C)C(=O)NCCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756371657 MIGASMHWYMTHJX-PWSUYJOCSA-N 294.370 2.441 10 20 CECD CC[C@H](C(=O)NCc1cc(OC)ccc1O)N(CC)CC 750023274 XCIPHGHBQKWFHY-CQSZACIVSA-N 294.395 2.137 10 20 CECD COc1ccc(N(C)C[C@H]2CCOC2)c(OC)c1 752113333 RPLZANRSXHZLGQ-LLVKDONJSA-N 251.326 2.177 10 20 CECD Cc1cc(CN(C)CC(C)(C)CN)ccc1N(C)C 923294802 QBJWSPNCEJLOJF-UHFFFAOYSA-N 263.429 2.478 10 20 CECD C[C@H](NC(=O)CN(C)C1CCC1)c1ccc(N(C)C)cc1 863906744 VUEFZFZLABAOCE-ZDUSSCGKSA-N 289.423 2.414 10 20 CECD COc1cccc(O)c1CN1CCOCC2(CCC2)C1 761225591 JSXPNWAPXSAEGQ-UHFFFAOYSA-N 277.364 2.403 10 20 CECD Cc1cccc(N(C)C(=O)/C=C/c2ccc(O)c(O)c2)n1 779518213 KBKFBEGEPRIGCO-VQHVLOKHSA-N 284.315 2.477 10 20 CECD Cn1cc(C(C)(C)NCc2cc(F)cc(F)c2O)cn1 883017961 IVBZZDCUHVTICU-UHFFFAOYSA-N 281.306 2.429 10 20 CECD C[C@H](NCCNC(=O)c1ccco1)c1c(O)cccc1F 886495152 KABHYJCNFKYWFO-JTQLQIEISA-N 292.310 2.205 10 20 CECD COC(=O)N1CCC[C@@H](N[C@H](C)c2c(O)cccc2F)C1 886521109 UQVZLBVKTJCFAD-GHMZBOCLSA-N 296.342 2.413 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCOC[C@H]2C)c1O 894749792 KSYHIDOOIWRDDC-CHWSQXEVSA-N 279.380 2.471 10 20 CECD COc1ccc(CN2CC(C)(C)C2)c(O)c1OC 895825466 IGDSRKPNTZBJTD-UHFFFAOYSA-N 251.326 2.251 10 20 CECD COc1ccc(CNC(=O)c2ccc(O)c(C)c2)c(O)c1 794381110 KZAYRSQDRNKBLO-UHFFFAOYSA-N 287.315 2.345 10 20 CECD COc1ccc(CNC[C@H]2CCCS2)c(O)c1OC 893110012 FBFUGKDNZRZJEQ-LLVKDONJSA-N 283.393 2.395 10 20 CECD O=C(NC[C@H](CO)CC1CCCC1)c1cccc(O)c1O 799052728 JIJAHFZAPDEPJN-GFCCVEGCSA-N 293.363 2.016 10 20 CECD Cc1noc(C)c1COC(=O)c1cccc(O)c1O 790074344 PVZALRZNAHETDG-UHFFFAOYSA-N 263.249 2.060 10 20 CECD O=C(NCCOc1ccccc1F)c1cccc(O)c1O 790472655 ORLZWEQLSJXWQF-UHFFFAOYSA-N 291.278 2.046 10 20 CECD CC[C@]1(C)CN(Cc2cccc(OC)c2O)CCO1 191153438 UCXYDISFOVLTBK-OAHLLOKOSA-N 265.353 2.402 10 20 CECD Oc1c(F)cc(F)cc1CNCCN1CCCCC1 708505585 XOUUHDLCBJNLDH-UHFFFAOYSA-N 270.323 2.246 10 20 CECD COc1cccc(O)c1CN1CC[C@@H]([C@H]2CCOC2)C1 769517200 ZXLJKGMAUNJUFW-OLZOCXBDSA-N 277.364 2.259 10 20 CECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@@H]1C[C@H]1F 1350909769 ZHVTXORUSYXZQR-ZIAGYGMSSA-N 294.395 2.214 10 20 CECD O=C(CSc1ncc(C(=O)O)s1)c1ccoc1 1601350721 FDOVCALPNLSZSS-UHFFFAOYSA-N 269.303 2.409 10 20 CECD CCCC[C@H](NCc1cc(F)c(F)cc1O)C(=O)O 1605244926 KDNXOYOFRPHOAP-NSHDSACASA-N 273.279 2.403 10 20 CECD CN(C)c1ccc(CNC[C@H]2CCC[C@@H](O)C2)cc1 230668687 FYWQKBVDQNHOKH-GOEBONIOSA-N 262.397 2.393 10 20 CECD CCOc1ccc(O)c(CN(CC(=O)O)[C@H](C)CC)c1 1597130926 ZGEYUDIYCBWJDJ-LLVKDONJSA-N 281.352 2.476 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCCO2)c1 157607758 HFEKNXZAGIQTSG-HZMBPMFUSA-N 279.336 2.147 10 20 CECD COc1cccc(CNC[C@H](C)CN2CCCC2)c1O 60942118 XJDZKRIYKDCNHI-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CC[C@H](O)C2)c1 189341927 SXURMZXJZGQVJH-TUAOUCFPSA-N 265.353 2.212 10 20 CECD CCOc1cccc(CNCC2(OC)CCOCC2)c1O 123091670 RDCPWZLKYOXYIN-UHFFFAOYSA-N 295.379 2.076 10 20 CECD CCCN(CC(=O)N(C)C)Cc1ccc(N(C)C)cc1 123237319 CTCVZXZNQSJKAM-UHFFFAOYSA-N 277.412 2.053 10 20 CECD Cc1cc(NCc2ccc(N3CCOCC3)cc2)no1 182218991 WYBYYHVLCLNTND-UHFFFAOYSA-N 273.336 2.432 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](CO)C2)c1O 122844765 SIWSHKZVAIZWDO-SNVBAGLBSA-N 283.755 2.062 10 20 CECD CCn1cc([C@@H](C)NCc2cc(OC)ccc2O)cn1 180896723 KMUWZUGOUBXIOM-LLVKDONJSA-N 275.352 2.468 10 20 CECD CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)CCS1 182529190 GJGJZBGIOJIRDH-SNVBAGLBSA-N 281.377 2.374 10 20 CECD CCN(Cc1cccc(C)c1O)[C@@H](C)CS(=O)(=O)CC 180249612 NAZUSUXJEXJHEJ-ZDUSSCGKSA-N 299.436 2.346 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCC[C@@H]2C)c1O 74126059 HGVJQKRXATUURN-CMPLNLGQSA-N 278.352 2.389 10 20 CECD Cc1ccc(O)c(CNc2ccc(OCC(N)=O)cc2)c1 71407610 OFGLWROZKLJTSY-UHFFFAOYSA-N 286.331 2.177 10 20 CECD C[C@H](NCCCN1CCCC1=O)c1ccc(F)c(F)c1O 191186870 MDVBYWVZDVQVMS-JTQLQIEISA-N 298.333 2.334 10 20 CECD CCNc1nnc(Sc2ncc([N+](=O)[O-])s2)s1 45371898 BPCMQWOFXSCZRX-UHFFFAOYSA-N 289.367 2.486 10 20 CECD CC[C@H](NC[C@H]1CN2CCC[C@@H]2CO1)c1ccccc1O 91666381 XLXYGFSLQLLGIG-YCPHGPKFSA-N 290.407 2.296 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](N(C)C)C2)cc1 92938206 GPFQEWMIPGUVPV-INIZCTEOSA-N 261.413 2.279 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NCCO)c2C)c1 98067071 ZDWXQZUDWZHFMY-UHFFFAOYSA-N 272.348 2.125 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc[nH]1 263642919 CFGUNKRCAUFQLP-UHFFFAOYSA-N 272.352 2.138 10 20 CECD CCN(CCOCCOC)c1ccc(OC)cc1 267465603 UYOVPRDXTIPDRB-UHFFFAOYSA-N 253.342 2.185 10 20 CECD CCOc1ccc(O)c(CN[C@@H](COC)[C@@H]2CCCO2)c1 278778412 YVZORQQMIOGKKA-HOCLYGCPSA-N 295.379 2.075 10 20 CECD CC[C@H](NC[C@H]1CCS(=O)(=O)C1)c1ccc(C)cc1O 280260118 XDISGEQJXYBMPD-OCCSQVGLSA-N 297.420 2.176 10 20 CECD Cc1c(CNc2ncnn2C)n(C)c2ccccc12 287667258 KZDGFDRXWYGEGE-UHFFFAOYSA-N 255.325 2.227 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(C=O)c[nH]1 292858685 SUVJWRJLIVLQAD-UHFFFAOYSA-N 285.347 2.165 10 20 CECD COc1cc(O)c(CN[C@H]2CSC[C@@H]2C)cc1OC 809702971 KUKPTVQOXKQUQH-ONGXEEELSA-N 283.393 2.251 10 20 CECD C[C@@H]1C[C@H](NC2CCNCC2)c2c(O)ccc(F)c21 817937120 TXHBCXRNJZGMOD-SKDRFNHKSA-N 264.344 2.421 10 20 CECD Cc1cc(C)c(O)c(CN2CCn3cncc3C2)c1 811787404 MIGONRYDEWTNBU-UHFFFAOYSA-N 257.337 2.221 10 20 CECD CCNCCN[C@H](C)c1cc(Br)ccc1O 817952164 OJFPKPNZPDZVLO-SECBINFHSA-N 287.201 2.415 10 20 CECD CCCNCCN[C@@H](C)c1cc(OC)ccc1O 817961823 DDNRCXJZQOCKKC-NSHDSACASA-N 252.358 2.051 10 20 CECD C[S@](=O)[C@@H]1CCC[C@H](NCc2cc(F)ccc2O)C1 826910300 DWOUTBXIHRIADO-QUJCMNEKSA-N 285.384 2.311 10 20 CECD COc1cc(C)cc(CN2CCC[C@H]2C2OCCO2)c1O 902623622 ZZFJCNVRXTWJLG-ZDUSSCGKSA-N 293.363 2.047 10 20 CECD Cc1noc(C2CN(Cc3cc(C)c(C)cc3O)C2)n1 839131689 YIVPGVIUWLJKAG-UHFFFAOYSA-N 273.336 2.300 10 20 CECD CCOC1CN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 838559552 NYVMAJXDSKRKBK-LBPRGKRZSA-N 291.395 2.244 10 20 CECD CO[C@H](C)CCc1nc(Cc2ccc(N)cc2)no1 843160373 XMNSBSNDTMCMEF-SNVBAGLBSA-N 261.325 2.210 10 20 CECD O=C1CCCCC[C@H](C(=O)NCc2ccc(O)cc2O)C1 910945420 VQZMMVOWQUIZMN-NSHDSACASA-N 291.347 2.254 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2cc(OC)ccc2O)C1 840975525 OYCCLBYLJKHNAV-INIZCTEOSA-N 293.363 2.176 10 20 CECD CCOc1ccc(CN(C[C@@H](C)O)C2CC2)c(O)c1 848928499 FSQYUAGZKPKKLM-LLVKDONJSA-N 265.353 2.136 10 20 CECD CN(C)c1ccc(CNC[C@@H](CC2CC2)C(=O)O)cc1 844291897 ZZJNHKLHGUABJL-CQSZACIVSA-N 276.380 2.343 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@H](CN)C2)c1O 843347004 QMOWHEVKOJTNAH-LLVKDONJSA-N 296.798 2.419 10 20 CECD COc1cccc([C@H](C)NC[C@H](O)C2CCC2)c1O 846170296 WKVRVXZNYISYRH-GWCFXTLKSA-N 265.353 2.212 10 20 CECD COc1cccc([C@H](C)N[C@H](C)[C@H](C)OC)c1O 846168457 CWNGTJZJWXWUBK-VWYCJHECSA-N 253.342 2.475 10 20 CECD CCOC(=O)/C=C\CN(C)c1ccc(OC)c(OC)c1 929347337 HJORWLKKYQEIAE-SREVYHEPSA-N 279.336 2.259 10 20 CECD COCC[C@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756524587 HJNQXPOOINVAKD-UWVGGRQHSA-N 268.313 2.376 10 20 CECD COc1ccc(O)c(CNc2ncnc3ccncc23)c1 752635982 RXMKNGBPKBCYLI-UHFFFAOYSA-N 282.303 2.351 10 20 CECD CC(=O)N1CC[C@@H](NCc2cc(Cl)c(C)cc2O)C1 857067705 FUAHEUQOWFILJA-GFCCVEGCSA-N 282.771 2.064 10 20 CECD Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](C)O)c2C)c1 863161570 GTWNLSANCVMKJG-AWEZNQCLSA-N 286.375 2.400 10 20 CECD O=C(NCc1ccccc1O)NC1Cc2ccccc2C1 762583739 FSICBPJSPMWCOK-UHFFFAOYSA-N 282.343 2.359 10 20 CECD C[C@@H](NC(=O)c1cn(C2CC2)nn1)c1ccc(N(C)C)cc1 860950702 QVQZRTHLSFNYKJ-LLVKDONJSA-N 299.378 2.170 10 20 CECD CCN1C[C@H](C)N(Cc2cc3c(cc2O)OCO3)C[C@H]1C 769467826 ZRGINNBMGHMFGP-NEPJUHHUSA-N 292.379 2.035 10 20 CECD Cc1noc(C(F)F)c1C(=O)NCc1ccc(O)c(O)c1 778926471 VIVCHTBLTLSATF-UHFFFAOYSA-N 298.245 2.262 10 20 CECD Cc1cccc(O)c1CNCC(C)(C)[C@@]1(O)CCCOC1 877636836 BUJWQPWVGZHANG-QGZVFWFLSA-N 293.407 2.358 10 20 CECD CN(Cc1cc2c(cn1)OCCO2)Cc1ccccc1O 876615574 IFXDXVSPXWDTDR-UHFFFAOYSA-N 286.331 2.190 10 20 CECD CC(C)c1cc(NS(=O)(=O)N2CCCC2)ccc1O 882798900 INKNSKGOBAWZLS-UHFFFAOYSA-N 284.381 2.268 10 20 CECD O=C(CCC1CC1)OCC(=O)c1ccc(O)c(O)c1 783685121 NOMOMIHYRYUPCA-UHFFFAOYSA-N 264.277 2.014 10 20 CECD CCOc1cccc(CN2CCC[C@@H]([C@H](C)O)C2)c1O 780892562 LMXJPXRDSUUMQH-QWHCGFSZSA-N 279.380 2.384 10 20 CECD CCC[C@@](C)(NCc1cc(F)cc(F)c1O)C(=O)OC 894137140 MHMOZKISOBBORA-CQSZACIVSA-N 287.306 2.492 10 20 CECD Cc1nc([C@H](C)NCc2ccc(N(C)C)cc2C)n[nH]1 894779448 YNXLEWIGZOBOBN-NSHDSACASA-N 273.384 2.338 10 20 CECD COCCC[C@@H](C)C(=O)NCc1ccc(OC)cc1O 794378920 GTLDPZQAPOHZOM-LLVKDONJSA-N 281.352 2.080 10 20 CECD CC(C)(C)CC(=O)NCCc1ccc(O)c(O)c1 98074471 ZMTMFDOCQNCSLI-UHFFFAOYSA-N 251.326 2.193 10 20 CECD COc1cccc(O)c1CN1CCC[C@](C)(C(=O)O)C1 1610356971 SMBQEIPVGYHQEZ-HNNXBMFYSA-N 279.336 2.088 10 20 CECD COc1cc(O)c(CN2CCC[C@](C)(CO)C2)cc1OC 1324905475 UVTPHOQFBNTDKS-INIZCTEOSA-N 295.379 2.004 10 20 CECD COc1ccc(CNC(=O)NCCCC(F)F)c(O)c1 1339947300 QRGPQNDVPKUEHS-UHFFFAOYSA-N 288.294 2.245 10 20 CECD CN[C@H](C)CCNCc1cccc(Br)c1O 1348517000 ZBVQUMFGNIGBJY-SECBINFHSA-N 287.201 2.242 10 20 CECD CC(C)c1ncc(C(=O)NCc2ccc(N)cc2)[nH]1 1343568243 YKNPZVIZNHIYBO-UHFFFAOYSA-N 258.325 2.045 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1C[C@@H]1F 1354922621 JOHBHWOCZANGLI-XINAWCOVSA-N 255.636 2.173 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H](N)CC(C)C 1357413346 HOPBPXXBRXYADD-HNNXBMFYSA-N 291.439 2.441 10 20 CECD C[C@H](NCC1(N(C)C)CCC1)c1cc(C(=O)O)ccc1O 1604336784 IUBROVQZLQNFGV-NSHDSACASA-N 292.379 2.225 10 20 CECD O=C(O)[C@@H](CC1CC1)NCc1cccc(Cl)c1O 1608533131 DVOROUWYBNLZND-LLVKDONJSA-N 269.728 2.389 10 20 CECD C[C@@H](NC(=O)[C@@H]1CC[C@H]1C(=O)O)c1ccc(N(C)C)cc1 1603234363 MXUWYDZONPXSHB-LERXQTSPSA-N 290.363 2.041 10 20 CECD CCC(CC)(CN)NCc1cc(C)cc(OC)c1O 1577059835 YEQUONOTAFAVNI-UHFFFAOYSA-N 266.385 2.316 10 20 CECD CCOc1ccc(N(C)CC(=O)NCc2ccco2)cc1 150732600 FDMYFHCGBPEEBO-UHFFFAOYSA-N 288.347 2.431 10 20 CECD CCC[C@@](C)(O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 153888835 IBUMTOKVLACGOW-ZUZCIYMTSA-N 281.352 2.129 10 20 CECD C[C@H](NC[C@](C)(O)C(F)(F)F)c1ccccc1O 272861336 MXZVZROCIBONSB-KWQFWETISA-N 263.259 2.356 10 20 CECD Cc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1 33675609 SDPUPOMCIDZKAL-UHFFFAOYSA-N 271.316 2.379 10 20 CECD CCOc1cccc(CNC[C@]2(O)CCC[C@@H]2C)c1O 293052752 RRHQFAPPKBDTGE-BLLLJJGKSA-N 279.380 2.432 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)[C@@H](CO)SC)c1 185511114 RMNQWWXXRQMGQT-PKFCDNJMSA-N 285.409 2.164 10 20 CECD COc1ccc(O)c([C@H](C)NCCOCCF)c1 705761630 MBWRQJNCROHNRL-JTQLQIEISA-N 257.305 2.038 10 20 CECD C[S@](=O)C1(CNCc2ccc(N3CCCC3)cc2)CC1 380193715 BGGPHWPBAGLNPD-FQEVSTJZSA-N 292.448 2.288 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)(F)F)c1ccccc1O 717816838 BKWWDRVYHNGXAW-RKDXNWHRSA-N 263.259 2.356 10 20 CECD CCOCCCC(=O)NCc1ccc(N(C)C)cc1C 115280222 ROIVROGZBQKARV-UHFFFAOYSA-N 278.396 2.494 10 20 CECD COc1cccc(CNC(=O)CCc2cscn2)c1O 171486716 AWTAIOXONOZUNH-UHFFFAOYSA-N 292.360 2.106 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]2C2CC2)cc1 176564113 CNNRQLBCBPYNHS-LSDHHAIUSA-N 258.365 2.415 10 20 CECD CSCC[C@H](C)N(C)C(=O)c1cccc(O)c1O 126566505 VZIDXPCSVOHZKO-VIFPVBQESA-N 269.366 2.311 10 20 CECD CCCOc1ccc(CN2CCC[C@@H]2C(=O)OC)c(O)c1 124805040 NGAXPIJXJABZTO-CQSZACIVSA-N 293.363 2.318 10 20 CECD Oc1c(Br)cccc1CN1CCCOCC1 132726765 KMPFLCJNELWZIR-UHFFFAOYSA-N 286.169 2.377 10 20 CECD CN(C(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCSC1 181263698 VCSLVNSTUKNPDJ-TZNOJPMFSA-N 279.361 2.075 10 20 CECD Oc1ccc(F)cc1CNC[C@H]1CCCC[C@@H]1O 226610888 INRNHCALACEULP-MFKMUULPSA-N 253.317 2.172 10 20 CECD C[C@H](NCC(=O)N1CCCCC1)c1ccc(N(C)C)cc1 135108373 DKYYCXQCQRQQOY-AWEZNQCLSA-N 289.423 2.416 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CC[C@H]1CCNC1 134511634 MNXFEWYLPJOICQ-AWEZNQCLSA-N 289.423 2.101 10 20 CECD CC[C@H](NC[C@@H]1CN2CCC[C@@H]2CO1)c1ccccc1O 91666379 XLXYGFSLQLLGIG-FMKPAKJESA-N 290.407 2.296 10 20 CECD Cc1nc([C@@H]2CCCN(Cc3cc(F)ccc3O)C2)n[nH]1 272478890 SLURWOSCHHQNEZ-LLVKDONJSA-N 290.342 2.337 10 20 CECD C[C@H](Cn1cncn1)N[C@H](C)c1ccc(F)c(F)c1O 276003717 AVQIDZKADIRSOF-RKDXNWHRSA-N 282.294 2.001 10 20 CECD CCOc1ccc(O)c(CN(C)Cc2nccn2C)c1 273770004 QPAWMNFTEYCQCJ-UHFFFAOYSA-N 275.352 2.156 10 20 CECD OC[C@H]1c2ccccc2CCN1Cc1ccccc1O 271244781 BTQIQXLTBQMDFW-INIZCTEOSA-N 269.344 2.484 10 20 CECD C[C@H](NC[C@@H](C)N)c1cc(Br)c(F)cc1O 817973456 UCMPBEUIHOOPHI-RQJHMYQMSA-N 291.164 2.292 10 20 CECD COc1cc(O)c(CNC[C@](C)(OC)C2CC2)cc1OC 812772241 BTMVNSVLUZDLKY-INIZCTEOSA-N 295.379 2.314 10 20 CECD COc1cccc(CNC(=O)c2ccc3c(c2)COC3)c1O 729859181 LEPWEGSSLTZYFQ-UHFFFAOYSA-N 299.326 2.361 10 20 CECD CC[C@@H]1NCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1C 829764060 FJQNKNOTAYJFGB-HOTGVXAUSA-N 289.423 2.065 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](O)C2CC2)cc1F 826941672 JWNRDSBFTAJZSP-HNNXBMFYSA-N 294.370 2.059 10 20 CECD C[C@](O)(CNC(=O)c1cc(O)cs1)c1ccccc1 734023891 QJYKSZZXIPEMBL-AWEZNQCLSA-N 277.345 2.091 10 20 CECD CN(CCn1cccn1)Cc1c(O)ccc2ccncc12 732184486 CAXXWKDAWFDOPC-UHFFFAOYSA-N 282.347 2.269 10 20 CECD CCc1cccc(CN[C@H](C)[C@@H](C)N2CCOCC2)c1O 848894953 ITYNSGJPHARXOJ-ZIAGYGMSSA-N 292.423 2.153 10 20 CECD C[C@@H](CN[C@H](C)c1ccc(Cl)cc1O)S(C)(=O)=O 841752544 UFNJJZXDNOUCPB-DTWKUNHWSA-N 291.800 2.129 10 20 CECD CC(C)[C@H](C(=O)O)C(=O)N(C)Cc1ccc(N(C)C)cc1 843329517 LTJBBLRHESMJPA-AWEZNQCLSA-N 292.379 2.068 10 20 CECD CCc1cccc(CN2CC[S@](=O)[C@H](C)[C@H]2C)c1O 848887718 CKPQMATXDSPTBS-CLUVUEOHSA-N 281.421 2.296 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc3O2)c(O)c1O 751534649 YUICTCHXHRFLRG-LBPRGKRZSA-N 299.326 2.140 10 20 CECD CCn1nccc1CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 853241423 UZVZTBGTUZAFMK-SNVBAGLBSA-N 290.323 2.368 10 20 CECD COc1cccc(CNC(=O)c2ncccc2C)c1O 750239604 MHVQUKKEOBJRQU-UHFFFAOYSA-N 272.304 2.034 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](OC)C(C)C 935948529 OLPOFNKFWGYXRU-AWEZNQCLSA-N 286.368 2.165 10 20 CECD C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCN2C1=O 761577957 ILYAKNRKJBOETC-SMDDNHRTSA-N 287.363 2.240 10 20 CECD C[C@H]1C(=O)N(Cc2ccc(N(C)C)cc2)C(=O)N1C1CC1 760950419 PSQDUKCJBWMECW-NSHDSACASA-N 287.363 2.068 10 20 CECD CCNC(=O)CN(CC)Cc1ccc(N(C)CC)cc1 773732473 BASLMFAXAFQDIZ-UHFFFAOYSA-N 277.412 2.101 10 20 CECD CCOc1ccc(CN[C@]2(C)CCCOC2)c(O)c1 771897818 YOIQTZAKZPYTEM-OAHLLOKOSA-N 265.353 2.450 10 20 CECD Cc1ccc(CN2CCOCC(F)(F)C2)c(O)c1 877536105 JRQFIYHMBLACKX-UHFFFAOYSA-N 257.280 2.168 10 20 CECD Nc1ccc(CNC(=O)N2CC[C@@H](C3CC3)C2)cc1 1120676976 HODCYQBAGYJUHA-CYBMUJFWSA-N 259.353 2.210 10 20 CECD Cc1cc(O)c(CNC[C@@H]2CCCCS2(=O)=O)cc1C 784621718 URTHQTQZPGVFJY-AWEZNQCLSA-N 297.420 2.066 10 20 CECD C[C@@H]1[C@H](CO)CCCN1Cc1cc(F)cc(F)c1O 895014937 QJNCKICSWFGQKT-ZJUUUORDSA-N 271.307 2.263 10 20 CECD COc1ccc(CN2CCCc3n[nH]cc32)c(O)c1OC 894105226 GAJWJVXFHJZNKS-UHFFFAOYSA-N 289.335 2.085 10 20 CECD OCC[C@@H](Cc1ccccc1)NCc1ccccc1O 799349818 KQJUARRLTXLCAC-INIZCTEOSA-N 271.360 2.476 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC[C@H]3C[C@H]32)cc1 796590927 QOVWCEGDNSPGPC-DZGCQCFKSA-N 273.380 2.447 10 20 CECD C[C@H]1COC[C@H]1NCc1cccc(Br)c1O 829430522 CHTHGMQSMLTLML-GZMMTYOYSA-N 286.169 2.279 10 20 CECD COc1ccc(CNC(=O)c2cccc(Cl)n2)c(O)c1 794382424 WMRGYIDFOFKFFC-UHFFFAOYSA-N 292.722 2.379 10 20 CECD COc1ccc(CNCCCNC(=O)CC2CC2)cc1C 1154093849 CUCBBRVNMRPHKG-UHFFFAOYSA-N 290.407 2.400 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1cc(C)cc(OC)c1O 1332708572 STYMHKMPGWQXAK-LBPRGKRZSA-N 295.379 2.483 10 20 CECD CC(C)COCCCNC(=O)NCc1ccc(N)cc1 1338730408 AHOHJQZFDMYZAN-UHFFFAOYSA-N 279.384 2.131 10 20 CECD COc1ccc(CN(C)c2ccc(OCC(=O)O)cc2)o1 1599559071 ROOQJKVNBSMYIO-UHFFFAOYSA-N 291.303 2.388 10 20 CECD CC(=O)c1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1 158869033 CKSQNQOJACYCOU-UHFFFAOYSA-N 285.299 2.230 10 20 CECD Cc1ccc([C@@H](C)NCCc2ccnn2C)c(O)c1 184011846 YSCXWGHXWKTVSJ-GFCCVEGCSA-N 259.353 2.327 10 20 CECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCO1 20208529 IEBBKHYDBSJTRF-PBHICJAKSA-N 290.407 2.180 10 20 CECD Cc1ccc([C@@H](C)NCc2nnc3n2CCCC3)c(O)c1 183847766 ZDDSEGMPELQJAR-GFCCVEGCSA-N 286.379 2.479 10 20 CECD COc1ccc(CN(C)C(=O)c2cccc(O)c2O)cc1 126281549 YDVDEWNDJNOMHX-UHFFFAOYSA-N 287.315 2.379 10 20 CECD CC(=O)NCCCN[C@@H](C)c1cc2c(cc1O)CCCC2 184921859 XIFBZKUPOIOYHM-LBPRGKRZSA-N 290.407 2.448 10 20 CECD C[C@H](CN1CCCCC1)NCc1cc2c(cc1O)OCO2 42880076 YGRGRTSPTQABIE-GFCCVEGCSA-N 292.379 2.085 10 20 CECD Cc1c(CN=c2cncc[nH]2)n(C)c2ccccc12 352533980 BVKDERQEXCTSHL-UHFFFAOYSA-N 252.321 2.311 10 20 CECD CCOCCOC1CN(Cc2c(O)cccc2Cl)C1 272439893 SUWYXAFITQUBRE-UHFFFAOYSA-N 285.771 2.283 10 20 CECD Cc1ccc(O)c(CN(C)CCc2cnccn2)c1 273750193 NMGBEBABPQGEPX-UHFFFAOYSA-N 257.337 2.165 10 20 CECD O=C(CCCc1nccs1)NCc1ccccc1O 283579264 WTLJOVXNHWQDEU-UHFFFAOYSA-N 276.361 2.488 10 20 CECD CC[C@H](NCCCS(C)(=O)=O)c1ccc(C)cc1O 280054235 JTEVOWCZMXFXQS-ZDUSSCGKSA-N 285.409 2.176 10 20 CECD Cc1cc(CN(C)[C@@H]2CCC[C@H]2O)ccc1N(C)C 293505658 HRSBISGNTRBOMP-HZPDHXFCSA-N 262.397 2.406 10 20 CECD CC(=O)C(=O)CSc1n[nH]c(-c2cc(F)cc(F)c2)n1 808023884 CGHHJNXEUGQZKE-UHFFFAOYSA-N 297.286 2.000 10 20 CECD CCN(CCCN1CCCC1)C(=O)c1cc(O)cs1 807368481 HEBIGWGGKHWIPD-UHFFFAOYSA-N 282.409 2.402 10 20 CECD C[C@H](NCc1ccc2ccccc2c1O)C(=O)NCCF 816600379 VLFYDDISOJPOGX-NSHDSACASA-N 290.338 2.109 10 20 CECD CC[C@@H](O)CNCc1ccc(N2CCSCC2)cc1 818963984 HJKMNWLRFUCEOW-OAHLLOKOSA-N 280.437 2.100 10 20 CECD CCOc1ccc(CNC[C@@H]2CCCOC2)c(O)c1 725847154 DHLPNJHBPUCEOP-LBPRGKRZSA-N 265.353 2.307 10 20 CECD Cc1cccc(CNC[C@H]2CC(=O)N(C(C)(C)C)C2)c1O 827554582 GURDUQYJYSEFMW-CYBMUJFWSA-N 290.407 2.437 10 20 CECD Cc1nnc(CN(C)Cc2cc(Cl)ccc2O)o1 827039180 JNWZOKFUMQDRKF-UHFFFAOYSA-N 267.716 2.369 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NOC2CCC2)c1 836569449 GORSPEVAKAPWSQ-SECBINFHSA-N 280.324 2.245 10 20 CECD C[C@@H]1C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)c2nccn21 836956552 WKALVVMLWXCGRW-VSEZHWFZSA-N 299.330 2.130 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@H](C)CC[C@@H]2C(=O)O)c1O 844836626 JPVVZKABJNKLHB-AMIZOPFISA-N 295.310 2.171 10 20 CECD Nc1ccc(NC(=O)NCCOCC2CCC2)cc1 841296116 OXRRUJTUBWXZJK-UHFFFAOYSA-N 263.341 2.207 10 20 CECD C[C@@H]1O[C@H](C)C[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 840964659 UHUGBQMMZMBYDT-VWYCJHECSA-N 280.324 2.204 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCN[C@@H](C)[C@@H]1C 843057234 HEHMSXPZAYGVTI-KBPBESRZSA-N 261.413 2.243 10 20 CECD Nc1ccc(Cc2noc(C3CCOCC3)n2)cc1 843160025 USFHALZGPIPFBJ-UHFFFAOYSA-N 259.309 2.137 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCC[C@@H]2CN)cc1F 841030951 PYTWKAJEYPIBEK-HIFRSBDPSA-N 279.403 2.499 10 20 CECD C[C@H](Cc1cnc[nH]1)C(=O)NCc1cc(Cl)ccc1O 848242438 GJOBKTXHIUXQRK-SECBINFHSA-N 293.754 2.264 10 20 CECD CCOc1ccc(CN[C@@H]2CCSC2)c(O)c1 742383070 SMGLIQXAYMGZPB-LLVKDONJSA-N 253.367 2.386 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@@H](C)[C@H](C)NC[C@H]2C)c1O 923446332 YGUGNBAIYUNQHQ-VWYCJHECSA-N 294.370 2.305 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)c1cnnn1C 925078570 IIIMBDKDTYYKSU-LBPRGKRZSA-N 273.384 2.040 10 20 CECD CCCN1CC[C@@H](NCc2cc(OCC)ccc2O)C1 850395492 UEZNBABDTYVNLU-CQSZACIVSA-N 278.396 2.365 10 20 CECD C[C@@H](NC[C@H]1CCC(=O)O1)c1ccc(N(C)C)cc1 851950331 NRAHCZRURIDFLW-BXUZGUMPSA-N 262.353 2.109 10 20 CECD CN(C)c1ccc(CN[C@H]2CC=C(C(=O)O)C2)cc1 853035446 UNHLKTCMLDRSFX-ZDUSSCGKSA-N 260.337 2.016 10 20 CECD CCOc1cccc(CN2CC[C@@](O)(CC)C2)c1O 779219065 LHMOZUSVIDPRNY-HNNXBMFYSA-N 265.353 2.138 10 20 CECD Cc1noc(C)c1N(C)C(=O)/C=C\c1ccc(O)c(O)c1 779489896 SVRKKYSRGZASEV-ALCCZGGFSA-N 288.303 2.379 10 20 CECD C[C@@H]1O[C@H](C)C[C@H]1NC(=O)N(C)Cc1ccccc1O 875988841 NJXCBGALKNWOCR-NTZNESFSSA-N 278.352 2.100 10 20 CECD CCc1cc(CNCc2cc(F)cc(F)c2O)n[nH]1 882997546 ULWZFTLJHDCCJH-UHFFFAOYSA-N 267.279 2.246 10 20 CECD COc1ccc(CNCCNC(=O)C2=CCCC2)cc1C 1125645125 BTIXJGRVKAESRO-UHFFFAOYSA-N 288.391 2.320 10 20 CECD CCCN(CCCN(C)C)C(=O)NCc1ccc(N)cc1 1120677440 QMMYCNCGSHDYLR-UHFFFAOYSA-N 292.427 2.142 10 20 CECD O=C1C[C@H](C(=O)NCc2ccc(O)c(O)c2)c2ccccc21 789815493 DIZNQPVSQPTYTF-ZDUSSCGKSA-N 297.310 2.084 10 20 CECD C[C@@H](NCc1cc(Cl)cc(F)c1O)c1ncn(C)n1 783705838 KBWHQQXOWJMJNV-SSDOTTSWSA-N 284.722 2.164 10 20 CECD CN(C)c1ccc(CNC(=O)N(C)[C@@H]2CCCOC2)cc1 796591064 RZQZNJAGRXIPLV-OAHLLOKOSA-N 291.395 2.073 10 20 CECD COc1ccc(CN2CC[C@H]3C[C@H]3C2)c(O)c1OC 895432929 GEJCADJJLVEOJE-JQWIXIFHSA-N 263.337 2.251 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)c2ncnn2C)c1O 276470757 MSNSRGKJZSZAQM-MRVPVSSYSA-N 296.758 2.034 10 20 CECD COc1ccc(CNC(=O)c2cccc(C)n2)c(O)c1 794387358 DZUHGLMCPSRQHJ-UHFFFAOYSA-N 272.304 2.034 10 20 CECD FCCOCCNCc1ccc(N2CCCC2)cc1 702632009 FISFTTYQVIDENQ-UHFFFAOYSA-N 266.360 2.363 10 20 CECD CC1(C)[C@@H](O)C[C@@H]1NCc1c(O)ccc(Cl)c1F 790989145 YJADRLPQSZFCEC-QWRGUYRKSA-N 273.735 2.434 10 20 CECD Oc1c(F)cc(F)cc1CN1CCCN2CCC[C@H]2C1 708423330 SBXHAPVWOGCJHQ-ZDUSSCGKSA-N 282.334 2.341 10 20 CECD CC(F)(F)CCC(=O)NCCc1ccc(O)c(O)c1 762261157 IKBNGPABBFQYBQ-UHFFFAOYSA-N 273.279 2.192 10 20 CECD CC1(C)CN(Cc2ccc(N3CCCC3)cc2)CCN1 1235833910 UZSJJHXIDQXBET-UHFFFAOYSA-N 273.424 2.471 10 20 CECD Cc1ccc(CNC2CCC(C(=O)O)CC2)c(O)c1 1607782582 ZBSXMCDSIZXLMZ-UHFFFAOYSA-N 263.337 2.434 10 20 CECD CC[C@@H](C)CS(=O)(=O)NCc1cc(C)ccc1O 1328849433 BKGALGJWCNMZEJ-SNVBAGLBSA-N 271.382 2.166 10 20 CECD O=C(CC1CC(F)(F)C1)NCc1ccccc1O 825664255 ATWFDVAIDGSAOE-UHFFFAOYSA-N 255.264 2.444 10 20 CECD O=C(O)[C@H]1CC[C@H](NCCCSc2nccs2)C1 1601794637 MJHXNDYCRHMOJR-UWVGGRQHSA-N 286.422 2.468 10 20 CECD COc1ccc(CN[C@H](CCSC)C(=O)O)cc1C 1777363208 ANDREVKPGPMAPP-GFCCVEGCSA-N 283.393 2.300 10 20 CECD COc1ccc(N(C)C[C@H]2CCCNC2)cc1F 259124590 WCJLIGVRHJJPLS-NSHDSACASA-N 252.333 2.270 10 20 CECD Cc1cccc(CN[C@H](C)C(=O)NC(C)(C)C)c1O 135760993 SHOXBCLMJNJNEX-LLVKDONJSA-N 264.369 2.093 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)CN2CCCC2=O)c(O)c1 37782953 JDAXDSIGEBLNMK-QWHCGFSZSA-N 276.380 2.362 10 20 CECD CC[C@@H](N[C@@H](C)c1ncn(C)n1)c1ccccc1O 275720043 NOWIRKOPFMWTEA-CMPLNLGQSA-N 260.341 2.323 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CCC1)c1cc(F)ccc1O 281024386 MNUVIQSEAHVYII-GIGQVBGESA-N 285.384 2.483 10 20 CECD C[S@](=O)C1(CNCc2cccc(Cl)c2O)CC1 281655117 BWBLDJHQAOCKHU-KRWDZBQOSA-N 273.785 2.046 10 20 CECD C[C@H](NCC(C)(C)OCCO)c1ccc(N(C)C)cc1 287402323 QZUPVYHSTRLKRX-ZDUSSCGKSA-N 280.412 2.191 10 20 CECD COc1cccc(CN(C)[C@@H]2CCCOC2)c1O 401584280 RTJPIORAXZPEDJ-GFCCVEGCSA-N 251.326 2.012 10 20 CECD CN[C@@H](C)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 54076427 ACEROKDOGAUOBV-AWEZNQCLSA-N 289.423 2.243 10 20 CECD c1cncc(CNCc2ccc(N3CCOCC3)cc2)c1 20141290 KPCPKVOEMRQLBC-UHFFFAOYSA-N 283.375 2.208 10 20 CECD O=C(NCCCF)NCc1ccc(N2CCCC2)cc1 178685715 YIOBBBJIKGDYLT-UHFFFAOYSA-N 279.359 2.446 10 20 CECD CC[C@@H](SC)C(=O)NCc1cc(OC)ccc1O 125113403 WZCUKFRJGCOYJT-GFCCVEGCSA-N 269.366 2.159 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCOC1 179164015 HJJAERKWOGKGKW-AWEZNQCLSA-N 291.395 2.073 10 20 CECD CCOc1cccc(CNCc2cccnc2OC)c1O 37650468 UZMPEHHIWNZHGA-UHFFFAOYSA-N 288.347 2.484 10 20 CECD CCN(C[C@H]1CCCO1)C(=O)/C=C/c1ccc(O)c(O)c1 180969524 VTIJJNWYJVIFCJ-STMXVASLSA-N 291.347 2.139 10 20 CECD COC[C@@H](NCc1ccc(N2CCOCC2)cc1)C(C)C 86697467 KEWXZRDKSKTRCU-QGZVFWFLSA-N 292.423 2.284 10 20 CECD CN1CCN(C(=O)Cc2ccc(N)cc2)c2ccccc2C1 237193186 ZEKQPOXJFPSGKN-UHFFFAOYSA-N 295.386 2.290 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1C[C@H]2CNC[C@@H]2C1 90319940 RAYOQHZRORSVCL-NXEZZACHSA-N 287.190 2.350 10 20 CECD CO[C@@]1(C)C[C@@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 237155401 ISRRGZGMBMCEAU-PBHICJAKSA-N 290.407 2.473 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)CC(=O)NC)cc1 298681864 FMGDTWZKPHCROA-CYBMUJFWSA-N 277.412 2.147 10 20 CECD CCOc1ccc(O)c(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c1 271192906 MLPKOTCCMZCGIQ-JGRMJRGVSA-N 297.420 2.132 10 20 CECD CN(C(=O)c1cn(C)nc1-c1cnn(C)c1)c1ccccc1 376231930 KOBBGPPCYFSXOJ-UHFFFAOYSA-N 295.346 2.097 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCSCC1 274897883 FOIHTUAKXDVTAV-JTQLQIEISA-N 295.404 2.288 10 20 CECD C[C@@H]1OCC[C@@]12CN(Cc1cc(Cl)ccc1O)CCO2 377274183 WNSLEDALAUGYPI-XHDPSFHLSA-N 297.782 2.425 10 20 CECD COC(=O)CC1(CN(C)Cc2ccccc2O)CC1 281629972 LICXWPZYVCTZTN-UHFFFAOYSA-N 263.337 2.167 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H]2CCS(=O)(=O)C2)c(O)c1 285265723 QNKXFPNULKXHIP-STQMWFEESA-N 297.420 2.094 10 20 CECD CC(C)(O)C1CN(Cc2cccc(Cl)c2O)C1 297535381 ZPPNHERXSQBBSN-UHFFFAOYSA-N 255.745 2.248 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CC[C@@H](CO)C2)c1O 295112453 VGSOGLDBISVCGD-SKDRFNHKSA-N 285.771 2.305 10 20 CECD CC[C@H](NCCN)c1ccc(C(F)(F)F)cc1O 817934670 AKUFHYVWDLXZSM-JTQLQIEISA-N 262.275 2.410 10 20 CECD COC1([C@H](C)NCc2cc(C)ccc2O)CCOCC1 817419409 GSLQIKLNDBVXHZ-ZDUSSCGKSA-N 279.380 2.374 10 20 CECD CC[C@@H](CO)C(=O)NCc1cc(Cl)cc(Cl)c1O 813683988 BPCPXZQMTCSHBT-ZETCQYMHSA-N 292.162 2.334 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@@H]2CCCNC2)c1 817947115 KOEKPIWTHAUCCX-FRRDWIJNSA-N 278.396 2.440 10 20 CECD CN1CCCc2cc(CN[C@H]3CCC[C@@H]3N)ccc21 817901447 VSRUNXDXCWLXGT-GJZGRUSLSA-N 259.397 2.038 10 20 CECD C[C@@H](NC(=O)C1(O)CCCCC1)c1ccccc1O 827937126 LPUMEJJVCKOWNX-LLVKDONJSA-N 263.337 2.265 10 20 CECD CCCCN(CC(N)=O)Cc1cc(Cl)c(C)cc1O 824593298 NWVYSGXYAWBKGN-UHFFFAOYSA-N 284.787 2.441 10 20 CECD CCC[C@H](O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 822832393 LMKVAPDZZRXSMD-CJNGLKHVSA-N 292.423 2.269 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCC[C@@H](C)OC)c1 729053493 JJABRAUNPPVWCT-MNOVXSKESA-N 296.367 2.186 10 20 CECD CCOc1cccc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1O 824837881 JJONAXQGVJSSKQ-LXTVHRRPSA-N 287.359 2.176 10 20 CECD C[C@H](NCc1ccccc1O)c1cccc(-c2nn[nH]n2)c1 820438922 ZRUAJIRWLDVQLA-NSHDSACASA-N 295.346 2.423 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C3OCCO3)C2)cc1C 905693784 DCFYTFHLMYDACL-CYBMUJFWSA-N 277.364 2.204 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2[C@H]3CC[C@H]2COC3)c1O 839180859 SVISWFUXICYZAV-QWRGUYRKSA-N 298.726 2.317 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)NCCc1ccc(N)cc1)OC 841907603 DFBRGAWTRXSXPS-SWLSCSKDSA-N 293.411 2.172 10 20 CECD CC[C@H](CN1CCCC1)NC(=O)Nc1ccc(N)cc1 841300098 NEPKJUQKDXRJSM-CYBMUJFWSA-N 276.384 2.265 10 20 CECD CCCOC(=O)[C@@H](C)N(C)c1ccc(OC)cc1 844353320 NBACQOKCQJODKN-LLVKDONJSA-N 251.326 2.473 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H]1CCCNC1 841032497 FNTXTUJKJJGTFE-AWEZNQCLSA-N 261.413 2.150 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1C=C[C@H](CO)C1 840937472 UIBAYMMCHVJEAC-DZGCQCFKSA-N 260.381 2.088 10 20 CECD CC[C@@H](NC(=O)Nc1ccc(N)cc1)[C@H]1CCCO1 841297807 IITXZLLJNFUKHA-CHWSQXEVSA-N 263.341 2.348 10 20 CECD CN(C)c1ccc(CN2CC[C@@]3(CCNC3)C2)cc1F 843120253 BGFUFSREWFNVHS-MRXNPFEDSA-N 277.387 2.077 10 20 CECD COc1ccc(N(C)CCC(C)(C)O)c(OC)c1 752108486 AMKMIYVKOIFOQC-UHFFFAOYSA-N 253.342 2.301 10 20 CECD COC[C@](C)(O)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756577227 QWVCETGBTNQRQR-XDMRBOTDSA-N 283.343 2.067 10 20 CECD CCOC(=O)c1ccc(CNC(=O)c2cc(O)cs2)o1 752815793 KTLMPZPUZUQYCE-UHFFFAOYSA-N 295.316 2.153 10 20 CECD CC(=O)[C@@H]1CCCCN1C(=O)c1cc(O)cs1 854733142 KSIPUKNCIOOIRK-JTQLQIEISA-N 253.323 2.037 10 20 CECD COCCC(C)(C)NC(=O)NCc1ccc(N(C)C)cc1 751992603 QOCMMASUUZYKHA-UHFFFAOYSA-N 293.411 2.367 10 20 CECD CCNc1nccnc1N(C)Cc1ccccc1O 853461935 DWZRXRNCMJRUHG-UHFFFAOYSA-N 258.325 2.250 10 20 CECD CC[C@H](NC(=O)NCc1cc(C)ccc1O)[C@H]1CCCO1 858323972 KJPHALMDRDGVCD-DZGCQCFKSA-N 292.379 2.457 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCCN2CC[C@H](O)C2)c1O 858601318 DWJFXHLMSOVNAZ-YPMHNXCESA-N 298.814 2.071 10 20 CECD CC[C@H](C)CONC(=O)NCc1cc(C)ccc1O 858480961 GIHAJWMLXNPERM-JTQLQIEISA-N 266.341 2.478 10 20 CECD CCc1nn(C)cc1NC(=O)NCc1cc(C)ccc1O 860873902 PEGFWJTUIKPOIZ-UHFFFAOYSA-N 288.351 2.318 10 20 CECD C[C@@H](CC(N)=O)NCc1cc(-c2ccccc2)ccc1O 765791432 RIXGLCICHNIFLC-LBPRGKRZSA-N 284.359 2.413 10 20 CECD C/C=C/C[C@@H](CO)NCc1c(O)cccc1Cl 769936075 CYZGVMQQRURFFM-PBKGFPTLSA-N 255.745 2.462 10 20 CECD CCn1cccc(CNCc2ccc(C)cc2O)c1=O 877484792 OACTWMFYLRUVNS-UHFFFAOYSA-N 272.348 2.172 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3ccc(C)cc32)cn1 773806394 UIAYDBMKPPSVQP-XQRVVYSFSA-N 295.342 2.396 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cscn1 62661813 SYHNYENDSZBQME-UHFFFAOYSA-N 275.377 2.481 10 20 CECD CC(C)CC[C@H](N)C(=O)NCc1ccc(N(C)C)c(F)c1 876739058 BWHHLHONAYGLCM-AWEZNQCLSA-N 295.402 2.271 10 20 CECD Cc1cccc(CN2CCC(O)(C(F)F)CC2)c1O 779207516 YSOIJWSDCJUJMS-UHFFFAOYSA-N 271.307 2.293 10 20 CECD C[C@@H]1CCN2[C@@H](c3cc(Cl)cc(F)c3O)NC(=O)[C@H]2C1 777900104 ZOWGPXKKXHJDIX-QUUYKZCZSA-N 298.745 2.414 10 20 CECD C[C@H](NC1CCN(C)CC1)c1c(O)cccc1F 886493522 OUHNKJXIYCTXSJ-JTQLQIEISA-N 252.333 2.276 10 20 CECD N=C(NCCCSc1nccs1)NCC1CC1 887355123 DKNAPILEHZCYES-UHFFFAOYSA-N 270.427 2.149 10 20 CECD CCN(CC)c1ccc(CN[C@@](C)(COC)C(=O)O)cc1 789902544 BPUNVFOQWMDVJC-INIZCTEOSA-N 294.395 2.112 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCSC1 74820915 JCPKZSSBYZZXAQ-LLVKDONJSA-N 266.366 2.039 10 20 CECD COC(=O)COc1ccc(N(C)Cc2ocnc2C)cc1 894445985 SHZPHERZDLJVPU-UHFFFAOYSA-N 290.319 2.171 10 20 CECD COC(=O)CC1(NCc2cc(C)cc(OC)c2O)CCC1 894375269 PIDHVAFXDAUIHW-UHFFFAOYSA-N 293.363 2.285 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@H]1CC[C@@H](O)C1 789585489 AAGDIFNNMWAVQK-LDYMZIIASA-N 273.735 2.435 10 20 CECD COc1cc(C)cc(CN[C@H]2CCCC[C@@H]2O)c1O 894504260 MPSDUUXSJXTNQV-STQMWFEESA-N 265.353 2.102 10 20 CECD COc1ccc(CNC(=O)[C@@H](F)C(C)C)c(O)c1 794389072 ILSBJMIWILPFFR-LBPRGKRZSA-N 255.289 2.011 10 20 CECD Oc1ccccc1CN[C@H]1c2ccccc2C[C@@H]1O 207895481 LZVULFXZJVRHCQ-HOTGVXAUSA-N 255.317 2.140 10 20 CECD c1cc2c(cc1CN[C@H]1CCN3CCC[C@@H]3C1)CCO2 108098113 RUIHHLKIMKYEFW-JKSUJKDBSA-N 272.392 2.338 10 20 CECD N[C@@H]1CC=C(C(=O)N2CCCc3c2cc(F)c(F)c3F)C1 1580170924 BYOCDJMZWRZATD-SECBINFHSA-N 296.292 2.431 10 20 CECD NC[C@@]12CC[C@H]1CCN2Cc1cc(Cl)c(F)cc1O 1580253720 QZMJHHVLEXUTIH-HZMBPMFUSA-N 284.762 2.498 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@](C)(C(=O)O)C2)cc1 1777039945 HBHOLAPMQGKNNI-CZUORRHYSA-N 276.380 2.486 10 20 CECD CO[C@H](CN1CCOc2cc(N(C)C)ccc21)C1CC1 822791871 XRFXPOKZNNDDCX-MRXNPFEDSA-N 276.380 2.376 10 20 CECD COc1ccc(N(C)CCCc2nc(C)no2)cc1 844354607 DGUOOEIIQWDIJV-UHFFFAOYSA-N 261.325 2.456 10 20 CECD C[C@@H](CNCc1ccc(N2CCCC2)cc1)N(C)C 38087615 VTJMHADISUXRGZ-AWEZNQCLSA-N 261.413 2.327 10 20 CECD COc1ccc(O)c([C@H](C)NC2CCN(OC)CC2)c1 692122497 BBELKQFYTLGYOF-NSHDSACASA-N 280.368 2.077 10 20 CECD C[C@H](C(=O)NC(C)(C)C)N(C)Cc1ccccc1O 109769228 RRFDOUKMRIGHEQ-LLVKDONJSA-N 264.369 2.127 10 20 CECD CCCNC(=O)CCCC(=O)N(C)Cc1ccccc1O 104853131 MDMYYFVXIMEDME-UHFFFAOYSA-N 292.379 2.047 10 20 CECD COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@H]3C)CC2)cc1 55877683 WHCQHPCQDNNITR-CZUORRHYSA-N 288.391 2.390 10 20 CECD O=C(CCc1cccs1)NCc1ccc(O)c(O)c1 178443831 XKQIKXHSSTVVGQ-UHFFFAOYSA-N 277.345 2.408 10 20 CECD COc1ccc(O)c(CNC(=O)CCC(F)(F)F)c1 173579227 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COc1ccc(O)c([C@@H](C)N[C@@H](C)Cc2cnn(C)c2)c1 825045562 HBNFKRPAMFZQTD-NWDGAFQWSA-N 289.379 2.416 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)CC(=O)O 820980276 MQBWHHHLWPIBSK-LLVKDONJSA-N 250.342 2.014 10 20 CECD COc1ccc(N(Cc2nnnn2C2CC2)CC2CC2)cc1 831583315 WQRLPHQQOWVLHC-UHFFFAOYSA-N 299.378 2.433 10 20 CECD C[C@@H]1CCC[C@H](OCC(=O)NCc2ccc(O)cc2O)C1 910955198 OQQMFPYNUYPFCH-RISCZKNCSA-N 293.363 2.309 10 20 CECD CCC1(NC(=O)C(=O)Nc2ccc(N)cc2)CCCC1 841135392 HXUNKZCZJKRZNK-UHFFFAOYSA-N 275.352 2.046 10 20 CECD CO[C@](C)(C1CC1)[C@H](C)NCc1cc2c(cc1O)OCO2 840961776 ZEDCBUQRMFPLNL-QFYYESIMSA-N 293.363 2.414 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)c2csnn2)c1 840969902 LYFORGCCIIKTLH-VIFPVBQESA-N 279.365 2.493 10 20 CECD C[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)[C@H](C)[C@@H]1C 842273259 DCEFFBGMVAGNAV-IWSPIJDZSA-N 267.300 2.353 10 20 CECD CC[C@H](C)CC[C@@H](O)CC(=O)NCc1ccc(O)cc1O 910945988 GYDZTWHZAAUPJE-SMDDNHRTSA-N 295.379 2.291 10 20 CECD CC(C)C(C)(C)CNC(=O)C(=O)Nc1ccc(N)cc1 841096344 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792849077 OKCIENKULABDEW-IUODEOHRSA-N 278.396 2.430 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H]2CCCCNC2=O)cc1 1256015759 JKUZLFZNVORWEA-MRXNPFEDSA-N 289.423 2.243 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN(C)[C@H](C)C2)c1O 110727314 VZILWMSSDDRPBI-SNVBAGLBSA-N 296.798 2.384 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@H](C(=O)O)C2)cc1 1606055999 SCZVGKAASMIDMT-CHWSQXEVSA-N 262.353 2.096 10 20 CECD C[C@H](NC[C@H]1CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589978771 PVDNPNMSYNJELE-VHSXEESVSA-N 287.367 2.269 10 20 CECD C[C@@H](NCCCCF)c1cc(C(=O)O)ccc1O 1593265392 SFMUKJBVQYJFAG-SECBINFHSA-N 255.289 2.491 10 20 CECD CCOc1cccc(CN2CCC(C(=O)OC)CC2)c1O 159200610 RJTNHWMHHYLNBY-UHFFFAOYSA-N 293.363 2.176 10 20 CECD COc1cccc(O)c1CN1CC[C@H](OC)[C@H](C)C1 824815068 IBWSUQSSDGKHEI-RISCZKNCSA-N 265.353 2.258 10 20 CECD Cc1ccc(CN2CC[S@](=O)C(C)(C)CC2)c(O)c1 877569962 BMXFMEZURFZFAY-IBGZPJMESA-N 281.421 2.434 10 20 CECD Cc1ccc(O)c([C@H](C)NCCc2n[nH]c(C)n2)c1 273435060 LVZAESWBBXWXJQ-JTQLQIEISA-N 260.341 2.020 10 20 CECD CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)C(=O)OC 182430675 WUINJJQZCNAYPK-CABZTGNLSA-N 267.325 2.003 10 20 CECD COCC[C@H](CO)N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 312155068 BSKMMVDEKBDZSC-YNEHKIRRSA-N 279.380 2.236 10 20 CECD CC[C@@H](C)C[C@@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 400859796 MOQNKEVDWYEOMW-CZUORRHYSA-N 291.439 2.475 10 20 CECD CCCc1cccc(C=C2C(=O)N(C)C(=O)N(C)C2=O)c1 186853205 VDSQHTQCCTZAJS-UHFFFAOYSA-N 286.331 2.073 10 20 CECD COCCCN(C)Cc1ccc(N(C)C)c(F)c1 120448125 GCFUKIHHIHGYKA-UHFFFAOYSA-N 254.349 2.360 10 20 CECD C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1cccnc1 180889570 LSQAZDKJPCQSDS-OKPNEXGHSA-N 284.315 2.383 10 20 CECD C[C@H]1COCCN1Cc1c(O)ccc2ccncc12 46478109 GORHWXPCSBIHCA-NSHDSACASA-N 258.321 2.161 10 20 CECD CC(C)C(=O)NCCN[C@@H](C)c1ccc(F)c(F)c1O 191184832 KYBLXYPBJSAVTJ-VIFPVBQESA-N 286.322 2.093 10 20 CECD CO[C@H]1CN(Cc2c(O)ccc3ccccc23)C[C@H]1OC 234840030 SGBMMSJILMZXCB-CALCHBBNSA-N 287.359 2.391 10 20 CECD CCN(CC)C[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1 236903398 BLZXFMSSRAKNSE-OAHLLOKOSA-N 289.423 2.002 10 20 CECD COc1ccc(N2CCCN(C[C@@H](C)OC)CC2)cc1 182076718 IVORZGSDZICGAR-CQSZACIVSA-N 278.396 2.242 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2CCCSC2)cc1 267348022 QWQFGADKHSXAKN-ZDUSSCGKSA-N 293.436 2.447 10 20 CECD Oc1cc2c(cc1CN[C@@H]1CCCc3cn[nH]c31)OCO2 268883920 YNRQJEKRXDLXNK-LLVKDONJSA-N 287.319 2.011 10 20 CECD CO[C@@H]1CCCC[C@@H]1NC(=O)c1ccc(C)c(O)c1O 272737994 LLCRLGFEOLMKEZ-NWDGAFQWSA-N 279.336 2.094 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C[C@@H]2CCC[C@@H]2O)c1O 270065993 HLMZMLWBKOOUEJ-NHYWBVRUSA-N 295.354 2.327 10 20 CECD CSCCCN(C)Cc1cc2c(cc1O)OCO2 281211421 JUCMDKGUTCNUIQ-UHFFFAOYSA-N 269.366 2.306 10 20 CECD CCOC(=O)C[C@H](Sc1nccs1)C(C)=O 286616285 PEORPTLDRBGERG-QMMMGPOBSA-N 259.352 2.146 10 20 CECD CC[C@](C)(OC)C(=O)NCc1ccc(N(C)C)c(F)c1 280052848 NPUPMWZHPFYRMQ-HNNXBMFYSA-N 282.359 2.323 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)c(F)c2)[C@H](C)C1 809698278 XPEDWBKBSWGMRM-CYBMUJFWSA-N 279.403 2.418 10 20 CECD OC[C@]1(F)CCN(Cc2c(O)ccc(Cl)c2F)C1 802661663 VAZBVCOOUWYQOU-LBPRGKRZSA-N 277.698 2.091 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCC[C@H](OC)C2)c(O)c1 816550663 XUPKEKKNLNEVIR-AAEUAGOBSA-N 293.363 2.222 10 20 CECD CNC(=O)C1CCN(Cc2cc(Cl)c(C)cc2O)CC1 824542150 OWRZFIJBBBOHIA-UHFFFAOYSA-N 296.798 2.312 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc(C)n(C)n1 727168600 RGFKAPGRPSNMGW-UHFFFAOYSA-N 287.363 2.487 10 20 CECD COC(=O)c1cnc(SCC2(C)COC2)s1 829681337 UNCZNYJVJSZORJ-UHFFFAOYSA-N 259.352 2.058 10 20 CECD Oc1ccccc1CN(C[C@H]1CCCN1)C[C@H]1CCCO1 903427598 YIOBWJFWARBQMJ-HZPDHXFCSA-N 290.407 2.125 10 20 CECD CC(C)[C@@H]1C[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 838079063 DCVROCYGZDUXGV-XEGQIGPUSA-N 261.321 2.272 10 20 CECD CCN(C)c1ccc(CN2C[C@@H](C)C[C@@H](O)C2)cc1 832716890 AQNUHFZLPMLLOX-XJKSGUPXSA-N 262.397 2.345 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@]2(CCSC2)C1 837100484 WPZXMPTXCNXEEW-HNNXBMFYSA-N 293.388 2.457 10 20 CECD CCc1cnc(O)c(C(=O)N(C)Cc2ccccc2O)c1 830140625 DTYLRZXDRZRIQO-UHFFFAOYSA-N 286.331 2.327 10 20 CECD O=C(NCCOCC1CCCC1)NCc1ccccc1O 836671469 CNONLYVDGKKDCT-UHFFFAOYSA-N 292.379 2.398 10 20 CECD Cc1cc(N(C)C)nc(NCc2cc(F)cc(F)c2O)n1 905412831 JNHBGBBGGJTGGB-UHFFFAOYSA-N 294.305 2.447 10 20 CECD Cc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)nn1 839524792 KNIWZZRGAIQYGT-UHFFFAOYSA-N 296.374 2.315 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1cnsn1 839116069 OSQUJCYJXMYWQH-UHFFFAOYSA-N 291.380 2.234 10 20 CECD Oc1cccc2c1[C@H](NCCOC[C@@H]1CCOC1)CC2 834578567 UWSVPAVFYQBSEI-TZMCWYRMSA-N 277.364 2.022 10 20 CECD C[C@H](NC(=O)C(=O)c1ccc[nH]1)c1ccc(N(C)C)cc1 836207333 HVASHGVRQNKBNE-NSHDSACASA-N 285.347 2.141 10 20 CECD O=C(NCc1ccc(O)cc1)NCc1ccccc1O 748459725 IRAHDDHKDZNLFN-UHFFFAOYSA-N 272.304 2.097 10 20 CECD COCC[C@@H](C)CNC(=O)NCc1ccc(N(C)C)cc1 840245504 WHBPDFCSMLAYHU-CYBMUJFWSA-N 293.411 2.224 10 20 CECD CCONC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840350622 PVFORTALVJJXQB-GFCCVEGCSA-N 279.384 2.243 10 20 CECD Oc1c(Cl)cccc1CNC[C@H]1CCCNC1 841032259 AYHVAITWERPCGN-JTQLQIEISA-N 254.761 2.135 10 20 CECD COc1cccc([C@H](C)N[C@H]2CCN(C(C)C)C2=O)c1O 846152877 VGNNQNRUNDFKQD-AAEUAGOBSA-N 292.379 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180858520 CIZQOMAHUGPMIF-ZVYZJRAXSA-N 273.332 2.370 10 20 CECD Cc1cc(C(=O)N2CCC[C@@H](O)C2)c(C)n1-c1ccccn1 73746370 NIDNDXNGGYYXES-CQSZACIVSA-N 299.374 2.086 10 20 CECD COC(=O)CC(C)(C)NCc1ccc(N(C)C)cc1 237130725 HOGQBKLFDFIARV-UHFFFAOYSA-N 264.369 2.184 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)N1CCC1 46984157 VLCUITBBDZDMBJ-UHFFFAOYSA-N 259.353 2.202 10 20 CECD COC(=O)Cc1cccc(NCc2ccccc2O)n1 191653645 DNZIHNCERMVISU-UHFFFAOYSA-N 272.304 2.115 10 20 CECD CCOc1cccc(CN2CCC[C@@]23CCOC3=O)c1O 190036020 HERLXAGSFWHWAC-INIZCTEOSA-N 291.347 2.072 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@H](C)CO)c1O 132098075 DQCWKYHCFMPLHR-MRVPVSSYSA-N 271.744 2.061 10 20 CECD CO[C@@H]1[C@H]2C[C@@H]3CN(Cc4ccccc4O)[C@H]1[C@H]3C2 289752861 QRQGVONXDJKCSF-KUCCMMOJSA-N 259.349 2.247 10 20 CECD Cc1ccc(O)c(CN(CCO)Cc2cccnc2)c1 93086303 NKEWOXJWIUWWDA-UHFFFAOYSA-N 272.348 2.090 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1cc(Cl)ccc1O 93771542 XQLXIGLZALLIRJ-LBPRGKRZSA-N 282.771 2.146 10 20 CECD Cc1c(CNC(=O)c2cc(C)n(C)n2)n(C)c2ccccc12 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CSC[C@@H](C)C(=O)NCc1cc(C)ccc1O 862760075 LBUIIIAZYXUWQA-SNVBAGLBSA-N 253.367 2.316 10 20 CECD C[C@@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccccc1O 877755948 URGYJYUCXKWVKR-AGIUHOORSA-N 297.420 2.399 10 20 CECD Cc1ccc(CN[C@@H](c2nncn2C)C(C)C)c(O)c1 877513744 BYOYMJYROKTBQR-CQSZACIVSA-N 274.368 2.316 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2C[C@H](C)[C@@H](C)C2)c1O 774904285 GBWMWDRGOFEXPN-UWVGGRQHSA-N 280.324 2.397 10 20 CECD CCC[C@@H](OCC)C(=O)NCCc1ccc(N)cc1 876527501 HVFRKKGOCOOFRN-CQSZACIVSA-N 264.369 2.133 10 20 CECD C[C@@H](NC(=O)C1(CC(=O)O)CCC1)c1ccccc1O 871596596 SIWJCIXVINRMCN-SNVBAGLBSA-N 277.320 2.214 10 20 CECD COc1cc(O)c(CN2CCC(CCO)CC2)cc1OC 775648421 UDWDZQBWDGNBDE-UHFFFAOYSA-N 295.379 2.004 10 20 CECD Cc1cc(C(=O)N2C[C@@H](N)C[C@H]2C)c(C)n1-c1ccccn1 877175411 JNFDBKXHJUSZEO-RISCZKNCSA-N 298.390 2.051 10 20 CECD O=C(/C=C/c1cccnc1)N1CCc2ncccc21 770672500 MLWVHHJSEVBKIL-AATRIKPKSA-N 251.289 2.079 10 20 CECD C[C@@H](NC(=O)N=c1cc[nH]cc1)c1ccc(N(C)C)cc1 775434211 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1575871175 AALSDVBEMHNYAN-UHFFFAOYSA-N 288.351 2.024 10 20 CECD CO[C@@]1(CN[C@@H](C)c2cc(C)ccc2O)CCOC1 123156440 ONORRWYVXNLKIO-SWLSCSKDSA-N 265.353 2.157 10 20 CECD CC(=O)NC[C@@H]1CCCN(Cc2cc(C)cc(C)c2O)C1 164219076 OAAHIKFQYUAEDW-HNNXBMFYSA-N 290.407 2.357 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)Cc1ccccc1 151260707 QWUROHODMWJOKX-UHFFFAOYSA-N 291.372 2.354 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1ccc(F)c(F)c1 37374605 DIPHWOGFZJTNDR-UHFFFAOYSA-N 285.271 2.471 10 20 CECD C[C@H](NCC1([S@@](C)=O)CCC1)c1ccc(F)cc1O 281172001 WIHDNIAFVVVNGP-APBUJDDRSA-N 285.384 2.483 10 20 CECD CCOc1cccc(CN[C@@H](C)CCN(C)C)c1O 49553121 JDZWTMXNRZPTNK-LBPRGKRZSA-N 266.385 2.221 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc(O)c1O 186961499 AJBZAOFRSTVMPM-UHFFFAOYSA-N 273.288 2.076 10 20 CECD CCN(CC)CCSc1ncc(C(=O)O)s1 309344673 YHRTUFYEEKRDTC-UHFFFAOYSA-N 260.384 2.275 10 20 CECD COc1cc(O)c(CN[C@@H]2CCOC(C)(C)C2)cc1OC 127237025 NTQLBHQMGYGABB-GFCCVEGCSA-N 295.379 2.457 10 20 CECD C[C@@H](O)CN[C@H](C)c1cc(Br)ccc1O 134835057 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CN(C)c1ccc(CN=c2nc[nH]n2C(C)(C)C)cc1 800815237 QODSZHCIHHHKKG-UHFFFAOYSA-N 273.384 2.133 10 20 CECD CCNC(=O)[C@@H](NCc1ccc(OCC)cc1O)C(C)C 815144510 FWSNWNTXYOTWNO-HNNXBMFYSA-N 294.395 2.041 10 20 CECD COCC[C@@](C)(O)CNCc1ccc2ccccc2c1O 816549860 ALIFXXCIGVTCPX-QGZVFWFLSA-N 289.375 2.423 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cn1ccc(C)n1 825679559 VEBFDFMJDGJMGU-UHFFFAOYSA-N 287.363 2.336 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C1CCC=CCC1 821071183 XDCLVBYGFKTXAQ-UHFFFAOYSA-N 261.321 2.460 10 20 CECD c1cc2c(cc1CN[C@@H]1CC13CCNCC3)CCCO2 904354858 JWUPMGCEUFBMEO-MRXNPFEDSA-N 272.392 2.243 10 20 CECD C[C@@H](NCc1cn(C2CC2)nn1)c1ccccc1O 906323003 NLURNTUSALWPTE-SNVBAGLBSA-N 258.325 2.169 10 20 CECD CC(C)N1CCC[C@H](NC(=O)c2cc(O)cs2)C1 832296759 NRIABJGYBCUZMO-JTQLQIEISA-N 268.382 2.056 10 20 CECD CC(=O)N1CCC(CN[C@@H]2CCc3cccc(O)c32)CC1 834570407 GRISXXIFLJNKOF-OAHLLOKOSA-N 288.391 2.228 10 20 CECD c1csc(SCCCNc2nccn3cnnc23)n1 746460789 JSMKHBSKRRYXAN-UHFFFAOYSA-N 292.393 2.175 10 20 CECD Oc1ccc2c(c1CNC(=S)NC1CC1)CCCC2 741874018 GTHSGGLBQITOLO-UHFFFAOYSA-N 276.405 2.398 10 20 CECD COc1cccc(O)c1CN1CCC(NCC2CC2)CC1 843054655 ZQOXEWWVJHRQPJ-UHFFFAOYSA-N 290.407 2.365 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CC[C@@H]2NCC[C@@H]2C1 843127091 OKBQKYXXIDNHAB-RNCFNFMXSA-N 284.762 2.369 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CO[C@@H](C)C2)c1 842775284 LYAJEGROQJHUSB-CMPLNLGQSA-N 251.326 2.058 10 20 CECD COc1cccc([C@H](C)NC[C@@](C)(O)C(F)(F)F)c1O 846156548 FYDOUQYCNLUUFC-QPUJVOFHSA-N 293.285 2.365 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCN(C(C)C)C1=O 840934218 OHLBJQWVMCJDCS-MRXNPFEDSA-N 289.423 2.160 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H](OC2CCC2)C1 848301764 DUVVLFCPVIFGTF-LBPRGKRZSA-N 291.347 2.272 10 20 CECD CC1CCN(C[C@H](C)NC(=O)Cc2ccc(N)cc2)CC1 852861323 BOXDUJJYSNAZNB-AWEZNQCLSA-N 289.423 2.048 10 20 CECD CO[C@@]1(C)C[C@H]1N[C@H](C)c1cc([N+](=O)[O-])ccc1O 850571926 WSARCXMKNZQWAU-WQHBLYJGSA-N 266.297 2.128 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)C(=O)N(C)C)c(O)c1C 756739841 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CC[C@@H](NC[C@H]1C[C@H](O)C1)c1ccc(F)cc1O 872125912 HEWOPKBKFZHISW-IRUJWGPZSA-N 253.317 2.343 10 20 CECD C[C@H](NC[C@@](C)(O)C(F)(F)F)c1c(O)cccc1F 886558378 ITVIVNUPZKKLLR-WRWORJQWSA-N 281.249 2.495 10 20 CECD CO[C@H]1CCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1O 774830831 DKEJNKXDYZSUGI-YGRLFVJLSA-N 280.324 2.205 10 20 CECD Nc1ccc(CNC(=O)C2C[C@@H]3CCC[C@H](C2)C3=O)cc1 1122445203 OOXJFEBICVFGPP-PBWFPOADSA-N 286.375 2.280 10 20 CECD CCc1cccc(CN2[C@@H](C)[C@@H](C)NC(=O)[C@H]2C)c1O 895123745 ZCHTXGGXVAKGFY-GRYCIOLGSA-N 276.380 2.052 10 20 CECD CN1CCN(Cc2ccc(N3CCCC3)cc2)CC1 1204320439 YTVHCCVYCYWLJU-UHFFFAOYSA-N 259.397 2.034 10 20 CECD CCOc1cccc(CN2CCOCC2(C)C)c1O 133551041 UTAYERSYHQKTAY-UHFFFAOYSA-N 265.353 2.402 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1cc(Cl)ccc1O 793324073 HTDJFRLUDFXNTH-MRVPVSSYSA-N 257.717 2.039 10 20 CECD CC[C@H](F)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1335961796 MYBIRGVCNGNLPE-WFASDCNBSA-N 294.370 2.386 10 20 CECD Cc1cc(O)c(CN2CCc3ncncc3C2)cc1C 1331066904 OCOZEZCFGGBOPV-UHFFFAOYSA-N 269.348 2.357 10 20 CECD CCN(CCc1ccccn1)C(=O)NCc1ccc(N)cc1 1337078917 ROEUDPYJKMDGDQ-UHFFFAOYSA-N 298.390 2.438 10 20 CECD O=C(C[C@H]1CCOC1)Nc1c(Cl)ccc2nonc12 1342950677 ILDZPLFHMBQKSF-SSDOTTSWSA-N 281.699 2.241 10 20 CECD C[C@@H](Cc1ccncc1)NC(=O)NCc1ccc(N)cc1 1346374566 AMHMOKVQMMDIJF-LBPRGKRZSA-N 284.363 2.094 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@]1(F)CCOC1 1342394746 HEUNCWNGGAYZLY-INIZCTEOSA-N 293.338 2.016 10 20 CECD Cc1nc(CC2CCN(Cc3ccc(N)cc3)CC2)no1 1345159498 IPXIGXXWLGMCAQ-UHFFFAOYSA-N 286.379 2.415 10 20 CECD CCC[C@@H]1C[C@H](C(=O)NCc2cccc(O)c2O)CCO1 1352658392 UGEAKNUVRPNXPH-DGCLKSJQSA-N 293.363 2.309 10 20 CECD O=C(O)[C@H](C[C@H]1CCCO1)NCc1cccc(Cl)c1O 1601641572 MEVMBCIDZMRROM-PWSUYJOCSA-N 299.754 2.158 10 20 CECD CC[C@H](COC)N[C@H](C)c1cc(C(=O)O)ccc1O 1605054886 ODCYYYDMHBSFNU-MWLCHTKSSA-N 267.325 2.166 10 20 CECD C[C@H](NC(=O)[C@@H](N)c1ccccc1)c1ccccc1O 1574107376 FEZVLJLJCJBQGF-NHYWBVRUSA-N 270.332 2.269 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)C1CC2(CCC2)C1 843832061 KLCHSRCOOBJYCJ-UHFFFAOYSA-N 275.348 2.337 10 20 CECD CCc1cccc(CN2CCN(CC)C[C@@H]2C)c1O 848910754 PNOXNHQZUXEYRO-ZDUSSCGKSA-N 262.397 2.481 10 20 CECD OCC[C@@H]1CCC[C@@H]1NCc1cc(F)cc(F)c1O 883093625 ASKCYXDRWSJOSD-ZANVPECISA-N 271.307 2.311 10 20 CECD C[C@H](CCN(C)C)NCc1cc(F)cc(F)c1O 708440677 DVZMJBPZSPZUCZ-SECBINFHSA-N 258.312 2.100 10 20 CECD C[C@@H]1CCC[C@@]1(O)CNCc1cc(F)cc(F)c1O 708516311 GSSIVUVXPGHUOD-YMTOWFKASA-N 271.307 2.311 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCN(C3CC3)C1)CC2 389088052 FYPYJFSWNCJGBK-TZMCWYRMSA-N 258.365 2.206 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccc(N)c2)cc1 40825800 WYBVTXLKCLLIQV-UHFFFAOYSA-N 269.348 2.265 10 20 CECD C[C@H]1C[C@@H]1NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 108796262 QUMXMCYDLKEUDK-BVUAFDDQSA-N 286.375 2.061 10 20 CECD Cc1cc(NCCc2ccc(O)c(O)c2)nc(C)n1 133130135 ZQTIVMWQWMAZJH-UHFFFAOYSA-N 259.309 2.159 10 20 CECD CC[C@H](C)NC(=O)CN1CCCc2cc(OC)ccc21 27959652 IWGNBXQUTNXJJD-LBPRGKRZSA-N 276.380 2.363 10 20 CECD COc1ccc(N(C)CC(=O)OCC(C)C)cc1F 181475717 ODMJWNSFWBSSNG-UHFFFAOYSA-N 269.316 2.470 10 20 CECD CSC[C@H](CCO)N[C@H](C)c1cc(F)ccc1O 185530999 KVNLZPVSELAXLC-KOLCDFICSA-N 273.373 2.296 10 20 CECD Cc1ccc(C(=O)N2C[C@@H]3[C@@H](C2)C3(C)C)c(O)c1O 182509915 GNZJHGVHVIRLIS-GHMZBOCLSA-N 261.321 2.134 10 20 CECD COc1ccncc1NC(=O)c1ccc(C)c(O)c1O 182265685 NUMYZALTWZRDMG-UHFFFAOYSA-N 274.276 2.062 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)ccc2O)C[C@H]1C 188118427 MAGWYKDXVCDNSP-TZMCWYRMSA-N 277.364 2.332 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H](C)c1cc(C)ccc1O 185510862 ASDMJINHUITFHY-MISXGVKJSA-N 269.410 2.464 10 20 CECD CC(C)[C@@H](CN[C@H](C)c1ccccc1O)N1CCOCC1 183395190 NVQMOTGOVJXQCD-GDBMZVCRSA-N 292.423 2.400 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCSCC2)cc1 43862645 LTYMYCVHNCZTHV-UHFFFAOYSA-N 279.409 2.011 10 20 CECD Cc1cnc(C)c(NCCc2ccc(O)c(O)c2)n1 811811533 XCMPKFDDKJWHEV-UHFFFAOYSA-N 259.309 2.159 10 20 CECD CCS(=O)(=O)C[C@H](C)N(C)Cc1cc(C)c(C)cc1O 93416973 WLGMLIQBMDQHHW-ZDUSSCGKSA-N 299.436 2.264 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)cc1F 265029005 BCXSRNKOFWRBPM-LALPHHSUSA-N 292.354 2.075 10 20 CECD CCc1cccc(N(C)C(=O)c2ccoc2CC(N)=O)c1 457327570 OGDBZZCEPYYSAA-UHFFFAOYSA-N 286.331 2.146 10 20 CECD CCN(CCCO)Cc1cc(Cl)cc(OC)c1O 273791466 VJIQBQJMDUJICO-UHFFFAOYSA-N 273.760 2.259 10 20 CECD C[C@@]1(O)CCCN(Cc2cc(F)ccc2O)CC1 279703714 RNWUOQNHWKYRIS-CQSZACIVSA-N 253.317 2.268 10 20 CECD CC[C@H](C)NC(=O)COc1ccc(N(C)C)cc1 289462807 WDXCSFTZERFPLH-NSHDSACASA-N 250.342 2.046 10 20 CECD COCCCCOC(=O)/C=C/c1ccc(O)c(O)c1 803400486 AZPQUWZPTJPJHJ-FNORWQNLSA-N 266.293 2.081 10 20 CECD CC[C@@H](NC[C@]1(O)CCN(C)C1)c1cccc(Cl)c1O 806159853 MVJRQEBCEVXBHJ-UKRRQHHQSA-N 298.814 2.153 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCOC2(CCCC2)C1 295008100 QMXHHIQKBFVFEG-UHFFFAOYSA-N 295.310 2.022 10 20 CECD CC[C@@H](NCCC(=O)O)c1ccc(N(C)C)cc1 818143580 CQUIZGOJJQPBRH-CYBMUJFWSA-N 250.342 2.268 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1cnc2n1CCC2 825519654 JGFMPRPRHCTPMR-UHFFFAOYSA-N 298.390 2.294 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@]1(C)CO 827699086 DXFQZMJEGNKYCH-IINYFYTJSA-N 269.772 2.496 10 20 CECD O=C(O)[C@@H](Cc1ccccc1)NCc1cc(F)ccc1O 821540116 SQGMFLMJQDNPIH-CQSZACIVSA-N 289.306 2.317 10 20 CECD CCn1cc(C(=O)N[C@H](C)c2ccccc2O)c(C)n1 827956369 KZOWDSXHWSCHNO-SNVBAGLBSA-N 273.336 2.408 10 20 CECD CCOc1cccc(CNCc2ccc(C(=O)O)o2)c1O 737210890 NTBQATUWTSNLNH-UHFFFAOYSA-N 291.303 2.372 10 20 CECD C[C@@H](NC(=O)[C@H]1CCn2cncc2C1)c1ccccc1O 827941457 SAFJLXRTESGFGY-NEPJUHHUSA-N 285.347 2.029 10 20 CECD CO[C@@H]1C[C@H](NC(=O)c2cc(O)cs2)C12CCC2 839796902 FUTSQNGWAJYVRG-WDEREUQCSA-N 267.350 2.141 10 20 CECD CCCOc1ccc(CN[C@H](C(=O)O)[C@@H](C)OC)cc1C 900059574 SNOGVSGROHPSIB-DOMZBBRYSA-N 295.379 2.362 10 20 CECD CN(C)c1ccc(CNC2(CO)CCSCC2)cc1 839177878 SUYWUFNEEQWPAN-UHFFFAOYSA-N 280.437 2.100 10 20 CECD CCCCCN(CC(N)=O)Cc1cccc(CC)c1O 848901669 ZHNMQLWZVPCCMQ-UHFFFAOYSA-N 278.396 2.432 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[S@](=O)C[C@@H](C)C1 840942152 UHXDWIIHMMMAFR-RBZFPXEDSA-N 294.464 2.261 10 20 CECD Nc1ccc(CCNC(=O)NCC2CC(F)(F)C2)cc1 841912548 YZXMOXFTYRBZJU-UHFFFAOYSA-N 283.322 2.156 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCN[C@H](C)[C@@H]1C 843057235 HEHMSXPZAYGVTI-KGLIPLIRSA-N 261.413 2.243 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C1CC2(CCC2)C1 843830574 IOCNFZLZAXCMRT-UHFFFAOYSA-N 261.321 2.294 10 20 CECD C/C=C/C(=O)N(C)CCN(C)c1ccc(OC)cc1 844851725 FDYSGYLBKADIGV-AATRIKPKSA-N 262.353 2.166 10 20 CECD C[C@@H](CN)NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 841065527 DUBJYTKQNZIBPP-LBPRGKRZSA-N 292.383 2.022 10 20 CECD CN(CCC1CCOCC1)C(=O)c1cc(O)cs1 758318082 UFVJPPSORHOTCL-UHFFFAOYSA-N 269.366 2.342 10 20 CECD CCn1cccc(CNCc2ccc3c(c2)CCCO3)c1=O 922074794 YGQZIPCHRDAOER-UHFFFAOYSA-N 298.386 2.483 10 20 CECD C[C@@H](NC/C=C/CO)c1cc2c(cc1O)CCCC2 850510216 VWMHHDAPCRPLIT-ZYOFXKKJSA-N 261.365 2.470 10 20 CECD CCCCC[C@@H](NC(=O)c1cc(O)cs1)C(=O)OC 752820180 VINLAMAUJAZLSS-SNVBAGLBSA-N 285.365 2.305 10 20 CECD CC[C@](C)(O)C(=O)NCc1ccc(N2CCCC2)cc1 930204889 FBGNJWJHKLVDAX-INIZCTEOSA-N 276.380 2.064 10 20 CECD COc1ccc(N(C)Cc2cnc3cnccn23)cc1OC 761220602 HDMMDQOMPLOZEQ-UHFFFAOYSA-N 298.346 2.383 10 20 CECD C[C@H]1N(C(=O)c2cc(O)cs2)CCOC1(C)C 764337744 MFGPQHIIYISZAL-MRVPVSSYSA-N 255.339 2.093 10 20 CECD CN(C)c1ccc(CN2CCNC(C)(C)C2)cc1F 769191588 AUWDHOAGQIOSNE-UHFFFAOYSA-N 265.376 2.076 10 20 CECD COc1ccc2c(c1)CCCN2CCC1OCCO1 767765045 YVIHXUROJFZPOP-UHFFFAOYSA-N 263.337 2.211 10 20 CECD C[C@H](NC(=O)[C@H](C)n1cccn1)c1ccc(N(C)C)cc1 773006740 FLERCLBOYXOQSX-STQMWFEESA-N 286.379 2.388 10 20 CECD COc1cc(C)cc(CN[C@@H](C)[C@H](O)C(F)(F)F)c1O 895445709 VVFGARGLGGIPIC-UFBFGSQYSA-N 293.285 2.111 10 20 CECD C[C@@H]1NC(=O)[C@H](C)N(Cc2cccc(Cl)c2O)[C@@H]1C 895119445 YQVHPVXLIPKLCX-AEJSXWLSSA-N 282.771 2.143 10 20 CECD COc1ccc(CNC(=O)CCC2CCOCC2)c(O)c1 794374572 WGTYYQCQLUCZJJ-UHFFFAOYSA-N 293.363 2.224 10 20 CECD COCCO[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 188822480 BDFFASQGVBDFCF-GFCCVEGCSA-N 285.771 2.283 10 20 CECD CSc1ccccc1C(=O)N1C[C@H](C)[S@@](=O)[C@H](C)C1 791172240 HSIQSQWVVYCOJX-QEAOQQLJSA-N 297.445 2.390 10 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285.351 2.189 10 20 CECD COc1cccc(CNc2ccc(C(=O)O)c(C)n2)c1O 1599675611 ONTBFWISEQJBNP-UHFFFAOYSA-N 288.303 2.415 10 20 CECD CCOC[C@H](NCc1ccc(N(C)CC)cc1C)C(=O)O 1776906303 KDSHAGVGKXSMTM-HNNXBMFYSA-N 294.395 2.030 10 20 CECD Oc1c(F)cccc1CN1CCO[C@@H]2CCC[C@@H]21 160208591 PTEMWAWBWAPTRI-QWHCGFSZSA-N 251.301 2.285 10 20 CECD CCONC(=O)N(CC)Cc1ccc(N(C)C)cc1 166541660 JIUAIRYAIZTPQH-UHFFFAOYSA-N 265.357 2.236 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)cc1 841298145 MSSQDURMUIOOTQ-MCIONIFRSA-N 275.352 2.348 10 20 CECD Nc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1 713135394 IHJWMBSSFIFSNX-ZNMIVQPWSA-N 258.365 2.316 10 20 CECD Oc1cccc2c1[C@H](NCC1CC3(C1)OCCO3)CC2 927000553 PWTWHSOARSHQSE-CYBMUJFWSA-N 275.348 2.122 10 20 CECD O=C(NCc1ccc(N2CCOCC2)cc1)c1ccoc1 54284738 FJWGFOHCZFXKFI-UHFFFAOYSA-N 286.331 2.046 10 20 CECD CN(C(=O)COc1ccc(N2CCCC2)cc1)C1CC1 178194904 QXZJVPFIMQRANL-UHFFFAOYSA-N 274.364 2.286 10 20 CECD O=C(CNCc1cc(Cl)cc(Cl)c1O)NC1CC1 36782422 HTNBVEDNUOCVEJ-UHFFFAOYSA-N 289.162 2.067 10 20 CECD CN(C)c1ccc(CN[C@]2(C)CCOC2)cc1F 120245262 UWRIAONFCGRMPR-CQSZACIVSA-N 252.333 2.160 10 20 CECD Cc1cccc(CN2CCC(Cn3cncn3)CC2)c1O 189969533 OUIFKHQBRGHFKT-UHFFFAOYSA-N 286.379 2.204 10 20 CECD CN(Cc1cc(F)ccc1O)C[C@@H]1CCCOC1 180086437 SPFVNORDZJFQTF-NSHDSACASA-N 253.317 2.390 10 20 CECD CN(CCOCC1CC1)Cc1cc(F)ccc1O 180231732 PMWUZMIGIVQSJG-UHFFFAOYSA-N 253.317 2.390 10 20 CECD CCN(C)c1ccc([C@@H](C)NCC(C)(C)C(N)=O)cc1 183201947 MTFNVDVBQNXAJM-GFCCVEGCSA-N 277.412 2.305 10 20 CECD CCN(CC)C(=O)CNCc1cccc(Cl)c1O 135763440 YNGUPIDITOGBLR-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CC(C)CN(CC(=O)O)Cc1cc(F)ccc1O 232582870 FNQXWFUUIDDQBU-UHFFFAOYSA-N 255.289 2.074 10 20 CECD CC[C@@H](C)NCc1ccc([N+](=O)[O-])c(OC)c1O 278936571 WYYZKCALBDASHQ-MRVPVSSYSA-N 254.286 2.197 10 20 CECD CC1(C)CN(Cc2c(O)cccc2Cl)C[C@@H]1O 280596143 XVTHXNQSHMNYDO-LBPRGKRZSA-N 255.745 2.248 10 20 CECD Cc1cccc(CCNCc2cc3c(cc2O)OCO3)n1 280490869 FJGOKUGSHDRKTN-UHFFFAOYSA-N 286.331 2.157 10 20 CECD C[C@@H](NCCCCCO)c1cc([N+](=O)[O-])ccc1O 280144180 REQPOZNIZOOKKE-SNVBAGLBSA-N 268.313 2.114 10 20 CECD CC[C@@H](NCC(C)(C)C(N)=O)c1ccc(F)cc1O 286066143 KWLFKVXSYWVMEN-LLVKDONJSA-N 268.332 2.084 10 20 CECD Cc1cc(CN2CCC3(CC2)OCCO3)ccc1N(C)C 815019588 JUWBBFHMSIFRTP-UHFFFAOYSA-N 290.407 2.400 10 20 CECD C[C@H](NCCCNC1CC1)c1cc(F)cc(F)c1O 817984781 ZWXZCMQDOKQYTQ-VIFPVBQESA-N 270.323 2.463 10 20 CECD O=C1CC[C@@H]2CN(Cc3cccc(Cl)c3O)CC[C@H]2N1 827133054 QVWZBCKVDCVYCV-ZWNOBZJWSA-N 294.782 2.146 10 20 CECD CCN1C[C@H](CNCc2cc(Cl)c(C)cc2O)CC1=O 826142709 IPRSKHVOPAKSTP-NSHDSACASA-N 296.798 2.312 10 20 CECD CCc1cc(C(=O)N[C@H](C)c2ccccc2O)n[nH]1 827923496 SDVKFMOUODSXKG-SECBINFHSA-N 259.309 2.169 10 20 CECD CN(CCc1ccccn1)C(=O)c1cc(O)cs1 732262256 QTXSMEJOFFVCLP-UHFFFAOYSA-N 262.334 2.163 10 20 CECD C[C@@H]1CC=C(C(=O)NCc2ccc(O)c(O)c2)CC1 836778290 VUNXAMFUYJQMPP-SNVBAGLBSA-N 261.321 2.460 10 20 CECD CCCCNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 917394225 AMGYBXDCQWGNHN-HNNXBMFYSA-N 289.423 2.278 10 20 CECD CCC(CC)C(=O)N(CC(=O)O)Cc1ccccc1O 911484449 NZYIGWIIZNKBRT-UHFFFAOYSA-N 279.336 2.242 10 20 CECD COc1cccc([C@H](C)NCC(C)(C)OC)c1O 846143951 BJBKHJZRCUSWIP-JTQLQIEISA-N 253.342 2.476 10 20 CECD COC[C@H](N[C@H](C)c1cccc(OC)c1O)[C@@H]1CCCO1 846167585 LAMLJILOGNGODE-XBFCOCLRSA-N 295.379 2.245 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](CN)C[C@H]2C)c1O 843362453 HJAPJFSFDMGZKO-MWLCHTKSSA-N 296.798 2.417 10 20 CECD Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)c(C)c1 748481841 PDCKJBWEHIXSOP-UHFFFAOYSA-N 298.342 2.264 10 20 CECD CCOc1ccc(CN[C@H](C)c2csnn2)c(O)c1 840969626 FVPZJMWAMRTRPR-SECBINFHSA-N 279.365 2.493 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=N)NCC(C)C 849009292 SOWLCIDUSGPQSX-UHFFFAOYSA-N 262.401 2.331 10 20 CECD CS[C@@H]1CC[C@@H](NC(=O)NCCc2ccc(N)cc2)C1 841841831 DQTBDBSDJAWGGK-ZIAGYGMSSA-N 293.436 2.395 10 20 CECD CO[C@@H](CNC(=O)Nc1ccc(N)cc1)C(C)(C)C 841299141 GJAIXLVKKQJJDQ-LBPRGKRZSA-N 265.357 2.451 10 20 CECD C[C@H](CCNC(=O)c1cc(O)cs1)N1CCCCC1 753520003 DOLHUFHSVKJBLU-LLVKDONJSA-N 282.409 2.448 10 20 CECD CC(C)N1C[C@@H](N[C@@H](C)c2cc(F)cc(F)c2O)CC1=O 756736545 IFGVPYXYCHFSMH-ONGXEEELSA-N 298.333 2.330 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1NCCC1(C)C 852883543 YNYHMVRTCZQUQA-HNNXBMFYSA-N 289.423 2.099 10 20 CECD C[C@@H]1CCCN(C(=O)Cc2ccc(N)cc2)[C@@H]1CCCN 851646079 VTHGDSZGHTYZIN-CZUORRHYSA-N 289.423 2.177 10 20 CECD CC[C@H](C)N(C)CCNC(=O)N[C@H](C)c1ccccc1O 868217806 YFVDKWFDSFCJHJ-QWHCGFSZSA-N 293.411 2.483 10 20 CECD CCn1cc(C(=O)Nc2c(Cl)ccc3nonc23)cn1 1117548199 PTDIQSGYZCQOQB-UHFFFAOYSA-N 291.698 2.345 10 20 CECD Cc1cc(CN2C[C@H]3COC[C@H]3C2)ccc1N(C)C 872320401 VHHCTOKPOCHYGA-GASCZTMLSA-N 260.381 2.139 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H]1[C@@H]2CNC[C@@H]21 1118122295 STWSSBJNESLAFU-GTXQXIFRSA-N 258.365 2.056 10 20 CECD Cc1cccc(O)c1CN1C[C@@H](C)O[C@]2(CCCOC2)C1 877494283 JIMNXBDMZQKYKV-RHSMWYFYSA-N 291.391 2.471 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2C=CCCC2)c(O)c1 1116862855 HCBUWXSXEBNCLB-GFCCVEGCSA-N 276.336 2.309 10 20 CECD Cc1cccc(O)c1CN1CCC(Cn2cncn2)CC1 877430220 BPQDRXIAYQPHDH-UHFFFAOYSA-N 286.379 2.204 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(C)=O)[C@H](C)C2)cc1C 1044391924 AIGBKMDZMVZKMS-CZUORRHYSA-N 290.407 2.493 10 20 CECD CCOc1ccc(CN[C@@H](C)[C@@H]2CCOC2)c(O)c1 776220361 WJXPZFGRSFFJHO-WCQYABFASA-N 265.353 2.306 10 20 CECD CCN(C)c1ccc(Cn2cc([C@H](N)C(C)C)nn2)cc1 881313923 WFPZCBKAZPVICN-MRXNPFEDSA-N 287.411 2.438 10 20 CECD COC1(C(=O)NCc2c(O)ccc3c2CCCC3)CCC1 782013140 GERDTBQNWAIBEU-UHFFFAOYSA-N 289.375 2.456 10 20 CECD CCc1cc(C(=O)N[C@@H](C)c2cc(OC)ccc2O)no1 896163373 LXVUNZYDCFYULE-VIFPVBQESA-N 290.319 2.442 10 20 CECD COc1ccnc(COC(=O)c2cc(O)cs2)c1OC 789048594 HRNCNWJGGPPVII-UHFFFAOYSA-N 295.316 2.223 10 20 CECD CCOc1ccc(CN[C@@]2(CC)CCOC2)c(O)c1 791004564 MUYNVOGJHCDBCB-HNNXBMFYSA-N 265.353 2.450 10 20 CECD CN(Cc1cc(F)cc(F)c1O)C[C@H]1CCCN1C 708397301 BCUJMLIPDMHECE-GFCCVEGCSA-N 270.323 2.196 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H]3[C@H](C2)C3(F)F)c1O 715518047 ZISORVSGFCYDHZ-RYUDHWBXSA-N 285.265 2.431 10 20 CECD CCc1cccc(CNC[C@H](O)CC(C)C)c1O 691494794 OUCZOQILGNVBMM-CQSZACIVSA-N 251.370 2.451 10 20 CECD O=C(CCCNCc1c(O)cccc1Cl)NC1CC1 83551920 MTHKAKCZALVSBE-UHFFFAOYSA-N 282.771 2.194 10 20 CECD CC[C@H](NC[C@@H]1CCCCS1(=O)=O)c1ccccc1O 694591862 WUQZTIWNNVJSTO-JSGCOSHPSA-N 297.420 2.400 10 20 CECD C[C@@H](Cn1cccn1)N[C@H](C)c1cc(F)ccc1O 94617555 OTZZSGFVYDPKCF-WDEREUQCSA-N 263.316 2.467 10 20 CECD COc1cccc(/C=C2\C(=O)NN(c3ccccc3)C2=O)c1 176884 DCCXPTQVFZFDSG-RVDMUPIBSA-N 294.310 2.157 10 20 CECD O=C(O)c1cc(O)ccc1NS(=O)(=O)C1=CCCCC1 1608857399 GBHAUFHJTPHWCR-UHFFFAOYSA-N 297.332 2.290 10 20 CECD CC/C=C/CN[C@H](C)c1cccc(-c2nn[nH]n2)c1O 1604120394 RBDRMVFUIIMLSE-ORAHPGNNSA-N 273.340 2.189 10 20 CECD CC1(C)CNC[C@H]1C(=O)NCc1c(O)ccc2ccccc12 1576472645 CWRSOKWEFNECFM-HNNXBMFYSA-N 298.386 2.407 10 20 CECD Cc1nn(C)c(C)c1CNCc1ccc(N(C)C)cc1 17318067 KGPBOLFAXJGLLQ-UHFFFAOYSA-N 272.396 2.393 10 20 CECD Oc1ccc(Br)cc1CNC[C@H]1CCOC1 163758837 JFDFUZOMGDHCCB-SECBINFHSA-N 286.169 2.281 10 20 CECD CCOC(=O)C[C@H]1CCCN1Cc1ccccc1O 156270918 MUJCXBZZCQXSKT-CYBMUJFWSA-N 263.337 2.310 10 20 CECD Cc1ccc(CN(C)C[C@@H]2CCCN(C)C2)c(O)c1 876597166 LYIHNLIJBVYPBH-CQSZACIVSA-N 262.397 2.474 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](C)[C@@H]2CCN)c1 404415931 GATCFBRPGRAQID-WFASDCNBSA-N 278.396 2.350 10 20 CECD CCOc1cccc(CNC2(CN(C)C)CCC2)c1O 393486204 PIEBZVMCGMULRZ-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](O)CC2)c1O 394450289 OSDNZJJYPAQRAM-CYBMUJFWSA-N 281.327 2.081 10 20 CECD COc1ccc(CNCCC(=O)N2CCCCC2)cc1C 69715951 YIOIPQBGJWLYGJ-UHFFFAOYSA-N 290.407 2.496 10 20 CECD CCN(CC)c1ccc(CN2CCS(=O)CC2)cc1 119444640 GBRKROIVMVEAOI-UHFFFAOYSA-N 280.437 2.097 10 20 CECD Nc1ccc(CNC(=O)NC[C@@H]2CCCCS2)cc1 1262580532 SWMRUHQDSQPXML-ZDUSSCGKSA-N 279.409 2.354 10 20 CECD CC(C)C[C@H](CNCc1ccccc1O)N(C)C 20201265 UEFTWVDFTSWMPN-CQSZACIVSA-N 250.386 2.458 10 20 CECD COC(=O)c1occc1CN(C)c1ccc2c(c1)OCO2 121419903 MDOVYYHLQLIVFP-UHFFFAOYSA-N 289.287 2.431 10 20 CECD CC1(C)[C@H](O)C[C@H]1NCc1c(O)cccc1Cl 128336287 NCNRIPJIRZTOBQ-VXGBXAGGSA-N 255.745 2.295 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2c(O)cccc2Cl)C1 128822184 HPFOHWUJBVHMFL-ZDUSSCGKSA-N 269.728 2.342 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCC[C@H]3OCC[C@H]23)c(O)c1O 182617173 LYLPIHOEKSFHSY-KGYLQXTDSA-N 291.347 2.094 10 20 CECD COc1cccc(CN(CCC(=O)O)C(C)C)c1O 86748237 QTFRXYSPGCCHNW-UHFFFAOYSA-N 267.325 2.086 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H](O)C2)cc1 85378777 CFIOPYIPMFNOED-INIZCTEOSA-N 284.359 2.301 10 20 CECD CCCCOCCNC(=O)N(C)Cc1ccccc1O 194509425 HVXBKKAPIDUUKT-UHFFFAOYSA-N 280.368 2.350 10 20 CECD CCOc1cccc(CNC[C@H](CC)CCO)c1O 94948291 AVCVRXIZMRJZFH-GFCCVEGCSA-N 267.369 2.289 10 20 CECD CC[C@H](N[C@@H](CCO)COC)c1ccc(N(C)C)cc1 269048542 WYAHFYQIAKKAJD-HOCLYGCPSA-N 280.412 2.191 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC[C@@H]1CCCO1 274919698 KYYQKEQBXLWVSD-YPMHNXCESA-N 293.363 2.104 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C)O[C@]3(CCOC3)C2)cc1C 280390747 WWBAUHFHDZTODN-RHSMWYFYSA-N 291.391 2.389 10 20 CECD COC[C@@H](O)CN[C@H](C)c1cc(Cl)cc(C)c1O 808717010 BRDCSOWUGIKDBH-KOLCDFICSA-N 273.760 2.012 10 20 CECD CCN(Cc1cc(OC)c(OC)cc1O)C[C@@H](C)OC 291273018 ZORJRANJGDRWSI-LLVKDONJSA-N 283.368 2.266 10 20 CECD COCc1cnc(NC(=O)c2cc(O)cs2)s1 807677805 YNXWOTBALIOJOT-UHFFFAOYSA-N 270.335 2.309 10 20 CECD C[C@@H](NCC1CCNCC1)c1ccc(F)cc1O 817940362 GLSNDXLGXMVTBO-SNVBAGLBSA-N 252.333 2.182 10 20 CECD CCCN(CC(N)=O)Cc1ccc(N2CCCCC2)cc1 814177859 RJSSNEAJZXBMAQ-UHFFFAOYSA-N 289.423 2.374 10 20 CECD C[C@@H](CN)N[C@@H](C)c1cc(Br)c(F)cc1O 817970283 QNDSMZWLMLDLEB-BQBZGAKWSA-N 291.164 2.292 10 20 CECD CCC1(NCc2ccc(N3CCN(C)CC3)cc2)CC1 824620439 OQAPAUMMFJBPJD-UHFFFAOYSA-N 273.424 2.471 10 20 CECD Cc1cccc(CNC2CCN([C@H]3CCOC3)CC2)c1O 827549079 AFJDKKTTYCRVKV-INIZCTEOSA-N 290.407 2.044 10 20 CECD COCc1ncc(C(=O)N[C@H](C)c2ccccc2O)s1 827946201 AHPUTASPQHFFHJ-SECBINFHSA-N 292.360 2.486 10 20 CECD COc1ccc(O)c(CNC(=O)CCCC(=O)C2CC2)c1 825839345 KYHTXTGATXRQTQ-UHFFFAOYSA-N 291.347 2.166 10 20 CECD Cc1ccc([C@@H](C)NC[C@]2(C)CCC(=O)N2)c(O)c1C 834910214 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O=C(C[C@H]1OC(=O)c2ccccc21)NCc1ccccc1O 748346060 LIXYICDMUSBGKN-OAHLLOKOSA-N 297.310 2.310 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)c2c(C)n[nH]c2C)c(O)c1O 910067370 CEKXBYYGDVZXHT-QMMMGPOBSA-N 289.335 2.237 10 20 CECD C[C@H]1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CCO1 845086047 FCBKLVOEACOHDU-CABZTGNLSA-N 298.770 2.412 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1ccc(N(C)C)cc1C 840938739 GHYABJSPYGZSGF-IAGOWNOFSA-N 292.423 2.345 10 20 CECD OC[C@H](CN[C@@H]1CCc2cccc(O)c21)CC1CC1 850546420 ZPSCJIIKKAXUTB-GXTWGEPZSA-N 261.365 2.378 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2cc(C)[nH]n2)c1 756586689 VRFZFXAGIRLSCG-SNVBAGLBSA-N 289.335 2.061 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCSC2)cc1 761837034 VFBIJIUETALAFY-LBPRGKRZSA-N 264.394 2.122 10 20 CECD COc1ccc(N(C)CC2=CCCOC2)cc1OC 761220577 GXSHNHISLQVNTC-UHFFFAOYSA-N 263.337 2.487 10 20 CECD C[C@@H]1[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)CCN1C 763989738 AYHZVTFUKAOQJU-CZUORRHYSA-N 289.423 2.051 10 20 CECD CC[C@]1(O)CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862334089 YLSYKXCRGBZUNH-HNNXBMFYSA-N 284.350 2.378 10 20 CECD Cc1cccc(NCCNCc2cc(F)ccc2O)n1 779125428 ZXFRNZFOMZHJAU-UHFFFAOYSA-N 275.327 2.436 10 20 CECD Cc1cccc(O)c1CNC[C@H]1CN(CC(C)C)CCO1 876880805 NDFLYANFRMITFQ-HNNXBMFYSA-N 292.423 2.147 10 20 CECD Cc1nonc1CN[C@H](C)c1ccc(N(C)C)cc1 775834943 WLAILBFVAUUDEW-SNVBAGLBSA-N 260.341 2.295 10 20 CECD Cc1ccc(CN[C@@H]2C[C@@H](C)N(C3CC3)C2)c(O)c1 877095511 ZXBOYBBPAKJSCX-TZMCWYRMSA-N 260.381 2.415 10 20 CECD C[C@@H](N[C@@H]1CCOC[C@H]1O)c1cc2c(cc1O)CCCC2 872140971 GKIYXJUTCRJXOM-RGYTYGDFSA-N 291.391 2.071 10 20 CECD CC[C@@H](NCc1ccc(OC)c(OC)c1O)[C@@H](O)C(C)C 894915433 LKXKZMYCOXASJQ-OCCSQVGLSA-N 297.395 2.295 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(=O)C(C)C)C2)cc1C 967207680 ICLSTTWZGXFQTQ-OAHLLOKOSA-N 290.407 2.350 10 20 CECD CCn1cc(/C=C2\C(=O)N3CCCc4cccc2c43)nn1 899385206 ROMNNDGHJGZDIW-ZROIWOOFSA-N 280.331 2.131 10 20 CECD COc1cccc(CN2CCCC[C@H]2CCN)c1O 70148670 RKDGBWOUVXVBRY-ZDUSSCGKSA-N 264.369 2.104 10 20 CECD C[C@@H](CNCc1ccc(Br)cc1O)N(C)C 691456319 SKFOJGJFXLMHGB-VIFPVBQESA-N 287.201 2.194 10 20 CECD O=C(O)CN(Cc1ccccc1)Cc1ccccc1O 692410689 RQRJSOBOXMTOCY-UHFFFAOYSA-N 271.316 2.479 10 20 CECD CCCC[C@@H](NCc1ccc(OC)c(OC)c1O)C(=O)O 1605244636 AXYIHLUCEPWTDA-LLVKDONJSA-N 297.351 2.142 10 20 CECD C[C@@H](NCCC(=O)NC(C)(C)C)c1ccc(F)cc1O 228337747 XXYBJEQHKRLEQA-SNVBAGLBSA-N 282.359 2.487 10 20 CECD CO[C@]12CCC[C@@]1(NC(=O)Nc1ccc(N)cc1)CCO2 1579133683 USJKEOWHUJNNDN-CABCVRRESA-N 291.351 2.076 10 20 CECD Cc1ccc(F)c2c1N(C(=O)C1=CC[C@H](N)C1)CCC2 1579705501 ACFXMQMXJVEURE-LBPRGKRZSA-N 274.339 2.461 10 20 CECD CCOc1cccc(CNC[C@@H]2CCC[C@@H](O)C2)c1O 230670170 BEOSBYUVAOYIMV-TZMCWYRMSA-N 279.380 2.432 10 20 CECD CCN(C)c1ccc(CNC[C@@H]2C[C@@H]2C(=O)O)c(C)c1 1776856562 YGPPDGDVXYUGBC-ZFWWWQNUSA-N 276.380 2.261 10 20 CECD COc1ccc(O)c(CNC(=O)CC2(O)CCCCC2)c1 155933119 WNFFGXFZQLKGGY-UHFFFAOYSA-N 293.363 2.102 10 20 CECD COc1ccc(N(C)C[C@H]2CCCNC2)c(OC)c1 258880861 BSGACDGOIBCDKW-LBPRGKRZSA-N 264.369 2.140 10 20 CECD CC1(C)NCC[C@@H]1NCc1ccc2c(c1)CCCO2 904357791 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273.373 2.298 10 20 CECD O=C(O)C1CCN(Cc2c(O)cccc2Cl)CC1 128807628 YASVCOPRJUITPF-UHFFFAOYSA-N 269.728 2.342 10 20 CECD COCCC[C@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186425139 DVYWIMYJHIRTLE-NWDGAFQWSA-N 295.379 2.208 10 20 CECD Cc1cc(O)c(CN2CCCC3(C2)OCCO3)cc1C 182082334 BZRDTJYPPAUFGS-UHFFFAOYSA-N 277.364 2.348 10 20 CECD Cc1ccc(C(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)c(O)c1O 182818773 AMOOOVSWESBBRV-SOUVJXGZSA-N 295.338 2.474 10 20 CECD CCO[C@H](CCN(C)C)CN[C@@H](C)c1ccccc1O 183548591 PHUWVXPGMQQKDJ-UONOGXRCSA-N 280.412 2.400 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2cc(C)ccc2O)C1 92101512 SAYFMNDHYMTECB-AWEZNQCLSA-N 276.380 2.001 10 20 CECD CC(C)n1cnnc1CN(C)Cc1ccccc1O 292798820 NHJSJMGXMHWRDM-UHFFFAOYSA-N 260.341 2.197 10 20 CECD Cc1cccc2c1OC[C@@H](NC(=O)c1cccc(O)c1O)C2 366288713 QTCHZVTZCHQUFB-LBPRGKRZSA-N 299.326 2.140 10 20 CECD CN(C)c1ccc(CN[C@@H](CO)CC2CCC2)cc1 279675436 IIAVRRUCGCUZOK-OAHLLOKOSA-N 262.397 2.393 10 20 CECD C[C@H](NCCC[C@@H](C)O)c1ccc(F)c(F)c1O 279124659 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ALZQMRYXUWDXIP-UHFFFAOYSA-N 285.347 2.346 10 20 CECD Oc1c(CNC[C@H]2COCCO2)ccc2ccccc12 816536769 JMCSTHQTIJYNDB-AWEZNQCLSA-N 273.332 2.050 10 20 CECD CCOc1ccc(CNC[C@@H](OC)C2CC2)c(O)c1 815152967 CPMMNHGFSUYFEA-OAHLLOKOSA-N 265.353 2.306 10 20 CECD COc1cccc(CN2CC3(CCNCC3)C[C@@H]2C)c1O 818431957 XQLTZVRCDYIFCF-ZDUSSCGKSA-N 290.407 2.365 10 20 CECD Cc1cc(O)c(CN[C@H](CO)[C@@H]2CCCOC2)cc1Cl 826120461 DPUJLHPNBJNLRD-BXUZGUMPSA-N 299.798 2.231 10 20 CECD OC[C@H]1CCCN1Cc1ccc(Br)cc1O 824548142 IEVFBVPHBZVHNY-LLVKDONJSA-N 286.169 2.111 10 20 CECD CCCCC[C@H](O)C(=O)NCc1ccc(N(C)C)c(F)c1 822864233 XYKSVRQDQZFOSF-HNNXBMFYSA-N 296.386 2.449 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@]1(C)CO 827699848 MYSLQCFPNLNUAT-QMTHXVAHSA-N 269.772 2.496 10 20 CECD CCS[C@H](C(=O)NCc1ccc(O)cc1O)C(C)C 910954171 IZSLPPXIWVKADQ-ZDUSSCGKSA-N 283.393 2.492 10 20 CECD COc1ccc(O)c(CNc2ncnc3[nH]ccc23)c1 733995014 VXQHRCYTFULIQO-UHFFFAOYSA-N 270.292 2.284 10 20 CECD CC(C)C(C)(C)C(=O)NCc1ccc(O)cc1O 910947880 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CC(C)CC[C@@H](CO)NCc1cc([N+](=O)[O-])ccc1O 858241745 ZTZDJBIPOSXJKD-LBPRGKRZSA-N 282.340 2.187 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cc(OC)no2)c1 851902405 QIKDAATZXHCRKP-SECBINFHSA-N 278.308 2.248 10 20 CECD CCOc1ccc(CN[C@H](C(=O)OC)C(C)(C)C)c(O)c1 768518787 IJIXNMPNPCJARB-CQSZACIVSA-N 295.379 2.468 10 20 CECD O=S(=O)(CC1CCCCC1)NCc1ccc(O)cc1O 867417253 PEHJGQRGJVCOLF-UHFFFAOYSA-N 299.392 2.098 10 20 CECD Cc1cccc(O)c1CN1CCSC[C@@H]1CCO 876807001 XBLNUNLFLDKGLO-LBPRGKRZSA-N 267.394 2.000 10 20 CECD C[C@@H](N[C@H](C)c1ccccc1O)C(=O)NC1CCCC1 879648966 HQTIRXZHCYGWGO-VXGBXAGGSA-N 276.380 2.490 10 20 CECD CN(C(=O)C1CCN(C2CC2)CC1)c1ccc(N)cc1 877075521 FCWNCYLJXHQYQT-UHFFFAOYSA-N 273.380 2.106 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccnc(Cl)c1F 778918296 KYTYACXFHKVUTB-UHFFFAOYSA-N 296.685 2.215 10 20 CECD COc1cccnc1NC(=O)NCc1ccccc1O 771794843 YPJJSODAHRYTKV-UHFFFAOYSA-N 273.292 2.118 10 20 CECD CC(C)Nc1ccccc1NCC(=O)NCC1CC1 871846064 PIZMMCOKZQYCLP-UHFFFAOYSA-N 261.369 2.445 10 20 CECD CCn1cnnc1CCN[C@H](C)c1ccc(N(C)C)cc1 773011386 TXJGKIXLMZFFNG-CYBMUJFWSA-N 287.411 2.257 10 20 CECD Cc1cc(COC(=O)/C=C/c2ccc(O)c(O)c2)no1 772777688 XNYLVQCGFJMQGW-HWKANZROSA-N 275.260 2.151 10 20 CECD CCOc1ccc(O)c(CN[C@@H](CCO)C(F)(F)F)c1 886371677 REKTVULNEFFFHA-LBPRGKRZSA-N 293.285 2.194 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)COC(C)=O)c1 894502806 UJLPJWJAZIJHLN-NXEZZACHSA-N 267.325 2.003 10 20 CECD COc1cc(C)cc(CN[C@]2(C)CCO[C@@H]2C)c1O 894443977 JQQKQKXVXYETFV-IAQYHMDHSA-N 265.353 2.366 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H]1CCCOC1 781028988 NGWTXRDSTBAPGF-VAFIWLDWSA-N 291.347 2.042 10 20 CECD CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)[C@H](C)CO1 895147550 MOPHCXTXCVELOV-DGCLKSJQSA-N 295.379 2.409 10 20 CECD COC(=O)[C@]1(C)CCCN(Cc2cc(F)cc(F)c2O)C1 895013501 BDMBRNDVSRVYTO-OAHLLOKOSA-N 299.317 2.446 10 20 CECD O=C(c1cccc(O)c1O)N1CCC(C2CC2)CC1 724830685 PWKFUKHSQTVZIZ-UHFFFAOYSA-N 261.321 2.360 10 20 CECD CC(=O)c1cc(F)cc(CN(C[C@H](C)O)C2CC2)c1O 692184350 XFDWJZAVWILSHK-VIFPVBQESA-N 281.327 2.079 10 20 CECD Cc1ccc(C(=O)NCc2ccccc2O)c(O)c1 133799621 RAQQJNBMBWSOLC-UHFFFAOYSA-N 257.289 2.336 10 20 CECD CC(=O)N1CC[C@@H](N[C@@H]2C[C@@H](C)c3c(C)ccc(O)c32)C1 1334695575 ZGMMKCKTIMDMKL-MRVWCRGKSA-N 288.391 2.459 10 20 CECD Cc1ncccc1CCNC(=O)NCCc1ccc(N)cc1 1357668171 LKHIJJIIHYLJNZ-UHFFFAOYSA-N 298.390 2.057 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CC12CCCC2 1520508552 FTWBKTDRFDNAJF-NSHDSACASA-N 261.321 2.294 10 20 CECD Cc1ccc2nn[nH]c2c1NC(=O)Cc1ccc(N)cc1 1579736992 IVUBMGCXOZQZCF-UHFFFAOYSA-N 281.319 2.030 10 20 CECD CCc1cc(Sc2ncc(C(=O)O)s2)ncn1 1597488957 QYNBZALTYBIPHA-UHFFFAOYSA-N 267.335 2.345 10 20 CECD CN(C)c1ccc(CNC(=O)COC(C)(C)C)cc1 158340641 MJHGFSXIXSODIT-UHFFFAOYSA-N 264.369 2.184 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)C(C)C)c1 168776019 FEDJCSLPJXCRMA-IINYFYTJSA-N 253.342 2.068 10 20 CECD C[C@H]1CCNCC[C@@H]1NCc1ccc(N(C)C)cc1 817896566 KQCUDEZQTWIPLR-BBRMVZONSA-N 261.413 2.230 10 20 CECD COc1cccc(CN2[C@H]3CCC[C@H]2CC(N)C3)c1O 843053972 NZCFZPPRCIJLCX-KBPBESRZSA-N 276.380 2.245 10 20 CECD Cc1ccc(O)c(CN[C@H]2CCN3CCC[C@H]3C2)c1 252672933 FFWANYUIQZTHRI-GJZGRUSLSA-N 260.381 2.417 10 20 CECD C[C@@H](CC(N)=O)N[C@H](C)c1ccc2ccccc2c1O 168829777 AJWOOUTWBJPOIL-WDEREUQCSA-N 272.348 2.460 10 20 CECD Nc1ccc(CCNC(=O)C2CCSCC2)cc1 262576912 KGDJTTILETZZEG-UHFFFAOYSA-N 264.394 2.071 10 20 CECD C[C@H](NCc1cc(F)ccc1O)[C@@H]1CCCOC1 388733971 CGYHEYBMXXXAJW-WDEREUQCSA-N 253.317 2.436 10 20 CECD CCOCc1cc(CNC[C@](C)(O)CC)ccc1OC 171785668 WGTRHXPEIIXMHK-MRXNPFEDSA-N 281.396 2.482 10 20 CECD CCCNC(=O)N[C@H](C)c1cc(OC)ccc1O 171728935 DEELCGBLMVOUHG-SECBINFHSA-N 252.314 2.171 10 20 CECD C/C=C/C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 105866901 BITMENRRXLSCRB-ONEGZZNKSA-N 274.364 2.058 10 20 CECD Cc1cccc(CN2CCCN(C(=O)C3CC3)CC2)c1O 119113194 AMFQPNWDOOSULU-UHFFFAOYSA-N 288.391 2.145 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)NCc1ccc2c(c1)CCCN2C 69960520 PMNJABYWCLDQKD-GDBMZVCRSA-N 288.391 2.110 10 20 CECD CCCNC(=O)NCc1ccc(N2CC=CC2)cc1 172690900 WGHVROLSQPFPJZ-UHFFFAOYSA-N 259.353 2.272 10 20 CECD Oc1ccc(F)cc1CN1CCC(C2OCCO2)CC1 180057281 CJAQXPYHYOAAJM-UHFFFAOYSA-N 281.327 2.116 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(F)cn2)c1 183652586 DUQMBRAIRCGKEX-VIFPVBQESA-N 290.294 2.426 10 20 CECD C[C@H](N[C@H]1CCc2[nH]ncc2C1)c1ccc(F)cc1O 186115050 KHFJJLONKLMDMN-CABZTGNLSA-N 275.327 2.463 10 20 CECD COc1cccc(CN(C)[C@H]2CCN(C)C[C@@H]2C)c1O 290466433 NGVPPFVBGGCZOK-JSGCOSHPSA-N 278.396 2.173 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)[C@@H](C)N)cc1 192098358 CURZCHLKRVDXMO-CHWSQXEVSA-N 277.412 2.132 10 20 CECD NC(=O)C[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 93808776 MBRQEZKDKJZUJC-SNVBAGLBSA-N 282.771 2.133 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](OC)C2CC2)c1 293602199 DMUSMZHDSNKPMH-BMIGLBTASA-N 265.353 2.476 10 20 CECD CN(C)c1ccc(CN2CCC(c3nc[nH]n3)CC2)cc1 93645948 BDXWBIAVFZAUNN-UHFFFAOYSA-N 285.395 2.250 10 20 CECD CCc1cc(NC(=O)NCc2ccccc2O)n(C)n1 265307376 RMMWJUMUCDLDQC-UHFFFAOYSA-N 274.324 2.010 10 20 CECD CO[C@@H](C)[C@@H](C)NCc1ccc(N2CCOCC2)c(F)c1 268877900 QVFCRPANTAPWFV-OLZOCXBDSA-N 296.386 2.175 10 20 CECD CNC(=O)C1CCC(N[C@H]2CCc3cccc(O)c32)CC1 297823680 RNIJQXXIACUQJE-RUXDESIVSA-N 288.391 2.274 10 20 CECD Nc1ccc(CCNC2CCN(C3CC3)CC2)cc1 817957887 QLRUPJRTZCWMLW-UHFFFAOYSA-N 259.397 2.028 10 20 CECD CC[C@@H](N[C@@H]1CCCNC1)c1ccc(F)cc1O 817942393 YFRLBPLKIPSKOJ-DGCLKSJQSA-N 252.333 2.324 10 20 CECD CCCC[C@@H](CN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 817962744 NWQRCSVHZWTGHJ-MNOVXSKESA-N 281.356 2.469 10 20 CECD O=C(O)CC1(NCc2ccc3c(c2)CCO3)CCCC1 901686680 IWZAPKBAFIFEHJ-UHFFFAOYSA-N 275.348 2.499 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H](C)CC(=O)NC)cc1 834898760 GNFAGTNTIRQGMT-OLZOCXBDSA-N 277.412 2.318 10 20 CECD Oc1cccc2c1[C@@H](N[C@@H]1CCc3c[nH]nc3C1)CC2 834620984 ZTXMVVSAOPZDTH-OLZOCXBDSA-N 269.348 2.250 10 20 CECD CCn1cncc1/C=C1\SC(N2CCCCC2)=NC1=O 901436525 UWVCWTOUXDETOD-WQLSENKSSA-N 290.392 2.359 10 20 CECD COc1cccc([C@@H](C)NCCC2CC(O)C2)c1O 846167106 UECVLNDZRFJRHV-VOMCLLRMSA-N 265.353 2.212 10 20 CECD C[C@@H]1CCC[C@H](CNC(=O)C(=O)Nc2ccc(N)cc2)C1 841022408 SVWQRZIRICGOJV-NEPJUHHUSA-N 289.379 2.150 10 20 CECD CCOCC(C)(C)CNC(=O)NCCc1ccc(N)cc1 841905443 FKSGXFWBXUPZBD-UHFFFAOYSA-N 293.411 2.173 10 20 CECD O=C(NCc1ccccc1O)c1cc(-c2ccco2)[nH]n1 748345740 JBORAASTTSOOMP-UHFFFAOYSA-N 283.287 2.305 10 20 CECD Nc1ccc(NC(=O)[C@]2(C(=O)O)CC=CCC2)cc1 849364811 QBRGIHXPGPOEEN-AWEZNQCLSA-N 260.293 2.018 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@@H]1CCCNC1 841033168 OCXFELBSGAJXRS-SECBINFHSA-N 272.751 2.274 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccccc2O)cc1 748325276 NJKOEYCHXXKWJF-UHFFFAOYSA-N 299.374 2.458 10 20 CECD CC(C)(C)N1CC[C@H](NCc2cc(F)ccc2O)C1=O 843416860 YYGHBMASUHXQHZ-LBPRGKRZSA-N 280.343 2.020 10 20 CECD Cc1cc(CNCc2cc(F)c(N(C)C)cc2F)n[nH]1 858141092 KFGVCZCQYYKVFN-UHFFFAOYSA-N 280.322 2.352 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@H]2CCO[C@H](C)C2)c1 858342371 LDSWWAUVCOZFFZ-OLZOCXBDSA-N 292.379 2.315 10 20 CECD Nc1ccc(CNC(=O)[C@H]2[C@H]3c4ccccc4C[C@H]32)cc1 859593091 AKOOQKVSVDHKBJ-IXDOHACOSA-N 278.355 2.471 10 20 CECD C[C@@H](N[C@H](CCO)C1CC1)c1cc(F)cc(F)c1O 756739383 MUAOXPLCMGQPJT-AMIZOPFISA-N 271.307 2.482 10 20 CECD CO[C@@H](C)[C@@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850565201 CBKPYZFZDXFBQL-KGLIPLIRSA-N 292.423 2.161 10 20 CECD C[C@@H](NC(=S)NCC(F)(F)F)c1ccccc1O 865269266 GFMQEYDUMULIMH-SSDOTTSWSA-N 278.299 2.480 10 20 CECD CC[C@@H](N[C@@H]1COCC[C@H]1O)c1cccc(Cl)c1O 866497479 MRKSBHQDDMEOPJ-JHJVBQTASA-N 285.771 2.236 10 20 CECD COC(=O)C[C@H]1CSCCN1Cc1ccc(C)cc1O 876757367 CKSXTTHFHBDPKL-ZDUSSCGKSA-N 295.404 2.181 10 20 CECD Cc1cc(N(C)C)ccc1CNC1CCS(=O)CC1 1119947473 SUKRUQMQDYDFHL-UHFFFAOYSA-N 280.437 2.062 10 20 CECD C[C@H](NC(=O)NCCCN(C)C)c1ccc(N(C)C)cc1 776096646 OMJNKTFRRGAAPS-ZDUSSCGKSA-N 292.427 2.065 10 20 CECD CCOc1ccc(CN2CCN(C)[C@@H](C)[C@@H]2C)c(O)c1 775987887 WVMPTMHZJYPARV-STQMWFEESA-N 278.396 2.315 10 20 CECD C[C@H](N[C@H]1CCc2c[nH]nc2C1)c1c(O)cccc1F 886538547 JROVPVQZRMNZSH-ONGXEEELSA-N 275.327 2.463 10 20 CECD COC(=O)[C@@H](NCc1ccccc1O)c1cccs1 789570899 GZGJGIPGYVSCQE-ZDUSSCGKSA-N 277.345 2.458 10 20 CECD Cc1cc(C(=O)N2C[C@@H](O)C[C@H]2C)c(C)n1-c1ccccn1 788547383 IWTUXZATHFVGDP-RISCZKNCSA-N 299.374 2.084 10 20 CECD COc1cc(C)cc(CN[C@H]2C[C@H](C)N(C3CC3)C2)c1O 894340511 OZMVJLXNXNFGLH-JSGCOSHPSA-N 290.407 2.424 10 20 CECD CCc1cccc(CN[C@H](C)Cn2ccnc2)c1O 691516445 XVAKJJCOOORHBQ-GFCCVEGCSA-N 259.353 2.329 10 20 CECD CN[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1329427010 IRUOJGJYIUGLLC-OAHLLOKOSA-N 259.397 2.081 10 20 CECD CC(C)[C@@H](CC(=O)O)NCc1ccc2c(c1)CCO2 1320873149 XVEWKWKJUJEDKU-CYBMUJFWSA-N 263.337 2.210 10 20 CECD CN[C@@H](C)CCNCc1cc(Cl)cc([N+](=O)[O-])c1O 1325321703 YRPZMEQZCCLPPL-QMMMGPOBSA-N 287.747 2.041 10 20 CECD CN(CCC(F)(F)F)C(=O)NCc1ccc(N)cc1 1335738059 VLFYBOWQMALFIY-UHFFFAOYSA-N 275.274 2.363 10 20 CECD CN(C)c1cc(F)c(CNCCC(C)(C)O)cc1F 1331510525 IECRMJWOSATEQD-UHFFFAOYSA-N 272.339 2.281 10 20 CECD C[C@@]1(C(=O)NCc2cccc(O)c2O)CC=CCC1 1348047120 LVZSDMIDMROTOB-OAHLLOKOSA-N 261.321 2.460 10 20 CECD Nc1ccc(CNC(=O)CSC[C@H]2CCCCO2)cc1 1346210498 SZURCZOOJQOFJY-CQSZACIVSA-N 294.420 2.187 10 20 CECD CCOCc1cc(CNCC[C@@H](C)NC)ccc1OC 1345100395 QLEDVQSCKIVTFZ-CYBMUJFWSA-N 280.412 2.319 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1CCC[C@@H](F)C1 1352669615 JXXLXMMOHXLDSF-GXSJLCMTSA-N 267.300 2.242 10 20 CECD CC(C)CN(CC(=O)O)Cc1c(O)ccc2ccncc12 1603804597 LEGOTDJHYKYFHG-UHFFFAOYSA-N 288.347 2.483 10 20 CECD O=C(O)C[C@@H]1CCCN(Cc2ccc(F)c(F)c2O)C1 1606095380 XJBDFXZNPRSCLL-VIFPVBQESA-N 285.290 2.357 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1ccn(C)c1 154915926 ARYPTGDONZUWSV-UHFFFAOYSA-N 271.364 2.490 10 20 CECD Cc1conc1NC(=O)N(C)Cc1ccccc1O 159042496 ARJNHHRIHUJVSH-UHFFFAOYSA-N 261.281 2.353 10 20 CECD Cc1nccn1CCCC(=O)Nc1ccc(N)cc1 22222558 PSICRPHPDYHEBO-UHFFFAOYSA-N 258.325 2.193 10 20 CECD COc1cccc(CNC(=O)Cc2ccc(N)cc2)c1 37996027 RJZRCBKFOKEUNV-UHFFFAOYSA-N 270.332 2.136 10 20 CECD CCOc1cccc(CNC2CCN(CC)CC2)c1O 38097914 OILMHODEFVWEID-UHFFFAOYSA-N 278.396 2.365 10 20 CECD Oc1ccc(Br)cc1CNCc1cocn1 310041814 YZZSSQRTWRIFGY-UHFFFAOYSA-N 283.125 2.433 10 20 CECD CO[C@@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)C12CCC2 713079533 RYBKIFPNGGCDPP-QWHCGFSZSA-N 275.352 2.348 10 20 CECD CO[C@H](CNC(=O)c1cccc(O)c1O)C1CCCC1 692957239 GNGGTTPZXHHFFX-CYBMUJFWSA-N 279.336 2.033 10 20 CECD CCCNC(=O)N[C@@H](C)c1cc(OC)ccc1O 171728933 DEELCGBLMVOUHG-VIFPVBQESA-N 252.314 2.171 10 20 CECD COc1ccc(N2CCC(NCc3cc[nH]n3)CC2)cc1 66992268 UOXYEHFUHQOTBS-UHFFFAOYSA-N 286.379 2.177 10 20 CECD CN(Cc1ccccc1O)[C@H]1Cc2ccccc2[C@@H]1O 182899125 RBSQWFADHBJVNR-RDJZCZTQSA-N 269.344 2.482 10 20 CECD CCCCN(CCO)C(=O)NCc1ccc(N(C)C)cc1 31730464 LQIZSPXIQYNELP-UHFFFAOYSA-N 293.411 2.057 10 20 CECD CSC[C@@H](CCO)N[C@@H](C)c1cc(C)ccc1O 185530214 GEJYENDEVSNJJN-NWDGAFQWSA-N 269.410 2.465 10 20 CECD COc1cccc(CNC(=O)c2ccc(C)c(O)c2)c1O 181225198 NNGLEHHOLLWOEZ-UHFFFAOYSA-N 287.315 2.345 10 20 CECD Cc1cccc(CN(C)CCN2C[C@H](C)O[C@H](C)C2)c1O 193399029 UPLLHGSEYFIAAH-GASCZTMLSA-N 292.423 2.242 10 20 CECD C[C@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(N(C)C)cc1 90181694 COCMTYZNVRRTET-GXTWGEPZSA-N 287.407 2.167 10 20 CECD COc1ccc(O)c(CN[C@H](C)c2nnc3ccccn23)c1 237362754 TUIMGEYALBAUIT-LLVKDONJSA-N 298.346 2.294 10 20 CECD C[C@@H](N[C@@H]1CCc2c[nH]nc2C1)c1cc(F)ccc1O 359956882 FZFTVIOIWVGDDL-BXKDBHETSA-N 275.327 2.463 10 20 CECD CN(C)c1ccc(CNC[C@@](C)(O)c2ccco2)cc1F 266127250 BXXYIJGJLBZAHP-MRXNPFEDSA-N 292.354 2.482 10 20 CECD CNC(=O)C1CCC(N[C@H](C)c2ccc(F)cc2O)CC1 273576913 LZZIGOYIGKJYSG-XSRFYTQQSA-N 294.370 2.487 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 271027980 FBYSMANZMQNOIY-AWEZNQCLSA-N 280.343 2.029 10 20 CECD CN1CCN(Cc2cc(-c3ccccc3)ccc2O)CC1=O 271159048 CKNXLDAROJRGBV-UHFFFAOYSA-N 296.370 2.333 10 20 CECD CC[C@H](N[C@@H](C)c1ncnn1C)c1ccc(F)cc1O 287385531 ILYAREHWTBIBIW-CABZTGNLSA-N 278.331 2.462 10 20 CECD CCC1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 294929555 UIFIFXVIUSKQTL-UHFFFAOYSA-N 267.300 2.499 10 20 CECD CN(Cc1cccc(Cl)c1O)C[C@H](O)C1CC1 809753053 ZIVXOQCRFSWNEA-LBPRGKRZSA-N 255.745 2.248 10 20 CECD CCN(C)C(=O)CN(Cc1ccc(N(C)C)cc1)C(C)C 299380902 JDLDNGNRVIWZMQ-UHFFFAOYSA-N 291.439 2.441 10 20 CECD COc1ccc(O)c(CNCC[C@@]2(O)C[C@H]3CC[C@H]2C3)c1 814171221 LFPDNLPJHPTLAL-RVSPLBMKSA-N 291.391 2.432 10 20 CECD C[C@H](N)CN[C@H](C)c1cc(Br)cc(F)c1O 817971296 CATFFRHOYNMZMH-NKWVEPMBSA-N 291.164 2.292 10 20 CECD CC[C@@H](N[C@H]1CCNC1)c1cc(Cl)ccc1O 817944638 ITGPZNDRANZWLK-CMPLNLGQSA-N 254.761 2.448 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)C[C@@H](CC)OC 817356805 UXIUFBLNVQFGIF-GFCCVEGCSA-N 287.381 2.121 10 20 CECD COCCOC[C@@H](C)NCc1cc(Cl)c(C)cc1O 825320129 HPOCFRBZFIBQRU-LLVKDONJSA-N 287.787 2.495 10 20 CECD Oc1cccc(Cl)c1CN1CCC[C@@H](n2ccnn2)C1 822503341 GKINBRQFBMKPDC-LLVKDONJSA-N 292.770 2.474 10 20 CECD CN1CCN(c2ccc(CN3CC4(CC4)C3)cc2)CC1 824533722 KZGLQWYBLLBESD-UHFFFAOYSA-N 271.408 2.034 10 20 CECD Oc1ccccc1CN1CCN(c2cccc(F)n2)CC1 824811150 XEBOITFCYLFALF-UHFFFAOYSA-N 287.338 2.249 10 20 CECD Oc1cccc2c1[C@H](NCCCOC[C@@H]1CCOC1)CC2 834598990 URDUCYUQKGKFAV-DZGCQCFKSA-N 291.391 2.412 10 20 CECD Cc1ccncc1NC(=O)/C=C\c1ccc(O)c(O)c1 588404155 SRLYPIWBNQKYJQ-HYXAFXHYSA-N 270.288 2.453 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1CN1CCCC1 732287766 FZDWHBARJNUDSF-LLVKDONJSA-N 280.393 2.154 10 20 CECD COC1(C)CN(Cc2cc(Cl)cc(F)c2O)C1 839100842 FDTUBNMQYOZPDM-UHFFFAOYSA-N 259.708 2.405 10 20 CECD COCC[C@@H](C)N[C@H](C)c1cccc(OC)c1O 846144278 IPPPLULGTUWTKN-GHMZBOCLSA-N 253.342 2.476 10 20 CECD COc1cc(O)c(CN[C@@H]2CS[C@H](C)C2)cc1OC 840958827 OLZJOGMFWYKJHO-KOLCDFICSA-N 283.393 2.393 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)CO[C@H]1CCOC1 840936799 GOZKOPSYGHIFQM-PBHICJAKSA-N 292.423 2.345 10 20 CECD CCC(CC)(CO)C(=O)NCc1cc(Cl)ccc1O 848242431 GFHOIDKAHQKPEU-UHFFFAOYSA-N 285.771 2.461 10 20 CECD Oc1cc2c(cc1CN1CCCC(F)(F)C1)[C@@H](O)CO2 844713873 JYVQPUUZDNKNMX-LBPRGKRZSA-N 285.290 2.049 10 20 CECD Cc1cc(O)c(CN[C@@H](C)[C@H]2CCCNC2)cc1C 841032393 BSNODWGIPIUBBH-KBPBESRZSA-N 262.397 2.487 10 20 CECD COc1ccc(N(C)CCN(C)Cc2csnn2)cc1 844402289 SEECUUBHALCATC-UHFFFAOYSA-N 292.408 2.115 10 20 CECD CCCN(CC(=O)OC)Cc1cccc(CC)c1O 848877988 WVOFIUKYKZDHEC-UHFFFAOYSA-N 265.353 2.340 10 20 CECD CCN1C[C@H](CN[C@@H](C)c2ccc(F)cc2O)CC1=O 846210277 WWTBNRJMXCQUTA-QWRGUYRKSA-N 280.343 2.050 10 20 CECD C[C@@H](NC(=O)NCc1ncccn1)c1ccc(N(C)C)cc1 852260946 HGOJQWVRSCLQKT-GFCCVEGCSA-N 299.378 2.103 10 20 CECD CC(C)(CNCc1ccccc1O)[C@]1(O)CCCOC1 850401035 TWMHBKUNFGKOHM-INIZCTEOSA-N 279.380 2.050 10 20 CECD CN(C(=O)/C=C/c1cnn(C)c1)c1ccccc1F 750553511 RBNNSFDGRQGPFV-BQYQJAHWSA-N 259.284 2.235 10 20 CECD COc1ccc(N(C)Cc2ccn(C)c(=O)c2)cc1F 757852201 ZXUQVIRECARTMN-UHFFFAOYSA-N 276.311 2.169 10 20 CECD CCc1cccc(CN2CC[C@@H](C)[C@@H](CO)C2)c1O 857061065 JESXYKHCMCMLIH-IUODEOHRSA-N 263.381 2.405 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCN(C)C(C)C)c1 756524649 MGNRTFBTJKYZCW-LBPRGKRZSA-N 294.395 2.170 10 20 CECD CC[C@H](NC(=O)c1cc(O)cs1)[C@H]1CCCO1 756809835 RXSKXLCGRLVOOJ-VHSXEESVSA-N 255.339 2.141 10 20 CECD Cc1ccc(NCc2ccc(N3CCN(C)CC3)cc2)nn1 865296559 ZWLWCDQQWBOJQB-UHFFFAOYSA-N 297.406 2.149 10 20 CECD C[C@@H](CNC(=O)N[C@H](C)c1ccccc1O)N(C)C1CC1 868371834 HMXKCWXCBKMMFM-NWDGAFQWSA-N 291.395 2.235 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2C[C@]23CCOC3)c1 764257350 DBTXIQRYDHLXJK-WNMQOVRZSA-N 291.347 2.005 10 20 CECD Cc1ccc(CN2CCN(Cc3cccnc3)CC2)c(O)c1 877169197 JIKXHBYEVQBLDL-UHFFFAOYSA-N 297.402 2.413 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H]1C[C@H](OC)C1 875905767 ASSWRVSRHNJGCW-HDJSIYSDSA-N 292.379 2.491 10 20 CECD Cc1cc(NS(=O)(=O)c2conc2C)c(C)c(C)c1O 872363772 PUXMQTZBVYOXJS-UHFFFAOYSA-N 296.348 2.415 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1CCC=CO1 777860851 QNWSJXBXQUSJFN-SNVBAGLBSA-N 284.406 2.434 10 20 CECD Cn1cnc(CNCc2c(O)ccc(Cl)c2F)c1 898043293 KXXFYKAIMPTBGM-UHFFFAOYSA-N 269.707 2.208 10 20 CECD CCC1(C(=O)NCCNCc2ccc(OC)c(C)c2)CC1 1133408833 APNLGBFZUNBNQL-UHFFFAOYSA-N 290.407 2.400 10 20 CECD CC(C)(CO)CNCc1c(O)cccc1Br 706871904 OJXDGQDMUJEETG-UHFFFAOYSA-N 288.185 2.263 10 20 CECD C[C@@H]1COCCN1Cc1c(O)cccc1Br 707133946 FFBHWKVYWQSGCA-SECBINFHSA-N 286.169 2.375 10 20 CECD Cc1ccc(O)c(CNCCNC(=O)OC(C)(C)C)c1 83454461 HKUICPHOARYHEN-UHFFFAOYSA-N 280.368 2.315 10 20 CECD CC(C)(C(=O)NCCc1ccc(O)c(O)c1)C(F)F 792238893 XUGZNRNQDJYMJC-UHFFFAOYSA-N 273.279 2.048 10 20 CECD CN1CCN(c2ccc(CNC(C)(C)CF)cc2)CC1 1255059333 ZJQUEROOXJTDRE-UHFFFAOYSA-N 279.403 2.276 10 20 CECD CCCC[C@@H](CN)N[C@H](C)c1cc(C(=O)O)ccc1O 1605237915 MIAXSSNDIRJHGI-PWSUYJOCSA-N 280.368 2.259 10 20 CECD C[C@H](N[C@H](C)CCN(C)C)c1cc(C(=O)O)ccc1O 1604142256 LGMIFERGWPHXRA-MNOVXSKESA-N 280.368 2.081 10 20 CECD C[C@@H](NC1CC(C)(C)C1)c1cccc(-c2nn[nH]n2)c1O 1603649347 COVOZFGYJVNKRW-SECBINFHSA-N 287.367 2.412 10 20 CECD O=C(O)C[C@@]1(NCc2cccc(Cl)c2O)CCCOC1 1608688456 IGZNGDNEEVMQFX-AWEZNQCLSA-N 299.754 2.159 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H](C)[C@H](C(=O)O)C1 1600237162 ROULMRBHXMVLHW-IUODEOHRSA-N 276.380 2.214 10 20 CECD Cc1cc(Cl)cc(CN[C@@H](C(=O)O)C2CC2)c1O 1600218937 HQHFDOMBROAOTM-LLVKDONJSA-N 269.728 2.307 10 20 CECD C[C@]1(C(=O)O)CC[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1 1776501936 TWJWAQWUKKRTQJ-YGRLFVJLSA-N 294.307 2.033 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(-c2ccco2)[nH]n1 158868886 LJKQOBFVYSYEGK-UHFFFAOYSA-N 299.286 2.011 10 20 CECD COc1cccc(CN2CCN(c3ccccn3)CC2)c1O 158897753 UVFORFXJXVKPGJ-UHFFFAOYSA-N 299.374 2.118 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCN(C)CCOC)cc1 159332318 TWNMYSAUOZPZEV-OAHLLOKOSA-N 293.455 2.372 10 20 CECD Cn1ccc(CNCc2ccc3c(c2)CCCO3)n1 921947031 CVCKJJLDJLDVCK-UHFFFAOYSA-N 257.337 2.035 10 20 CECD COc1ccc(O)c(CNc2ccc(N(C)C)nc2)c1 36988719 MAGFFRHXGONCLL-UHFFFAOYSA-N 273.336 2.474 10 20 CECD C[C@@H](NCC1([S@](C)=O)CC1)c1cc(F)ccc1O 282191892 GGPDPOONOBVHNC-LZVRBXCZSA-N 271.357 2.093 10 20 CECD Oc1ccc(F)cc1CNCCC[C@H]1CCOC1 402369078 GIVDIHIKROOJEC-NSHDSACASA-N 253.317 2.438 10 20 CECD O=C(O)[C@H]1CCCCN1Cc1cc(F)cc(F)c1O 708215123 HSAOCTSJIJEYMV-LLVKDONJSA-N 271.263 2.110 10 20 CECD COc1cccc(CNC(=O)[C@H](C)OCCC(C)C)c1O 105650972 QXEPHUOCMVMIDG-LBPRGKRZSA-N 295.379 2.468 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2cccc(C)c2O)C1 183370394 RLMPLBHYYMIRQO-AWEZNQCLSA-N 277.364 2.476 10 20 CECD C[C@H](O)CNCc1cc(Cl)cc(Cl)c1O 35601757 CCVJLHZVJCVBFG-LURJTMIESA-N 250.125 2.169 10 20 CECD CCC1(CO)CCN(Cc2cc3c(cc2O)OCO3)CC1 93592405 CJOWXTWJTRXLLA-UHFFFAOYSA-N 293.363 2.105 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)CC[S@]1=O 277647687 OBSLSVISSMSDIC-MPBGBICISA-N 298.427 2.235 10 20 CECD Cn1cc([C@H]2OCCC[C@@H]2NCc2ccccc2O)cn1 275687147 WTQGADHQCZCLTE-GOEBONIOSA-N 287.363 2.136 10 20 CECD CC[C@@H](C)NC(=O)COc1ccc(N(C)C)cc1 289462803 WDXCSFTZERFPLH-LLVKDONJSA-N 250.342 2.046 10 20 CECD CN(C)c1ccc(CN[C@H]2COc3ccccc3[C@H]2O)cc1 288644682 UQTXRLBTSWFMGR-FUHWJXTLSA-N 298.386 2.337 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2ccccc2F)o1 808013690 MDHRDRNLVWVRQK-UHFFFAOYSA-N 280.280 2.126 10 20 CECD CCNC(=O)[C@H](C)N[C@@H](C)c1c(C)cc(C)cc1O 293677669 KDZAZHUYONOCTP-RYUDHWBXSA-N 264.369 2.184 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC2(CCOC2)C1 816668934 CAXGKUKFPORLOG-UHFFFAOYSA-N 271.719 2.407 10 20 CECD Cc1cc(CC(=O)N(C)Cc2ccc(N(C)C)cc2)on1 816822786 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HWAFOYYHCOWIMM-UHFFFAOYSA-N 298.814 2.375 10 20 CECD CCc1ncc(CNCc2ccc3c(c2)CCO3)cn1 840889819 OFCZHQDLBKNVLH-UHFFFAOYSA-N 269.348 2.264 10 20 CECD CO[C@](C)(C1CC1)[C@@H](C)NC(=O)NCc1ccccc1O 840276390 JNUMPOWESPUYHQ-BZNIZROVSA-N 292.379 2.395 10 20 CECD CC1(C)CC[C@@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 840336885 USIVWWVXEGEOHS-DIECRNLCSA-N 290.315 2.412 10 20 CECD Oc1ccc2ccncc2c1CN1[C@H]2CC[C@H]1COC2 840163386 BDDPEPISIJFRLV-STQMWFEESA-N 270.332 2.304 10 20 CECD CC(C)[C@@H](NCc1cc(Cl)ccc1O)C(=O)O 43429897 NOAPZMYVHSOBDG-LLVKDONJSA-N 257.717 2.244 10 20 CECD CC(C)OCCC(=O)NCc1cc(Cl)ccc1O 846474119 ZPEBDXRZMAOQBY-UHFFFAOYSA-N 271.744 2.477 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)C(=O)O 841768534 MUHMVMLDKQLUPW-LBPRGKRZSA-N 292.379 2.210 10 20 CECD Cc1cc(CN2CC[C@](C)(C(=O)O)C2)ccc1N(C)C 846275631 RMAWFCNCHYUPTM-INIZCTEOSA-N 276.380 2.358 10 20 CECD CC[C@H](NCCN1CCCC1=O)c1ccc(N(C)C)cc1 846207765 DUUCZAXRDTUTKW-INIZCTEOSA-N 289.423 2.416 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@@H]([C@H]2CCNC2)C1 843125599 YMDTWIUXFBFCSA-QWHCGFSZSA-N 278.371 2.353 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)C[C@@H]1CCC(=O)N1 925082537 XOOOKLJZPGPQGC-HIFRSBDPSA-N 289.423 2.208 10 20 CECD COC(=O)N(C)CCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 850548539 UVCUXHXHNYTAJS-ONGXEEELSA-N 296.342 2.367 10 20 CECD CCN(CC)CCOCCN[C@@H](C)c1ccccc1O 757673770 JGOLKUQBSCDHAZ-AWEZNQCLSA-N 280.412 2.401 10 20 CECD CCC(=O)CCCOC(=O)c1cccc(O)c1O 758570802 AFPFCIMKJXCEHY-UHFFFAOYSA-N 252.266 2.014 10 20 CECD COc1ccc(CN[C@@H](CCO)C2CCOCC2)cc1C 763466883 NQZMZTTYFHYLLI-INIZCTEOSA-N 293.407 2.271 10 20 CECD CNC(=O)OC[C@H]1CCCCN1Cc1ccc(C)cc1O 877533248 OHGLGHNMCKRYCG-CQSZACIVSA-N 292.379 2.411 10 20 CECD C[C@H](NC(=O)[C@H]1C[C@@]12CCOC2)c1ccc(N(C)C)cc1 773007378 HZGDCIJAYDMSSY-XGWLTEMNSA-N 288.391 2.356 10 20 CECD Cc1cccc(O)c1CNC[C@@H](O)COc1ccccc1 876918966 PVTOUCZBNHFZGH-CQSZACIVSA-N 287.359 2.230 10 20 CECD Cc1[nH]ccc(=NC(=O)NCc2ccccc2O)c1Cl 771761813 CZCMCVGITSVJDD-UHFFFAOYSA-N 291.738 2.493 10 20 CECD COc1cc(C)cc(CNCC[C@H](C)N(C)C)c1O 895290782 UIDMWFRLXBTZHG-LBPRGKRZSA-N 266.385 2.139 10 20 CECD COc1cc(C)cc(CN(C[C@@H](C)O)C2CC2)c1O 895193395 XLFFZIKIFLUOAL-LLVKDONJSA-N 265.353 2.054 10 20 CECD Cc1sc(=O)n(CCC(=O)Nc2ccc(N)cc2)c1C 71351407 PQDNRBIXMVKKQR-UHFFFAOYSA-N 291.376 2.138 10 20 CECD CN[C@@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1326200017 LYHPACWNCXPZRU-MRXNPFEDSA-N 273.424 2.471 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1CC12CCCC2 1520508551 FTWBKTDRFDNAJF-LLVKDONJSA-N 261.321 2.294 10 20 CECD O=C(NCc1cccc(O)c1O)c1cc[nH]c1C1CC1 1548791586 BATBMAFGQSHGKU-UHFFFAOYSA-N 272.304 2.233 10 20 CECD COC[C@H](O)CCN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 230670038 XBRIDKZAXZKGGY-JHJVBQTASA-N 279.380 2.236 10 20 CECD CC[C@H](CCO)N[C@@H](C)c1cc(OC)ccc1O 168794244 OWHDWTFQVZGVMS-WDEREUQCSA-N 253.342 2.212 10 20 CECD COc1cccc(CNC(=O)/C=C/c2cccnc2)c1O 155344302 UBOPHYLNPKCAMR-BQYQJAHWSA-N 284.315 2.125 10 20 CECD Cc1cccc(O)c1CNCCCc1c[nH]nc1C 876923609 XMMHYFUJOMQLFT-UHFFFAOYSA-N 259.353 2.455 10 20 CECD COCCOCCCN[C@H](C)c1cc(OC)ccc1O 20192278 DWAXDNZPTDWLGM-GFCCVEGCSA-N 283.368 2.105 10 20 CECD C[C@@H](NCCc1cnn(C)c1)c1ccc(N(C)C)cc1 148769549 RMOJYTNMOFQTDI-CYBMUJFWSA-N 272.396 2.379 10 20 CECD CN(C)c1ccc(CNC[C@@](C)(O)C(F)(F)F)cc1 270455238 DKVXJYKRLZUUID-GFCCVEGCSA-N 276.302 2.156 10 20 CECD CCCOc1ccc(CNC[C@](C)(O)CCOC)c(O)c1 172069791 CCVCRQZOBXLZOX-MRXNPFEDSA-N 297.395 2.058 10 20 CECD C[C@@H](N[C@H]1CCc2[nH]ncc2C1)c1ccccc1O 183618769 VPSKQOYSNMYJQB-PWSUYJOCSA-N 257.337 2.323 10 20 CECD Cc1ccc(NC(=O)c2ccc(C)c(O)c2O)cn1 182843362 YVDVUSDFHOSDFE-UHFFFAOYSA-N 258.277 2.362 10 20 CECD COc1cccc(CNCC2(CCO)CCCC2)c1O 72925708 PCYLJVCXZGHTPK-UHFFFAOYSA-N 279.380 2.433 10 20 CECD CCCn1cc(C(=O)NCc2ccc(N(C)C)cc2)cn1 180544520 SLOPRMYPGIDLDH-UHFFFAOYSA-N 286.379 2.289 10 20 CECD CCOCCN(C)Cc1cc(F)cc(C(C)=O)c1O 127391719 MAYUTMZNFAXVCL-UHFFFAOYSA-N 269.316 2.202 10 20 CECD COc1ccc(O)c(CN[C@H]2C[C@H](OC)C2(C)C)c1 224894993 AOKZKBWVCCZFKB-KBPBESRZSA-N 265.353 2.304 10 20 CECD CN(C(=O)/C=C/c1cnn(C)c1)c1ccc(Cl)cn1 134728791 SELXEGIJNIKYTL-ZZXKWVIFSA-N 276.727 2.145 10 20 CECD O=C(NC[C@H]1CCOc2ccccc21)c1cccc(O)c1O 193049722 OABRQDOIVPKRCU-LLVKDONJSA-N 299.326 2.394 10 20 CECD CN(Cc1ccccc1O)C(=O)CCc1ccccn1 49475159 HPRQXWOLKBIVQJ-UHFFFAOYSA-N 270.332 2.378 10 20 CECD O=C(O)C[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 236425130 GQEFUXDQJGAKBX-JTQLQIEISA-N 267.300 2.218 10 20 CECD O=C(/C=C\c1ccccc1)NCc1ccc(O)c(O)c1 255910847 ROTXSPHVBSMVQP-CLFYSBASSA-N 269.300 2.427 10 20 CECD C[C@H](O)CCN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 268877620 KTNWCLICJFPSPF-STQMWFEESA-N 296.386 2.084 10 20 CECD COc1cccc(CN[C@H]2CCCc3cn[nH]c32)c1O 268871102 VFXHCNQTZKLAEJ-LBPRGKRZSA-N 273.336 2.291 10 20 CECD Oc1ccc(F)cc1CN1CCO[C@@H]2CCC[C@H]21 272252233 IOAPSYCCMZFNFY-TZMCWYRMSA-N 251.301 2.285 10 20 CECD Cc1n[nH]c(C)c1CN(C)c1ccc2c(c1)OCO2 272513932 JQSLFEUUPNCBQX-UHFFFAOYSA-N 259.309 2.392 10 20 CECD Cc1nc(CCN[C@H](C)c2cc(Cl)ccc2O)n[nH]1 273499058 YKGORZBAHYYAPQ-MRVPVSSYSA-N 280.759 2.365 10 20 CECD CN(C)C(=O)OC[C@@H]1CCCCN1Cc1ccccc1O 289537965 HYCCRLLPAJSZLG-AWEZNQCLSA-N 292.379 2.445 10 20 CECD CCN(CC)c1ccc(CN2CC(=O)N(C3CC3)C2)cc1 280422421 IVWHMRGVZAOKGH-UHFFFAOYSA-N 287.407 2.297 10 20 CECD O=C(NC[C@H]1CCCSC1)c1cc(O)cs1 807850595 PQWJDXFGZOAFFB-MRVPVSSYSA-N 257.380 2.327 10 20 CECD CCN(CC)c1ccc(CNC(=O)C(=O)c2ccc[nH]2)cc1 296442376 XPIWCCZTQLZQDX-UHFFFAOYSA-N 299.374 2.360 10 20 CECD OCC1(CNCc2cc(Cl)c(F)cc2O)CC1 816555455 FOEWBZUGWHKOQO-UHFFFAOYSA-N 259.708 2.047 10 20 CECD Cc1ccc2c(c1)/C(=C\c1cnn(C)c1)C(=O)N2C 811701543 ZKFNTEBARSXTPL-NTUHNPAUSA-N 253.305 2.246 10 20 CECD CN(CCCF)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 714790845 PYOJDBXAMNBTIA-XQRVVYSFSA-N 282.271 2.488 10 20 CECD COCCN1CC[C@H](NCc2cc(Cl)c(C)cc2O)C1 825292020 SJLYBZUJLUTSHN-ZDUSSCGKSA-N 298.814 2.164 10 20 CECD Cc1ncc(/C=C/C(=O)N2C[C@H](N)Cc3ccccc32)s1 493334433 KDCJLSCODHZXKZ-KTRBRXNASA-N 299.399 2.381 10 20 CECD C[C@@]1(C(=O)O)CCN(Cc2cc3c(cc2O)CCC3)C1 828029266 XFNCUEMXNWCACX-MRXNPFEDSA-N 275.348 2.178 10 20 CECD C[C@H](O)CCN(Cc1ccc(N(C)C)cc1)C1CC1 827441944 GQLQTKRJCKEBDB-ZDUSSCGKSA-N 262.397 2.488 10 20 CECD Cc1cc(O)c(CN2CCSC[C@@H]2CC(=O)O)cc1C 738463491 HOBQPWNTTQHOAR-ZDUSSCGKSA-N 295.404 2.401 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C(=O)C(C)(C)C 734405003 NWFGJUNPHRGWRS-UHFFFAOYSA-N 276.380 2.292 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@H]1C(=O)O 833629511 JZDGFHNYRUZIIH-WCBMZHEXSA-N 269.728 2.198 10 20 CECD Cc1ccncc1C(=O)NCc1ccc(N(C)C)cc1 741889163 NHXYUUKRKPAZHY-UHFFFAOYSA-N 269.348 2.386 10 20 CECD CC[C@H](C1CC1)N1C(=O)CN(Cc2ccccc2O)C1=O 849363114 DOVRXDDPBXLFIS-CYBMUJFWSA-N 288.347 2.345 10 20 CECD CCn1cncc1CN(C)c1ccc2c(c1)OCO2 841867561 NHYLFUWCGOLLAF-UHFFFAOYSA-N 259.309 2.268 10 20 CECD CCCCOCCCNC(=O)NCCc1ccc(N)cc1 841619624 NFPKUOGWKDKIGK-UHFFFAOYSA-N 293.411 2.317 10 20 CECD COc1cccc([C@@H](C)NC[C@@H]2CCOC2)c1O 846146477 RVIHCZFACBZNIP-MNOVXSKESA-N 251.326 2.088 10 20 CECD CN1CCN(c2ccc(/C=C/c3cnccn3)cc2)CC1 849246296 QXGGETJQAWIRDD-GORDUTHDSA-N 280.375 2.399 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1SCCS1 846476145 LHVWPOZFWNUUPV-UHFFFAOYSA-N 289.809 2.468 10 20 CECD C[C@H](N)C1CCN(Cc2cccc(F)c2O)CC1 843048636 MLXGEJNUPFEBLJ-JTQLQIEISA-N 252.333 2.091 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC(CF)CF 846717283 KUOOQCIHUWLLRC-UHFFFAOYSA-N 278.686 2.152 10 20 CECD CCN(C)c1ccc(CN2CC[C@@](C)(C(=O)O)C2)cc1 846274004 CDQMTZMZQUQROD-MRXNPFEDSA-N 276.380 2.439 10 20 CECD CO[C@@H]1COC[C@H]1N[C@H](C)c1cc(Cl)cc(C)c1O 842911883 OCJPZGZVZCVYSX-OASPWFOLSA-N 285.771 2.418 10 20 CECD CCOc1ccc(O)c(CNC[C@]2(C)CCCNC2)c1 841058629 ZHUXSTCJTSKLOH-MRXNPFEDSA-N 278.396 2.270 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@@H](c2cccnc2)C1 843962353 BZJVHXDUHSFJGU-GFCCVEGCSA-N 284.315 2.123 10 20 CECD COc1ccc(CN[C@H]2CCN(C(=O)C(C)C)C2)cc1C 1018523359 ICLSTTWZGXFQTQ-HNNXBMFYSA-N 290.407 2.350 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCN[C@@H](C)C2)c1O 841061225 HCBSJSHTXICCGT-CABZTGNLSA-N 284.787 2.284 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2[C@H](C)N)c1O 843346098 LSVAJBNEGJGCIP-BONVTDFDSA-N 294.370 2.436 10 20 CECD CC[C@@H]1CN(C)CCN1Cc1c(O)ccc2ccncc12 840091773 OIGRJSATHFIKLV-CQSZACIVSA-N 285.391 2.466 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1ccc(Cl)cc1O 841763237 LMLHXGIXEALYMC-QMTHXVAHSA-N 287.787 2.484 10 20 CECD CC(C)n1ccc(COC(=O)c2cccc(O)c2O)n1 758581926 PZWWYOFSHLWKCF-UHFFFAOYSA-N 276.292 2.232 10 20 CECD CCOc1ccc(O)c(CN[C@H](CO)CC2CC2)c1 754835047 RQZHNHVOQWIECA-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD C[C@@H]1C[C@@H](NC[C@H]2COCCO2)c2c(O)ccc(F)c21 756433590 DLZMJWYGTUMHDW-JFGNBEQYSA-N 281.327 2.085 10 20 CECD C[C@@H]1C[C@@H](N[C@@H]2CCN(C)C2)c2c(O)ccc(F)c21 756534695 MXCDFYWCEONYFS-CKYFFXLPSA-N 264.344 2.373 10 20 CECD C[C@@H]1C[C@@H](NCC(C)(C)C(N)=O)c2c(O)ccc(F)c21 756782953 XAJUINANMLSZLO-PSASIEDQSA-N 280.343 2.181 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCCS1 935948597 PMBCLGDAXNNMDV-NSHDSACASA-N 286.393 2.390 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H](C)n2ccnc2)c1 862755731 WYVCMYFNNIWISJ-LBPRGKRZSA-N 273.336 2.165 10 20 CECD Cc1ccc(O)c(CN[C@H](C)CCn2cccn2)c1 862475901 BFHQUVWSNICGNA-CYBMUJFWSA-N 259.353 2.466 10 20 CECD CCOc1ccc(CN2CCN(CC)[C@H](C)C2)c(O)c1 769382622 ZMXSMAZQIFJVBG-CYBMUJFWSA-N 278.396 2.317 10 20 CECD CSCCNC(=S)N[C@H](C)c1ccccc1O 865269655 VLWSYWCRAPWLKR-SECBINFHSA-N 270.423 2.280 10 20 CECD CCCNC(=O)NC(=O)CNc1ccccc1NC(C)C 871846902 FUFIZDJJDHLSFV-UHFFFAOYSA-N 292.383 2.155 10 20 CECD CN1CCN(c2ccc(CN(C)C3CCC3)cc2)CC1 775703563 SVJMJFFJWORPLY-UHFFFAOYSA-N 273.424 2.423 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C)C[C@@H]2C(N)=O)cc1 773844580 GRGPQXPEFBYXQR-XJKSGUPXSA-N 289.423 2.229 10 20 CECD C[C@H](NC[C@](C)(O)C1CC1)c1c(O)cccc1F 886526024 CQTOCNYYTFBADO-XPTSAGLGSA-N 253.317 2.343 10 20 CECD CC[C@@H](NCC[C@@H](O)COC)c1cc(Cl)ccc1O 775526556 RXOAFLGXKSPJOM-DGCLKSJQSA-N 287.787 2.484 10 20 CECD O=C(NCCCNCc1cc(F)cc(F)c1O)C1CCC1 883027854 RBGLHSCCASNMDB-UHFFFAOYSA-N 298.333 2.066 10 20 CECD COc1cc(C)cc(CN2CCC[C@H]([C@@H](C)O)C2)c1O 894423537 TWGDOJXZDNZBFF-OLZOCXBDSA-N 279.380 2.302 10 20 CECD OCCCN(Cc1cc(F)cc(F)c1O)CC(F)(F)F 893998009 AVAQTJXUIDZKJK-UHFFFAOYSA-N 299.239 2.417 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H]1C 787421148 NUUOWKHLIKYWQP-WFASDCNBSA-N 276.380 2.136 10 20 CECD CC[C@H]1CN(Cc2ccc(OC)c(OC)c2O)[C@H](C)CO1 895147556 MOPHCXTXCVELOV-YPMHNXCESA-N 295.379 2.409 10 20 CECD CC(C)(C)n1cc(NC(=O)c2cccc(O)c2O)cn1 187038227 DWIXCBKVUCDHAQ-UHFFFAOYSA-N 275.308 2.302 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1CCC[C@H](O)C1 708517044 NOIRTWLDRGIDNR-CABZTGNLSA-N 271.307 2.311 10 20 CECD CC[C@@H](NC[C@]1(O)CCSC1)c1ccc(F)cc1O 796786453 CPZOCTUOJCKNRW-TZMCWYRMSA-N 285.384 2.440 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCC[C@H]2C)c(O)c1 792916963 BZBJYQFJYMISMK-ZWNOBZJWSA-N 278.352 2.389 10 20 CECD Nc1ccc(CNC(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)cc1 1336863087 JOLXDKDNQGWXIQ-CDGCEXEKSA-N 271.364 2.113 10 20 CECD CCOC(=O)N(C)C1CCN(Cc2ccc(N)cc2)CC1 1356083499 QAUHFTGQPLFRLZ-UHFFFAOYSA-N 291.395 2.322 10 20 CECD C[C@H](NCC1=CCOCC1)c1cc(C(=O)O)ccc1O 1609775654 CPUWAMTYUZLSAE-JTQLQIEISA-N 277.320 2.088 10 20 CECD CS[C@H]1CC[C@@H](NCc2cc3c(cc2O)OCO3)C1 230696808 OXLWITISXQRVJC-MNOVXSKESA-N 281.377 2.495 10 20 CECD Nc1ccc(CC(=O)NCc2ccc(O)c(Cl)c2)cc1 1580443366 ZOEBKWMEMMTJOK-UHFFFAOYSA-N 290.750 2.487 10 20 CECD Nc1ccc(CN[C@H]2CCN(C3CCCCC3)C2=O)cc1 1580445480 GFLGNGNDDPLXIL-INIZCTEOSA-N 287.407 2.292 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2C[C@@H]2C(=O)O)cc1F 1776861068 JHDVUQOHJCYKQL-STQMWFEESA-N 294.370 2.482 10 20 CECD C[C@H](N[C@H](C)CC[S@](C)=O)c1ccc(F)cc1O 168839315 UWEBFDITFIEQRO-AUSHCKSDSA-N 273.373 2.339 10 20 CECD CCn1nncc1CN[C@@H](C)c1ccc(N(C)C)cc1 838937024 OXDIIPNGMXEFOQ-LBPRGKRZSA-N 273.384 2.215 10 20 CECD CC(C)[C@@H](O)C(C)(C)CNC(=O)Nc1ccc(N)cc1 841298523 QOHUPAKMCYNEHA-CYBMUJFWSA-N 279.384 2.433 10 20 CECD CCCCN(C)S(=O)(=O)N[C@H](C)c1ccccc1O 867833982 IXGVMIZEVBTGGU-LLVKDONJSA-N 286.397 2.020 10 20 CECD Cc1ccc(CNCCC(=O)NC(C)(C)C)c(O)c1 877025782 VYHUGRJYWGWXGT-UHFFFAOYSA-N 264.369 2.095 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)NCc2ccccc2O)[C@H]1C 253090641 IKJYWJHZRCCQHJ-DYNIEEOBSA-N 263.337 2.068 10 20 CECD Oc1cccc(Cl)c1CNC[C@@]1(O)CCSC1 267049095 NLQZUJXAXWYUPL-LBPRGKRZSA-N 273.785 2.003 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2ccnn2C)c1 184014786 DLHKKQYAYKSPAD-LLVKDONJSA-N 275.352 2.028 10 20 CECD CCOc1cccc(CNC[C@@H](O)C2CCC2)c1O 316011527 SAOZZYSGJYXAKM-CYBMUJFWSA-N 265.353 2.042 10 20 CECD O=C(O)CN(Cc1cc(Cl)ccc1O)C[C@H]1CCCO1 739794114 SKYWSWQMZSWUPG-GFCCVEGCSA-N 299.754 2.111 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)C1CCOCC1 28329135 USJRXCGRQOIZIW-UHFFFAOYSA-N 288.391 2.330 10 20 CECD C[C@H](Sc1nccs1)c1nc(-c2nnc[nH]2)no1 174036683 HTVXOKQVTDPILE-YFKPBYRVSA-N 280.338 2.165 10 20 CECD C[C@@H]1SCCN(Cc2cc3c(cc2O)OCO3)[C@H]1C 118381770 RZMFINMSBWQIDD-UWVGGRQHSA-N 281.377 2.447 10 20 CECD CCc1cnc(CNC(=O)c2ccc(C)c(O)c2O)s1 182522615 AORMNQDQKPLYAX-UHFFFAOYSA-N 292.360 2.355 10 20 CECD CCOc1cccc(CN[C@H]2CC[C@H](CO)CC2)c1O 153168938 UTYPAEDZLBZPHW-XBXGTLAGSA-N 279.380 2.432 10 20 CECD CC[C@H](NCC(F)(F)CO)c1ccc(N(C)C)cc1 184715274 ZFRMKHANPGGVQQ-ZDUSSCGKSA-N 272.339 2.421 10 20 CECD CC[C@@]1(C(=O)NCc2ccc(N(C)C)c(F)c2)CCCN1 134584484 ZMQQXFUJCYUVJP-INIZCTEOSA-N 293.386 2.040 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)NCC(=O)O)c1C 237725186 WQHRBYXUBXUGHS-UHFFFAOYSA-N 286.331 2.217 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@](C)(C(=O)OC)C2)c1 93813971 JWGYHKALADFLAM-MRXNPFEDSA-N 293.363 2.176 10 20 CECD C[C@H](N[C@H]1CCOC1)c1ccc(N2CCOCC2)c(F)c1 90774591 RLHRUGSUIDSOHS-JSGCOSHPSA-N 294.370 2.102 10 20 CECD Cc1cc(O)c(CN2CCO[C@@H]([C@H]3CCCO3)C2)cc1C 246303781 VOVXDVVKZDKCGS-IAGOWNOFSA-N 291.391 2.389 10 20 CECD C[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)C[C@@H](C)O1 245511731 ZDAHVPYYOFDTNG-DABQJJPHSA-N 292.379 2.490 10 20 CECD Cc1c(CNC(=O)N=c2cccn[nH]2)n(C)c2ccccc12 344042340 ZMXNLBARHCQYAF-UHFFFAOYSA-N 295.346 2.020 10 20 CECD Oc1ccccc1CN1CCN(c2ccc(F)cn2)CC1 367723943 VADHQBXLVNVBLU-UHFFFAOYSA-N 287.338 2.249 10 20 CECD CCNC(=O)[C@@H](C)N[C@@H](CC)c1ccc(N(C)C)cc1 268709157 FUEDKQBBZUJGPD-DOMZBBRYSA-N 277.412 2.318 10 20 CECD OC[C@@H](CC1CCC1)NCc1cc(F)ccc1O 279831104 QHOZWJCCCMRCNH-CYBMUJFWSA-N 253.317 2.172 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCc3c[nH]nc3C2)cc1F 372738988 HTXQBLCWGSATIT-CYBMUJFWSA-N 288.370 2.262 10 20 CECD CCCCN(Cc1ccccc1O)[C@@H]1CCOC1=O 282492349 PXJKIWRYBLMCID-CYBMUJFWSA-N 263.337 2.310 10 20 CECD CCOC1CC(N(C)Cc2cc3c(cc2O)OCO3)C1 288401357 BKTLVBKGLXLHLT-UHFFFAOYSA-N 279.336 2.120 10 20 CECD C[C@H](N[C@H]1CCCNC1)c1cc(F)cc(F)c1O 817942493 ZZWDYNHNNAVDCA-WPRPVWTQSA-N 256.296 2.073 10 20 CECD CC(C)NCCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 817952247 CXSRYLCBSSWQJY-LLVKDONJSA-N 281.356 2.339 10 20 CECD CC[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cccc(Cl)c1O 817977729 NTGHMKRVJGYGJE-DNIRFERGSA-N 266.772 2.304 10 20 CECD COCCN(Cc1ccco1)C(=O)c1cc(O)cs1 731868837 ZHXURUGHSOCYAB-UHFFFAOYSA-N 281.333 2.336 10 20 CECD Cc1cc(O)c(CN[C@H](C)c2nncn2C)cc1Cl 825241702 WKOHQLZQRQOKRX-SECBINFHSA-N 280.759 2.333 10 20 CECD C[C@H](O)C[C@@H]1CCCCN1C(=O)c1cc(O)cs1 834740831 YSMKRNBAQRUJBK-UWVGGRQHSA-N 269.366 2.219 10 20 CECD COC(=O)[C@@H]1CCCC[C@@]1(C)NC(=O)c1cc(O)cs1 831624309 TVUOEEXKTLIEAG-IINYFYTJSA-N 297.376 2.305 10 20 CECD CC(=O)CCCCCNC(=O)c1cc(O)cs1 909106231 RTAALRNHKNGCFK-UHFFFAOYSA-N 255.339 2.333 10 20 CECD C[C@@]1(CNC(=O)Nc2ccc(N)cc2)CCCC[C@@H]1O 841298461 AANZZFVESZDMQQ-ZFWWWQNUSA-N 277.368 2.332 10 20 CECD CCO/C=C\C(=O)NCc1cc(Cl)ccc1O 848242424 GEFQRDZSGXBIRS-WAYWQWQTSA-N 255.701 2.212 10 20 CECD C[C@H]1[C@H](N2CCCC2)CCN1C(=O)Nc1ccc(N)cc1 841299619 LNDKCTQRFHWYGR-SWLSCSKDSA-N 288.395 2.359 10 20 CECD CCN(C)c1ccc(CN2CCc3nc[nH]c3C2)cc1 859305148 BICOAWACQWVDGM-UHFFFAOYSA-N 270.380 2.424 10 20 CECD CCCNC(=O)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756355045 GDHSMFFWUYPHNJ-MWLCHTKSSA-N 280.343 2.195 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCCOC(F)F)c1 858430603 CDTBILRWIWUTCA-UHFFFAOYSA-N 288.294 2.129 10 20 CECD O=C(CC(F)(F)C(F)(F)F)NCc1ccc(O)c(O)c1 866769079 HJQAALIRDYSKNN-UHFFFAOYSA-N 299.195 2.302 10 20 CECD Cc1cccc(O)c1CNC[C@H](O)Cc1ccccc1 877014830 SDJGHMSBBSSPID-OAHLLOKOSA-N 271.360 2.394 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1nccs1 770102059 HIJPIDQGLPFMQQ-UHFFFAOYSA-N 275.377 2.481 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@@H](O)C(F)(F)F 877693759 QCMZRABCHJXNDP-GXFFZTMASA-N 290.329 2.462 10 20 CECD Cc1cccc(O)c1CN1CCO[C@H](C(F)F)C1 877502862 UUIKDVRDHDBCKW-LBPRGKRZSA-N 257.280 2.167 10 20 CECD Cn1cc(/C=C\C(=O)N2CCCOc3ccccc32)cn1 779455221 GUHDZXDEKOBGDG-FPLPWBNLSA-N 283.331 2.249 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CCC(F)(F)C1 1123889648 PMSJNZUIEMOLBM-MRVPVSSYSA-N 271.263 2.149 10 20 CECD COc1cc(C)cc(CN2CCOCC23CCC3)c1O 894036562 ZMDIRCVTQLGHES-UHFFFAOYSA-N 277.364 2.464 10 20 CECD CCN1CCC[C@H]1CNCc1cc(C)cc(OC)c1O 894139074 AQDGAEKKVJQJQZ-AWEZNQCLSA-N 278.396 2.283 10 20 CECD C[C@H](O)C[C@@H](C)NCc1ccc(Br)cc1O 701015867 SCZRKDKGCQIXEU-BDAKNGLRSA-N 288.185 2.404 10 20 CECD CC(C)(CO)NCc1c(O)cccc1Br 706828460 DQRTWZFVIGQPGA-UHFFFAOYSA-N 274.158 2.015 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCN(C(C)(C)C)C2)c1 693905646 IULXFCDWKBCYSG-CYBMUJFWSA-N 278.396 2.363 10 20 CECD CSCC[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)O 1333938857 RWGIJUFZNDGVGX-CYBMUJFWSA-N 295.404 2.308 10 20 CECD CCOc1ccc(N2CCN(C[C@@H](O)C(C)C)CC2)cc1 1253767311 BRVZGLBMFOAYCW-QGZVFWFLSA-N 292.423 2.224 10 20 CECD Cc1ccc(O)c(CN[C@H](C(=O)O)c2cccc(O)c2)c1 1607811308 HHDSCYVNHAZUDU-HNNXBMFYSA-N 287.315 2.322 10 20 CECD C[C@H](NC(=O)c1ccc(N)cc1O)c1ccccc1O 1579483022 HXNLLMGLSNHWOO-VIFPVBQESA-N 272.304 2.171 10 20 CECD NCc1ccc2c(c1)N(Cc1cccc(F)c1O)CCO2 1580340775 JFGPOQJRYUGQIN-UHFFFAOYSA-N 288.322 2.389 10 20 CECD CCCC[C@@H](NCc1cccc(OC)c1O)C(=O)O 1595641112 RBTOPHOPVOOLKT-LLVKDONJSA-N 267.325 2.134 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCO2)c1 19963696 CMZGXSDLXSDVGU-PWSUYJOCSA-N 251.326 2.230 10 20 CECD C[C@H](NC1CNC1)c1ccc(N2CCCCC2)cc1 169172145 YWYNPAVDDSHOCI-ZDUSSCGKSA-N 259.397 2.299 10 20 CECD C[C@H]1CCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 154699269 WGNIKLUYFOZAGH-AWEZNQCLSA-N 289.423 2.195 10 20 CECD CCCOc1ccc(CN2CC[C@H](OC)C2)c(O)c1 233250864 ASPZFZFUHZSSLB-AWEZNQCLSA-N 265.353 2.402 10 20 CECD CN1CCC[C@@H](CNCc2ccc3c(c2)CCCO3)C1 921716704 JOKJTWQFAVPZEE-HNNXBMFYSA-N 274.408 2.443 10 20 CECD CC[C@H]1C[C@@H](NCc2cc(OC)ccc2O)CCO1 823871924 RPICZBHKWONUSS-STQMWFEESA-N 265.353 2.448 10 20 CECD Cc1cccc(CNc2ccc(CC(N)=O)cc2)c1O 158044658 YZBHVLOOELJTCV-UHFFFAOYSA-N 270.332 2.341 10 20 CECD COC1CCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 37323362 UGUYCYMMNWYSQT-UHFFFAOYSA-N 281.327 2.345 10 20 CECD C[C@@H](NCc1cncn1C)c1ccc(N(C)C)cc1 274725913 ACXLSRREFXMWSB-GFCCVEGCSA-N 258.369 2.337 10 20 CECD CNCCC1CCN(Cc2cccc(OC)c2O)CC1 70188970 YKFVTJOLTREXCY-UHFFFAOYSA-N 278.396 2.222 10 20 CECD COc1cc(Cl)cc(CN2CC[C@]3(CCNC3)C2)c1O 394395636 BLWRHVDMHPZEHX-HNNXBMFYSA-N 296.798 2.240 10 20 CECD CN(Cc1ccccc1O)C(=O)C(F)(F)C(F)F 225842919 LRQWBPFDHBSLNH-UHFFFAOYSA-N 265.206 2.251 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(C)[nH]n1 54148923 BTBWTLRJILPCGL-UHFFFAOYSA-N 286.379 2.446 10 20 CECD O=C(NCc1ccc(N2CCOCC2)c(F)c1)C1CCC1 55522709 JAEZAOYPNJDSHO-UHFFFAOYSA-N 292.354 2.079 10 20 CECD Cc1ccc(O)c(CN2CCCN(C(=O)C3CC3)CC2)c1 119101131 OSBSVBGIUQSFNT-UHFFFAOYSA-N 288.391 2.145 10 20 CECD CCOc1cccc(CN2C[C@@H](COC)O[C@H](C)C2)c1O 188373906 XTTMGMYVGJLJFQ-OCCSQVGLSA-N 295.379 2.027 10 20 CECD CC[C@H](NC[C@@H](O)COCC(C)C)c1ccccc1O 121081746 MWXAUFZKUTZGTH-HIFRSBDPSA-N 281.396 2.466 10 20 CECD COc1ccc(O)c(CN2CC[C@H]([C@H]3CCOC3)C2)c1 374998464 NLLQCFMNIJXDMZ-STQMWFEESA-N 277.364 2.259 10 20 CECD CCN(CC)CCSCC(=O)Nc1ccc(N)cc1 88734005 LXFPLCPIJCGZSP-UHFFFAOYSA-N 281.425 2.282 10 20 CECD COc1ccc(O)c(CNC[C@H]2COC3(CCCC3)O2)c1 271874062 YSSXWWJJDLESEH-AWEZNQCLSA-N 293.363 2.176 10 20 CECD C[C@@H](O)CCCNCc1cc(Cl)cc([N+](=O)[O-])c1O 278609362 IPZXYLOVLMLSRY-MRVPVSSYSA-N 288.731 2.204 10 20 CECD COc1cc(O)c(CN[C@@H]2CCCC[C@H]2OC)cc1OC 278785094 VJKNMZNRFFLATJ-TZMCWYRMSA-N 295.379 2.457 10 20 CECD Oc1ccc2c(c1CNc1nccn3cnnc13)CCCC2 271375762 WOCIOFVRWXKTGJ-UHFFFAOYSA-N 295.346 2.321 10 20 CECD CC(C)Oc1ccc(N(C)Cc2nnnn2C2CC2)cc1 277205605 MVHUPEIPJBBLEA-UHFFFAOYSA-N 287.367 2.432 10 20 CECD CN(C)c1ccc(CNc2nncs2)cc1F 271952225 BZIHEMKITBRNSE-UHFFFAOYSA-N 252.318 2.355 10 20 CECD COc1cc(Cl)cc([C@@H]2NC(=O)CN2CC(C)C)c1O 273477897 IDUNZAIJGPXMNO-CQSZACIVSA-N 298.770 2.141 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1cncnc1 807836170 PZQQYDRYUGRBLP-UHFFFAOYSA-N 298.129 2.419 10 20 CECD CCOc1ccc(O)c(CNC[C@H](C)CCCO)c1 294850040 RZTIQVWYVVSITP-GFCCVEGCSA-N 267.369 2.289 10 20 CECD Cc1ccc(O)c(CN2CC(O)(c3ccccc3)C2)c1 291519856 JAIPJJGHOJVXJC-UHFFFAOYSA-N 269.344 2.404 10 20 CECD C[C@@H]1C[C@H](NCCNC2CC2)c2c(O)ccc(F)c21 817951950 BRSSXYRFPFPCGX-SKDRFNHKSA-N 264.344 2.421 10 20 CECD C[C@@H](NC[C@H]1CCCNC1)c1cc(F)ccc1O 817946002 PNWUHPNYMLVSKK-MNOVXSKESA-N 252.333 2.182 10 20 CECD C[C@H](N[C@H]1CCNC1)c1cccc(C(F)(F)F)c1O 817945274 YSIHXDKKYWHDAB-IUCAKERBSA-N 274.286 2.424 10 20 CECD O=C1COc2c(cccc2NC(=O)c2cc(O)cs2)N1 811597250 HLFAIDVHPXBCGC-UHFFFAOYSA-N 290.300 2.037 10 20 CECD CCCN1C[C@H](CN[C@@H](C)c2cc(F)ccc2O)CC1=O 817589642 OVQUBXKZLLCWAB-RYUDHWBXSA-N 294.370 2.440 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCN(C)C2)cc1Cl 825247908 ZNVPHNMOOLPVGT-LLVKDONJSA-N 254.761 2.148 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CC1(F)F 825873500 KZCCVTJHCAMSLU-GFCCVEGCSA-N 268.307 2.332 10 20 CECD O=C1CN(C(=O)/C=C\c2cccnc2)c2cccc(F)c2N1 492492838 MQSZXFPBKVWDKH-SREVYHEPSA-N 297.289 2.219 10 20 CECD COC(=O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1cccc(C)c1O)C2 839173989 XTYSJTJOCAUTPQ-BPLDGKMQSA-N 289.375 2.474 10 20 CECD CC(C)COCCCNC(=O)c1cc(O)cs1 731867737 RVXDVWKCNJMNJO-UHFFFAOYSA-N 257.355 2.246 10 20 CECD c1ccn(-c2ccc(-c3nc(-c4nc[nH]n4)no3)cc2)c1 731793658 PTIYJKWKHYDBTM-UHFFFAOYSA-N 278.275 2.312 10 20 CECD CCOCCNC(=S)NCc1ccc(N(C)C)cc1C 734385495 NMKDEJPUULDPSH-UHFFFAOYSA-N 295.452 2.062 10 20 CECD CC[C@H](NC[C@]1(C)CCC(=O)N1)c1ccccc1O 834908865 MJHMPXJNDGTMFB-WFASDCNBSA-N 262.353 2.102 10 20 CECD COCC1(N[C@@H](C)c2cccc(OC)c2O)CC1 846160515 PLVYQTFQGGWTOM-JTQLQIEISA-N 251.326 2.230 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CCCN(C)C 840946332 OBEYKMPZJIHKHG-UHFFFAOYSA-N 263.429 2.445 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H](C)C(=O)N(C)C)cc1 741678370 PIWLYAVFZMPANK-CQSZACIVSA-N 291.439 2.441 10 20 CECD CC[C@H](CN(C)c1ccc(OCC(=O)OC)cc1)OC 842154501 UKDIWMJGJWXWNH-CYBMUJFWSA-N 281.352 2.100 10 20 CECD C[C@H](CN)CNCc1ccc(N2CCCCC2)cc1 841050169 YRJGZQPZFCINBJ-CQSZACIVSA-N 261.413 2.361 10 20 CECD CO[C@H](COC(=O)c1cccc(O)c1O)CC(C)C 842090634 DPTOBEVFSGCAIC-JTQLQIEISA-N 268.309 2.316 10 20 CECD CCOCc1cc(CN[C@@H](C)CCN)ccc1OC 841051971 SRHJJLTULHQEQE-LBPRGKRZSA-N 266.385 2.059 10 20 CECD N[C@@H]1CCO[C@H]([C@@H]2CCCN(Cc3ccccc3O)C2)C1 844901449 FMAFIBLZPQYUFG-INMHGKMJSA-N 290.407 2.111 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H]3COC[C@@H]3C)C2)cc1 926610779 FULUCYWROOQLSN-JJRVBVJISA-N 290.407 2.146 10 20 CECD C[C@]1(CNC(=O)c2cc(O)cs2)CCCS1 759095375 QZEWGDKVKOLHDD-LLVKDONJSA-N 257.380 2.469 10 20 CECD CC(C)N(C)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756526950 UYPJUQBVCMTYSQ-LLVKDONJSA-N 281.356 2.291 10 20 CECD O=C(O)C1(C(=O)NCc2ccccc2O)CCCCCC1 852943721 YBKGQGHEIHYTDG-UHFFFAOYSA-N 291.347 2.434 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC[C@@H]1CCCC1=O 759598409 WSYCZVNZFFSWOK-PZBABLGHSA-N 290.315 2.414 10 20 CECD Cc1nocc1C(=O)NCc1ccc(N(C)C)c(F)c1 865051878 XPDVIHKETQEFJX-UHFFFAOYSA-N 277.299 2.118 10 20 CECD COc1ccc([C@@H](CN)CN(C)c2ccc(N)cc2)cc1 863558783 XLPVPZXKHMZTDT-AWEZNQCLSA-N 285.391 2.456 10 20 CECD C[C@H](NC(=O)COCC1CC1)c1ccc(N(C)C)cc1 773024579 MCSFAJHHYVSALQ-LBPRGKRZSA-N 276.380 2.356 10 20 CECD C[C@H](NC(=S)NC1CC1)c1ccc(N(C)C)cc1 774248709 GUUDCGWPFRIYHG-JTQLQIEISA-N 263.410 2.440 10 20 CECD CN(C)c1ccc(/C=C\CN[C@H]2C[C@@H](C(=O)O)C2)cc1 874045119 OBKLCDTXXAMHKY-LQOBQMSGSA-N 274.364 2.219 10 20 CECD COC(=O)CCN(Cc1ccc(C)cc1O)C(C)C 876733080 NNTQYHMNPTVMJV-UHFFFAOYSA-N 265.353 2.474 10 20 CECD C[C@@H](NC(=O)C[C@@H]1CCCO1)c1ccc(N(C)C)cc1 773011283 FNIDXVSMICXDFR-DOMZBBRYSA-N 276.380 2.499 10 20 CECD COCC1(NCc2c(O)ccc(Cl)c2F)CC1 790977698 OWAOEMQDOXEZJA-UHFFFAOYSA-N 259.708 2.453 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@H]2CCC=CO2)cc1 780184785 SQPCPFAGDLECNY-OAHLLOKOSA-N 289.379 2.245 10 20 CECD CC(C)OC(=O)C(C)(C)NCc1cc(F)ccc1O 898507503 UOBFXADTDRGXIW-UHFFFAOYSA-N 269.316 2.351 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCN(CC3CC3)C2)c1O 894250464 JZILKRSCAAGVHO-OAHLLOKOSA-N 290.407 2.283 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC(F)(F)CC1 794292785 BZGKKDSXFVMQTF-RQOWECAXSA-N 283.274 2.369 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](CO)CC(F)F)c1 717811255 LUIFUIKSSPRGJT-RKDXNWHRSA-N 275.295 2.068 10 20 CECD Cc1nc(N(C)C)sc1C(=O)NCc1ccccc1O 1320712719 BDBXYYZLLWKGGQ-UHFFFAOYSA-N 291.376 2.153 10 20 CECD Cc1nnc(CN[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)n1C 1321022050 AXHXVTIKRVQFPP-LDYMZIIASA-N 290.342 2.306 10 20 CECD COc1ccc([C@@H](CO)N(C)Cc2ccc(N)cc2)cc1 1336118269 VVXFXYTWZRXALD-QGZVFWFLSA-N 286.375 2.443 10 20 CECD Nc1ccc(CN2CCc3ccccc3[C@@H]2CO)cc1 1345160779 YTDNMNIBXOUVCW-KRWDZBQOSA-N 268.360 2.361 10 20 CECD O=C(O)[C@H]1C[C@H]2CC[C@H]1N(Cc1cc(F)c(F)cc1O)C2 1608615856 KKOOTSAXUHUWNR-DFAYQTQMSA-N 297.301 2.356 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1CCNC1 1579674169 NTCRWNOCYGAESV-LBPRGKRZSA-N 289.404 2.247 10 20 CECD CCN1CCc2cc(CN[C@H](C)CC(=O)O)ccc21 1776877648 QYIRZSJWWUAYOZ-LLVKDONJSA-N 262.353 2.022 10 20 CECD CC[C@H](CC(=O)O)NCc1ccc2c(c1)CCN2CC 1776955344 UAUQAGUFJHBFSJ-CQSZACIVSA-N 276.380 2.412 10 20 CECD COc1ccc(CNCCC(=O)NC(C)(C)C)cc1C 134592633 LBMOJAWAYCTINE-UHFFFAOYSA-N 278.396 2.398 10 20 CECD CCOCCOCCN[C@H](C)c1cc(OC)ccc1O 927088006 UADXIYJFLVMIJG-GFCCVEGCSA-N 283.368 2.105 10 20 CECD C[C@H](NCCc1cnn(C)c1)c1ccc(F)cc1O 128020293 VDQQDFKIAXKFDB-JTQLQIEISA-N 263.316 2.158 10 20 CECD C[C@H](CC[S@](C)=O)N[C@H]1CCc2cccc(O)c21 296666488 FPJAABBICDOWBD-MYFIVHGGSA-N 267.394 2.126 10 20 CECD CCN1CC[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)C1=O 708678820 BOVLLJOATXZOBR-IUODEOHRSA-N 275.396 2.024 10 20 CECD Cc1ccc(C(=O)N(C[C@@H]2CCOC2)C2CC2)c(O)c1O 179454974 OSCHYEOXHOGNOT-NSHDSACASA-N 291.347 2.047 10 20 CECD CCc1cc(NCc2cc(OC)ccc2O)n2ncnc2n1 301302971 WGOOXXIIENWYLK-UHFFFAOYSA-N 299.334 2.013 10 20 CECD COc1ccc(O)c(CNC(=O)c2sc(C)nc2C)c1 114544274 BRGXDXSBGFPZQD-UHFFFAOYSA-N 292.360 2.404 10 20 CECD CC(C)[C@@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186423823 BUZKUWDCIKUFEK-GHMZBOCLSA-N 265.353 2.437 10 20 CECD C[C@@H](NCC1(CO)CCOCC1)c1cc(Cl)ccc1O 186149528 GFRRXTBQPLNNRE-LLVKDONJSA-N 299.798 2.485 10 20 CECD COc1cccc(CNC(=O)Nc2ccncc2C)c1O 120571013 OWQBLCTUBRHIOS-UHFFFAOYSA-N 287.319 2.426 10 20 CECD COCCN(C)CCCN[C@H](C)c1cc(F)ccc1O 185009021 WWUSOPNHQVWSOJ-GFCCVEGCSA-N 284.375 2.150 10 20 CECD CCN(CCCN(C)C)Cc1cccc(C)c1O 230744774 OCMGBAGWEOBZQP-UHFFFAOYSA-N 250.386 2.474 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1CCO[C@H](C2CC2)C1 274147939 DPFOTMVIRKEFJF-ZFWWWQNUSA-N 290.363 2.149 10 20 CECD Cc1ccc(C(=O)N2CCC(CCCO)CC2)c(O)c1O 272879033 XLWLYWGNDLWPCA-UHFFFAOYSA-N 293.363 2.031 10 20 CECD CCN(CC)c1ccc(CNc2nnc(CO)o2)cc1 275319082 SUHWXEDZJPWGLD-UHFFFAOYSA-N 276.340 2.020 10 20 CECD Cn1ccnc1[C@@H]1CCN(Cc2cc(F)ccc2O)C1 377881911 AWGPCVGKHGSTRI-LLVKDONJSA-N 275.327 2.254 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CCCN(CCCO)C2)c(O)c1 297385151 RKLJQYVQGIUJOI-LSDHHAIUSA-N 292.423 2.198 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2nnc(C(C)C)[nH]2)c1 294902380 XHFXJVLTIIRMCI-SNVBAGLBSA-N 290.367 2.493 10 20 CECD NC[C@H](N[C@H]1CCc2cccc(O)c21)C1CCCC1 817981687 MPTMIPQYBZEZLJ-KBPBESRZSA-N 260.381 2.487 10 20 CECD C[C@H]1C[C@H](O)CN1Cc1cc(Cl)c(F)cc1O 816589427 XZTQOGJHLMCUMH-CBAPKCEASA-N 259.708 2.140 10 20 CECD CCOc1ccc(CN2C[C@@H](CO)C[C@@H](C)C2)c(O)c1 817412578 MVWFCQXTLISADQ-OLZOCXBDSA-N 279.380 2.241 10 20 CECD CCn1ccnc1[C@H](C)NCCc1ccc(N)cc1 817958556 XLOAXQFSIFQJBU-LBPRGKRZSA-N 258.369 2.379 10 20 CECD Cc1cccc(CNCc2ccc(CC(N)=O)cc2)c1O 811509815 GHDUULYQVWYLKZ-UHFFFAOYSA-N 284.359 2.018 10 20 CECD COCCOCCCNCc1cc(Cl)c(C)cc1O 825064162 IVZSQJQXBMXWSY-UHFFFAOYSA-N 287.787 2.497 10 20 CECD C[C@H]1C[C@@H](NCC2(N)CC2)c2c(O)ccc(F)c21 902406124 LTSKDBWQBAQYGC-WCBMZHEXSA-N 250.317 2.161 10 20 CECD CCCN1CCC(NC(=O)NCc2ccccc2O)CC1 736650542 WETNNYZKGLDDSL-UHFFFAOYSA-N 291.395 2.066 10 20 CECD CC(C)[C@@H]1C[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 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848906229 RVEYZCVQEFEFRP-LLVKDONJSA-N 287.306 2.241 10 20 CECD COc1ccc(O)c([C@H](C)NCc2ccc(CO)o2)c1 845972375 NTWDPSDXQZHOAM-JTQLQIEISA-N 277.320 2.337 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1ccc(C)cc1O 756733922 RSQNCZFZQCQEGT-STQMWFEESA-N 267.369 2.403 10 20 CECD CCC[C@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756575556 HNCOPQCIYWQGPZ-KOLCDFICSA-N 268.313 2.112 10 20 CECD C[C@H](Cn1cccn1)NCc1cc(F)c(N(C)C)cc1F 858095615 RIKSAGGOGMGQFI-LLVKDONJSA-N 294.349 2.406 10 20 CECD N[C@@H]1CCC[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 852811435 NJFORWYTJIYYGJ-DZGCQCFKSA-N 288.391 2.015 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@@H](C)c1cc(F)cc(F)c1O 756773957 DFKBRZZIAZYPML-IYYTYJHQSA-N 298.333 2.236 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCC=CO1)c1ccccc1O 868522297 DNIICKZIKCBPSJ-VXGBXAGGSA-N 276.336 2.445 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@@H](C)n2ccnc2)c1 862755729 WYVCMYFNNIWISJ-GFCCVEGCSA-N 273.336 2.165 10 20 CECD CCOc1ccc(CN(C)CCn2cccn2)c(O)c1 769404823 SAKFWHFNAJXJOC-UHFFFAOYSA-N 275.352 2.119 10 20 CECD CCn1cc(C(=O)NCc2ccc(N(C)C)cc2)c(C)n1 1118905341 KLEVBLACMQDAFB-UHFFFAOYSA-N 286.379 2.207 10 20 CECD CO[C@H](CNCc1ccc2c(c1)CCO2)C1CCOCC1 876995300 DJKAMKRBMOUNOR-QGZVFWFLSA-N 291.391 2.153 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc2occc2[nH]1 778928810 BYPUZVNWEMNEOA-UHFFFAOYSA-N 272.260 2.102 10 20 CECD COc1cc(N(C)CCCF)c([N+](=O)[O-])cc1OC 884857230 SNZKFDWZGNXVMO-UHFFFAOYSA-N 272.276 2.408 10 20 CECD C[C@H](N[C@@H](CCO)C(F)(F)F)c1c(O)cccc1F 886803931 PFFUHNHCBTYRRC-XVKPBYJWSA-N 281.249 2.495 10 20 CECD CCOc1ccc(CNc2cc(CO)ccn2)c(O)c1 883147934 NZIRRXCYTKVENA-UHFFFAOYSA-N 274.320 2.290 10 20 CECD COC(=O)[C@@H](CC(F)F)NCc1cc(Cl)ccc1O 789578652 DAVQYYFAEWXULT-SECBINFHSA-N 293.697 2.332 10 20 CECD CCC[C@@H](NCc1cc(C)c(C)cc1O)C(=O)OC 897835448 GLENQJWXFSZOIR-CYBMUJFWSA-N 265.353 2.440 10 20 CECD CCc1noc(C)c1C(=O)NCCc1ccc(N)cc1 701359340 KLGHFQXBOZTMFK-UHFFFAOYSA-N 273.336 2.100 10 20 CECD Cc1cccc2c1N[C@H](c1cc(O)ccc1O)NC2=O 1317910607 SEDZCUQZPDTWCH-AWEZNQCLSA-N 270.288 2.260 10 20 CECD Cc1ccc(C)n1-c1ccc(Cl)c(C(=O)NCCO)c1 1322110108 KHSZQRIZEKHUKG-UHFFFAOYSA-N 292.766 2.470 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@H]1CCCNC1=O 1325575035 SXNVKONDHZPLPR-JHJVBQTASA-N 288.391 2.365 10 20 CECD Cc1cc(O)c(CNCc2csnn2)cc1Cl 1352879707 ZBFIKENRFHDZCG-UHFFFAOYSA-N 269.757 2.495 10 20 CECD COc1cccc(CNCCOCC(F)(F)F)c1O 111607841 PKDMRACCDKAVPB-UHFFFAOYSA-N 279.258 2.069 10 20 CECD Cc1ccc(CNc2cnn(C(C)(C)C(=O)O)c2)c(O)c1 1605277450 DIVIPOGETNFTEY-UHFFFAOYSA-N 289.335 2.329 10 20 CECD CC(C)(C)CC[C@@H](NC(=O)c1cccc(O)c1O)C(=O)O 1588647023 AYIRWYYPTONWGK-SNVBAGLBSA-N 295.335 2.107 10 20 CECD C[C@@H]1CC[C@H](C(=O)O)N1Cc1cc(F)c(F)cc1O 1594220009 BZRSFQMJRFIZTP-RDDDGLTNSA-N 271.263 2.108 10 20 CECD CC(C)=CC[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776298700 JVMQVZDZDJGXPL-LBPRGKRZSA-N 294.307 2.200 10 20 CECD COc1ccncc1CNCc1c(O)cccc1OC 814298306 QVTDIEDRCIDNCN-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CCc1cccc(CN2CCN(C)CC2(C)C)c1O 848887179 PNZFMWVAJUWLHW-UHFFFAOYSA-N 262.397 2.481 10 20 CECD CC[C@@H](NCCCN1CCOCC1)c1ccccc1O 20141813 WZCBDDVJUVXCRU-OAHLLOKOSA-N 278.396 2.155 10 20 CECD C[C@H](NCc1cccc(C(N)=O)c1)c1ccccc1O 36902833 PBRQMYKBZZQFFL-NSHDSACASA-N 270.332 2.342 10 20 CECD Cc1cccc(S(=O)(=O)NCc2ccccc2O)c1F 313227855 FUPIZLGHXYGYTN-UHFFFAOYSA-N 295.335 2.318 10 20 CECD Oc1c(Cl)cccc1CNCC12CC(CO1)C2 529663224 PXUHNSCLZLADJS-UHFFFAOYSA-N 253.729 2.314 10 20 CECD O=C(O)[C@@H]1CCN(Cc2c(O)ccc3ccccc23)C1 86789695 GARGMDGRKVXZAP-GFCCVEGCSA-N 271.316 2.452 10 20 CECD C[C@@H](CCN(C)C)NCc1ccc2c(c1)CCCO2 389078111 ZWINNDMRZVBIFJ-ZDUSSCGKSA-N 262.397 2.441 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)[C@H]1C[C@H]1C(=O)O 1593293721 XHNBQBOTQMZDBA-WHGOUJPWSA-N 269.728 2.244 10 20 CECD CCOc1cccc(CNC[C@](C)(O)CC)c1O 106448925 ZBXJFVQLVKIRTO-CQSZACIVSA-N 253.342 2.042 10 20 CECD CC(C)NC(=O)COc1ccc(N2CCCC2)cc1 178196431 PEOMAUOQBOFZAC-UHFFFAOYSA-N 262.353 2.190 10 20 CECD CC1(C)CN(CCNCc2cc(Cl)ccc2O)CCO1 171766532 ATPFJELMWRIJLL-UHFFFAOYSA-N 298.814 2.246 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccccc1C(=O)O 317407233 IYGQEMCQNASEBG-UHFFFAOYSA-N 299.326 2.292 10 20 CECD CCn1cc(C(=O)NCc2c(O)ccc3c2CCCC3)cn1 75159996 RAHUUBYUBPOHLF-UHFFFAOYSA-N 299.374 2.417 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)c1nnc2n1CCC2 37363550 VNDKEQHTTLJZON-NSHDSACASA-N 284.363 2.010 10 20 CECD Cc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 181229541 MAJDVGRWSWHKCP-QPJJXVBHSA-N 270.288 2.453 10 20 CECD COC(=O)Cc1cccc(NCc2cc(C)ccc2O)n1 191607844 JTJMGGABVGUNCV-UHFFFAOYSA-N 286.331 2.423 10 20 CECD c1n[nH]c(CCNCc2ccc(N3CCCCC3)cc2)n1 80574008 JERWONGPWCSBIW-UHFFFAOYSA-N 285.395 2.127 10 20 CECD COC[C@H](CCO)N[C@H](C)c1ccc(C)c(C)c1O 273587001 OAXGDCVGZICDDC-OLZOCXBDSA-N 267.369 2.057 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCCc3cn[nH]c32)c1 271805909 JXBJUYZSJRVZFY-CYBMUJFWSA-N 273.336 2.291 10 20 CECD COCCN1CC[C@H](N[C@@H](C)c2cc(Cl)ccc2O)C1 273599705 RRKKIAYNCBUYTI-AAEUAGOBSA-N 298.814 2.417 10 20 CECD Cc1cc(O)c(CN2CCOC[C@@H]2[C@H]2CCCO2)cc1C 377702058 UAMHVTWTYRPWEO-NVXWUHKLSA-N 291.391 2.389 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H](C)[S@]1=O 286026163 QCEVGDMSWLNKQK-GQWAEJPESA-N 294.464 2.484 10 20 CECD CC[C@@](C)(OC)C(=O)N1CCOc2cc(N(C)C)ccc21 280249122 DIKZQSKMXSMRRY-MRXNPFEDSA-N 292.379 2.293 10 20 CECD CN(C)c1ccc(CNC(=O)OC[C@H]2CCCO2)cc1F 804975541 OWAHLELXRTYBNT-GFCCVEGCSA-N 296.342 2.297 10 20 CECD O=C(/C=C/c1cccnc1)N1C[C@H](CO)Cc2ccccc21 816785830 VECYIYYIGMQNAE-MVGZEHJDSA-N 294.354 2.293 10 20 CECD COc1cc(O)c(CN2CC[C@@H](OC)[C@H](C)C2)cc1OC 824815316 LRHBUMJNLOWLKT-BXUZGUMPSA-N 295.379 2.266 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@]1(C)CO 827699849 MYSLQCFPNLNUAT-YGRLFVJLSA-N 269.772 2.496 10 20 CECD CC(=O)N1CCCN(Cc2cc(Cl)c(C)cc2O)CC1 824542861 ZDFPGZLRTCTCPL-UHFFFAOYSA-N 296.798 2.408 10 20 CECD COC(=O)[C@H](NC(=O)c1cc(O)cs1)C1CCCCC1 829954008 JHJKSWUKHNAOOR-GFCCVEGCSA-N 297.376 2.305 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C(\C)Cl)c1 901134528 ZJTVPYDIDGAAPZ-VMPITWQZSA-N 255.701 2.160 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@H]1C(=O)O 828456689 NAWPPQNXQWABOC-QMTHXVAHSA-N 275.348 2.033 10 20 CECD C[C@@H]1CC[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 829680867 GSKLEENOMXHZJI-SFYZADRCSA-N 253.273 2.155 10 20 CECD Cc1nc(CCC(=O)NCc2ccccc2O)cs1 733360552 LNSKUGYURAGKPL-UHFFFAOYSA-N 276.361 2.406 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)CCN(C2CC2)C1 832953956 HVNVTYQKTPVBFG-SNVBAGLBSA-N 280.393 2.010 10 20 CECD CCN1C(=O)C(C)(C)N[C@H]1c1cc(Cl)ccc1O 840833589 RFZKRGWTWPJYTP-LLVKDONJSA-N 268.744 2.275 10 20 CECD COc1ccc(N2CCC(N[C@H](C)CCCN)CC2)cc1 841079617 KNRFUTCFDIUHNA-CQSZACIVSA-N 291.439 2.381 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)[C@H](C)CN1 843119949 QBYKJINNIZLXOJ-RKDXNWHRSA-N 272.751 2.367 10 20 CECD Fc1cccc(CNCc2ccc3c(c2)CCO3)n1 747937626 JTYUXACWPDUZIJ-UHFFFAOYSA-N 258.296 2.445 10 20 CECD C[C@@H]1N(C(=O)NCCc2ccc(N)cc2)CCOC1(C)C 841956591 CSRYMIHEYNFNDM-LBPRGKRZSA-N 291.395 2.020 10 20 CECD CCS(=O)(=O)CCCN[C@@H](C)c1cc(F)ccc1O 840889243 QIOAMDKICPHITK-JTQLQIEISA-N 289.372 2.007 10 20 CECD CC1(C)CNCC[C@H]1NCc1cc(F)ccc1O 841071793 BNVAHEAMWCZNME-CYBMUJFWSA-N 252.333 2.009 10 20 CECD C[C@@H](CO)NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 742383098 SRALPTCUAXQEMP-LBPRGKRZSA-N 293.367 2.056 10 20 CECD C[C@H]1SCCN(C(=O)NCCc2ccc(N)cc2)[C@@H]1C 841954419 METJDAKMIICELV-VXGBXAGGSA-N 293.436 2.347 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H](O)C(C)(C)C1 840941169 UOTZJNLLQVGKBN-OAHLLOKOSA-N 262.397 2.264 10 20 CECD CN(CCOCC1CCC1)c1ccc(OCC(=O)O)cc1 846280210 VDMSTTGFAYHZQE-UHFFFAOYSA-N 293.363 2.403 10 20 CECD CCc1cccc(CNCc2ccc(CC(N)=O)cc2)c1O 848912686 ITXQVFWJMDUFAH-UHFFFAOYSA-N 298.386 2.272 10 20 CECD CO[C@H]1C[C@H](N[C@H](C)c2cc(F)cc(F)c2O)C1 858584679 UZSSPJYKJNULRC-SZEHBUNVSA-N 257.280 2.498 10 20 CECD CN(C)c1ccc(CNC/C=C/CO)c(C(F)(F)F)c1 850357610 POPOCEIVFVZETH-ONEGZZNKSA-N 288.313 2.410 10 20 CECD CC[C@@H](C)N(C)CCNC(=O)N[C@H](C)c1ccccc1O 868217803 YFVDKWFDSFCJHJ-CHWSQXEVSA-N 293.411 2.483 10 20 CECD COc1ccc2c(c1)CCCN2Cn1nccc1[N+](=O)[O-] 766341767 PLCQBANUGKUWCW-UHFFFAOYSA-N 288.307 2.210 10 20 CECD COC(=O)CC[C@H]1CCCN(C(=O)c2cc(O)cs2)C1 874528010 HGJLFRXDSFMFIL-SNVBAGLBSA-N 297.376 2.259 10 20 CECD Cc1ccc(CN(C)CCN2CCOC(C)(C)C2)c(O)c1 877485487 WBNQDEPOWIVAPG-UHFFFAOYSA-N 292.423 2.243 10 20 CECD c1cc(N2CCCC2)ccc1CN1CC[C@@H]2NCC[C@H]2C1 1118180543 KEDWNINYEMMZGN-WMZOPIPTSA-N 285.435 2.471 10 20 CECD C[C@H](NC(=O)N=c1cc[nH]cc1)c1ccc(N(C)C)cc1 775434213 HPLBXZZXIHBSLE-LBPRGKRZSA-N 284.363 2.452 10 20 CECD CCc1nn(C)c(Cl)c1C(=O)N(C)c1ccc(N)cc1 877076495 RCSAQAITPQIXLL-UHFFFAOYSA-N 292.770 2.495 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CO[C@@H](C)C1 784109585 WCXDUEJZHYBSPZ-GXTWGEPZSA-N 276.380 2.102 10 20 CECD Cc1cccc(CN[C@@H]2Cc3ccccc3[C@H]2O)c1O 898392005 OKZRUKAKMLBNHU-NVXWUHKLSA-N 269.344 2.449 10 20 CECD Cc1ccc(CN(C)Cc2cccc(O)n2)c(O)c1 897391245 JYHAPCIRAXOIEU-UHFFFAOYSA-N 258.321 2.433 10 20 CECD COc1ccc(CNC[C@@H](OC)C(C)C)c(O)c1OC 893085927 JXTBZUBREWNIHS-CYBMUJFWSA-N 283.368 2.170 10 20 CECD C[C@H](Cn1cccn1)NCc1cc(F)cc(F)c1O 708494293 FAUWRIPOVIVWSF-SECBINFHSA-N 267.279 2.045 10 20 CECD Cc1cccc(CNCc2n[nH]cc2Br)c1O 718138892 FQQVVQMDVXCJGD-UHFFFAOYSA-N 296.168 2.476 10 20 CECD CCc1cccc(CNCCC[C@@H](C)CO)c1O 691496818 VYGKSFSYGIMZHY-GFCCVEGCSA-N 251.370 2.453 10 20 CECD COCC1CCN(Cc2c(O)cccc2OC)CC1 769328799 BYKGZTJJYPELEG-UHFFFAOYSA-N 265.353 2.259 10 20 CECD c1cc(N2CCCC2)ccc1CN[C@@H]1CCCNC1 1246173434 HBLPUJGYGHIDPX-OAHLLOKOSA-N 259.397 2.128 10 20 CECD C[C@@H](C[C@@H](C)O)NCc1cc(F)c(N(C)C)cc1F 1335157290 SMWMQCYANCOOCJ-VHSXEESVSA-N 272.339 2.280 10 20 CECD COc1cc(C)cc(CN2C[C@H]3CC[C@H]2[C@H](O)C3)c1O 1333847601 ROPUDTUMNKDWJO-FPMFFAJLSA-N 277.364 2.054 10 20 CECD Nc1ccc(CNC(=O)N2CCCC23CCC3)cc1 1335736759 IALLJLCNBJHPNT-UHFFFAOYSA-N 259.353 2.497 10 20 CECD C[C@H](CC(F)(F)F)NC(=O)NCc1ccc(N)cc1 1262603311 FASKOFGMFZQINN-MRVPVSSYSA-N 275.274 2.409 10 20 CECD CC(=O)N1CC[C@@H](N[C@H]2C[C@H](C)c3c(C)ccc(O)c32)C1 1334695576 ZGMMKCKTIMDMKL-YUTCNCBUSA-N 288.391 2.459 10 20 CECD C[C@H](Cc1ccncc1)NC(=O)NCc1ccc(N)cc1 1346374564 AMHMOKVQMMDIJF-GFCCVEGCSA-N 284.363 2.094 10 20 CECD CN1CCN(c2ccc(CNC/C=C/C3CC3)cc2)CC1 1261237852 HNWUGSFTOMDXEZ-NSCUHMNNSA-N 285.435 2.494 10 20 CECD Nc1ccc(NC(=O)NCCOC2CCCC2)cc1 111642620 KPVGWVXMAILSFV-UHFFFAOYSA-N 263.341 2.350 10 20 CECD CCn1nccc1CCSc1ncc(C(=O)O)s1 1605945711 VCJUGLHVVOTRIR-UHFFFAOYSA-N 283.378 2.393 10 20 CECD COc1ncccc1CNCc1cc(F)ccc1O 226584409 LZQVPDYFZMWGMR-UHFFFAOYSA-N 262.284 2.225 10 20 CECD CC(F)(F)C[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 1776443514 ZOWBGPNQMHENTI-LLVKDONJSA-N 285.290 2.210 10 20 CECD Cc1nnc(NCc2c(O)cccc2Cl)n1C 162041372 MSXZWBFUUTZZHY-UHFFFAOYSA-N 252.705 2.095 10 20 CECD COCc1nc(CNCc2c(O)cccc2OC)cs1 810171493 YQZBEMKRQXLFQB-UHFFFAOYSA-N 294.376 2.294 10 20 CECD Cc1cc(CNCc2ccc3c(c2)CCCO3)ncn1 921939091 UDFLEBMTGKZLNH-UHFFFAOYSA-N 269.348 2.400 10 20 CECD COc1cc(C(=O)N(C)Cc2ccccc2O)ccn1 1115862290 XJUVUYNRVPBMTR-UHFFFAOYSA-N 272.304 2.068 10 20 CECD CCOc1cccc(CNC[C@](C)(O)C2CC2)c1O 311593700 AZKICXUHXRFVFU-HNNXBMFYSA-N 265.353 2.042 10 20 CECD NC[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 50245110 TVSFZEYDOWAEDU-MRVPVSSYSA-N 275.179 2.480 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCC(C)C)c1 103504978 WLLFMVDTPPRMQE-JTQLQIEISA-N 266.341 2.417 10 20 CECD CC(C)CCOCCNC(=O)CSc1nccs1 64669862 OGESSLHWJOJEHB-UHFFFAOYSA-N 288.438 2.414 10 20 CECD N[C@@H]1CC[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 178710478 DDKPTMYUAYKWHA-LSDHHAIUSA-N 287.407 2.030 10 20 CECD C[C@@H](CC[S@](C)=O)NCc1c(O)cccc1Cl 125477211 NDDVLVIBHHKFPX-HUTHGQBESA-N 275.801 2.292 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)C[S@](C)=O)c1 186540076 PTZOGMSTAVEPIP-AGKHESDQSA-N 255.383 2.118 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cn3cccnc3n2)c1 182429460 QUYWBZTZGAMKJH-LLVKDONJSA-N 298.346 2.294 10 20 CECD CC[C@@H](NCCCOCCO)c1ccc(N(C)C)cc1 180241392 QLCBZUYXXSAMJQ-MRXNPFEDSA-N 280.412 2.192 10 20 CECD COc1cc(O)c(CN[C@H]2CCC[C@@H]2CCO)cc1OC 190303876 BACNIPWPZPGLST-YPMHNXCESA-N 295.379 2.050 10 20 CECD C[C@H](NCC1(O)CCCC1)c1cc(F)ccc1O 94618380 BTBSCEKYGGFRIS-JTQLQIEISA-N 253.317 2.487 10 20 CECD COC(=O)N1CCC(N[C@@H](C)c2ccc(F)cc2O)CC1 273432184 VYERSVYUQMZACY-JTQLQIEISA-N 296.342 2.413 10 20 CECD Cc1cccc(CN2CCO[C@H](COC(C)C)C2)c1O 372123853 DOENQNFELFUANE-HNNXBMFYSA-N 279.380 2.326 10 20 CECD Cc1ccc(O)c(CNCc2ncnn2C(C)(C)C)c1 282699181 ORBWNPMLCWEXDZ-UHFFFAOYSA-N 274.368 2.337 10 20 CECD Cc1cc(C)c([C@@H](C)NCCCc2cnn(C)n2)c(O)c1 293646150 HOCZWHVAJHKCEB-CYBMUJFWSA-N 288.395 2.421 10 20 CECD CCN(C)C(=O)CN[C@H](C)c1c(C)cc(C)cc1O 294271856 LVYXNCDASBPNJC-GFCCVEGCSA-N 264.369 2.138 10 20 CECD CCCN1C[C@H](CN[C@H](C)c2ccc(F)cc2O)CC1=O 817589838 QDWPVPMONBCJJX-NEPJUHHUSA-N 294.370 2.440 10 20 CECD CCCCN(CCOC)C(=O)c1cc(O)cs1 732290937 JEUVANKJAABOPQ-UHFFFAOYSA-N 257.355 2.342 10 20 CECD Cc1cc(CN2C[C@@H](O)C[C@@H](C)C2)ccc1N(C)C 832718169 RJLQWAYXUJFJBN-DOMZBBRYSA-N 262.397 2.264 10 20 CECD COC1(CNC(=O)NCc2ccccc2O)CCCC1 836498512 HROMHINGAZKPJT-UHFFFAOYSA-N 278.352 2.151 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1CC12CCCC2 910950153 DFIUSEGJBHFOPW-LBPRGKRZSA-N 261.321 2.294 10 20 CECD CCc1cccc(CN2CCC[C@]23CCOC3=O)c1O 848904181 MUUFLKLXZSHKAM-MRXNPFEDSA-N 275.348 2.236 10 20 CECD NCC[C@H](NCc1c(O)cccc1Cl)C(F)F 841074162 MQIPKVYYMUMPKN-VIFPVBQESA-N 264.703 2.118 10 20 CECD CN(C[C@H]1CC=CCC1)C(=O)C(=O)Nc1ccc(N)cc1 841087735 VKOIMRAVKWIIAH-LBPRGKRZSA-N 287.363 2.022 10 20 CECD CC1(C)CCC[C@H]1CNC(=O)C(=O)Nc1ccc(N)cc1 841135257 GWICITLDLFBZQP-NSHDSACASA-N 289.379 2.150 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2CN)c1O 843347181 BTBOGMVDMOMTMU-ZDUSSCGKSA-N 280.343 2.047 10 20 CECD CCCC[C@H](CN)NCc1cc(OC)ccc1O 841030822 ZVKPSUZCBLHHRQ-GFCCVEGCSA-N 252.358 2.008 10 20 CECD CCON(C(=O)c1c(F)ccc(O)c1O)C(C)C 844150147 JSORPIKXQHAFFR-UHFFFAOYSA-N 257.261 2.039 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CN)C2)cc1F 843047849 YSSPKFNWSIMSRA-ZDUSSCGKSA-N 265.376 2.062 10 20 CECD CN[C@H]1CCN(Cc2cc(C)cc(Br)c2O)C1 843045825 XISQREZZKSUCAM-NSHDSACASA-N 299.212 2.257 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCn2ccnc2C1 840938369 OEYSCSSRGMKKGF-HNNXBMFYSA-N 284.407 2.362 10 20 CECD N[C@@H](CNCc1cc(Cl)cc(F)c1O)C1CC1 841049637 MNGPNBYNOWFCNC-NSHDSACASA-N 258.724 2.012 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1CC12CCOCC2 846476650 NZOREUBPYDMZCY-LBPRGKRZSA-N 295.766 2.479 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](C)N[C@@H](C)C2)c1O 843351838 GSERZFBGXYXICM-UWVGGRQHSA-N 296.798 2.430 10 20 CECD CCOCCCNC(=N)NCc1cc(Cl)ccc1O 849049153 NZPDFEUCYCJCEE-UHFFFAOYSA-N 285.775 2.086 10 20 CECD Cc1cc(Br)c(O)c(CN[C@H]2CCCNC2)c1 841041625 BPBNJHVFCRFSOV-NSHDSACASA-N 299.212 2.305 10 20 CECD CC1CCC(CNC(=O)C(=O)Nc2ccc(N)cc2)CC1 841021963 NVPXVSHLQKPHAF-UHFFFAOYSA-N 289.379 2.150 10 20 CECD CO[C@H]1CCC[C@@H]1CNC(=O)NCc1cc(C)ccc1O 858346552 OQWCDIGUBAJKPX-DOMZBBRYSA-N 292.379 2.315 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@]1(C)CCOC1 754267640 AFYUFGYDNVZRFZ-MRXNPFEDSA-N 276.380 2.104 10 20 CECD C[C@@H](NC[C@@H](C1CC1)N(C)C)c1cc([N+](=O)[O-])ccc1O 756433065 MPFCBLQYSDOFAQ-YGRLFVJLSA-N 293.367 2.291 10 20 CECD CC(C)N(C)C[C@H](C)NC(=O)N[C@H](C)c1ccccc1O 868622424 IWMVKWVUDRHGKZ-QWHCGFSZSA-N 293.411 2.481 10 20 CECD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 762824615 RYAFKGZYNURNAM-SSDOTTSWSA-N 272.322 2.341 10 20 CECD CCOc1cccc(CN(C)CC2(C)COC2)c1O 862477601 NZGJCENQHTYJPC-UHFFFAOYSA-N 265.353 2.259 10 20 CECD CN(C)c1ccc(/C=C2\SC(=O)NC2=O)cc1F 874928944 YIQNKEBVQRVHBT-POHAHGRESA-N 266.297 2.216 10 20 CECD CC(C)CC[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 876873237 ZKLYLDWEJOCPPB-INIZCTEOSA-N 291.439 2.475 10 20 CECD Cc1ncc(C(=O)NCc2ccc(N(C)C)cc2C)c(C)n1 776928052 JKNDTWAIPSEQIJ-UHFFFAOYSA-N 298.390 2.398 10 20 CECD Cc1noc(C)c1NC(=O)/C=C/c1ccc(O)c(O)c1 779503461 PFEMDPHHGABGJA-GQCTYLIASA-N 274.276 2.355 10 20 CECD CN(C(=O)c1cccn1C1CCNCC1)c1ccc(N)cc1 877079159 SSLNLSDJSFLRFU-UHFFFAOYSA-N 298.390 2.271 10 20 CECD C[C@@H](NCc1cnc(N(C)C)nc1)c1ccccc1O 877756241 AGHBRNVVEIYTKJ-LLVKDONJSA-N 272.352 2.099 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(C)c(C)cc2O)[C@@H]1C 787237370 FURWTULQBKIRED-OCCSQVGLSA-N 277.364 2.392 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@]2(C)CO)c1O 789557074 FXNHPAQJWZUYOA-AWEZNQCLSA-N 285.771 2.401 10 20 CECD CO[C@H](C)[C@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898448423 RVOSLMKLBUMJJZ-JJRVBVJISA-N 293.455 2.368 10 20 CECD CN(C)c1ccc(CNC(=O)NC/C=C\Cl)cc1 891605731 FBIKBBIBMCRHBS-BAQGIRSFSA-N 267.760 2.304 10 20 CECD CCOc1ccc(N2CCN(C[C@H]3CCCO3)CC2)cc1 1207894407 KTPJTVVCECORKZ-QGZVFWFLSA-N 290.407 2.386 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)NCc1ccc(N(C)C)cc1 792849080 OKCIENKULABDEW-SWLSCSKDSA-N 278.396 2.430 10 20 CECD CC(C)(C)c1cc(O)c(O)c(CN2CCO[C@@H]3C[C@@H]32)c1 793620163 NPGXJTQUTJCLDV-GXTWGEPZSA-N 277.364 2.368 10 20 CECD C[C@H](O)[C@H](C)NCc1ccc(N2CCSCC2)cc1 1325840491 MUQXNLJXWOBCFD-STQMWFEESA-N 280.437 2.099 10 20 CECD CC[C@@H](F)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 1337025267 FMBYGYMCHYBDOM-OAHLLOKOSA-N 294.370 2.482 10 20 CECD Cc1ccc(O)c(CNC(=O)N=c2cc(C)[nH]c(C)c2)c1 1261814512 FDJZEDDAWWAFDR-UHFFFAOYSA-N 285.347 2.456 10 20 CECD O=C(O)CCC(=O)NCc1ccc(N2CCCCC2)cc1 1606098931 OXUVSQQRUHYPOK-UHFFFAOYSA-N 290.363 2.158 10 20 CECD O=C(O)c1ccnc(NC(=O)N2Cc3cccc(O)c3C2)c1 1595263346 NBRRACCVHRANNB-UHFFFAOYSA-N 299.286 2.033 10 20 CECD C[C@@H](N[C@H]1CC[C@H](CN)CC1)c1cc(C(=O)O)ccc1O 1593360068 OEMUESVSRYGJNS-NQBHXWOUSA-N 292.379 2.259 10 20 CECD COc1ccc(N(C)C[C@@H]2CCCNC2)c(OC)c1 258880858 BSGACDGOIBCDKW-GFCCVEGCSA-N 264.369 2.140 10 20 CECD C[C@]1(CNCc2cc3c(cc2O)OCO3)CCCS1 126479213 MLDOGUGCBDNUCU-CQSZACIVSA-N 281.377 2.496 10 20 CECD O=C(O)[C@H](NCc1cc(F)ccc1O)c1ccccc1 236456279 JBRAVLCXRCZFKY-CQSZACIVSA-N 275.279 2.447 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)c1 252870856 SPCVDHPUDCHZKK-AEGPPILISA-N 260.381 2.260 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@](C)(O)C(F)(F)F)c1 273450705 FYTNCGNWXBFCRK-UFBFGSQYSA-N 293.285 2.365 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CCc3cccc(O)c32)CCN1C 312064493 DXMDSHBESRGEOI-MRVWCRGKSA-N 260.381 2.452 10 20 CECD CCN(CC)c1ccc(CNC[C@H](C)S(C)(=O)=O)cc1 697589995 RFCAAFJMUOOOSU-ZDUSSCGKSA-N 298.452 2.056 10 20 CECD CN1CCCc2cc(CNc3ncnc4[nH]ncc34)ccc21 69716060 XQSIKMMDCSUJHU-UHFFFAOYSA-N 294.362 2.347 10 20 CECD CN(Cc1ccccc1O)c1nnnn1C(C1CC1)C1CC1 1262216917 PEWXLDRFEILQSK-UHFFFAOYSA-N 299.378 2.376 10 20 CECD CN(Cc1ccccc1O)c1nnnn1-c1ccccc1 302646665 MGSGLGKWSOPOKG-UHFFFAOYSA-N 281.319 2.004 10 20 CECD CC[C@H](C)N(C)CCNC(=O)N(C)Cc1ccccc1O 171077337 YTQORZORULDCFD-ZDUSSCGKSA-N 293.411 2.264 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ncc(F)cn1 184147774 PEODLZSLQVFFKT-QMMMGPOBSA-N 263.272 2.070 10 20 CECD CC(C)[C@@]1(C)C[C@H]1C(=O)NCCc1ccc(O)c(O)c1 186453551 AJHYPQUWVIUMNW-BLLLJJGKSA-N 277.364 2.439 10 20 CECD OCCc1cccc(NCc2cc3c(cc2O)OCO3)c1 313158915 JJVGRPBTNKVMME-UHFFFAOYSA-N 287.315 2.268 10 20 CECD COc1cccc(CNC(=O)c2cc(F)ccc2O)c1O 80023437 QXPWXPBYXCVGPR-UHFFFAOYSA-N 291.278 2.176 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1[C@@H](C2CC2)[C@H]1C 528997041 RTNRUEVFWSIGSM-DJUAPZDMSA-N 289.375 2.437 10 20 CECD Cc1c(CNC(=O)c2cnc[nH]2)n(C)c2ccccc12 352136299 XQSCSENQTKRBJF-UHFFFAOYSA-N 268.320 2.140 10 20 CECD CCOCCOCCN(C)Cc1ccc(N(C)C)c(F)c1 276213081 PNOHWZMWFFYJDH-UHFFFAOYSA-N 298.402 2.377 10 20 CECD COC1(C(=O)NCc2ccc(N3CCCC3)cc2)CCC1 272929871 CFSDKYKIKRYMII-UHFFFAOYSA-N 288.391 2.472 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(N3CCOCC3)CC2)c1 278491899 PQPYAHZMLYNQNR-AWEZNQCLSA-N 290.407 2.216 10 20 CECD COc1cccc(CN2CC[C@@H](N3CCCC3)[C@@H]2C)c1O 289727584 HPEIWSOYMUHCJM-DZGCQCFKSA-N 290.407 2.459 10 20 CECD COCc1ncc(C(=O)N(C)Cc2ccccc2O)s1 285586996 HODPESZZOOOKSW-UHFFFAOYSA-N 292.360 2.267 10 20 CECD Cc1cc(Cn2cccc([N+](=O)[O-])c2=O)ccc1N(C)C 292569759 DXHZMIFLFKCTHC-UHFFFAOYSA-N 287.319 2.179 10 20 CECD COC(=O)CC1CC(NCc2ccc(N(C)C)cc2)C1 818328122 NMAZRTCUZGQTIS-UHFFFAOYSA-N 276.380 2.184 10 20 CECD CCOc1ccc(CN[C@H](C)[C@H](C)OC)c(O)c1 810174263 QTNDJKHPNOCGJQ-MNOVXSKESA-N 253.342 2.304 10 20 CECD Oc1cc2c(cc1CN1CCSC[C@@H]1C1CC1)OCO2 824914321 PGVHMJIXSWERQX-GFCCVEGCSA-N 293.388 2.448 10 20 CECD O=C(CC1(O)CCC1)NCc1ccc(N2CCCC2)cc1 822495771 OTEMFHJMRAVYMQ-UHFFFAOYSA-N 288.391 2.208 10 20 CECD C[C@@H](NC(=O)C(C)(C)C)C(=O)N[C@H](C)c1ccccc1O 827923670 XAYGFMQBBLFZMQ-GHMZBOCLSA-N 292.379 2.120 10 20 CECD Cc1ccncc1/C=C/C(=O)N1CCOc2ncccc21 492463953 WVNGXOFNJBEHNK-SNAWJCMRSA-N 281.315 2.224 10 20 CECD CCN(CC)c1ccc(CNCC(F)(F)C(=O)O)cc1 904031246 OARWNXCTRCYRMR-UHFFFAOYSA-N 286.322 2.342 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c(O)c1C 834906746 GXXWTSCTZOWAOR-FRRDWIJNSA-N 276.380 2.314 10 20 CECD CC(C)[C@@H](CNCc1c(O)cccc1Cl)C(=O)O 848638708 CDFBGKDQRHQTPR-SECBINFHSA-N 271.744 2.492 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@H]([C@H]2CCNC2)C1 843125600 YMDTWIUXFBFCSA-STQMWFEESA-N 278.371 2.353 10 20 CECD C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc(N)cc1 841299986 PSDACFVRJOAKHV-DOMZBBRYSA-N 288.395 2.359 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2[C@@H](C)N)c1O 843346096 LSVAJBNEGJGCIP-BMIGLBTASA-N 294.370 2.436 10 20 CECD CCn1ccc(CC(=O)NCc2cc(Cl)ccc2O)n1 846475347 CRHTUTFSASHHNR-UHFFFAOYSA-N 293.754 2.121 10 20 CECD Cc1ccc([C@H](C)NCc2nnnn2C2CC2)c(O)c1C 756731964 KASXRIVFRXNJTM-NSHDSACASA-N 287.367 2.181 10 20 CECD COCC1(NCc2ccc(N(C)C)c(C)c2)CCOCC1 852089075 CDDPUUKLRIEIAG-UHFFFAOYSA-N 292.423 2.346 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1cc(F)cc(F)c1O 756782650 SUFZQAURHCSUGF-QMMMGPOBSA-N 286.322 2.093 10 20 CECD Cn1cncc1CCNCc1c(O)ccc(Cl)c1F 857783046 QOCLXRBUDUVFKE-UHFFFAOYSA-N 283.734 2.251 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2COC[C@H]2C)c1 699834561 ITQWYBAWCRTVTA-GBIKHYSHSA-N 251.326 2.086 10 20 CECD CC[C@@H](C)[C@@H](OC)C(=O)NCc1cc(C)ccc1O 862755426 GXIJHMYVVDACBW-BXUZGUMPSA-N 265.353 2.378 10 20 CECD CC(C)CN1CC(=O)N[C@@H]1c1cc(F)c(N(C)C)cc1F 864377761 YAAZYGCUBRXUFC-HNNXBMFYSA-N 297.349 2.117 10 20 CECD COc1ccc(O)c(CN[C@@H](CO)CCC(C)C)c1 862481117 SHARPPBRMVUJHZ-CYBMUJFWSA-N 267.369 2.288 10 20 CECD CCN(CC)c1ccc(CN(C)Cc2cnnn2C)cc1 768209015 WYIYROBATNCANW-UHFFFAOYSA-N 287.411 2.293 10 20 CECD CC(=O)N1CCC[C@@H](CNCc2ccc(C)cc2O)C1 877490633 BENSILCJIZGAHZ-AWEZNQCLSA-N 276.380 2.049 10 20 CECD CO[C@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2O)CCO1 878965987 BQZFMQXQBHVAEB-CYBMUJFWSA-N 299.754 2.053 10 20 CECD Cc1cc(NCc2ccc(N3CCN(C)CC3)cc2)ncn1 882880002 XMFMDHZVMFUJPC-UHFFFAOYSA-N 297.406 2.149 10 20 CECD C[C@H](C[S@](C)=O)N(C)Cc1cc(Cl)cc(F)c1O 776521223 MTEGTTYOVKBNKL-CVJBHZAOSA-N 293.791 2.384 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCCCC(F)F)c1O 1120065992 WWLJYCBXFOZINK-UHFFFAOYSA-N 290.266 2.444 10 20 CECD Oc1c(F)cc(F)cc1CN1CC(O)(c2ccccc2)C1 894789263 FJPAVSHWYOSCHI-UHFFFAOYSA-N 291.297 2.374 10 20 CECD CC(C)[C@H](F)C(=O)NCc1ccc(N(C)C)cc1 784030320 OHQFNFNZZSWTOD-ZDUSSCGKSA-N 252.333 2.363 10 20 CECD CCC(=O)N1C[C@@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1054307163 ICUCZZQKQGCKAY-HIFRSBDPSA-N 290.407 2.350 10 20 CECD C[C@@H](O)CCNCc1cccc(Br)c1O 78780341 CFYCCYLAKRCYEG-MRVPVSSYSA-N 274.158 2.015 10 20 CECD CCCNC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891464892 LFJJWEKFXNMVAL-HNNXBMFYSA-N 292.427 2.065 10 20 CECD COCCC1(C)CN(Cc2ccc(OC)c(OC)c2O)C1 894838913 FLCOCGXEADGJEK-UHFFFAOYSA-N 295.379 2.268 10 20 CECD COc1ccc(CN2CCOC(C)(C)C2)c(O)c1OC 891704935 BAHPCXYVAOAHGU-UHFFFAOYSA-N 281.352 2.020 10 20 CECD CCOc1cccc(CNC[C@H](OC)C(F)(F)F)c1O 733330021 OIBCEGHKNGPTPF-NSHDSACASA-N 293.285 2.458 10 20 CECD CO[C@H]1CCN(C(=O)c2cc(O)cs2)[C@@H](C)C1 799853003 FYDKLUIULYZRRI-WPRPVWTQSA-N 255.339 2.093 10 20 CECD O=C(Cc1ccccc1F)NCc1ccccc1O 82285409 OXHXMFNFBYQKEN-UHFFFAOYSA-N 259.280 2.390 10 20 CECD CCC[C@H](CCO)NCc1cc(F)cc(F)c1O 708394195 RQFVGLNKTQHTPU-LLVKDONJSA-N 259.296 2.311 10 20 CECD CCOc1ccc(CNC(=O)c2cccc(O)c2O)cc1 790528230 OIUFLKXUPGUQGI-UHFFFAOYSA-N 287.315 2.427 10 20 CECD Cc1cc(C(=O)CSc2ncc(C(=O)O)s2)on1 1600077100 LDVZNARXLMXCBD-UHFFFAOYSA-N 284.318 2.113 10 20 CECD C[C@@H](NCC[C@@H]1CCCNC1)c1cc(C(=O)O)ccc1O 1593264715 MDLFJYJRNDAKMW-NEPJUHHUSA-N 292.379 2.131 10 20 CECD CNC(=O)CC1CCN(Cc2cc(C)cc(C)c2O)CC1 164441417 SJGWPIIZCIHQER-UHFFFAOYSA-N 290.407 2.357 10 20 CECD O=C(NCc1ccccc1O)c1cc(F)c(F)c(O)c1F 168711761 NNMZIRIGSDVNOV-UHFFFAOYSA-N 297.232 2.445 10 20 CECD C[C@@H]1CCNCC[C@@H]1NCc1ccc(N(C)C)cc1 817896567 KQCUDEZQTWIPLR-CJNGLKHVSA-N 261.413 2.230 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CCN(C3CC3)C2)c1 44684598 KKJKXXVIDBPJAT-NEPJUHHUSA-N 276.380 2.288 10 20 CECD C[C@H](C(=O)NC1CCCC1)N(C)Cc1ccccc1O 109773410 BFYANOCTDQCURM-GFCCVEGCSA-N 276.380 2.271 10 20 CECD COC(CN[C@H](C)c1ccc(N(C)C)cc1)OC 37566776 PRLQEHSJPHKCIX-LLVKDONJSA-N 252.358 2.022 10 20 CECD CSC[C@@](C)(O)CNCc1c(O)cccc1Cl 120647042 HZWHMKUGGSDGCQ-LBPRGKRZSA-N 275.801 2.249 10 20 CECD N[C@H]1CCCN(Cc2cc(Br)ccc2O)C1 219508054 CVTKGOGMYCOSDH-NSHDSACASA-N 285.185 2.078 10 20 CECD C[C@H](N[C@H](C)c1nnnn1C1CC1)c1ccc(F)cc1O 189128271 XUNHJEJZPRNJGV-DTWKUNHWSA-N 291.330 2.265 10 20 CECD C[C@H](N[C@H](C)CO[C@H]1CCOC1)c1ccccc1O 183549446 BVFLYUICUUKWGM-AGIUHOORSA-N 265.353 2.237 10 20 CECD C[C@@H](CO)CN[C@H](C)c1ccc(Br)cc1O 134914758 NCZHVIVGDKDCCY-RKDXNWHRSA-N 288.185 2.434 10 20 CECD CCOc1ccc(O)c(CN2CC[C@](C)(C(=O)OC)C2)c1 93813972 JWGYHKALADFLAM-INIZCTEOSA-N 293.363 2.176 10 20 CECD CCOc1ccc(CNCC23CC(CO2)C3)c(O)c1 527790725 UITXDCGZTQZWDW-UHFFFAOYSA-N 263.337 2.060 10 20 CECD COC[C@@H](C)NC(=O)NCc1c(C)c2ccccc2n1C 349815224 ZWZWNCRJGQBIOX-LLVKDONJSA-N 289.379 2.321 10 20 CECD COc1ccc(CNC(=O)[C@H]2[C@@H](C3CC3)[C@H]2C)c(O)c1 529225742 AHMQRFKYDWBQNB-DFKRKDTASA-N 275.348 2.309 10 20 CECD COc1ccc(O)c([C@H](C)NCCOCC2CC2)c1 182370190 HTWJOHSUJOBWEQ-NSHDSACASA-N 265.353 2.478 10 20 CECD COc1ccc(N2CCC(NC[C@H](O)C(C)C)CC2)cc1 368644059 VFRHRAWBCRJZQU-KRWDZBQOSA-N 292.423 2.271 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@H]1CO 276748435 LIUHBYCGGRJQAB-NHYWBVRUSA-N 266.360 2.094 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCc1ncc[nH]1 279215035 OIVSCLXPLWIGQY-UHFFFAOYSA-N 287.363 2.487 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@@H]1CCCC[C@H]1O 280856584 WQRSUXZNSSCRCG-GXTWGEPZSA-N 277.364 2.292 10 20 CECD Oc1c(Cl)cccc1CN[C@@H]1CCc2c[nH]nc2C1 376856311 NWAYWALZNCRGGT-LLVKDONJSA-N 277.755 2.416 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H]2CNCCCO2)cc1 817983237 ZXXDMVRYXLITLC-PBHICJAKSA-N 291.439 2.172 10 20 CECD CCOc1ccc(O)c(CN(C)C2(CO)CCC2)c1 827903622 MADMYGNVXCMMTC-UHFFFAOYSA-N 265.353 2.138 10 20 CECD CC1(C)NCC[C@@H]1NCc1cc(Cl)cc(F)c1O 841085582 HNUAQTUOUOOWKH-NSHDSACASA-N 272.751 2.415 10 20 CECD COc1ccc(N(C)CCN(C)CC2(C)COC2)cc1 844402497 ZWFTZNVVMZQVCG-UHFFFAOYSA-N 278.396 2.100 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H]2C[C@H](O)C2(C)C)c1O 846961701 QZMOVVMPZVUMSD-OLZOCXBDSA-N 297.782 2.497 10 20 CECD Nc1ccc(NC(=O)N2CCN(c3ccncc3)CC2)cc1 841302171 NWBGIQHCCKKOEN-UHFFFAOYSA-N 297.362 2.018 10 20 CECD C[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)[C@@H]1C 841959296 WPMOAKBCLGYWQL-VXGBXAGGSA-N 261.369 2.251 10 20 CECD Cc1cc(O)c(CNCC[C@]2(O)CCCOC2)cc1C 846109383 HUUKGEMTSAJZGO-MRXNPFEDSA-N 279.380 2.030 10 20 CECD Cc1ncccc1CN(C)c1ccc(OCC(=O)O)cc1 846279835 NEMDSFFZWFBVEW-UHFFFAOYSA-N 286.331 2.490 10 20 CECD C[C@H](CC(C)(C)C)NC(=O)C(=O)Nc1ccc(N)cc1 841139473 GTWWYJJALVUNHS-SNVBAGLBSA-N 277.368 2.148 10 20 CECD CCC[C@H](O)CC(=O)NCc1ccc2c(c1)CCCN2C 750261957 JJAOGMDLLVCSRW-HNNXBMFYSA-N 290.407 2.236 10 20 CECD CSC(C)(C)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 852792256 UBHIEZZKOUMWRG-ZDUSSCGKSA-N 295.452 2.010 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCCOC1 764142666 KLANTIAXVOQPCM-QGZVFWFLSA-N 290.407 2.134 10 20 CECD C[C@H](NC(=O)NCc1ccccc1O)c1ccc[nH]1 760348639 NEONKUYXFGFCDY-JTQLQIEISA-N 259.309 2.281 10 20 CECD C[C@H]1[C@H](C)N(Cc2cc(F)ccc2O)CCN1C 775983645 CGMZNZVTZXQKLF-QWRGUYRKSA-N 252.333 2.056 10 20 CECD CC[C@@]1(O)CCCN(Cc2cc(F)ccc2O)C1 877691722 UMHBSZAHRJJEAG-CQSZACIVSA-N 253.317 2.268 10 20 CECD C[C@H]1C(=O)N(C)[C@H](C)[C@@H](C)N1Cc1cc(F)cc(F)c1O 895924114 ZKJXROAGRHGRMF-BBBLOLIVSA-N 298.333 2.110 10 20 CECD COc1cc(O)c(CN[C@H](C)[C@H]2CCCOC2)cc1OC 780780324 QAZALPJYVWRUPD-NEPJUHHUSA-N 295.379 2.314 10 20 CECD COC(=O)[C@H](CNCc1cc(OC)ccc1O)CC(C)C 894791151 PEBAPMUODATNGF-ZDUSSCGKSA-N 295.379 2.326 10 20 CECD COc1ccc(CN(CCCCO)C2CC2)c(O)c1OC 892036328 UDJMAUGOCDPDOJ-UHFFFAOYSA-N 295.379 2.146 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H]3C[C@]3(CO)C2)cc1F 783737430 ZXOFTJJIEFQSND-WMLDXEAASA-N 292.398 2.486 10 20 CECD CN(C)c1cc(F)c(CNCC[C@H](O)C2CC2)cc1F 898199053 JLSYCWCAORLGJM-HNNXBMFYSA-N 284.350 2.281 10 20 CECD COc1ccc(O)c(CNC(=O)NCCC2(C)CC2)c1 792085620 QHDFWLUXHYRHNN-UHFFFAOYSA-N 278.352 2.390 10 20 CECD CC[C@H](NCc1cc(F)cc(F)c1O)C(C)(C)O 708505018 WMSXTIBLGRNAQC-NSHDSACASA-N 259.296 2.310 10 20 CECD COc1ccc(CNC(=O)c2coc(C)c2)c(O)c1 794377955 NWYIMIPFNQYCNM-UHFFFAOYSA-N 261.277 2.232 10 20 CECD O=C(Nc1nc2ccccc2[nH]1)c1c(F)ccc(O)c1O 790065049 HHGIKAPZWYQCFY-UHFFFAOYSA-N 287.250 2.366 10 20 CECD CCCc1nc(C(=O)NCc2ccc(OC)cc2O)co1 794377716 UYZZCEHSNCIHAX-UHFFFAOYSA-N 290.319 2.271 10 20 CECD COc1ccc(CNC(=O)c2cnc(C)s2)c(O)c1 794380786 CRXZKIXMKLJCLJ-UHFFFAOYSA-N 278.333 2.096 10 20 CECD CC[C@H](N[C@H](CO)CC(F)F)c1ccccc1O 717749543 KJPQHSVBVUABLL-ONGXEEELSA-N 259.296 2.449 10 20 CECD CC(C)CC(=O)N1CCCN(Cc2ccc(N)cc2)CC1 1262487732 CPUUPBYGNLZZCK-UHFFFAOYSA-N 289.423 2.349 10 20 CECD N[C@@H]1CCC[C@H]2CN(Cc3cc(F)c(F)cc3O)C[C@@H]12 1580177495 PJDNSELZRHIIMC-DRCTWCGVSA-N 282.334 2.230 10 20 CECD CN(C)c1ccc(OC[C@@H]2CCCCO2)cc1C(=O)O 1598328012 BAJGIHKFTRWKBD-LBPRGKRZSA-N 279.336 2.399 10 20 CECD O=C(O)C[C@H]1CCCN(Cc2cc(F)c(F)cc2O)C1 1594993496 PTTARZXJXUKHFX-SECBINFHSA-N 285.290 2.357 10 20 CECD COc1ccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cc1 206789628 ASNPOZQAIYGUKX-UITAMQMPSA-N 299.326 2.436 10 20 CECD COc1cc(O)c(CN2C[C@H](C)OC[C@H]2C)cc1OC 159765133 FOLIPFRXDLMRGK-MNOVXSKESA-N 281.352 2.019 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H](O)[C@@H](C)C2)c1O 166462303 VTBQXRCTSKGYLT-XPTSAGLGSA-N 297.782 2.451 10 20 CECD NCc1ccc2c(c1)CCCN2C[C@@H]1CCCOC1 690528952 MISWGODGCWKKSZ-AWEZNQCLSA-N 260.381 2.325 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccon1 66096226 YKRRBLRBSGWPQT-UHFFFAOYSA-N 260.293 2.433 10 20 CECD COc1cc(Cl)cc(CNC[C@](C)(O)C2CC2)c1O 311881507 YKRUWQYSSZJRDA-AWEZNQCLSA-N 285.771 2.305 10 20 CECD CCN(CC)c1ccc(CN2CCn3cnnc3C2)cc1 121892348 PYZVDKQUVFEZDD-UHFFFAOYSA-N 285.395 2.140 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccncc2F)cc1F 78099049 VMMQCMJWBJSYKW-UHFFFAOYSA-N 291.301 2.356 10 20 CECD COc1cc(OC)cc(C(=O)NCc2ccccc2O)c1 133780572 CBZUCTAHIKZLMZ-UHFFFAOYSA-N 287.315 2.339 10 20 CECD CCn1nncc1CN[C@@H](C)c1cc(C)ccc1O 527913730 BEVWTZXZTDRJRG-NSHDSACASA-N 260.341 2.163 10 20 CECD Cc1cccc(CN(C)[C@H]2CCN(C)C[C@@H]2C)c1O 290414353 KFYQRUKATXVDGR-ZFWWWQNUSA-N 262.397 2.473 10 20 CECD CCn1ccnc(NCCCSc2nccs2)c1=O 91011439 MZSDTLCBZUFTCJ-UHFFFAOYSA-N 296.421 2.314 10 20 CECD Nc1ccc(CC(=O)N2CCO[C@@H](c3ccccc3)C2)cc1 262030289 YRZXCXYMABVUEA-QGZVFWFLSA-N 296.370 2.411 10 20 CECD CCOc1ccc(O)c(CN2CC([C@@H]3CCOC3)C2)c1 368443160 SFENKAXIXBOBJV-GFCCVEGCSA-N 277.364 2.259 10 20 CECD Cc1cccc(CN2CCN(c3nccnc3C)CC2)c1O 374216096 IDDNYJXQVGQMPF-UHFFFAOYSA-N 298.390 2.121 10 20 CECD C[C@H](NC[C@H](CO)[C@@H]1CCOC1)c1ccc(N(C)C)cc1 280912532 QMTOJYQPHBVYFE-NUEKZKHPSA-N 292.423 2.048 10 20 CECD Cc1nc([C@@H](C)N2CCOc3cc(N(C)C)ccc32)no1 280994574 MCVJCJAWTGLWMM-SNVBAGLBSA-N 288.351 2.404 10 20 CECD CC(C)[C@@H](CO)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 806169244 JPVRVGNYWHNNRB-GHMZBOCLSA-N 282.340 2.216 10 20 CECD CNC(=O)C1CN(Cc2cc(-c3ccccc3)ccc2O)C1 297525871 YQVHEWPBIDQQAU-UHFFFAOYSA-N 296.370 2.237 10 20 CECD COc1ccc(O)c(CNCc2ncnn2C(C)(C)C)c1 800536219 OSANOYCONXRUBM-UHFFFAOYSA-N 290.367 2.037 10 20 CECD COC[C@H](O)CN1C[C@@H](C(C)C)Cc2cc(OC)ccc21 817298689 OOYIKSVTHCBKHX-LSDHHAIUSA-N 293.407 2.337 10 20 CECD C[C@@H](NCC[C@H]1CCNC1)c1cc(F)ccc1O 817955519 XXENGAUMTSPKMV-GHMZBOCLSA-N 252.333 2.182 10 20 CECD C[C@H]1CCC[C@H]1N1C(=O)CN(Cc2ccccc2O)C1=O 819167732 HPBIINHCHVUGPH-WCQYABFASA-N 288.347 2.345 10 20 CECD Cc1cc(Br)cc([C@H](C)NC[C@@H](C)N)c1O 817972963 QOSBBBDICBZVED-BDAKNGLRSA-N 287.201 2.461 10 20 CECD C[C@@H](NC(=O)c1ccn(CC(F)F)n1)c1ccccc1O 827946266 BWFMCAKFWBRNFY-SECBINFHSA-N 295.289 2.345 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@]1(C)CO 827699281 GGMGMJJCNLNUQR-MLGOLLRUSA-N 280.387 2.342 10 20 CECD CCOc1cccc(CN[C@H](C)Cc2cnn(C)c2)c1O 825046956 ZTHLCRWRIXSZMF-GFCCVEGCSA-N 289.379 2.245 10 20 CECD O=C(c1cc(O)cs1)N1CCOc2ccccc2C1 732274640 JWMMWPHIWZPOLF-UHFFFAOYSA-N 275.329 2.489 10 20 CECD CN(C)c1ccc(CNC(=O)NOC2CCC2)cc1 834926508 OXUJOTZOUHSJIH-UHFFFAOYSA-N 263.341 2.036 10 20 CECD CCC1(CN[C@H](C)c2cc(C(=O)OC)ccc2O)COC1 834899662 LIHHCSIGMPIVTN-LLVKDONJSA-N 293.363 2.256 10 20 CECD O=C(CCN[C@H]1CCc2cccc(O)c21)Nc1ccccn1 834541262 SKZKOLNPMVMLJR-ZDUSSCGKSA-N 297.358 2.393 10 20 CECD CC1(C)CCC[C@]1(O)CNC(=O)c1cc(O)cs1 832870732 PBOQIYNIIGQBMV-ZDUSSCGKSA-N 269.366 2.125 10 20 CECD CCCN1CCC(NC(=O)c2cc(O)cs2)CC1 731866203 ZZPQVPJSWRDRFU-UHFFFAOYSA-N 268.382 2.058 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1CCOC2(CCC2)C1 910956651 MXKDFKYAUOYIKV-LLVKDONJSA-N 291.347 2.063 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@H]1CCCNC1 841033813 ZRIZFUAUNDFCJA-SECBINFHSA-N 272.751 2.274 10 20 CECD CCc1cccc(CN[C@H](C)c2nnnn2C2CC2)c1O 848906496 VHAODPYWWPVLGB-SNVBAGLBSA-N 287.367 2.127 10 20 CECD Oc1ccc(-c2csc(NC3CCNCC3)n2)cc1O 844268704 RKDALPCJWKMSGF-UHFFFAOYSA-N 291.376 2.385 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)[C@@H](C)CN1 843120076 UKUVOLBLIZZSTL-RYUDHWBXSA-N 265.376 2.074 10 20 CECD Cc1cc(CN(C[C@@H](C)O)C2CC2)ccc1N(C)C 847103876 GMVZUXPWIYOZPL-CYBMUJFWSA-N 262.397 2.406 10 20 CECD Cc1cc(N(C)C)ccc1CNC(C)(C)CCO 840934748 WTHNPUHJXHKOGV-UHFFFAOYSA-N 250.386 2.312 10 20 CECD N[C@]12CCC[C@@H]1CN(Cc1c(O)cccc1Cl)C2 857226781 ZDCRWAFHPONXSD-YGRLFVJLSA-N 266.772 2.359 10 20 CECD CC(=O)N1CC[C@@H](N[C@@H](C)c2cc(Cl)ccc2O)C1 857084576 WFGGQZXZGHUBGG-JOYOIKCWSA-N 282.771 2.317 10 20 CECD Cc1cc(CN2C[C@@H](C)[C@H](C(=O)O)C2)ccc1N(C)C 923248089 KRZCEOKTGBMOFQ-TZMCWYRMSA-N 276.380 2.214 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2C[C@H]3CC[C@@H]2O3)cc1F 858185158 SQHZVKKUXSUCLD-YVLXSGLVSA-N 282.334 2.440 10 20 CECD CC[C@H](CO)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756344287 SXLLIYFCAQYRFV-KKZNHRDASA-N 253.317 2.440 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CCCCO 868889740 LUPJWCOSEMVHAD-CQSZACIVSA-N 292.423 2.271 10 20 CECD CCO[C@H](CC(=O)NCc1cccc(OC)c1O)C(C)C 761542161 BUNIKZGWHQPRGM-CQSZACIVSA-N 295.379 2.468 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H](C)CC(N)=O)cc1 763399506 WZJPSMYGUYLZDE-NEPJUHHUSA-N 263.385 2.057 10 20 CECD O=C1N[C@@H](c2cccc(F)c2O)N2Cc3ccccc3C[C@@H]12 877866341 RWJHPBVWJBRFQB-GOEBONIOSA-N 298.317 2.087 10 20 CECD CN(C(=O)c1cc(C2CC2)no1)c1ccc(N)cc1 877076002 KYCZXQJZZCSTMI-UHFFFAOYSA-N 257.293 2.411 10 20 CECD C[C@H]1N(C(=O)/C=C/c2ccc(O)c(O)c2)CCOC1(C)C 779535930 YTGJPGPYXZZKMN-OKPNEXGHSA-N 291.347 2.137 10 20 CECD CCN(C)c1ccc(CN(CCO)C2CCC2)cc1 773889543 XKZKMNMMKLESGO-UHFFFAOYSA-N 262.397 2.490 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](OCCOC)C2)cc1 773887851 ITRHZDJXJFZOQF-QGZVFWFLSA-N 292.423 2.380 10 20 CECD CCN(C)c1ccc([C@H](C)NCCN2CCC2)cc1 773091850 KTINIVXVKNYGCK-AWEZNQCLSA-N 261.413 2.499 10 20 CECD CCOc1ccc(CN2CC[C@](O)(CC)C2)c(O)c1 779217826 CMLJSGYLSMJSOR-OAHLLOKOSA-N 265.353 2.138 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)[C@H]1CCCOC1 780044243 MMBVBTABTYUCFO-YPMHNXCESA-N 278.352 2.007 10 20 CECD CC[C@H](NCc1nnnn1CC1CC1)c1ccccc1O 784266647 XIUZIJAYOJSMMZ-ZDUSSCGKSA-N 287.367 2.030 10 20 CECD Cc1nc([C@H]2CCN(Cc3cc(Cl)ccc3O)C2)n[nH]1 895007514 JTALZXLTVCZJIB-JTQLQIEISA-N 292.770 2.462 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@H]([C@H]2CCCO2)C1 894089067 PRJFQPODGNGMCL-KGLIPLIRSA-N 299.317 2.050 10 20 CECD OCCN(Cc1ccccc1O)[C@@H]1C[C@H]2CC[C@H]1C2 793329533 UYGUKZPBZMHAJZ-KCQAQPDRSA-N 261.365 2.375 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC(C(C)C)C2)c1O 793188840 JKUMBWZPXLJMRR-UHFFFAOYSA-N 280.324 2.397 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1CCC[C@@H](O)C1 795491573 SQVZEXDICREPHH-MVTQWGDUSA-N 292.331 2.205 10 20 CECD COc1cc(Cl)cc(CN(C)CC(C)(C)N)c1O 692075593 YLXGRPSBIXSDQD-UHFFFAOYSA-N 272.776 2.223 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCC[C@@H]2C(=O)OC)c1 1320838256 XOOBIILUXIDZOH-KBPBESRZSA-N 293.363 2.222 10 20 CECD CN(C[C@H]1CC1(C)C)C(=O)NCc1ccc(N)cc1 1337018227 IGYPEHRWFXKDME-GFCCVEGCSA-N 261.369 2.456 10 20 CECD CCCn1cc(C(=O)NCc2ccc(N)cc2)c(C)n1 1346219821 KWEPDXGMQFLPNA-UHFFFAOYSA-N 272.352 2.114 10 20 CECD C[C@H](N[C@H](CO)CC(F)(F)F)c1c(O)cccc1F 1262077946 URJCVEUQRWOHPA-YUMQZZPRSA-N 281.249 2.495 10 20 CECD O=C(O)[C@H]1CC12CCN(Cc1cc(F)cc(F)c1O)CC2 1608608764 QRDDFWSESNPDQP-LLVKDONJSA-N 297.301 2.357 10 20 CECD CC1(C)CC(NCc2cc(F)cc(F)c2O)(C(=O)O)C1 1776538258 PVHYCMBDCIZHQG-UHFFFAOYSA-N 285.290 2.403 10 20 CECD OC[C@@H](CC1CC1)NCc1ccc2c(c1)CCCO2 921935825 VEYJFDAESKJPCG-OAHLLOKOSA-N 261.365 2.262 10 20 CECD C[C@@H]1OCC[C@@H]1CN1CCCc2cc(CN)ccc21 866659936 YGJPNOWMWWNNAY-SWLSCSKDSA-N 260.381 2.323 10 20 CECD CCOc1cccc(CNC[C@@](C)(O)C(F)(F)F)c1O 270547466 LFTWNYQDCWDPLK-GFCCVEGCSA-N 293.285 2.194 10 20 CECD O=C(c1cccc(O)c1O)N1CCC=C(Cl)C1 404534460 GAMYIKNRSMSAJI-UHFFFAOYSA-N 253.685 2.066 10 20 CECD C[C@@H](NC[C@@H](O)C1CCC1)c1ccc(F)cc1O 316068328 ZJCHXHWVTRURBC-YMTOWFKASA-N 253.317 2.343 10 20 CECD C[C@@H]1CCCCN1CC(=O)NCc1ccc(N(C)C)cc1 7354333 SHEFDQSGJSGPIE-CQSZACIVSA-N 289.423 2.243 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 179861880 NADLGRPHGXECJV-MRVPVSSYSA-N 286.715 2.175 10 20 CECD CCCN1CCN(Cc2cc(F)ccc2O)CC1 183291450 SMDGVQVZXDMXLN-UHFFFAOYSA-N 252.333 2.059 10 20 CECD CCCCN1CCC(NC(=O)Cc2ccc(N)cc2)CC1 37005013 XPDGWWUODCPUEX-UHFFFAOYSA-N 289.423 2.192 10 20 CECD CCC(=O)[C@@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 185817237 YFHKYSYGRJLCIV-LBPRGKRZSA-N 291.347 2.380 10 20 CECD C[C@H](N[C@H]1CCc2[nH]ncc2C1)c1cc(F)ccc1O 186115736 SMNYHSQUKUCIBW-CABZTGNLSA-N 275.327 2.463 10 20 CECD Cc1nc(C(=O)N2CCOc3cc(N(C)C)ccc32)co1 185763079 VWUBCKAIVDXCJZ-UHFFFAOYSA-N 287.319 2.088 10 20 CECD C[C@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc(N)cc1 195308647 HWOMRRDLJNBZMO-BMIGLBTASA-N 284.315 2.436 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Nc2ccncn2)c1 194046524 LLOOZUFTLIZUGL-VIFPVBQESA-N 288.307 2.074 10 20 CECD C[C@@H](CC(N)=O)NCc1cc(Cl)cc(Cl)c1O 161576456 FXEBQMLNVXGIGD-LURJTMIESA-N 277.151 2.053 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)c1O 246211737 ODASUCFVOJKQFC-GMXVVIOVSA-N 275.348 2.453 10 20 CECD O=C(Nc1ccc(N2CCCC2)cn1)c1cccc(O)c1O 275175737 XESGXSSLKKKIAX-UHFFFAOYSA-N 299.330 2.345 10 20 CECD COc1cccc(CN2CCC[C@@H]2c2ncc[nH]2)c1O 375353550 CAMRKAQKADTYFG-GFCCVEGCSA-N 273.336 2.461 10 20 CECD CN(C)c1cccnc1CNCc1ccc2c(c1)CCO2 289950571 XLVBNIFFUGCTDN-UHFFFAOYSA-N 283.375 2.372 10 20 CECD CC(C)CNC(=O)NCc1ccc(N(C)C)c(F)c1 299347239 XBDSJHBDBJPGGI-UHFFFAOYSA-N 267.348 2.347 10 20 CECD CC[C@@H](C)[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)OC 296170966 SJWDRQXXCCZODV-VWEULIBQSA-N 293.363 2.288 10 20 CECD Cc1cc(C)nc(C(=O)NCCc2ccc(O)c(O)c2)c1 801173313 NYORATGITZTURO-UHFFFAOYSA-N 286.331 2.082 10 20 CECD C[C@H](CC(C)(C)O)NC(=O)NCc1ccc(N(C)C)cc1 296462014 WFTUGAJDYXUTCD-GFCCVEGCSA-N 293.411 2.101 10 20 CECD Cc1cc(CNC(=O)NCc2ccc(N(C)C)cc2)on1 299417713 VECQINKMQKQFKH-UHFFFAOYSA-N 288.351 2.048 10 20 CECD CCOCC[C@H](O)CNc1ccccc1OCCF 819489367 UEAJWFALYIZQTP-LBPRGKRZSA-N 271.332 2.234 10 20 CECD CC(C)OCC[C@H](O)CNCc1ccc(N(C)C)cc1 818941250 GOYSTOQNVWOBSE-INIZCTEOSA-N 280.412 2.018 10 20 CECD COc1ccc(O)c(CNC(=O)CC2CC(F)(F)C2)c1 825840977 YJMHDMOVCCIFPH-UHFFFAOYSA-N 285.290 2.452 10 20 CECD F[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 824570300 BODMPCALWWJKIV-AWEZNQCLSA-N 264.344 2.067 10 20 CECD CC[C@H](NCCCON)c1cccc(Cl)c1O 902414824 DBGZKAJGBRFTOO-NSHDSACASA-N 258.749 2.367 10 20 CECD C[C@@H](C1CC1)N(C)C(=O)/C=C\c1ccc(O)c(O)c1 588404389 PXLPSMJAEDRJMJ-PENHIPQLSA-N 261.321 2.368 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc2c1OCO2 917376549 JQDAVSZTKRVAEZ-UHFFFAOYSA-N 285.299 2.393 10 20 CECD Cc1cc(CCN2C(=O)CNC2=O)c(C)n1-c1ccccc1 917140798 QOHKAYJHBUHZMU-UHFFFAOYSA-N 297.358 2.188 10 20 CECD CCOCc1cc(CNC[C@@H]2CCCN2)ccc1OC 841035131 HTLJFEYZCAXGES-HNNXBMFYSA-N 278.396 2.073 10 20 CECD COc1ccc(CNC(=N)N2CCC(C)CC2)c(O)c1 849025318 YYOLWNWECNGXJJ-UHFFFAOYSA-N 277.368 2.157 10 20 CECD Nc1ccc(CCNC(=O)N2C[C@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)cc1 841956125 WAGMBTWAPKMBMN-NXNVCVFFSA-N 299.418 2.499 10 20 CECD C[C@@H](COCC1CC1)NC(=O)NCc1ccccc1O 844940790 ZQWQAQGQBKXXHV-NSHDSACASA-N 278.352 2.007 10 20 CECD CCOc1ccc(CNCCC[C@H]2CCCN2)c(O)c1 841073790 YNDSEMREAACRRW-AWEZNQCLSA-N 278.396 2.413 10 20 CECD C[C@H](N[C@@H]1C=C[C@H](CO)C1)c1cc(F)cc(F)c1O 756662187 XSORIFYIGLAILM-ATZCPNFKSA-N 269.291 2.258 10 20 CECD CC[C@@H](NCc1cc(F)c(N(C)C)cc1F)[C@@H](C)O 858172405 SYYYNJAFVHJIQW-NOZJJQNGSA-N 272.339 2.280 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@H]([S@](C)=O)C2)c1O 850356638 QUZYUIWBZBYZDK-UVARLRKDSA-N 297.420 2.180 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@](C)(OC)C1CC1 935946072 WGYQFKVXXKASGD-MRXNPFEDSA-N 298.379 2.309 10 20 CECD CCOc1cccc(CN2CCC(CCO)CC2)c1O 768238253 XYLSUVHIAJUSCW-UHFFFAOYSA-N 279.380 2.385 10 20 CECD O=C(c1cc(O)cs1)N1CCC(c2ncco2)CC1 862108199 YRLVVWXSJGWZSQ-UHFFFAOYSA-N 278.333 2.462 10 20 CECD Cc1ccc(O)c(CNC(=O)CCOCC(F)(F)F)c1 862759627 ISKNQXVZICJHBM-UHFFFAOYSA-N 291.269 2.286 10 20 CECD Nc1ccc(OCc2cn(CCOC3CCC3)nn2)cc1 864638949 PVWLUYPVJZKAPA-UHFFFAOYSA-N 288.351 2.008 10 20 CECD CC(=O)NC[C@@H]1CCCCN1Cc1ccc(C)cc1O 877673382 FMFAHFUYPGCSLG-HNNXBMFYSA-N 276.380 2.191 10 20 CECD CC1(O)CN(Cc2cc(Cl)cc(Cl)c2O)C1 877580994 KRWZILYDSOMISB-UHFFFAOYSA-N 262.136 2.266 10 20 CECD Cc1cccc(O)c1CN(C)C[C@@H](O)C(F)(F)F 877528298 WWDGHWCBDPWJAQ-LLVKDONJSA-N 263.259 2.056 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1C[C@@H]1F 1123496614 YVZNTEYSSYCOAL-KGLIPLIRSA-N 262.328 2.261 10 20 CECD CN1CCCc2cc(CNC(=O)CCC(C)(C)O)ccc21 787269816 YXUKKWKEZVADRS-UHFFFAOYSA-N 290.407 2.236 10 20 CECD Cc1ccc(CCNC(=O)c2ccc(C)c(O)c2O)o1 780885792 IKOOEBXBIOXOIX-UHFFFAOYSA-N 275.304 2.280 10 20 CECD CCN(C)c1ccc(Cn2cc(CC[C@@H](C)O)nn2)cc1 881313424 LURMDEUYCLDLEM-CYBMUJFWSA-N 288.395 2.096 10 20 CECD CO[C@@H]1CCN(C(=O)c2cc(O)cs2)[C@H](C)C1 799853000 FYDKLUIULYZRRI-PSASIEDQSA-N 255.339 2.093 10 20 CECD CC[C@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@H]1O 792173175 TXCRVBIOMXSEJI-QPUJVOFHSA-N 273.735 2.387 10 20 CECD COc1cccc(O)c1CN(C)CC1CCOCC1 769384584 RGPMCDNLPYVWOG-UHFFFAOYSA-N 265.353 2.259 10 20 CECD Cc1cc(NCc2ccc(N(C)C)cc2C)nc(CO)n1 1326394326 NVVJNVMSWAHFSA-UHFFFAOYSA-N 286.379 2.264 10 20 CECD COC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccc(N)cc1 1335285216 LLBPQCBHMHNVTH-KRWDZBQOSA-N 296.370 2.369 10 20 CECD CCOC(=O)C[C@@H]1CCCN1Cc1ccc(N)cc1 1262486792 APPRBDZIGHUZQD-AWEZNQCLSA-N 262.353 2.186 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@@H]1F 1262801102 JDRXCWAYPNFPFD-GLQYFDAESA-N 278.371 2.466 10 20 CECD COc1ccc(CCNCc2ccc(N)cc2)cn1 1356083560 SMJHJANKNSVWAL-UHFFFAOYSA-N 257.337 2.005 10 20 CECD COC1(CN[C@@H](C)c2cc(C(=O)O)ccc2O)CCC1 1606717556 OPDNJMFLDMEVOV-JTQLQIEISA-N 279.336 2.310 10 20 CECD CN(CCNCc1cc(F)ccc1O)C1CCCC1 226606637 AVBZQYLGMMEGRT-UHFFFAOYSA-N 266.360 2.495 10 20 CECD O=C(O)c1csc(NC(=O)c2cccc(O)c2O)c1 1610868599 WCILGTHGWLBOSQ-UHFFFAOYSA-N 279.273 2.110 10 20 CECD O=C1CC[C@H]2CN(C(=O)C3=CCCNCC3)c3cccc1c32 1580844223 WNRIPPMJYZDYES-ZDUSSCGKSA-N 296.370 2.403 10 20 CECD C[C@@H](CC(=O)O)NCc1c(O)ccc(Cl)c1F 1776401679 MAUNNFPKYAOMLD-LURJTMIESA-N 261.680 2.138 10 20 CECD C[C@@H](CNCc1ccc2c(c1)CCCO2)[C@@H](F)C(=O)O 1776425624 BHFHTSXJVJKLKN-IINYFYTJSA-N 281.327 2.160 10 20 CECD Cn1cnc(NCc2ccc(N3CCCCC3)cc2)n1 814255409 MUEHOWRPEHPWHX-UHFFFAOYSA-N 271.368 2.418 10 20 CECD COc1ccc(CNCCCNC(=O)C(C)C)cc1C 1154739965 URISVRGPJUFAJZ-UHFFFAOYSA-N 278.396 2.256 10 20 CECD CCN1CCC(CNCc2ccc3c(c2)CCO3)CC1 44517862 YMXXRULNSDSEER-UHFFFAOYSA-N 274.408 2.443 10 20 CECD CNC(=O)[C@H](C)N[C@H](C)c1ccc2ccccc2c1O 49095648 XASOSKGQVRXRFS-MNOVXSKESA-N 272.348 2.331 10 20 CECD O=C(O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1ccccc1O)C2 394662431 OKPJXYMETWSFSX-RAIGVLPGSA-N 261.321 2.077 10 20 CECD Oc1cc2c(cc1CN(C[C@@H]1CCOC1)C1CC1)OCO2 54495152 LQRDBPTZQQVDSD-NSHDSACASA-N 291.347 2.122 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Cc2cc(C)on2)c1 172328034 HRJTYQWGFALRTE-JTQLQIEISA-N 290.319 2.117 10 20 CECD C[C@H](C(=O)O)C1(NCc2ccc(N(C)C)cc2)CC1 1261503526 CVZDZJMTBGDFBE-LLVKDONJSA-N 262.353 2.096 10 20 CECD CCOc1cccc(CNC[C@@H]2CCN(C3CC3)C2)c1O 37649323 OCMRKSZEMBIPKD-ZDUSSCGKSA-N 290.407 2.365 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)c2nnnn2C2CC2)c1 189132790 DJNDFIKQGKLQBA-GHMZBOCLSA-N 287.367 2.434 10 20 CECD CC(C)COC(=O)CN(C)c1ccc2c(c1)OCO2 181495316 DOMSQUULUMDPOB-UHFFFAOYSA-N 265.309 2.051 10 20 CECD Cc1cc(NCc2ccc(N(C)C)cc2)n2ncnc2n1 78992152 HRPPDMRKZFFQPU-UHFFFAOYSA-N 282.351 2.111 10 20 CECD COc1cc(N(C)Cc2cc[nH]n2)cc(OC)c1OC 180754948 XVAGIIPFDCCPKZ-UHFFFAOYSA-N 277.324 2.072 10 20 CECD C[C@H](N[C@H](C)c1cc(Cl)ccc1O)C(=O)N(C)C 188998852 DGOVIDMLXGAOSZ-BDAKNGLRSA-N 270.760 2.173 10 20 CECD COc1cccc(CNC(=O)NCC2(SC)CC2)c1O 195169757 IMALFHSTYZEPNJ-UHFFFAOYSA-N 296.392 2.096 10 20 CECD Cc1ccc(C(=O)N2CCSCC[C@@H]2C)c(O)c1O 190083439 HVNAHCLYIADBML-JTQLQIEISA-N 281.377 2.374 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)CCCO)c1 94941815 ANWWKFZPSRKPCU-GHMZBOCLSA-N 253.342 2.212 10 20 CECD Cc1cc(O)c(C(=O)N(C)Cc2ccc(N(C)C)cc2)cn1 266766903 OXKAKSWOSDNHED-UHFFFAOYSA-N 299.374 2.434 10 20 CECD COCCc1nc(CN(C)c2ccc(OC)c(F)c2)no1 289311934 FBQCWWKHHZRQIU-UHFFFAOYSA-N 295.314 2.043 10 20 CECD Cc1cc(CN(C)CC[C@H](C)O)ccc1N(C)C 292718277 FPWJKXDGLMEVBZ-ZDUSSCGKSA-N 250.386 2.264 10 20 CECD O=C(/C=C\c1ccc(O)cc1)NCc1ccccc1O 706233251 MHXYSXSKZZLTMI-YFHOEESVSA-N 269.300 2.427 10 20 CECD CO[C@H]1COC[C@@H]1N[C@H](C)c1cc(Cl)ccc1O 290111809 IRLIDWRZDORRDB-WLTAIBSBSA-N 271.744 2.110 10 20 CECD CCc1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)n[nH]1 728977613 BFSRFKZREONWNJ-SECBINFHSA-N 289.335 2.177 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCCOCC2)c(O)c1 903228145 POIXPSDOWSUIER-CQSZACIVSA-N 278.396 2.074 10 20 CECD Cc1ccc([C@H](C)NCCN2CCCOCC2)c(O)c1C 903228604 SRYXTYKWEJEGAM-HNNXBMFYSA-N 292.423 2.382 10 20 CECD CNC(=O)C(C)(C)CNCc1cc(Cl)c(C)cc1O 825375687 PMUFXXCWRKWZPD-UHFFFAOYSA-N 284.787 2.216 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H](C)CC(=O)NC)cc1 834898762 GNFAGTNTIRQGMT-QWHCGFSZSA-N 277.412 2.318 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H](C(=O)O)C2)cc1C 738464034 XRBAXAITTVTPRO-GFCCVEGCSA-N 263.337 2.306 10 20 CECD CCN(C)c1ccc(CN[C@@H](CO)[C@H]2CCCOC2)cc1 839651777 RDNNLYYSBAYTLI-RDJZCZTQSA-N 292.423 2.020 10 20 CECD CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(O)cs2)C1 830576305 FNFRTROAAUSVRR-CMPLNLGQSA-N 280.393 2.010 10 20 CECD CCOC1CN(Cc2c(O)ccc(Cl)c2F)C1 839131503 UNGDTIQUSVIBFP-UHFFFAOYSA-N 259.708 2.405 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]3COC[C@@H]32)c1O 839194690 UFRKLISJUARWTF-ABAIWWIYSA-N 293.338 2.345 10 20 CECD CO[C@H](CC(=O)N(C)Cc1ccccc1O)C(F)(F)F 845792356 UTTBMEJKQQWIOA-LLVKDONJSA-N 291.269 2.318 10 20 CECD CCC(C)(C)N1CCN(C(=O)c2cccc(O)c2O)CC1 848301803 LGZWEEPYCHOGLN-UHFFFAOYSA-N 292.379 2.044 10 20 CECD Nc1ccc(CCNC(=O)N[C@H]2CC=CCC2)cc1 841827616 AFFNHOSLFXVTHY-AWEZNQCLSA-N 259.353 2.219 10 20 CECD C[C@@H]1C[C@@H](CN)CN1Cc1c(O)ccc(Cl)c1F 843058857 ZPQHOUWNHZZWPV-BDAKNGLRSA-N 272.751 2.354 10 20 CECD CC[C@@H](NC(=O)C(=O)Nc1ccc(N)cc1)C1CCCC1 841138732 GTEKIJKEWRDYQF-CQSZACIVSA-N 289.379 2.292 10 20 CECD COC1([C@@H](C)NC(=O)NCc2ccccc2O)CCC1 840277743 WAVFGCPPIARKMG-LLVKDONJSA-N 278.352 2.149 10 20 CECD COc1ccc2c(c1)CCCN2CCc1cnn(C)c1 740873548 JZVWYPKYHNMCJR-UHFFFAOYSA-N 271.364 2.424 10 20 CECD C[C@H](OCC1CC1)C(=O)NCc1cc(Cl)ccc1O 846473083 OGLOKSPTBHIQNE-VIFPVBQESA-N 283.755 2.477 10 20 CECD CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C1CCNCC1 843044214 AJMXXDCBZVHVNB-UHFFFAOYSA-N 299.758 2.138 10 20 CECD CCN(CC)C(=N)NCc1cc(Cl)ccc1O 849050337 ZVNJLVVULJTVIK-UHFFFAOYSA-N 255.749 2.412 10 20 CECD CCOCc1cc(CN[C@H]2CC[C@@H](CN)C2)ccc1OC 841085185 WGHOAKCZUOCOKA-CJNGLKHVSA-N 292.423 2.449 10 20 CECD COC(=O)N(C)CCN[C@H](C)c1ccc(Cl)cc1O 850547298 SCZXARNURROYQT-SECBINFHSA-N 286.759 2.394 10 20 CECD C[C@@H](NCc1nncs1)c1ccc(N(C)C)cc1 1332897650 NMXNHKAVBCOOTE-SNVBAGLBSA-N 262.382 2.455 10 20 CECD C[C@@H]1C[C@H]1[C@@H]1C[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 928038876 MGLBDBKDUDEMTR-JHJYTTNVSA-N 273.332 2.272 10 20 CECD CCOc1ccc(COC(=O)c2cccc(O)c2O)nc1 758572295 JIYSKFTYUKBSQN-UHFFFAOYSA-N 289.287 2.249 10 20 CECD Cc1nnsc1CNC(=O)N[C@H](C)c1ccccc1O 868644090 ZILUUMUQNPNBGH-MRVPVSSYSA-N 292.364 2.113 10 20 CECD O=C(NCc1ccccc1O)c1cc(O)nc(C2CC2)c1 771417840 NQKHSZXCZLYKFI-UHFFFAOYSA-N 284.315 2.300 10 20 CECD Cc1ccc(CN2CCC[C@@H](OC(=O)N(C)C)C2)c(O)c1 877560463 RGVBLJACNSKOEV-CQSZACIVSA-N 292.379 2.363 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](O)[C@H](C)C2)cc1 773846871 LHIPTTUFKYKLHX-CJNGLKHVSA-N 262.397 2.345 10 20 CECD CCc1noc(CN[C@H](C)c2cc(OC)ccc2O)n1 775369325 OCJREDWTVZIKTF-SECBINFHSA-N 277.324 2.197 10 20 CECD Cc1cc(O)c(CNCCc2cnccn2)cc1C 774833258 QWLIKBRJXSTVSN-UHFFFAOYSA-N 257.337 2.131 10 20 CECD CCNC(=O)C(C)(C)CN[C@H](C)c1c(O)cccc1F 886578348 SQQPIQWPEGEBCP-SNVBAGLBSA-N 282.359 2.344 10 20 CECD C[C@H](NC(=O)N1CCCOCC1)c1ccc(N(C)C)cc1 776249705 RDCMJKWJZPXVLW-ZDUSSCGKSA-N 291.395 2.246 10 20 CECD CCN(C)c1ccc(CN(C)C[C@@H](O)C(F)(F)F)cc1 773824873 WJEOTDRQAVVKQC-CYBMUJFWSA-N 290.329 2.498 10 20 CECD CN(C)c1ccc(CN2CCc3ncncc3C2)cc1 880599176 HTRROOFJQBZUGO-UHFFFAOYSA-N 268.364 2.101 10 20 CECD C[C@H](NCCN1CC=CCC1)c1c(O)cccc1F 886605800 YTMXDKHFGDCRFR-LBPRGKRZSA-N 264.344 2.444 10 20 CECD COc1ccc(CN2CC(C(F)F)C2)c(O)c1OC 894830745 RVBGUMJZWKLXBB-UHFFFAOYSA-N 273.279 2.106 10 20 CECD CN(C)c1ccc(CN(C)c2c([N+](=O)[O-])cnn2C)cc1 891564860 FIHYKFXMINHFFP-UHFFFAOYSA-N 289.339 2.031 10 20 CECD COc1ccc(CNCC2(OC)CCOCC2)cc1C 746753164 CHRNPPHLSAIZLS-UHFFFAOYSA-N 279.380 2.289 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@@H](OC)C2)c1O 746755675 REMPLMHPTKGMGU-CHWSQXEVSA-N 265.353 2.448 10 20 CECD CCOc1ccc(N2CCN(Cc3ncc[nH]3)CC2)cc1 1203982017 NYOKNMILUQLJCZ-UHFFFAOYSA-N 286.379 2.131 10 20 CECD O=C(NCCCc1ccc(O)cc1)c1cccc(O)c1O 790744596 CGSANZIUFUJEHO-UHFFFAOYSA-N 287.315 2.166 10 20 CECD CCc1cccc(CN[C@@H](CO)CC(F)F)c1O 717734599 CDCNFQJJJUPKRY-LLVKDONJSA-N 259.296 2.060 10 20 CECD O=C(NCc1ccccc1O)c1ccc2nsnc2c1 776712090 ZNKJFIHDVDPDSU-UHFFFAOYSA-N 285.328 2.327 10 20 CECD C[C@@]1(CNC(=O)NCc2ccc(N)cc2)CCCC[C@@H]1O 1337017660 AUVRSMAITXOAQF-HOCLYGCPSA-N 291.395 2.009 10 20 CECD Cc1ncccc1CCNC(=O)NCc1ccc(N)cc1 1337054066 QQHZECIGQOOVGK-UHFFFAOYSA-N 284.363 2.014 10 20 CECD O=C(O)CC1(CNCc2cc(F)cc(F)c2O)CCC1 1333174848 ADDBDJSSKHOSCH-UHFFFAOYSA-N 285.290 2.405 10 20 CECD CC(C)CN1CCC[C@H]1C(=O)NCc1ccc(N)cc1 1342698615 GJQWREBOUWCYQL-HNNXBMFYSA-N 275.396 2.005 10 20 CECD CC[C@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)O 1605090063 QOTYOZIZKOUNSN-WFASDCNBSA-N 292.379 2.037 10 20 CECD Cc1cnn(CCSc2ncc(C(=O)O)s2)c1 1610542661 FTPNKQACRQCISZ-UHFFFAOYSA-N 269.351 2.139 10 20 CECD Cc1cccc(CN(CCC(=O)O)C(C)C)c1O 1610520884 NSTQZJYGNNMQOE-UHFFFAOYSA-N 251.326 2.386 10 20 CECD CC(C)[C@H](CNCc1cc(Cl)cc(F)c1O)ON 1575435703 VTZZUVSOIOANTG-NSHDSACASA-N 276.739 2.189 10 20 CECD Nc1ccc(OC(=O)Cc2cccnc2Cl)cc1 1580449698 SDAHTLRMYBPBDY-UHFFFAOYSA-N 262.696 2.465 10 20 CECD CC(C)[C@@H](Sc1ncc(C(=O)O)s1)C(=O)N(C)C 1591052292 PBTMNQQWJQPQKT-MRVPVSSYSA-N 288.394 2.046 10 20 CECD Oc1cccc2c1[C@@H](N[C@@H]1CCn3ccnc3C1)CC2 834773551 GUVVNMXSTVWCBF-OLZOCXBDSA-N 269.348 2.181 10 20 CECD C[C@@H]1CCC[C@@H](C)N1NC(=O)c1cccc(O)c1O 126515552 VDUXSSSDDWVTPZ-NXEZZACHSA-N 264.325 2.006 10 20 CECD CC(C)NC(=O)CCN[C@H](C)c1cc(F)ccc1O 181270416 YFTRVFXAQXNITG-SNVBAGLBSA-N 268.332 2.097 10 20 CECD COc1ccc(O)c(CNCCC2CCOCC2)c1 311538952 XVTSIDHFVBFUTE-UHFFFAOYSA-N 265.353 2.307 10 20 CECD CN1CCC[C@H](CN[C@@H]2CCc3cccc(O)c32)C1 381742124 PIOZBCPDFONMRL-TZMCWYRMSA-N 260.381 2.311 10 20 CECD CCNC(=O)CSc1ncc(-c2ccccc2)n1C 22267820 AROBJDQGKYBVON-UHFFFAOYSA-N 275.377 2.315 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCC2CC2)c1 103507777 VUVTZYDTQVPFBL-SECBINFHSA-N 264.325 2.171 10 20 CECD CO[C@]1(C)C[C@H](NC(=O)c2ccc(C)c(O)c2O)C1(C)C 179531726 ZOJJBYUJMKIKIN-MEDUHNTESA-N 293.363 2.340 10 20 CECD CCOc1cccc(CN2C[C@H](C)O[C@H](C)C2)c1O 127035179 MBOLLHHPGPUJOY-TXEJJXNPSA-N 265.353 2.400 10 20 CECD Cc1cccc(C[C@H](CO)NCc2ccccc2O)c1 189017261 CALVMWRCGSQHGB-MRXNPFEDSA-N 271.360 2.394 10 20 CECD Cc1cccc(NC(=O)C(=O)N(C)Cc2ccccc2O)c1 122333659 HPSGBHICQGUAKM-UHFFFAOYSA-N 298.342 2.298 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NC[C@@H]2CCCO2)s1 1537962873 HKKQOIQCFZYIDC-QMMMGPOBSA-N 266.326 2.467 10 20 CECD CCOc1ccc(O)c(CN[C@]2(C)CCOC2)c1 120159469 MYTUKSVJHJJVMW-CQSZACIVSA-N 251.326 2.060 10 20 CECD Cc1cccc(CN[C@@H](C)C(=O)OCC(C)C)c1O 187907257 KLEAVBQWFRAHNP-LBPRGKRZSA-N 265.353 2.378 10 20 CECD C[C@H](NCC1(C)COC1)c1ccc(F)c(F)c1O 187717471 SEYHBTGVCUZUFB-QMMMGPOBSA-N 257.280 2.358 10 20 CECD Cc1c[nH]nc1CNCc1cccc(Br)c1O 291618990 RLWRQFJNEAVEOX-UHFFFAOYSA-N 296.168 2.476 10 20 CECD CC(C)c1cc(C(=O)Nc2ccc(N)cc2)n(C)n1 236617582 KSQOTVZGQSMFDJ-UHFFFAOYSA-N 258.325 2.378 10 20 CECD Cc1cc(C(=O)N2CCC[C@@H]2CN)c(C)n1-c1ccccn1 237692262 YFRHKANGLRWWKY-CQSZACIVSA-N 298.390 2.052 10 20 CECD COc1ccc(N(CCn2cncn2)C(C)C)cc1F 264144090 VDBLCOOQSPLLIO-UHFFFAOYSA-N 278.331 2.341 10 20 CECD C[C@H]1C(=O)NCCN1Cc1cc(-c2ccccc2)ccc1O 271209460 TYICDPMUMNCOOH-ZDUSSCGKSA-N 296.370 2.380 10 20 CECD Oc1ccc(F)cc1CN1C[C@@H](O)Cc2ccccc21 279529853 ZGGUBSXDNCNGGC-AWEZNQCLSA-N 273.307 2.455 10 20 CECD COc1ccc(O)c(CN[C@H](CO)CC2CCC2)c1 279776597 KWKAULWPTHTHKZ-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD COC(=O)[C@]1(C)CN(Cc2cccc(OC)c2O)C[C@H]1C 282883708 YRWQJXKGZFKSOU-BDJLRTHQSA-N 293.363 2.032 10 20 CECD C[C@H]1C[C@@H](CCNC(=O)c2cccc(O)c2O)CCO1 280461387 MHNJWRMQMJXUIN-QWRGUYRKSA-N 279.336 2.033 10 20 CECD COC(=O)[C@]12CCC[C@H]1CN(Cc1cc(C)ccc1O)C2 372951715 JXDOCOGCWSJSHU-YOEHRIQHSA-N 289.375 2.476 10 20 CECD CC(=O)N1CCC[C@@H](CN[C@@H](C)c2ccccc2O)C1 280939295 IQTDKULOWHSPQL-JSGCOSHPSA-N 276.380 2.301 10 20 CECD Cc1cc(C)nc(C(=O)NCc2ccc(O)c(O)c2)c1 801173820 FBOBWDABEBHLLE-UHFFFAOYSA-N 272.304 2.040 10 20 CECD Cc1cc(CN2CC[C@@H]([C@H](C)O)C2)ccc1N(C)C 294773583 ZJSFYRZVJISFHY-DZGCQCFKSA-N 262.397 2.264 10 20 CECD CCOc1cccc(CN(C)C[C@H](O)C(F)(F)F)c1O 809750792 IBEGXNBCHDBKTB-NSHDSACASA-N 293.285 2.146 10 20 CECD COc1ccc(CNCc2cnc([C@@H](C)O)s2)c(O)c1 809658468 OESQNYCQYVIRKU-SECBINFHSA-N 294.376 2.200 10 20 CECD Cc1cc(CN2CC[C@@H](O)[C@H](C)C2)ccc1N(C)C 815096662 UIZKBPIGNZDNQQ-CZUORRHYSA-N 262.397 2.264 10 20 CECD COC[C@H](C)[C@H](C)C(=O)N(C)Cc1ccccc1O 812475677 WRJGKEVRGWQAMH-RYUDHWBXSA-N 265.353 2.269 10 20 CECD Cc1cc(CN2CCC[C@H](CC(N)=O)C2)ccc1N(C)C 815055932 UCWBVEAFDAVOKD-CQSZACIVSA-N 289.423 2.148 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)c1c[nH]ccc1=N 817896525 JESNOMIGMDFOMI-LBPRGKRZSA-N 270.380 2.411 10 20 CECD Brc1ncn(CCSc2nccs2)n1 821078206 LOXNZKCLEDKLPI-UHFFFAOYSA-N 291.199 2.289 10 20 CECD Cc1cc(O)c(CNCCOCCF)cc1Cl 827951411 YQCLKEMDFONRNT-UHFFFAOYSA-N 261.724 2.430 10 20 CECD O=C(O)[C@H](Cc1ccccc1)NCc1cc(F)ccc1O 821541342 SQGMFLMJQDNPIH-AWEZNQCLSA-N 289.306 2.317 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cnc2n1CCC2 827955189 ARPRQYYEVLFUAS-UHFFFAOYSA-N 298.390 2.134 10 20 CECD CCOC1CCN(C(=O)c2cc(O)cs2)CC1 731870571 QUILCIDITMLFCH-UHFFFAOYSA-N 255.339 2.095 10 20 CECD CC[C@]1(C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCO1 588553399 OGTCBPVGLGAJIJ-GMNBZTITSA-N 291.347 2.139 10 20 CECD C[C@@H](NCC[C@@H](O)C1CC1)c1c(O)cccc1F 903411052 LMIHQEVMQFWEPR-BXKDBHETSA-N 253.317 2.343 10 20 CECD CNC(=O)C[C@@H](C)N[C@@H](C)c1c(C)cc(C)cc1O 834901984 YQWXJJDNTQSMNE-NEPJUHHUSA-N 264.369 2.184 10 20 CECD OC[C@H](CN[C@@H]1CCc2cccc(O)c21)Cc1ccco1 834624027 DWWBYTNRJDTDNB-SWLSCSKDSA-N 287.359 2.413 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 834902841 DJXLJJXOXZSQDA-PQFRYHKHSA-N 295.354 2.473 10 20 CECD Cc1ccoc1C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832293626 ZBDGFLYKHMLLRJ-CQSZACIVSA-N 287.363 2.084 10 20 CECD COC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 918632663 AQQLZHNUOODOIQ-QWRGUYRKSA-N 296.342 2.295 10 20 CECD COc1ccc(N(C)CCN(C)c2ncc(C)cn2)cc1 845673637 SRESNUXEZJGOHP-UHFFFAOYSA-N 286.379 2.366 10 20 CECD CNCCN(C)Cc1ccc(N(C)C)cc1C(F)(F)F 843057458 MSVLUWMVWMZCOB-UHFFFAOYSA-N 289.345 2.423 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H]1CCCNC1 843069979 UNEZKDPQCNNHQX-CYBMUJFWSA-N 260.381 2.447 10 20 CECD COc1cccc(O)c1CNC[C@H]1CC[C@H](CN)CC1 841080233 QWSZEQGXLLSHFY-JOCQHMNTSA-N 278.396 2.256 10 20 CECD C[C@H](NC[C@@H](O)C1CCOCC1)c1ccc(Cl)cc1O 841749094 NEGSDDAYPPTWBW-ZUZCIYMTSA-N 299.798 2.484 10 20 CECD COc1cccc(CNC[C@H]2CC[C@H](CN)CC2)c1O 841078713 JABORAKTIZTMPN-JOCQHMNTSA-N 278.396 2.256 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2C2CCC2)c1 845833250 DVFHKQOCRQJYGX-UONOGXRCSA-N 275.348 2.453 10 20 CECD CCc1cccc(CNC(C)(C)CC(=O)OC)c1O 848899398 FPFBUTQKPZYWIG-UHFFFAOYSA-N 265.353 2.386 10 20 CECD CN1CCCc2cc(CN[C@H]3CCC[C@H](N)C3)ccc21 848718420 MOVAWMRTBQAVCR-HOTGVXAUSA-N 273.424 2.429 10 20 CECD CC(C)C[C@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756497627 RHDZYVWVOCMHBC-PWSUYJOCSA-N 282.340 2.358 10 20 CECD CON(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(Cl)cc1O 858580602 SDQPENXAWJJVPT-IUCAKERBSA-N 286.759 2.105 10 20 CECD CCC/C=C/C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 852792482 XEVIEDZPDUWBHC-LFAOLKIESA-N 275.396 2.225 10 20 CECD C[C@@H](NCCCNc1ncccn1)c1cc(F)ccc1O 756643527 VLRYKWKFFJYTDW-LLVKDONJSA-N 290.342 2.474 10 20 CECD CCn1cc(C(=O)NCc2ccc(N)cc2)c(C2CC2)n1 868062814 WMLVIXJGAZAOFG-UHFFFAOYSA-N 284.363 2.293 10 20 CECD CO[C@@H]1CCC[C@H]1NC(=O)N[C@H](C)c1ccccc1O 868674512 SPIUVHPPELMOCU-MPKXVKKWSA-N 278.352 2.320 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1ccccn1 772768935 MEDGJJYJYITTQR-ALCCZGGFSA-N 271.272 2.249 10 20 CECD Cc1cc(O)c(CN(C)CC(=O)N2CCCC2)cc1C 873984776 KZANOXGXCGKJRY-UHFFFAOYSA-N 276.380 2.063 10 20 CECD Cc1nccc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 773009182 PHADRLNCRPJBEN-NSHDSACASA-N 284.363 2.342 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H](CF)C2)cc1F 883241272 RPPPSUYHGNIPAD-GFCCVEGCSA-N 297.349 2.393 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCC(F)(F)C1 779533327 JGIVWWVGHQHAKV-YWNRKNDBSA-N 283.274 2.415 10 20 CECD C[C@@H](N[C@H](C)c1nncn1C)c1c(O)cccc1F 886523300 ZXWPIIXPAGMGRA-RKDXNWHRSA-N 264.304 2.072 10 20 CECD C[C@H]1C[C@H](O)CN1Cc1cccc(Br)c1O 788269425 NOUQDWOFXMRTLC-WPRPVWTQSA-N 286.169 2.110 10 20 CECD COc1ccc(CN2CC[C@]3(CCOC3)C2)c(O)c1OC 892175090 JUDNZAWANRMPHG-INIZCTEOSA-N 293.363 2.022 10 20 CECD COc1cccc(CN(C)C[C@@H]2CCCN(C)C2)c1O 92253760 BHCUGGIDTIDXLM-CYBMUJFWSA-N 278.396 2.174 10 20 CECD CCN1CCN(C(=O)/C=C\c2cnn(C)c2)c2ccccc21 1318399490 ZMQVLYLQHSZRAL-HJWRWDBZSA-N 296.374 2.306 10 20 CECD CCCc1n[nH]cc1C(=O)NCc1cc(C)ccc1O 1331806844 IROLPSXFFWBJOM-UHFFFAOYSA-N 273.336 2.306 10 20 CECD CCOc1cccc(CN[C@H]2CCN(C)[C@@H](C)C2)c1O 227376199 VWYUFMJQRUEVLT-JSGCOSHPSA-N 278.396 2.363 10 20 CECD CNC(=O)[C@]1(C)CCN(Cc2c(O)cccc2Cl)C1 228099017 APZDCLCAEZMJFS-CQSZACIVSA-N 282.771 2.004 10 20 CECD CCOCCN(C)Cc1cccc(OCC)c1O 156089717 HHGXKDSCPYURAO-UHFFFAOYSA-N 253.342 2.259 10 20 CECD C[C@H](NCCCN1CCCC1=O)c1ccc(N(C)C)cc1 159495822 YELRKPYFRKZOMG-AWEZNQCLSA-N 289.423 2.416 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@](C)(O)C(F)(F)F)c1 273450703 FYTNCGNWXBFCRK-QPUJVOFHSA-N 293.285 2.365 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2([S@](C)=O)CC2)c1 282342599 OWMNLPZJLSXVMZ-VOJFVSQTSA-N 267.394 2.262 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 188502430 BRYGQEDPEXJTRT-CHWSQXEVSA-N 277.412 2.270 10 20 CECD CC[C@H](NC1CCN(OC)CC1)c1ccccc1O 692097442 ROYPEVKFPCHHIC-AWEZNQCLSA-N 264.369 2.459 10 20 CECD CC[C@H](NCc1cc(OC)ccc1O)C(C)(C)O 394023793 XWDJTEJOGYLMDM-ZDUSSCGKSA-N 253.342 2.040 10 20 CECD COCCN1CCC(NCc2c(O)cccc2Cl)CC1 113328763 HPGPXSSBEALMML-UHFFFAOYSA-N 298.814 2.246 10 20 CECD C[C@H](NCc1cc[nH]n1)c1ccc(N2CCOCC2)cc1 66989828 SMSXTYBYARIVOC-ZDUSSCGKSA-N 286.379 2.097 10 20 CECD COc1ccc([C@@H]2NC(=O)CN2Cc2ccccc2)c(O)c1 112369179 PEFRPFKSJZOCOH-QGZVFWFLSA-N 298.342 2.031 10 20 CECD C[C@@H](NCCCC(=O)O)c1ccc(N(C)C)cc1 37417768 UHRAKVOOAIXYBH-LLVKDONJSA-N 250.342 2.268 10 20 CECD Oc1ccc(F)cc1CNCc1cnc2n1CCCC2 367434919 ABNZQBZWZQHDST-UHFFFAOYSA-N 275.327 2.354 10 20 CECD C[C@@H]1CCCC[C@H]1OCCNC(=O)c1cccc(O)c1O 186944726 YNHTVGKMSJAHIJ-BXUZGUMPSA-N 293.363 2.423 10 20 CECD CN1C(=O)/C(=C\c2csc([N+](=O)[O-])c2)SC1=S 48642719 NCPRKQAZECRNOJ-QHHAFSJGSA-N 286.359 2.487 10 20 CECD CSC1(C(=O)N(C)Cc2ccccc2O)CC1 190639805 AEIUQANVENTUIO-UHFFFAOYSA-N 251.351 2.246 10 20 CECD COc1ccc(O)c([C@@H](C)NCC[C@H](C)CCO)c1 295106743 LBHJMICZHBFLJH-NWDGAFQWSA-N 267.369 2.460 10 20 CECD CCC[C@H](CNCc1cc2c(cc1O)OCO2)OC 293801327 YGSOKXJAXRDJBL-LLVKDONJSA-N 267.325 2.026 10 20 CECD O=S(=O)(CCC1CC1)Nc1ccc(O)cc1F 384016795 QMWIDRWDSIPLAS-UHFFFAOYSA-N 259.302 2.073 10 20 CECD CN(C)c1ccc(CN[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)O)cc1 250357181 PXVSSDRTSUZZOU-UGQVUOCMSA-N 288.391 2.342 10 20 CECD Cn1ccc(/C=C/C(=O)N2CCCc3ncccc32)c1 277124041 SYVUJDBPTBNXHM-VOTSOKGWSA-N 267.332 2.413 10 20 CECD Cc1cc(CN[C@@H](C)Cn2cccn2)ccc1N(C)C 274353965 IQJBJIRUQPIRJB-AWEZNQCLSA-N 272.396 2.436 10 20 CECD CCCN(Cc1cc2c(cc1O)OCO2)CC(C)(C)O 271170278 PRIJSXIKFWOEBV-UHFFFAOYSA-N 281.352 2.104 10 20 CECD Cc1n[nH]c(C)c1[C@H](C)C(=O)NCc1ccccc1O 273210173 MISWPTAQHRCWKQ-VIFPVBQESA-N 273.336 2.152 10 20 CECD CCCCN(Cc1ccccc1O)[C@H](C)C(=O)N(C)C 282348717 CKEOJFJJSOAJQS-CYBMUJFWSA-N 278.396 2.471 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)N(C)CC)c1ccc(F)cc1O 287532185 OYOZGIUTTAKNAY-GXFFZTMASA-N 282.359 2.439 10 20 CECD CC[C@@H](NCC1(S(C)(=O)=O)CC1)c1ccc(C)cc1O 281258289 WJMHIOHQOPKERS-CYBMUJFWSA-N 297.420 2.319 10 20 CECD COc1cc(O)c(CN[C@@H](C)CCCCO)cc1OC 294953451 DERIQYMGWFMHOR-NSHDSACASA-N 283.368 2.050 10 20 CECD CN(C)c1ccc(CN(C(=O)c2cnn(C)c2)C2CC2)cc1 298355264 IACVTGUFSUIZBJ-UHFFFAOYSA-N 298.390 2.291 10 20 CECD CCC[C@@H]1C[C@H]1C(=O)OCC(=O)c1ccc(O)c(O)c1 812637991 LODYLBHGJOVZKC-MWLCHTKSSA-N 278.304 2.260 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCCSC2)c(O)c1 811485160 XMALRGLCUZJIEJ-NSHDSACASA-N 281.377 2.160 10 20 CECD C[C@@H]1CN(Cc2ccc3ccccc3c2O)C[C@H](CO)O1 816588171 HTUWQVKTPFTUND-IUODEOHRSA-N 287.359 2.127 10 20 CECD C[C@H]1C[C@@H](NCC2(CC(N)=O)CC2)c2c(O)ccc(F)c21 817586550 PMGZWQBQGBACMG-GXSJLCMTSA-N 292.354 2.325 10 20 CECD Oc1ccc(F)cc1CNCCO[C@@H]1CCCCO1 813333331 LOHHWWVCKCEWDX-CQSZACIVSA-N 269.316 2.164 10 20 CECD C[C@H](O)C1(NCc2cc(Cl)c(F)cc2O)CC1 827586546 YOKLOLBILSDGHY-ZETCQYMHSA-N 259.708 2.188 10 20 CECD Cc1ncc(/C=C\C(=O)N2C[C@@H](N)Cc3ccccc32)s1 493334432 KDCJLSCODHZXKZ-FWWRYZNZSA-N 299.399 2.381 10 20 CECD COc1ccc(O)c(CNc2ncnc3c2CCC3)c1 733995022 WEDOPVCQABTUBP-UHFFFAOYSA-N 271.320 2.292 10 20 CECD O=C(c1cc(O)cs1)N1CCc2ccc(O)cc2C1 732269162 GMYYPOCUHWRZTE-UHFFFAOYSA-N 275.329 2.358 10 20 CECD CC[C@@]1(C(=O)O)CCCN(Cc2c(O)cccc2OC)C1 904400152 FDGCUYQGRSDVNI-MRXNPFEDSA-N 293.363 2.478 10 20 CECD O=C(NC[C@@H](CO)C1CCCCC1)c1cc(O)cs1 832890248 WHYZRFZRBKDGAH-NSHDSACASA-N 283.393 2.372 10 20 CECD CO[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)C12CCC2 838062625 WBUYDFVWFDDQPI-UONOGXRCSA-N 290.363 2.149 10 20 CECD CO[C@H](C)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 839919109 PLVZEEWKGUJOME-CHWSQXEVSA-N 278.396 2.143 10 20 CECD Cn1cccc1CNC(=S)NCc1cccs1 743061588 LRBQVZHWGBGENS-UHFFFAOYSA-N 265.407 2.251 10 20 CECD Oc1cc2c(cc1CN[C@@H]1COCc3ccccc31)OCO2 841891329 OHIXOCQUYVKNMX-CQSZACIVSA-N 299.326 2.482 10 20 CECD Nc1ccc(CCNCc2nccn2CC(F)(F)F)cc1 841035199 LEJFHXQZDCPEIK-UHFFFAOYSA-N 298.312 2.360 10 20 CECD COc1ccc2c(c1)CCCN2Cc1oncc1C(=O)O 846235122 SFFYUBAJIDJHLY-UHFFFAOYSA-N 288.303 2.334 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1N 843052263 RGCUOZWOCKUNFT-SMDDNHRTSA-N 265.376 2.061 10 20 CECD CNC[C@@H]1CCCN1Cc1cccc(Cl)c1O 843056163 VZGYFDPQOYPYPF-NSHDSACASA-N 254.761 2.229 10 20 CECD Cc1ccc(O)c(CNCc2ccc(CCN)cc2)c1 841032569 TVODIDVMZYPXAI-UHFFFAOYSA-N 270.376 2.492 10 20 CECD Cc1cc(CN2CC[C@@H](CCN)C2)ccc1N(C)C 923478412 BRXSPIHQPRTXDX-CQSZACIVSA-N 261.413 2.232 10 20 CECD CC[C@H](NCC[C@]1(O)CCCOC1)c1ccccc1O 846108712 QTYGKMRMFNQUKM-GOEBONIOSA-N 279.380 2.365 10 20 CECD C[C@@H](NCc1nnc2n1CCC2)c1cc(F)cc(F)c1O 756395845 ZRQMKRNZELWUTK-MRVPVSSYSA-N 294.305 2.059 10 20 CECD C[C@@H]1C[C@H](NC(=O)N[C@H](C)c2ccccc2O)CCO1 868469658 MNFZHDJGIZPVOA-IJLUTSLNSA-N 278.352 2.320 10 20 CECD Cn1cc(C(C)(C)NCc2cc(F)ccc2O)cn1 779085564 QLXVIFQOKMZTJF-UHFFFAOYSA-N 263.316 2.290 10 20 CECD C[C@H](NC[C@@]1(O)CCSC1)c1ccc(F)cc1O 185638603 DEMAPXIBIRHHRR-ZANVPECISA-N 271.357 2.050 10 20 CECD CC[C@H](NC[C@H](C)S(C)(=O)=O)c1ccc(C)cc1O 794819663 XBGHBDVXSJFHAL-AAEUAGOBSA-N 285.409 2.174 10 20 CECD CCc1cccc(CN2CC[C@@](O)(C3CC3)C2)c1O 1329170632 ZIUXTXYMKFQCAU-INIZCTEOSA-N 261.365 2.301 10 20 CECD Cc1cc(O)c(CN(C)[C@H](C)C(=O)O)c(Cl)c1 1607700351 XFISIIXZPMVZQV-MRVPVSSYSA-N 257.717 2.259 10 20 CECD CC[C@](C)(CC(=O)O)NCc1cc(OC)c(OC)cc1O 1604903619 PODYPNBTKCOZCF-OAHLLOKOSA-N 297.351 2.142 10 20 CECD Cc1ncoc1CN(C)c1ccc(OCC(=O)O)cc1 1607992616 DDISFHGWJAEDRS-UHFFFAOYSA-N 276.292 2.083 10 20 CECD C[C@](CNCc1ccc(N)cc1)(C(=O)O)c1ccccc1 1592712227 IXLLRSMOKLEJRS-QGZVFWFLSA-N 284.359 2.401 10 20 CECD C[C@@H](NCCCCCCO)c1cc(C(=O)O)ccc1O 1593264149 GAGKKPLHHVFBRV-LLVKDONJSA-N 281.352 2.294 10 20 CECD C[C@H](CN(Cc1cc(F)cc(F)c1O)C1CC1)C(=O)O 1592598735 JUMSZRSCADXJOR-MRVPVSSYSA-N 285.290 2.356 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)CC2 160382867 RUUITOTZUWMONO-DOMZBBRYSA-N 299.422 2.318 10 20 CECD COc1cccc(CNC[C@@]2(O)CCC[C@@H]2C)c1O 293051295 ROFZXTVBLPTHPK-NHYWBVRUSA-N 265.353 2.042 10 20 CECD Cc1cc(CN2CCCc3cc(CN)ccc32)no1 700926463 QIFGLCUGVFAUTP-UHFFFAOYSA-N 257.337 2.395 10 20 CECD C[C@H]1NCCN(Cc2cc(Cl)ccc2O)[C@@H]1C 379501893 WWQPNGIJJIBBJI-NXEZZACHSA-N 254.761 2.228 10 20 CECD Cc1cc(C)nc(C(=O)NCc2ccc(N)cc2)c1 381659238 MKRMNYJTLQPLAL-UHFFFAOYSA-N 255.321 2.211 10 20 CECD OCC[C@H](NCc1ccc2c(c1)CCCO2)C(F)(F)F 922345504 RCSYVIBUNTUFNE-ZDUSSCGKSA-N 289.297 2.415 10 20 CECD C[C@H](C(=O)NCc1ccc2c(c1)CCCN2C)n1cccn1 58769687 JNGSYEDFRNJKLC-CYBMUJFWSA-N 298.390 2.143 10 20 CECD Nc1ccc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)cc1 110380184 KXRKWMYPNKBQJO-OAHLLOKOSA-N 288.395 2.361 10 20 CECD CSC[C@H](C)C(=O)N1CCOc2cc(N(C)C)ccc21 173190688 FUGXNSOBSKDWEP-NSHDSACASA-N 294.420 2.477 10 20 CECD Cc1ccc(C(=O)NC[C@]2(C)CCCC[C@H]2O)c(O)c1O 179535781 XAMGGNAJOYEBEW-WBMJQRKESA-N 293.363 2.077 10 20 CECD Cc1nccn1C[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1 178847474 JSSYTDZRGQSTBX-INIZCTEOSA-N 298.390 2.007 10 20 CECD COc1cccc(CNC(=O)C2(OC)CCCCC2)c1O 184977537 SFBDRXQOLRGAGV-UHFFFAOYSA-N 293.363 2.366 10 20 CECD CCn1nccc1CN(C)c1ccc2c(c1)OCO2 180761351 RGYUPOZELPKMLJ-UHFFFAOYSA-N 259.309 2.268 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc(F)n1 131174879 GRTSGCDZRAEQQW-UHFFFAOYSA-N 260.268 2.199 10 20 CECD C[C@H]1CN(C(=O)c2cccc(O)c2O)CCC1(F)F 290753311 APDRIFZQQYYVQE-QMMMGPOBSA-N 271.263 2.215 10 20 CECD C[C@H](N[C@@H]1C[C@@H](O)C1(C)C)c1cc(F)ccc1O 228855056 IXGFHPQNMLKXCR-ZEGGKSINSA-N 253.317 2.341 10 20 CECD C[C@@H](O)CN(Cc1ccco1)Cc1ccccc1O 192756696 AUKZENSUTCKEJB-GFCCVEGCSA-N 261.321 2.368 10 20 CECD CC(C)Oc1ccc(N(C)C[C@@H](O)Cn2cccn2)cc1 191592952 SDUGUFDLUIIINE-OAHLLOKOSA-N 289.379 2.168 10 20 CECD CCOc1ccc(O)c(CNC[C@@H]2CCCOC2)c1 237046483 KBVLOZVEFKSHHJ-LBPRGKRZSA-N 265.353 2.307 10 20 CECD COCCN(CCO)Cc1ccc(N2CCCCC2)cc1 93005578 AIKVHHZBEHMJDN-UHFFFAOYSA-N 292.423 2.118 10 20 CECD COCCC[C@H](C)NCc1ccc(N2CCOCC2)cc1 268826574 JBWBUEUCNGWMHB-HNNXBMFYSA-N 292.423 2.428 10 20 CECD COc1ccc(N2CCN(C(=O)CC(C)(F)F)CC2)cc1 277996492 ZVHLVOJSMMLZLI-UHFFFAOYSA-N 298.333 2.389 10 20 CECD Cc1ccc(O)c(CN[C@@H]2COc3ccccc3[C@@H]2O)c1 288507089 ILPRUTUVFDXGPK-PBHICJAKSA-N 285.343 2.285 10 20 CECD Cc1cc(C(=O)NC[C@H]2CCOC2)c(C)n1-c1ccccn1 298743266 KCYQUARIEPFEEL-CQSZACIVSA-N 299.374 2.255 10 20 CECD CC[C@@H](CO)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 294677625 AZCQLRNONAOJET-JTQLQIEISA-N 288.731 2.157 10 20 CECD CO[C@H](CNCc1ccc(N(C)C)c(F)c1)C1CC1 292901021 DRPYNHRSDVSKEC-OAHLLOKOSA-N 266.360 2.406 10 20 CECD CO[C@H]1CN(Cc2cc(Cl)c(F)cc2O)C[C@H]1OC 816591334 BPBQZBVYFMLLLA-BETUJISGSA-N 289.734 2.030 10 20 CECD C[C@@H](N)CN[C@H](C)c1ccc(N2CCOCC2)cc1Cl 817970793 FGUSPROIMKEUEN-VXGBXAGGSA-N 297.830 2.174 10 20 CECD COC[C@@H](C)[C@@H](C)C(=O)N(C)Cc1ccccc1O 812475678 WRJGKEVRGWQAMH-VXGBXAGGSA-N 265.353 2.269 10 20 CECD CCO[C@@H]1COC[C@H]1NCc1ccc(N(CC)CC)cc1 825196980 RTAYOAICXFNDCD-IAGOWNOFSA-N 292.423 2.426 10 20 CECD C[C@@H](NC(=O)/C=C\[C@@H]1CCOC1)c1ccccc1O 827952567 XRGJCYUNOGJJFD-UXFRKABBSA-N 261.321 2.162 10 20 CECD C[C@@H](NC(=O)c1ccc(C=O)n1C)c1ccc(N(C)C)cc1 829817214 LBAUWHKHGISPPS-GFCCVEGCSA-N 299.374 2.395 10 20 CECD C[C@H](Cc1cnc[nH]1)C(=O)N[C@H](C)c1ccccc1O 827952599 YGNIEGWPDLIQTH-GHMZBOCLSA-N 273.336 2.171 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@@H](C)C(=O)O)c1O 825946857 TWFGTYBZIYJGIC-MRVPVSSYSA-N 299.754 2.401 10 20 CECD CCC(CC)NC(=O)[C@@H](C)OC(=O)c1cc(O)cs1 732355790 UGFHLZGWUMFWOZ-MRVPVSSYSA-N 285.365 2.304 10 20 CECD CCOC(=O)CN(C(=O)c1cc(O)cs1)C1CCC1 832271364 VWKPUCSFPHDGBO-UHFFFAOYSA-N 283.349 2.012 10 20 CECD Cc1ccc(O)c(CN[C@H]2CCNC3(CCC3)C2)c1 841089326 LSRRSKGCXFBFHZ-AWEZNQCLSA-N 260.381 2.465 10 20 CECD CCc1cccc(CN[C@@H](C)CO[C@@H]2CCOC2)c1O 848898544 DWSBIVSJCWHNDT-SWLSCSKDSA-N 279.380 2.238 10 20 CECD CCOc1ccc(CN[C@@H]2CC[C@H](C(=O)O)C2)c(O)c1 843039315 PDOHKSQSTRKIGR-CMPLNLGQSA-N 279.336 2.134 10 20 CECD CO[C@H](CC(C)C)C(=O)N(C)Cc1ccccc1O 841405968 WQZIJSNQKGFEDY-CQSZACIVSA-N 265.353 2.412 10 20 CECD CN(C)c1ccc(CN(c2cc(=O)n(C)cn2)C2CC2)cc1 848651133 ZDNCCTTWHNPPDK-UHFFFAOYSA-N 298.390 2.015 10 20 CECD CCc1cccc(CNCCCNc2ncccn2)c1O 848890439 IXKKWOGOQBRBIZ-UHFFFAOYSA-N 286.379 2.336 10 20 CECD CCN1C[C@H](CN[C@@H](C)c2cc(F)ccc2O)CC1=O 846207499 CFUZFEQEIJLQCJ-QWRGUYRKSA-N 280.343 2.050 10 20 CECD CCC(CC)(CO)C(=O)N(C)Cc1ccccc1O 847570850 UAQOZUNAKKKJHC-UHFFFAOYSA-N 265.353 2.149 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@H](C)C[S@@](C)=O 840940079 VEMLYRNYDOYCSN-BFUOFWGJSA-N 282.453 2.260 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC2CCNCC2)c1 844923669 HEGTYJOFPUDERC-GFCCVEGCSA-N 278.396 2.441 10 20 CECD CO[C@@]1(C)CCCN(C(=O)NCCc2ccc(N)cc2)C1 841957370 AKOWLUZGFXIVIC-INIZCTEOSA-N 291.395 2.022 10 20 CECD Cc1c(F)cccc1S(=O)(=O)NCc1ccccc1O 751152005 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C[C@@H]1[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)C1(F)F 1123630450 JOPXZVIUBDZQQF-PELKAZGASA-N 286.297 2.409 10 20 CECD O=C(NC[C@@H]1Cc2ccccc21)c1c(F)ccc(O)c1O 789959100 OSRSTBDCSWIXCS-JTQLQIEISA-N 287.290 2.307 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC[C@H]2CCCC[C@H]2O)c1 897539192 RIPMCCROHMKMOU-BXUZGUMPSA-N 294.351 2.331 10 20 CECD C[C@@H](O)C[C@H]1CCCN1Cc1cc(F)cc(F)c1O 894035047 XEAGNJIJCUKALV-BXKDBHETSA-N 271.307 2.406 10 20 CECD CC[C@@H](C)[C@@H](O)CNCc1cc(C)cc(OC)c1O 894250053 CZKBWGALAGSRLS-YPMHNXCESA-N 267.369 2.206 10 20 CECD C[C@H]1CN(Cc2ccc3ccccc3c2O)C[C@H]1O 897681188 YRUSVPLOFDNCNC-XHDPSFHLSA-N 257.333 2.358 10 20 CECD C[C@H](CCCO)NCc1ccc(Br)cc1O 691453595 IUGMLSWREJQOEJ-SECBINFHSA-N 288.185 2.405 10 20 CECD Nc1ccc(CNC(=O)c2cc(O)nc3c2CCCC3)cc1 1263303589 BROFUSOOGIUOAX-UHFFFAOYSA-N 297.358 2.178 10 20 CECD C[C@@H](NCCOCC(F)F)c1cc(C(=O)O)ccc1O 1609776711 BWHCIVNNELNKPO-MRVPVSSYSA-N 289.278 2.023 10 20 CECD Cc1cccc(-n2c(C)cc(CNC(=O)[C@H](C)N)c2C)c1 1579748273 WVMLJDHTHVHDPP-ZDUSSCGKSA-N 285.391 2.366 10 20 CECD CCOc1ccc(N(C)CC(=O)NCC(F)(F)F)cc1 150735223 PKMKOJOOQZOUSU-UHFFFAOYSA-N 290.285 2.200 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)NC(C)C)cc1 161957612 RVIYZYPWNAELLK-UHFFFAOYSA-N 291.439 2.489 10 20 CECD Cc1cccc(CN[C@H](CC(C)C)C(=O)O)c1O 158742764 BNXVOOBMBHBWMQ-GFCCVEGCSA-N 251.326 2.290 10 20 CECD CCc1cccc(CNCCN2CC[C@H](C)C2)c1O 848899754 JWPIODFXSKYCSN-ZDUSSCGKSA-N 262.397 2.386 10 20 CECD C[C@H](N[C@H](C)[C@@H](O)C(F)(F)F)c1ccc(F)cc1O 866463182 KQJQQKOABFKFSC-MVKOHCKWSA-N 281.249 2.494 10 20 CECD Cc1ccc(CNCc2n[nH]cc2Br)c(O)c1 877057414 CZEKLPKFQYWGSE-UHFFFAOYSA-N 296.168 2.476 10 20 CECD COc1ccncc1CNCc1c(C)cccc1O 877548402 KAIPMEYBIBFPAB-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Oc1cccc(Cl)c1CNC[C@]1(O)CCSC1 267049093 NLQZUJXAXWYUPL-GFCCVEGCSA-N 273.785 2.003 10 20 CECD CC[C@H](N[C@@H]1CCCCNC1=O)c1ccc(N(C)C)cc1 177874405 XQXTVNCGSRXIQD-JKSUJKDBSA-N 289.423 2.462 10 20 CECD CC[C@H](O)CCNC1CCN(c2ccc(OC)cc2)CC1 305175988 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IFORMXNLJMKBJZ-UHFFFAOYSA-N 285.315 2.172 10 20 CECD CCCN1C[C@@H](CNCc2c(O)cccc2Cl)CC1=O 817411775 YXQLAASCZSQDGR-LLVKDONJSA-N 296.798 2.394 10 20 CECD CNCCCN[C@@H](C)c1ccc(Br)cc1O 817941743 WGJVAZALWAVVJM-VIFPVBQESA-N 287.201 2.415 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1[C@H]2CCC[C@H]1CC2 826753440 RYFZURKYQKHYNK-IUCAKERBSA-N 265.284 2.394 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@H]3C[C@@H]3C2)c1O 827506217 FBZNURCJDIIOON-GXSJLCMTSA-N 278.308 2.151 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCc2cccc(F)n2)c1 747938892 PSWYAPQOUCPMGP-UHFFFAOYSA-N 277.255 2.124 10 20 CECD COc1ccc(N(C)CCOC[C@H]2CCCO2)cc1OC 741243872 ALDGWIHYMFVBLH-CQSZACIVSA-N 295.379 2.336 10 20 CECD CCOc1ccc(CN2CCC[C@@H](CO)[C@H]2C)c(O)c1 840977469 IHIGSUCJVVZIRP-OCCSQVGLSA-N 279.380 2.384 10 20 CECD CCC[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841067271 MFARNVVSCXFQAU-GFCCVEGCSA-N 289.379 2.246 10 20 CECD COc1cccc(CN2CCC([C@H](C)CO)CC2)c1O 846057309 GMRSLLKRQHWFIC-GFCCVEGCSA-N 279.380 2.241 10 20 CECD COCCO[C@@H]1CCN(Cc2ccc(N(C)C)cc2C)C1 840938953 JYYXEVFIKAIPGK-QGZVFWFLSA-N 292.423 2.298 10 20 CECD Cc1cc(Br)cc(CN[C@@H](CN)C2CC2)c1O 841029125 SXTOKBHZHHNKGZ-LBPRGKRZSA-N 299.212 2.290 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(CO)cc2)cc1 744380790 HTTVZWYCPNRBTF-UHFFFAOYSA-N 284.359 2.175 10 20 CECD N[C@H]1CCC[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 841055737 VJBOLBNDSODDHK-WDEREUQCSA-N 299.758 2.313 10 20 CECD CC(=O)[C@H]1CCCCN1C(=O)/C=C\c1ccc(O)c(O)c1 854724851 BGPQFECNNSATON-FWPCIQOSSA-N 289.331 2.081 10 20 CECD CCC[C@H](O)CN[C@@H](C)c1cc(F)cc(F)c1O 756576134 JYDQYJQVOWMQDW-WPRPVWTQSA-N 259.296 2.482 10 20 CECD Cc1cc(Br)c(O)c(CN(C)C[C@@H](C)O)c1 761500118 SGCZYGWNTOAXSN-SECBINFHSA-N 288.185 2.276 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CC(OCC)C1 935945876 NXHKHPNRYVIEON-UHFFFAOYSA-N 298.379 2.309 10 20 CECD Cc1cccc2c1CCN2C(=O)/C=C/c1cn(C)cn1 931133385 BTYNYMLLZQMVSR-VOTSOKGWSA-N 267.332 2.331 10 20 CECD CC(C)[C@@H]1C[C@H](C(=O)NCc2ccccc2O)CCO1 934936683 WDINKYMRGTZPAS-DOMZBBRYSA-N 277.364 2.460 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@H](C)N)c1O 863566198 DSWYRPIFRNAASJ-QMMMGPOBSA-N 270.760 2.027 10 20 CECD CCn1ncc(C(=O)N(C)Cc2ccccc2O)c1C 866597347 RAGAMSCQPACSDF-UHFFFAOYSA-N 273.336 2.189 10 20 CECD CN(C)c1ccc(CN2CCc3c[nH]nc3C2)cc1F 769468252 FQWWCDUDPVWJBF-UHFFFAOYSA-N 274.343 2.173 10 20 CECD COc1ccc(N2CCN(CCSC)CC2)c(OC)c1 879462964 WZHBASXTLNVLFI-UHFFFAOYSA-N 296.436 2.189 10 20 CECD Cc1cccc(O)c1CNCCCCN1CCC[C@H]1CO 877042036 RXBUACGGMCPPKA-HNNXBMFYSA-N 292.423 2.027 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CC[C@H](N)CC2)c1 870881691 GVGYFTAFSWVTDW-SRVKXCTJSA-N 292.379 2.096 10 20 CECD CC[C@@H](N[C@@H](CO)C1CCOCC1)c1ccccc1O 775551290 LZNMFBUBJPAWQW-CABCVRRESA-N 279.380 2.220 10 20 CECD CN[C@@H](CC(C)C)C(=O)NCc1ccc(N(C)C)c(F)c1 884205420 WDFXRSIGYCVVOT-AWEZNQCLSA-N 295.402 2.142 10 20 CECD CCN(C)c1ccc(Cn2cc([C@@H](C)NC)nn2)cc1 881313498 MHGYLLZKHIBGTD-GFCCVEGCSA-N 273.384 2.063 10 20 CECD C[C@@H](CO)N[C@@H](C)c1cccc(C(F)(F)F)c1O 788629710 CUPZYONWPRCIMY-YUMQZZPRSA-N 263.259 2.442 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)C1 895432923 GBSSVPSOYYNBHD-OKILXGFUSA-N 275.348 2.053 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](CCCO)C2)c1O 894956736 LAOZJFPFFQFHMQ-CYBMUJFWSA-N 279.380 2.304 10 20 CECD C[C@@H]1C[C@H]1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891247412 HBCSCXWJNPQPPY-WQVCFCJDSA-N 289.423 2.128 10 20 CECD CCO[C@@H]1C[C@@H](N[C@H](C)c2ccccc2O)[C@H]1OC 895851975 LXDPXNDOBLEKBS-PZTHBURQSA-N 265.353 2.235 10 20 CECD Nc1ccc(CCNC(=O)N2CCC[C@H](CF)C2)cc1 892039500 VXHADQGFIZXXDO-CYBMUJFWSA-N 279.359 2.202 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1ccc2c(c1)CCCO2 894897252 LKRSMZUOBUNRJN-OAHLLOKOSA-N 289.375 2.443 10 20 CECD C[C@@H](NCc1cccc(Cl)c1O)C1(CO)CC1 696098767 GSVFCHSYXDSMBC-SECBINFHSA-N 255.745 2.296 10 20 CECD C[C@]1(CNCc2ccc(N3CCCC3)cc2)CCC(=O)N1 1326637540 PYHQFFOJYCVYBL-QGZVFWFLSA-N 287.407 2.045 10 20 CECD CCSC1(CNC(=O)NCc2ccc(N)cc2)CC1 1336150117 KCZFQDFVEOQJRD-UHFFFAOYSA-N 279.409 2.354 10 20 CECD Cc1cc(CN[C@H](C(=O)O)C(C)C)ccc1N(C)C 1600211783 FGPYOHIIYXUJDA-AWEZNQCLSA-N 264.369 2.260 10 20 CECD Nc1cc(CN2CCCC2)c(O)c(CN2CCCC2)c1 27883080 ZCVLBPMYDFQUBD-UHFFFAOYSA-N 275.396 2.166 10 20 CECD COc1ccc(CNCCCn2ccnc2)cc1C 35052419 NSKFLFFFCPUIJA-UHFFFAOYSA-N 259.353 2.380 10 20 CECD CN(C)c1ccc(CN[C@H]2[C@@H]3C[C@@H]2CN3)c(C(F)(F)F)c1 1578425391 BCCFGSXAXGWABV-DDTOSNHZSA-N 299.340 2.221 10 20 CECD O=C(O)C1(NCc2ccc3c(c2)CCCO3)CCCC1 1777600205 UJDASJJCGBOVJI-UHFFFAOYSA-N 275.348 2.499 10 20 CECD CCN1CCCc2cc(CNC[C@H](C)C(=O)O)ccc21 1776876066 QAWOJPHOLVWDPW-LBPRGKRZSA-N 276.380 2.269 10 20 CECD CCOC[C@H]1CCN(Cc2cc(OC)c(OC)cc2O)C1 160349837 MDNLEJLOZXNYSD-LBPRGKRZSA-N 295.379 2.268 10 20 CECD C[C@H](NCCCn1cccn1)c1ccc(F)cc1O 126319078 PVVZNYMWGAEZDI-NSHDSACASA-N 263.316 2.469 10 20 CECD Cc1cccc(O)c1CNCCC(=O)NC(C)(C)C 877025300 GKMPRRBBTDEVQW-UHFFFAOYSA-N 264.369 2.095 10 20 CECD COc1ccc(O)c([C@H](C)NCC[C@H](O)C2CC2)c1 898199001 XXJFTHXEUIDTRS-HZMBPMFUSA-N 265.353 2.212 10 20 CECD CN(C)c1ccc(CNC(=O)CC2(O)CCCC2)cc1 118758946 WXWFINIAIXVASA-UHFFFAOYSA-N 276.380 2.064 10 20 CECD COc1ccc(CNCC2(S(C)(=O)=O)CCC2)cc1C 279841059 QXZMBRNYAWCCQD-UHFFFAOYSA-N 297.420 2.061 10 20 CECD Cc1n[nH]cc1CN1CCOc2cc(N(C)C)ccc21 184944915 WHNFEZJHJFBNNF-UHFFFAOYSA-N 272.352 2.183 10 20 CECD CC(C)OCCCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186425690 AFVVWDCUIGVNTB-GFCCVEGCSA-N 295.379 2.350 10 20 CECD Oc1ccccc1CNC[C@@H](O)c1cccc(F)c1 134228751 AUQJCNLNKDFGTE-OAHLLOKOSA-N 261.296 2.355 10 20 CECD CCCNC(=O)CCNCc1ccc(N2CCCC2)cc1 44351324 JQWZPMXITWSYRW-UHFFFAOYSA-N 289.423 2.293 10 20 CECD CCCOc1ccc(CN2C[C@H](OC)[C@H](OC)C2)c(O)c1 233250874 PSRALCKDJMJJAM-IYBDPMFKSA-N 295.379 2.027 10 20 CECD CN(Cc1ccccc1O)Cc1cc2c(cc1O)OCO2 91974622 LYENHTNXHMXSFD-UHFFFAOYSA-N 287.315 2.459 10 20 CECD CN(C)[C@@H]1CCC[C@H](NC(=O)NCc2ccccc2O)C1 267285086 ARKAWQZTMHRCTE-UONOGXRCSA-N 291.395 2.064 10 20 CECD CC[C@@H](NC[C@@H](C)CO)c1ccc(N(C)C)cc1 268799315 AOQBFNOKJGZUTD-IUODEOHRSA-N 250.386 2.422 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2cccn2C)cc1 266470830 JDWFRQSBJWEPPA-UHFFFAOYSA-N 286.379 2.091 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)C[S@@](C)=O)c(O)c1C 273470126 RVMIBZZQFYSYDF-GDAOTKPNSA-N 269.410 2.427 10 20 CECD Cc1ccc(C(=O)NC2(C3CC3)CCOCC2)c(O)c1O 375101019 QULNDYNXXRILJN-UHFFFAOYSA-N 291.347 2.095 10 20 CECD CCCN(CC(=O)NCc1ccc(N(C)C)cc1)C1CC1 298176171 RENSMHUXNKOIGA-UHFFFAOYSA-N 289.423 2.243 10 20 CECD CS[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 295086264 QZOVSRIRRKULCW-SNVBAGLBSA-N 267.350 2.058 10 20 CECD Nc1ccc(CCN[C@@H]2CCN3CCC[C@H]3C2)cc1 817956212 TZCPJOUWFIERLR-CVEARBPZSA-N 259.397 2.028 10 20 CECD C[C@](CO)(NCc1cc(Cl)c(F)cc1O)C1CC1 816564198 XQGFIESQLRZWQE-CYBMUJFWSA-N 273.735 2.435 10 20 CECD C[C@H](NC[C@@]1(C)CCCNC1)c1cc([N+](=O)[O-])ccc1O 817965816 CISCEAJOBLOGJQ-NHYWBVRUSA-N 293.367 2.341 10 20 CECD C/C=C\C(=O)NC1CCN(c2ccc(OC)cc2)CC1 726629956 FNHAWTSZQLFAEL-ARJAWSKDSA-N 274.364 2.356 10 20 CECD CN(C)c1ccc(CN(C)S(=O)(=O)C2CCC2)cc1 820780575 VLZBOPRNSGWKLK-UHFFFAOYSA-N 282.409 2.067 10 20 CECD CCCCC[C@@H](O)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 828884947 PDFZJGCWCVUYEU-SMDDNHRTSA-N 295.379 2.086 10 20 CECD Cc1cnn(CCC(=O)N[C@H](C)c2ccccc2O)c1 827930402 JHHKWXVNQIZILD-GFCCVEGCSA-N 273.336 2.165 10 20 CECD CCOc1cccc(CN(C)Cc2noc(C)n2)c1O 827892475 ZJTNLHPEOBUWBX-UHFFFAOYSA-N 277.324 2.114 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2cc(Cl)c(C)cc2O)C1 827501659 ZYGBHIOZBCOEFU-JGZJWPJOSA-N 283.755 2.395 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@]1(Cl)C[C@H]2CC[C@H]1O2 906990484 DHTBPQHYBCGIKH-UXIGCNINSA-N 295.766 2.280 10 20 CECD C[C@H]1CN(C(=O)/C=C/c2cnn(C)c2)c2ccccc2O1 732033055 GBEZRUICNOVRJR-GUOLPTJISA-N 283.331 2.247 10 20 CECD CC(C)Cc1noc(COC(=O)c2cc(O)cs2)n1 731910915 WSWDBHROWLPOIC-UHFFFAOYSA-N 282.321 2.392 10 20 CECD CCC(N)(CC)CNCc1cc(OC)ccc1O 841030486 JDKPUDBKEMYDAJ-UHFFFAOYSA-N 252.358 2.008 10 20 CECD CCN(CC)c1ccc(CNC(=O)C(C)(C)CO)cc1 847357695 NHEGSLUSTWRXSO-UHFFFAOYSA-N 278.396 2.168 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@H]1[C@H]2c3ccccc3C[C@H]21 910942603 FZCZUSFRBSZFDG-HYVNUMGLSA-N 295.338 2.300 10 20 CECD CNC[C@H]1CCCN1Cc1cc(Cl)cc(C(C)=O)c1O 843352637 JLVITOOFAKARNN-CYBMUJFWSA-N 296.798 2.432 10 20 CECD Cn1cc(/C=C\C(=O)N2CCc3ccc(F)cc32)cn1 746805144 UIXISSFRVGRBTB-DJWKRKHSSA-N 271.295 2.162 10 20 CECD C[C@H]1CCC[C@H]1NC(=O)NCCc1ccc(N)cc1 841795016 VQGKXJTURGCQJD-SMDDNHRTSA-N 261.369 2.299 10 20 CECD C[C@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)CCN1 841061418 IRQSLNRGSIBEKO-WCQYABFASA-N 265.376 2.122 10 20 CECD CCc1cccc(CN2CCC(OC(C)=O)CC2)c1O 848885851 AWXKTCSQRGXCOK-UHFFFAOYSA-N 277.364 2.482 10 20 CECD Cc1cccc(CN[C@H]2c3ccccc3C[C@@H]2O)c1O 848925669 BJKDNJGWGMVLOJ-HOTGVXAUSA-N 269.344 2.449 10 20 CECD CCOCCOCCCC(=O)NCc1cc(C)ccc1O 862754093 QWYSWRKGCHZUKL-UHFFFAOYSA-N 295.379 2.150 10 20 CECD C[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@]1(C)CO 862418026 KCLMVKZOZUOQNN-MEDUHNTESA-N 298.377 2.481 10 20 CECD Cc1ccc(O)c(CNC(=O)C2SCCS2)c1 862758098 OPGBXEUSLYQOAL-UHFFFAOYSA-N 269.391 2.123 10 20 CECD CCN1C[C@H](C)N(Cc2cccc(OC)c2O)C[C@@H]1C 769465545 HEBSJBBSLMAZPI-STQMWFEESA-N 278.396 2.315 10 20 CECD COc1cccc(O)c1CNCCNc1cccc(C)n1 769401151 PQTFVOTWXRJEEV-UHFFFAOYSA-N 287.363 2.306 10 20 CECD COc1ccc(O)c(CN2CCC(C(C)(C)O)CC2)c1 877754063 UNQZNKSTBGPAMN-UHFFFAOYSA-N 279.380 2.384 10 20 CECD CO[C@@H]1CCC[C@H]1CNCc1cc(F)ccc1O 779106257 BACBXJKHLVUVNG-IINYFYTJSA-N 253.317 2.436 10 20 CECD COc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1F 778916351 FLJRMEBJMLTJEI-UHFFFAOYSA-N 291.278 2.176 10 20 CECD COc1nc(C)cc(NCc2ccc(N(C)C)cc2)n1 780905804 BAYCFNOBYHDRQG-UHFFFAOYSA-N 272.352 2.472 10 20 CECD CCOC[C@@H]1CCCCN1C(=O)NCc1ccc(N)cc1 1120677820 XNCOUVHKMPTICK-HNNXBMFYSA-N 291.395 2.369 10 20 CECD CCOCc1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881377971 AAXDZEAGTFBRKB-UHFFFAOYSA-N 274.368 2.237 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2C[C@H]2[C@@H]2C[C@H]2C)c1O 896401930 VAHMJHFXMLDTGM-KXGXSXBTSA-N 292.335 2.443 10 20 CECD C[C@H](O)[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 780786878 OOMABHGYTBRZJW-VHSXEESVSA-N 255.745 2.248 10 20 CECD COc1ccc(O)c(CNC(=O)C2(SC)CCC2)c1 787450066 PLHFWRQNWOPCBC-UHFFFAOYSA-N 281.377 2.303 10 20 CECD COc1ccc(CN2C[C@H](C)OC[C@H]2C)c(O)c1OC 891669262 AYMPPWBRQYMKEY-MNOVXSKESA-N 281.352 2.019 10 20 CECD COc1ccc(CNC[C@@]2(O)CCC[C@H]2C)c(O)c1OC 894642038 KJYALJKKHLIIHL-BZNIZROVSA-N 295.379 2.050 10 20 CECD CC[C@H](N[C@H](C)c1ncnn1C)c1ccccc1O 276696460 VHQVQCAZWHKUFU-PWSUYJOCSA-N 260.341 2.323 10 20 CECD CCOc1cccc(CN[C@H]2CCC[C@H]2CCO)c1O 189974894 HFRRMVPZTWZJHW-JSGCOSHPSA-N 279.380 2.432 10 20 CECD Cc1nnc(CCNCc2cc(F)cc(F)c2O)s1 708534692 DMILWENFUBUBHC-UHFFFAOYSA-N 285.319 2.163 10 20 CECD CCN1C(=O)/C(=C/c2ccoc2C(=O)OC)SC1=S 796972572 RJLGTAAPPDOYEL-VURMDHGXSA-N 297.357 2.287 10 20 CECD CN(Cc1ccccc1O)C(=O)NC1CCSCC1 195472798 WRAXHSJPNKSFPY-UHFFFAOYSA-N 280.393 2.429 10 20 CECD COc1ccc(CNC(=O)c2cc(F)ccc2O)c(O)c1 794387020 CHFSJIGDHGYZOK-UHFFFAOYSA-N 291.278 2.176 10 20 CECD CCc1cccc(CN2CCCN(C(C)=O)CC2)c1O 692091245 DCICXEXFPQMFTH-UHFFFAOYSA-N 276.380 2.009 10 20 CECD Cc1ccc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)c(O)c1 1600414200 GTSHINFEPAKGLF-WCQYABFASA-N 263.337 2.243 10 20 CECD CN(C(=O)NCc1ccc(N)cc1)[C@H](CO)CC(C)(C)C 1346739689 SZNKOKRMDQEADZ-AWEZNQCLSA-N 293.411 2.207 10 20 CECD O=C(O[C@H](C(=O)O)c1ccsc1)c1cccc(O)c1O 1602605469 OLCOHWQENXJYQW-NSHDSACASA-N 294.284 2.142 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1cc(F)c(N(C)C)cc1F 1603498410 BZGGABDGRAQEII-LBPRGKRZSA-N 286.322 2.326 10 20 CECD O=C(/C=C/[C@@H]1CCCNC1)N1CCc2cc(F)ccc21 1580491952 WNKSFTJNBNGZHX-UXONFWTHSA-N 274.339 2.271 10 20 CECD CCOc1ccc(CN2CC[C@@](C)(C(=O)O)C2)c(O)c1 1592448053 VTYWSEBRKFLLRR-OAHLLOKOSA-N 279.336 2.088 10 20 CECD COc1cccc(CNC(=O)Nc2ccc(C)nc2)c1O 161576274 IQKYQABKGQYYGA-UHFFFAOYSA-N 287.319 2.426 10 20 CECD CN(C)c1ccc(CNc2ncnc3nn(C)cc23)cc1 162909096 HWRNWMMOYJYEBM-UHFFFAOYSA-N 282.351 2.041 10 20 CECD COCc1ccccc1NC(=O)c1cccc(O)c1O 126311670 ZTWMSPFIGIXMPV-UHFFFAOYSA-N 273.288 2.497 10 20 CECD O=C(NCCc1ccccc1F)c1cccc(O)c1O 126208638 YQIPHKLMPLXMSS-UHFFFAOYSA-N 275.279 2.209 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@H](C)c1cc(F)ccc1O 94617747 AAVGUNQUIHHKLH-GHMZBOCLSA-N 282.359 2.487 10 20 CECD CN(C)c1ccc(CN(C)c2c([N+](=O)[O-])ncn2C)cc1 8374612 IOUNTVUNTHWLPI-UHFFFAOYSA-N 289.339 2.031 10 20 CECD C[C@H](NC1CC1)c1ccc(N2CCOCC2)c(F)c1 20551014 MRIVQKDYLQCSLL-NSHDSACASA-N 264.344 2.475 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@](C)(O)C2)c1O 184701466 DLZHKRQHPLJTBN-CYBMUJFWSA-N 271.744 2.011 10 20 CECD O=C(C[C@@H]1CCCO1)NCCCSc1nccs1 74136467 GGKDERXYXYVAOC-JTQLQIEISA-N 286.422 2.311 10 20 CECD CC(=O)N1CCC(CN[C@H](C)c2ccc(F)cc2O)CC1 185377098 XOYIEAZKTFZDJF-LLVKDONJSA-N 294.370 2.440 10 20 CECD O=C(NCc1ccc(N2CCOCC2)cc1)C1=CCCC1 131123563 QVEWNFKQYHXVHS-UHFFFAOYSA-N 286.375 2.250 10 20 CECD Oc1ccc(F)cc1CNc1cccc(-c2nnn[nH]2)c1 226561276 VQPKDALXVRLRKB-UHFFFAOYSA-N 285.282 2.324 10 20 CECD C[C@@H](NCCN(C)C)c1cc(Br)ccc1O 286871797 BVUBDMYWADYXRF-SECBINFHSA-N 287.201 2.367 10 20 CECD CCC1(CO)CCN(Cc2cccc(OC)c2O)CC1 93592230 PMZZFRBDHLKPNS-UHFFFAOYSA-N 279.380 2.385 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(N)cc2)on1 269153239 WUBZJMJZHLDKHW-UHFFFAOYSA-N 273.336 2.353 10 20 CECD C[C@@H]1C(=O)NCCN1Cc1cc(-c2ccccc2)ccc1O 271209459 TYICDPMUMNCOOH-CYBMUJFWSA-N 296.370 2.380 10 20 CECD COC(=O)[C@H]1C[C@@H](C)CCN1Cc1cccc(C)c1O 274923153 MSMYVFJGEUYBRV-SMDDNHRTSA-N 277.364 2.474 10 20 CECD COc1ccc(O)c(CNC[C@@](C)(O)c2cccs2)c1 271877523 ZUIZQDFSZBVFMM-OAHLLOKOSA-N 293.388 2.460 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CCc3c[nH]nc3C2)c1 370395859 JOERGYOFTLGWFX-PWSUYJOCSA-N 287.363 2.332 10 20 CECD CC[C@@H](N[C@@H](C)c1ncnn1C)c1ccc(F)cc1O 287385533 ILYAREHWTBIBIW-JOYOIKCWSA-N 278.331 2.462 10 20 CECD CCN(Cc1nnnn1C1CC1)c1ccc(OC)cc1 299331004 CBWCSFIFEGUJPQ-UHFFFAOYSA-N 273.340 2.043 10 20 CECD CC(=O)C(=O)CSc1nnc(Cc2ccccc2F)o1 808021850 WJVKAWYEOSQBES-UHFFFAOYSA-N 294.307 2.050 10 20 CECD CCOC(=O)[C@H](F)C1CN(Cc2cc(C)c(C)cc2O)C1 294043593 WLGZRRBYUGUGEN-OAHLLOKOSA-N 295.354 2.342 10 20 CECD Cc1cc(CN2CC[C@H](C)[C@H]2CO)ccc1N(C)C 294757045 YBTGOTVDDQRGPD-BLLLJJGKSA-N 262.397 2.264 10 20 CECD CCN(CC1CC1)C(=O)c1c(F)ccc(O)c1O 295247168 MGSADZOGBSYHHC-UHFFFAOYSA-N 253.273 2.109 10 20 CECD OC[C@@H]1CN(Cc2cccc(Cl)c2O)CCC1(F)F 291236838 KXHLFEINKKIOKE-JTQLQIEISA-N 291.725 2.495 10 20 CECD CC[C@@H](NC[C@@H]1CNCCCO1)c1ccc(C)cc1O 817982466 SSIJGZIHVRKEEZ-DZGCQCFKSA-N 278.396 2.120 10 20 CECD C[C@H](NCC1=CCNCC1)c1cc(F)cc(F)c1O 817967374 GQJRVTHGGXOJPL-VIFPVBQESA-N 268.307 2.241 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(C)no2)c1 728985672 ZQLLRHOWJOUUIO-VIFPVBQESA-N 276.292 2.188 10 20 CECD O=S(=O)(CCCCF)Nc1ccc(O)cc1F 829906112 FBPBOCOVBZLVHZ-UHFFFAOYSA-N 265.281 2.023 10 20 CECD O=C1CC[C@@H]2[C@H]1[C@@H]2C(=O)NCc1c(O)ccc2c1CCCC2 907059290 IVZWIUZVAZKBOB-CSMYWGQOSA-N 299.370 2.112 10 20 CECD CCOc1ccc(CNC[C@](C)(O)C2CC2)c(O)c1 732668939 LTJGSBUQALDLIY-HNNXBMFYSA-N 265.353 2.042 10 20 CECD COc1ccc2c(c1)CCCN2CC(=O)N(C)C1CC1 733193499 SHQXJMCQVDNZEA-UHFFFAOYSA-N 274.364 2.069 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1C[C@H]2CC[C@H]1O2 837586632 FITHIZAWUPPDGV-PXNTVVDSSA-N 290.315 2.222 10 20 CECD Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@H]1CCOC1 732203619 YYGINVANUUEGCA-ZBFHGGJFSA-N 291.391 2.410 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCC[C@@H]2C[C@@H]21 838256472 SGYNPGXINUWGIK-CGRPGPNWSA-N 273.332 2.416 10 20 CECD O=C(/C=C/c1ccco1)OCC(=O)c1ccc(O)c(O)c1 916590033 ANNJXZUAGCSVRI-GQCTYLIASA-N 288.255 2.130 10 20 CECD CCOc1ccc(CN[C@@H]2CCN(C)[C@@H](C)C2)c(O)c1 742374627 AQWZPBLGNVLUPS-GXTWGEPZSA-N 278.396 2.363 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)OCO3)CC2(CCC2)O1 842644712 TZCDLADTVGIMAS-NSHDSACASA-N 291.347 2.264 10 20 CECD Nc1ccc(NC(=O)N2C[C@]3(CCCO3)[C@@H]2C2CC2)cc1 841298745 FEURUQWLEIDYGJ-GOEBONIOSA-N 287.363 2.444 10 20 CECD COc1ccc(N(C)Cc2nccnc2C)cc1OC 857038676 BSPFTQBGIMLADW-UHFFFAOYSA-N 273.336 2.439 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H](N2CCCC2=O)C1 876715135 JLEHGVVYQUZWNV-AWEZNQCLSA-N 288.391 2.287 10 20 CECD COC(=O)c1cc(CN[C@H](C)c2ccccc2O)c[nH]1 877756571 UAYXKIXZQNMKCI-SNVBAGLBSA-N 274.320 2.358 10 20 CECD NC[C@H]1CC[C@H](N[C@@H]2CCc3cccc(O)c32)CC1 873239199 PKLGUJZPILAVNY-MRVWCRGKSA-N 260.381 2.487 10 20 CECD Cc1ccc(CN[C@@H](C)Cc2cnccn2)c(O)c1 876975388 FGHSHXKSOGVNSC-LBPRGKRZSA-N 257.337 2.211 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)c2ccc[nH]2)c(O)c1O 780997224 CDBMNCXGDDFJFM-VIFPVBQESA-N 260.293 2.225 10 20 CECD CSC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCC1 787236353 WVVFVJKKEBLQIN-UHFFFAOYSA-N 296.344 2.109 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2cc(C)c(C)cc2O)C1 896126160 WRCUKTNZPLBDMG-OCCSQVGLSA-N 277.364 2.440 10 20 CECD CC(=O)OC[C@H](C)NCc1ccc2c(c1)CCCN2C 892732716 JPSZBLGUYOLABF-LBPRGKRZSA-N 276.380 2.110 10 20 CECD COc1cc(C)cc(CNCCO[C@@H]2CCCCO2)c1O 894794301 NOYIMYDHEVGJKT-OAHLLOKOSA-N 295.379 2.342 10 20 CECD Cc1ccc(O)c(CNc2ccc(-n3cncn3)cn2)c1 790247656 QDVZPIYIRARAMQ-UHFFFAOYSA-N 281.319 2.288 10 20 CECD COc1ccc(CNc2ncc([N+](=O)[O-])s2)c(O)c1 799961894 GQNNEDDWMFAFTB-UHFFFAOYSA-N 281.293 2.378 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@@H]1c1ccccn1 790574821 STXOYSBTWOVGEU-CYBMUJFWSA-N 284.315 2.470 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](CO)CC(F)(F)F)c1 717809903 FYAHQGDXHDCUGK-DTWKUNHWSA-N 293.285 2.365 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2nccn3c(C)nnc23)c1 1336503647 QCJAPQGXQPLLMZ-SECBINFHSA-N 299.334 2.320 10 20 CECD Oc1c(F)cc(F)cc1CN1CC[C@@](O)(C2CC2)C1 1262111063 VUIYFKSMRVGOJS-AWEZNQCLSA-N 269.291 2.017 10 20 CECD CN(C)c1ccc(CNCCCCC(=O)O)cc1 820547684 AXGLWXGNBOMBPG-UHFFFAOYSA-N 250.342 2.097 10 20 CECD Cc1cc(CNC(=O)CNC2CC2)c(C)n1-c1ccccc1 1579602197 XGSUHVYBLPNPDX-UHFFFAOYSA-N 297.402 2.462 10 20 CECD CCc1cccc(CNCC[C@@H](N)C(C)C)c1O 1578266208 DPUZZMBMAMFMEE-CQSZACIVSA-N 250.386 2.418 10 20 CECD Nc1ccc(NC(=O)c2cc3cc[nH]c(=O)c3s2)cc1 1580449149 DLUUEQYTHRQKPD-UHFFFAOYSA-N 285.328 2.424 10 20 CECD CC(C)[C@H](O)CNCc1ccc(N2CCCC2)cc1 134694792 RFNPDBPYUFGOMK-MRXNPFEDSA-N 262.397 2.393 10 20 CECD CC(=O)N1CC[C@H](CN(C)Cc2cc(C)c(C)cc2O)C1 165139460 OYYHCTSMUAYHKX-OAHLLOKOSA-N 290.407 2.309 10 20 CECD Cc1ccc(O)c(CNC2CN(C(=O)OC(C)(C)C)C2)c1 152504990 DCYIMPOBTZXFDP-UHFFFAOYSA-N 292.379 2.410 10 20 CECD COc1cc(CN2C[C@H](C)OC[C@@H]2C)c(O)cc1C 159766211 NBELWAXYRWEWAJ-RYUDHWBXSA-N 265.353 2.318 10 20 CECD COC[C@H](CO)N[C@H](C)c1ccc2ccccc2c1O 234842712 YNFRMOLLRRAKPX-YPMHNXCESA-N 275.348 2.203 10 20 CECD COc1ccc(O)c(CNCCN2CCCCCC2)c1 40767581 LVCOWUQOKUMNKU-UHFFFAOYSA-N 278.396 2.366 10 20 CECD CN(C)c1ccc(CNCCc2ccncc2)cc1 48261188 KQGKWODWCWCKIP-UHFFFAOYSA-N 255.365 2.480 10 20 CECD CCOc1cccc(CNCC23CC(CO2)C3)c1O 527790151 SETIFSUSHKBXFM-UHFFFAOYSA-N 263.337 2.060 10 20 CECD N[C@@H](CC1CCCCC1)C(=O)NCc1ccccc1O 380297555 TWWQBGBIILMLDG-AWEZNQCLSA-N 276.380 2.306 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)C1CC1 186429455 UZOOJEOXTKWWET-VHSXEESVSA-N 263.337 2.191 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@H]2CCNC2)c1C 127745943 ORSRPUQRRZVFJL-HNNXBMFYSA-N 297.402 2.494 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2ccc(F)cc2O)C1 185787836 KPJTWTIUUOIADM-ZYHUDNBSSA-N 280.343 2.193 10 20 CECD CSC[C@H](CCO)N[C@@H](C)c1ccc(F)cc1O 185530239 BXJPESPSYRFVHC-ONGXEEELSA-N 273.373 2.296 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H](C)c1cc(F)ccc1O 185512220 RZFVVKSISSIFOP-JRKPZEMJSA-N 273.373 2.294 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCC[C@H]2O)cc1F 74370960 YQHDQMFDIVAVBU-UKRRQHHQSA-N 266.360 2.285 10 20 CECD COCCN(Cc1ccccc1)C(=O)Cc1ccc(N)cc1 237080886 CTEHBPGPOJYNNI-UHFFFAOYSA-N 298.386 2.487 10 20 CECD COc1ccc(C(=O)NCc2ccccc2O)cc1OC 133779653 JEXTXZVQBKTOTF-UHFFFAOYSA-N 287.315 2.339 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2(SC)CC2)c1 194969067 AXWLUVBRZHXXEM-UHFFFAOYSA-N 296.392 2.096 10 20 CECD CCc1nc(C)cc(NCCc2ccc(O)c(O)c2)n1 288494028 RRJTUPOIPMPYQF-UHFFFAOYSA-N 273.336 2.413 10 20 CECD O=C(NC[C@@H]1[C@@H]2Cc3ccccc3[C@@H]12)c1cccc(O)c1O 193138240 HGFLDTDVMMWBPT-SQWLQELKSA-N 295.338 2.414 10 20 CECD CC1(C)CN(Cc2cc(F)ccc2O)CC[C@H]1O 275814852 DSDKIPCXOIIQKG-CYBMUJFWSA-N 253.317 2.124 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H]2CC(=O)N(C(C)C)C2)c1 273520450 UAZZDMWTMZWWFD-STQMWFEESA-N 276.380 2.361 10 20 CECD CC(C)Oc1ccc(N(C)Cc2cnnn2C)cc1 277307259 BKXCPWYXRPETCP-UHFFFAOYSA-N 260.341 2.239 10 20 CECD Oc1ccc(F)cc1CN[C@H]1COc2ccccc2[C@H]1O 290270833 XVULRCQUPRLMSQ-XJKSGUPXSA-N 289.306 2.116 10 20 CECD CC[C@@H](N[C@@H](CN)C1CC1)c1ccc(F)cc1O 817959608 DIXCFWLTUAJYIB-OLZOCXBDSA-N 252.333 2.309 10 20 CECD C[C@H]1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 819168521 QBNSPSUVHZLOSX-WCQYABFASA-N 288.347 2.345 10 20 CECD C[C@H]1C[C@@H](NC2CCNCC2)c2c(O)ccc(F)c21 817937118 TXHBCXRNJZGMOD-JOYOIKCWSA-N 264.344 2.421 10 20 CECD CC[C@@H](NCCNC)c1cc(Br)ccc1O 817953216 XJIRSVBWDKXDIZ-LLVKDONJSA-N 287.201 2.415 10 20 CECD Cc1ncc(CN(C)C(=O)c2cc(O)cs2)s1 732274795 SQWKUGLLLAXOCI-UHFFFAOYSA-N 268.363 2.491 10 20 CECD CCOc1cccc(CN2CC(OCC(F)F)C2)c1O 839138175 MRUXTCHEKIZDRU-UHFFFAOYSA-N 287.306 2.257 10 20 CECD C[C@H](NC[C@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 846205512 HTCFKGFJSBZDRU-NWDGAFQWSA-N 274.364 2.054 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H]([C@@H](C)N)C2)c1O 843364443 IGBOMRCSZSTVJL-MWLCHTKSSA-N 296.798 2.417 10 20 CECD CC[C@@H](C)CN(CC)C(=O)C(=O)Nc1ccc(N)cc1 841057686 LLKLXRWPXBFXCW-LLVKDONJSA-N 277.368 2.102 10 20 CECD O=C(NCc1nc2ccc(F)cc2[nH]1)c1cc(O)cs1 748377072 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Cc1cc(C(=O)CN2CC[C@@H]2CO)c(C)n1-c1ccccc1 934030139 XOMBPOGIAFTRLI-MRXNPFEDSA-N 298.386 2.343 10 20 CECD CCOc1ccc(CN2CCC[C@H](CCO)C2)c(O)c1 769333278 JDCORKALGWMJGA-CYBMUJFWSA-N 279.380 2.385 10 20 CECD C[C@@H](CNCc1cc(F)c(N(C)C)cc1F)CC(=O)O 864513238 XQZHPRYNKHEMBH-SECBINFHSA-N 286.322 2.231 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2(F)CCOCC2)c1 866763950 JKMQTKJWMWXKLU-JTQLQIEISA-N 297.326 2.097 10 20 CECD OC[C@H](CC(F)(F)F)NCc1ccc2c(c1)CCCO2 1354169867 IENGFDBGPCILJV-LBPRGKRZSA-N 289.297 2.415 10 20 CECD COC(=O)[C@H]1C[C@H](C)CCN1Cc1ccccc1O 776000790 NPSCOCLQEKDHNZ-DGCLKSJQSA-N 263.337 2.166 10 20 CECD COCc1noc(CN[C@@H](C)c2ccc(N(C)C)cc2)n1 775833924 HRYVMZZRDHELRF-NSHDSACASA-N 290.367 2.133 10 20 CECD Cc1ncc(CCNC(=O)c2cc(O)cs2)s1 772532880 FSFLPDLSJYKMEM-UHFFFAOYSA-N 268.363 2.191 10 20 CECD Cc1cc(C(=O)NC2CSC2)c(C)n1-c1ccccn1 880737719 MOQGXTGEZZEGMP-UHFFFAOYSA-N 287.388 2.334 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCC[C@@H]2OC)c1 776256930 SVRJSFMMSRENEG-NHYWBVRUSA-N 265.353 2.306 10 20 CECD Cc1ncc(CN2CCOc3cc(N(C)C)ccc32)cn1 774754169 YXFZGAIDZQQMHS-UHFFFAOYSA-N 284.363 2.250 10 20 CECD COc1cc(Cl)cc(CNC[C@@H]2CC(C)=NO2)c1O 895302856 CGIIDBLVAFMRHT-NSHDSACASA-N 284.743 2.309 10 20 CECD C/C=C(/C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 893608689 ZOWFODMBNUAWLE-CPSFFCFKSA-N 287.407 2.021 10 20 CECD CCN(CC)C(=O)CN(C)Cc1ccc(N(C)C)cc1 102675116 XCWMXUPPXRHRKH-UHFFFAOYSA-N 277.412 2.053 10 20 CECD CC[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@@H]1O 792173171 TXCRVBIOMXSEJI-PELKAZGASA-N 273.735 2.387 10 20 CECD Cc1cccc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)n1 792494288 SHUAWIVJBLTZJA-SOFGYWHQSA-N 298.342 2.173 10 20 CECD C[C@H]1C[C@@H](C(=O)N(C)Cc2ccccc2O)CCO1 776466534 YVPGAKWNNPBLBK-RYUDHWBXSA-N 263.337 2.166 10 20 CECD C[C@H]1CC[C@H](NCc2ccc(Br)cc2O)CN1 1246341642 BLZIIHOGVRATCZ-CABZTGNLSA-N 299.212 2.385 10 20 CECD CCOCc1cc(CNCC[C@H](C)NC)ccc1OC 1345100396 QLEDVQSCKIVTFZ-ZDUSSCGKSA-N 280.412 2.319 10 20 CECD Cc1ncc(CNC(=O)N[C@H](C)c2ccccc2O)o1 1348720086 SOOLNTKRMBRLEI-SECBINFHSA-N 275.308 2.249 10 20 CECD C[C@H]1CCCC[C@@H]1OCC(=O)NCc1cccc(O)c1O 1348045650 FTEFQOPQPYYPGV-FZMZJTMJSA-N 293.363 2.309 10 20 CECD Cc1cccc(CN2C[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c1O 1607851084 XUVNWYRCNBFKGP-YUTCNCBUSA-N 275.348 2.386 10 20 CECD Cc1cc(O)c(CN(C)CCC(=O)O)cc1Cl 1605213527 QXRASEMSLLRVFO-UHFFFAOYSA-N 257.717 2.261 10 20 CECD CC1(C)OC[C@H](CCSc2ncc(C(=O)O)s2)O1 1604559399 FZNAWBRDACYQAI-ZETCQYMHSA-N 289.378 2.475 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H]2CC(=O)O)c1O 229118930 WRWBLYUBMYXPRR-LLVKDONJSA-N 299.754 2.493 10 20 CECD CN(Cc1ccccc1O)C(=O)C1(C(=O)O)CCCCC1 1593760562 CQSPPPGYRSFEKE-UHFFFAOYSA-N 291.347 2.386 10 20 CECD CN(C(=O)CCOCC(F)(F)F)c1ccc(N)cc1 232323232 NRUKCWBBXOUFIE-UHFFFAOYSA-N 276.258 2.201 10 20 CECD CCCNC(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 37280109 MHRTTXYDYOHOHE-CHWSQXEVSA-N 277.412 2.318 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2COCCO2)cc1 37997895 ANISMBXLLOAVOP-INIZCTEOSA-N 278.396 2.038 10 20 CECD C[C@@H](C(=O)NCc1ccccc1O)N1[C@H](C)CC[C@H]1C 263696158 NLOMJAQNUFAERQ-UPJWGTAASA-N 276.380 2.270 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCCN1 386111696 LOBGNYIJJXMDJT-BBRMVZONSA-N 261.413 2.373 10 20 CECD O[C@H](CNCc1ccc2c(c1)CCCO2)C(F)(F)F 921590121 YDVFXFBHDKGRGC-GFCCVEGCSA-N 275.270 2.024 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2ccc(N(C)C)cc2)C1 126447722 ZJTGLHMHZCSTSR-HIFRSBDPSA-N 289.423 2.414 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cn(C(C)(C)C)nn1 189364924 QDKKEOPMIDHYKJ-UHFFFAOYSA-N 288.351 2.011 10 20 CECD COC(=O)COc1ccc(N(C)Cc2cscn2)cc1 183807219 HPVOGXZASNVMGM-UHFFFAOYSA-N 292.360 2.331 10 20 CECD C[C@@H](N[C@@H]1CCCn2ncnc21)c1ccc(F)c(F)c1O 187751559 RYRWCURNASOQKY-LDYMZIIASA-N 294.305 2.448 10 20 CECD COCCC1(C(=O)NCc2cccc(OC)c2O)CCC1 131044749 LUXAQMZFGPCZCQ-UHFFFAOYSA-N 293.363 2.224 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)C(=O)NC(C)C)c1 228945982 ILJWXMDBLOGXHB-VXGBXAGGSA-N 264.369 2.264 10 20 CECD CN1C(=O)/C(=C\c2cccc3c2OCCO3)SC1=S 48642752 NYIWPUHMWFGJIG-JXMROGBWSA-N 293.369 2.289 10 20 CECD COc1ccccc1N(CCO)Cc1ccccc1O 267170350 UGGFKYCJAYPXRT-UHFFFAOYSA-N 273.332 2.400 10 20 CECD Cc1ccc([C@@H](O)CNCc2ccc3c(c2)CCO3)o1 265959100 ISLWYECGHIXLQF-AWEZNQCLSA-N 273.332 2.346 10 20 CECD Cc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)on1 273563883 IYUQKDICBILXRA-SECBINFHSA-N 277.280 2.448 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@@H](C)CCC[C@H]2CO)c1O 272697732 VPHMXEKKOIMKPZ-HZMBPMFUSA-N 295.354 2.469 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)c1 273516871 SSHFQHLKPVQLAD-VXGBXAGGSA-N 292.379 2.061 10 20 CECD CC[C@@H](NCC(C)(C)C(=O)NC)c1ccc(F)cc1O 285938765 DHBPZZODRACYIW-GFCCVEGCSA-N 282.359 2.344 10 20 CECD CC[C@@H](N[C@@H](C(N)=O)c1ccccn1)c1ccc(C)cc1O 296639293 BYABNYRLPRWFOO-CZUORRHYSA-N 299.374 2.363 10 20 CECD CC(=O)C(=O)COC(=O)C1(c2ccc(Cl)cc2)CC1 808487247 XHFUDNGUXOVMCX-UHFFFAOYSA-N 280.707 2.073 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2cc(F)cc(F)c2O)n1 818346951 WKMILVREZRPDAE-QMMMGPOBSA-N 296.321 2.441 10 20 CECD Cc1cc(CN2CCSC[C@H]2CCO)ccc1N(C)C 815061441 VEAZGTUEFMLWRN-OAHLLOKOSA-N 294.464 2.361 10 20 CECD OC[C@@H](C1CC1)[C@@H](NCc1ccccc1O)C1CC1 824845093 HOMWBWCCNVISTP-HOCLYGCPSA-N 261.365 2.279 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](CCCO)C2)cc1 825338306 ODDWVNXQZGJRJS-CQSZACIVSA-N 262.397 2.347 10 20 CECD COc1ccc(O)c(CNCc2ccc(C(=O)O)cc2)c1 820846060 PJLNRHUAYQKYQA-UHFFFAOYSA-N 287.315 2.389 10 20 CECD CN1CCN(C(=O)/C=C/c2cncc(F)c2)c2cccnc21 492063097 BPVBEGRDCVDUJQ-SNAWJCMRSA-N 298.321 2.112 10 20 CECD C[C@@H](NC(=O)CCC1(O)CCC1)c1ccccc1O 827952618 YQROHBLDRVPLRE-LLVKDONJSA-N 263.337 2.265 10 20 CECD N[C@@H](CC(=O)NCc1c(O)ccc2c1CCCC2)C1CC1 830597559 OHBHUHQGVGILTL-HNNXBMFYSA-N 288.391 2.015 10 20 CECD CC(C)ONC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 836405881 NFNMYFCGQCDOKW-NSHDSACASA-N 265.357 2.453 10 20 CECD CCC[C@H](CNC(=O)NCc1cc(OC)ccc1O)OC 838474995 VSUFSZBFMBIZLO-CYBMUJFWSA-N 296.367 2.015 10 20 CECD COc1ncc(C)cc1NC(=O)NCc1ccccc1O 746740754 RRDAOXXMGQAOHS-UHFFFAOYSA-N 287.319 2.426 10 20 CECD CC(=O)C(=O)COc1ccc(C(C)=O)c(Cl)c1 919427025 UAWQRRHDMXNGJQ-UHFFFAOYSA-N 254.669 2.080 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@H]1CCCN1 841035669 JOUZKZSOZRCADJ-JTQLQIEISA-N 258.724 2.026 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1C[C@H]2CC[C@H]1O2 846475199 DHARANWGMSKRRK-NTZNESFSSA-N 281.739 2.229 10 20 CECD Cc1ccc(C(=O)N[C@H]2C[C@@H]2c2cccnc2)c(O)c1O 847030253 KRHIDIFLJGJRHV-OLZOCXBDSA-N 284.315 2.087 10 20 CECD CC[C@H](NC[C@@H]1CC(=O)N(CC)C1)c1ccccc1O 846096358 GWODYRQELKZHGG-JSGCOSHPSA-N 276.380 2.301 10 20 CECD CC1(C)NCC[C@H]1NCc1cccc(Br)c1O 841088365 ZJNZWLVBBJPFMD-LLVKDONJSA-N 299.212 2.385 10 20 CECD CNC[C@@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 843349211 LWWHZPSTGCLNFI-NSHDSACASA-N 296.798 2.290 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1NCC1(C)C 843487473 GUFUYADNBMCCOY-HNNXBMFYSA-N 289.423 2.099 10 20 CECD N[C@H]1Cc2ccccc2N(Cc2cccc(F)c2O)C1 841107067 USLXXAPJMMVVBX-ZDUSSCGKSA-N 272.323 2.421 10 20 CECD CS/C=C\C(=O)NCc1ccc(N(C)C)c(F)c1 751464454 RZIYSLMWQVJAES-SREVYHEPSA-N 268.357 2.385 10 20 CECD COC(=O)N(C)CCN[C@@H](C)c1ccc(Cl)cc1O 850547299 SCZXARNURROYQT-VIFPVBQESA-N 286.759 2.394 10 20 CECD CCn1cc(CN[C@H]2C[C@H](C)c3c(F)ccc(O)c32)nn1 850522520 SUEQVYRHWVLSIX-CABZTGNLSA-N 290.342 2.481 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@H](S(C)(=O)=O)C2)c1 763381867 JEAJSAPLAOLLJI-AWEZNQCLSA-N 297.420 2.018 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)NCc1ccc(C)cc1O 877145745 BJHYLUPLBJQXKU-VXGBXAGGSA-N 264.369 2.093 10 20 CECD CCOC(=O)[C@H]1CSCCN1Cc1cccc(C)c1O 775648721 WLLLXYWHNPRXOD-CYBMUJFWSA-N 295.404 2.181 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@@H]1C(=O)Nc1ccc(N)cc1 884009130 MXEHBNGJSHNKIY-LKFCYVNXSA-N 270.336 2.297 10 20 CECD COc1ccc(CN(C)C[C@H]2CCCCO2)c(O)c1OC 891787248 SGFYQQZUKZAHCI-CYBMUJFWSA-N 295.379 2.410 10 20 CECD CC[C@]1(O)CCCN(Cc2ccc(OC)c(OC)c2O)C1 895758114 CFHWQKRURRSYST-INIZCTEOSA-N 295.379 2.146 10 20 CECD C[C@@H]1OCC[C@]12CN(Cc1cc(F)cc(F)c1O)CCO2 894603522 ZJNMPHYIKJQCKE-BONVTDFDSA-N 299.317 2.050 10 20 CECD COc1ccc(CNC(=O)NCC=C(C)C)c(O)c1 793076532 PGMKRBCUDNHSBR-UHFFFAOYSA-N 264.325 2.166 10 20 CECD COc1cccc(O)c1CNc1ccc(C(N)=O)c(C)c1 798085395 REQSZMFQDIUTPO-UHFFFAOYSA-N 286.331 2.420 10 20 CECD CC[C@H](N[C@H](C)C(=O)N(C)C)c1ccc(C)cc1O 794815301 JTNGOXHZLIKEGC-YPMHNXCESA-N 264.369 2.218 10 20 CECD Cc1nc([C@@H](C)NCc2cc(F)ccc2O)no1 1323768811 XNDHDVIYAOGFBL-SSDOTTSWSA-N 251.261 2.074 10 20 CECD CCCN1CCC[C@H](C(=O)Nc2ccc(N)cc2)C1 1341227200 ZHFSZNOXEOTZNP-LBPRGKRZSA-N 261.369 2.329 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CCC(F)CC1 1350467945 BOACQCQYZQKTNT-UHFFFAOYSA-N 282.344 2.188 10 20 CECD Nc1ccc(CN(CCO)CCc2ccccc2)cc1 1352788971 SINNEUYMKKIVGB-UHFFFAOYSA-N 270.376 2.306 10 20 CECD C[C@H](NC[C@H]1CCCC[C@@H]1O)c1cc(C(=O)O)ccc1O 1593286015 NPYIJZMWZBANHF-SUHUHFCYSA-N 293.363 2.292 10 20 CECD C[C@](NCc1ccc2c(c1)CCCO2)(C(=O)O)C1CC1 1776450449 ZEVGLFGHQDDMBJ-MRXNPFEDSA-N 275.348 2.355 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2(O)CCCCC2)c1 153939128 NWXOGEKGAQLVKF-LLVKDONJSA-N 293.363 2.273 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc[nH]2)c1 157851377 UOSCSTXIWDFVSO-VIFPVBQESA-N 260.293 2.220 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCN2CCC[C@@H]2C1 876940796 XTQMKNTZOYPKSY-ZIAGYGMSSA-N 260.381 2.417 10 20 CECD Cc1ccc(CN[C@@H](C)c2nnc3n2CCC3)c(O)c1 877166210 POYOEZZUJSLOLU-NSHDSACASA-N 272.352 2.089 10 20 CECD COc1ccc(CN[C@@H]2CCN3CCC[C@H]3C2)c(O)c1 252667500 KPODXWJHSJXVKY-KGLIPLIRSA-N 276.380 2.117 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)CN2CCOCC2)c(O)c1 36932533 MCRDXJBHDAOPEN-KGLIPLIRSA-N 278.396 2.072 10 20 CECD CN(Cc1ccccc1O)C(=O)CCNC(C)(C)C 37823795 KFFHVJYSEVZPRS-UHFFFAOYSA-N 264.369 2.129 10 20 CECD CCc1nn(C)c(NCc2ccccc2O)c1[N+](=O)[O-] 163773768 UHEJGXGCUFYPCI-UHFFFAOYSA-N 276.296 2.208 10 20 CECD COc1ccc(O)c([C@@H](C)NCC[C@H](C)OC)c1 273568728 KEWCEYQTUXEMRH-WDEREUQCSA-N 253.342 2.476 10 20 CECD Oc1cccc2c1[C@H](NCCCN1CCCC1)CC2 296211351 ZLAMYCIDIHUBET-CQSZACIVSA-N 260.381 2.455 10 20 CECD CCc1cccc(CN[C@@H](C)[C@@H](CO)SC)c1O 709456722 SZWLMVMWPYXEKN-GXFFZTMASA-N 269.410 2.157 10 20 CECD COc1ccc(O)c(CN2C[C@H](CN)[C@@H](C)C[C@H]2C)c1 397429071 ZGPBRDAQVYQUNI-SCRDCRAPSA-N 278.396 2.206 10 20 CECD CCN(CC)c1ccc(CNCCNC(=O)C(C)C)cc1 20125440 ITBHOLUJIIWGSZ-UHFFFAOYSA-N 291.439 2.395 10 20 CECD Cc1ccc(C(=O)N2CCS[C@@H](C)[C@@H]2C)c(O)c1O 179507720 XSMIGBGJZGJTLL-UWVGGRQHSA-N 281.377 2.372 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)C[C@@H]1CCCCO1 189426218 AGJYMHWOABFYLD-ZDUSSCGKSA-N 299.392 2.265 10 20 CECD COc1ccc(CN[C@H](C)[C@@H](CO)SC)cc1C 219070491 MJDOZKVMJSMPLJ-BXUZGUMPSA-N 269.410 2.206 10 20 CECD CCOC(=O)C1CCN(Cc2cccc(C)c2O)CC1 183463462 UQYOZOPRNJQVBV-UHFFFAOYSA-N 277.364 2.476 10 20 CECD CC1CCN(C(=O)CN(C)c2ccc3c(c2)OCO3)CC1 121419539 CVTGORRLAOQBGL-UHFFFAOYSA-N 290.363 2.110 10 20 CECD NC(=O)CC[C@H]1CCCN(Cc2cc(F)ccc2O)C1 180010944 AYYUBZXEAVSHNO-LLVKDONJSA-N 280.343 2.009 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](N3CCCCC3)C2)c1 134121646 OLTLCDOUODBJIU-OAHLLOKOSA-N 290.407 2.461 10 20 CECD CCOC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C(C)C 191431329 FQGBCDRUVBRBRC-CFNZNRNTSA-N 293.363 2.288 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H]2C(=O)O)c1O 229118035 IFXWCTAVPAZIMN-JTQLQIEISA-N 285.727 2.103 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H](CN)c2ccccc2)cc1 237084600 HABBEUDMPORGCH-QGZVFWFLSA-N 297.402 2.111 10 20 CECD CN(C)[C@H]1CCC[C@H](NC(=O)NCc2ccccc2O)C1 267285083 ARKAWQZTMHRCTE-KBPBESRZSA-N 291.395 2.064 10 20 CECD C[C@H](N[C@H](C)CCN(C)C)c1cc([N+](=O)[O-])ccc1O 273570618 KNGITJUFLHKYAE-MNOVXSKESA-N 281.356 2.291 10 20 CECD CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@@H](C)[S@@]1=O 289831896 UGWDDIDKMGUPBM-TVZGQMOCSA-N 281.421 2.432 10 20 CECD CN(C)c1ccc(CN(C(=O)c2cncn2C)C2CC2)cc1 289253655 MBQXFBPBBACFEU-UHFFFAOYSA-N 298.390 2.291 10 20 CECD C[C@H](N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21)C(=O)NCCF 800499016 SYOJUEUBLHDRAK-ATZCPNFKSA-N 298.333 2.143 10 20 CECD Cc1ccc([C@H](C)NCC2(CC(N)=O)CC2)c(O)c1 817585195 CCEIJCUDHNQXCE-NSHDSACASA-N 262.353 2.007 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@H](C)[C@H](C)OC)c1 811957591 GCURIWUEJJYLSZ-MXWKQRLJSA-N 296.367 2.184 10 20 CECD CCOc1ccc(CNC[C@H](O)C2CCC2)c(O)c1 825239986 FGGFFJRABZTLTP-HNNXBMFYSA-N 265.353 2.042 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCS[C@H]2C)c1O 828543316 VAFKLJJEFHPXMN-GXSJLCMTSA-N 296.392 2.094 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)NC(=O)CC 727168667 UJMRMZWWYKRLFO-GFCCVEGCSA-N 292.379 2.046 10 20 CECD Oc1ccccc1CN(C[C@@H]1CCCO1)C[C@H]1CCCN1 903427595 YIOBWJFWARBQMJ-CVEARBPZSA-N 290.407 2.125 10 20 CECD COc1cccc(O)c1CNCC1(N)CCCCC1 841039703 ZYQMRCKQGIZHLY-UHFFFAOYSA-N 264.369 2.152 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CCO[C@@H](CF)C1 840953954 DLHFUNMCUZAFAI-QMMMGPOBSA-N 277.698 2.355 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)[C@@H]2CC=CCC2)cc1 846663982 UDCRSXGWVBCRFF-GDBMZVCRSA-N 287.407 2.225 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]([C@H]3CCNC3)C2)c1 843125016 LGTUWIRICLHYBS-KBPBESRZSA-N 290.407 2.222 10 20 CECD CCOC[C@H](NCc1ccc(N(CC)CC)cc1)C(=O)O 841808705 NJLSSXVHIDHMAZ-HNNXBMFYSA-N 294.395 2.112 10 20 CECD CCc1cccc(CN[C@H]2CCc3n[nH]cc3C2)c1O 848897513 QTLNDOOVCXGCOQ-AWEZNQCLSA-N 271.364 2.325 10 20 CECD CCN1C(=O)C(C)(C)N[C@H]1c1ccc(N(C)C)c(F)c1 840832672 DKSIEUUNLVJGCP-CYBMUJFWSA-N 279.359 2.121 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCO[C@H](C)C2)c1 858340804 OGBUEFGGQIQKHV-DGCLKSJQSA-N 278.352 2.067 10 20 CECD CC[C@H](C)[C@H](OC(=O)c1cc(O)cs1)C(=O)OC 922437623 JVROYQJTOOZPMZ-XVKPBYJWSA-N 272.322 2.198 10 20 CECD C[C@@H](Nc1cnn(CCO)c1)c1cc(Cl)ccc1O 756855711 LYZDSVQOUMPYOG-SECBINFHSA-N 281.743 2.408 10 20 CECD COC[C@H](NCc1ccc2c(c1)CCCO2)[C@H]1CCCO1 922078723 GUXAQOKWMQQZTK-DOTOQJQBSA-N 291.391 2.295 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCO[C@@H](C)C2)c1 756542502 ASPMNNACGPEWHV-KBPBESRZSA-N 278.396 2.072 10 20 CECD CSCCNC(=S)N(C)Cc1ccc(N(C)C)cc1 752735571 VKHJQXAUWDVBAK-UHFFFAOYSA-N 297.493 2.422 10 20 CECD COCC[C@@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756524591 HJNQXPOOINVAKD-ZJUUUORDSA-N 268.313 2.376 10 20 CECD CCOC(=O)CN(CC)Cc1ccc(OCC)cc1O 769004494 ILFMKVKXJDMQBT-UHFFFAOYSA-N 281.352 2.176 10 20 CECD CC(C)[C@@H](NCc1cc(F)cc(F)c1O)c1nncn1C 883117403 YIGYDZGOVVHVIW-GFCCVEGCSA-N 296.321 2.286 10 20 CECD CCN(C)c1ccc(Cn2cc(CC[C@H](C)O)nn2)cc1 881313426 LURMDEUYCLDLEM-ZDUSSCGKSA-N 288.395 2.096 10 20 CECD Cc1ccc(S(=O)(=O)Nc2ccc(O)cc2C)cn1 795325094 QLRNNUOHIZGGHA-UHFFFAOYSA-N 278.333 2.205 10 20 CECD OC[C@H](CC(F)(F)F)NCc1ccc2c(c1)CCO2 717742471 CDXZPAGKSRCVLQ-NSHDSACASA-N 275.270 2.024 10 20 CECD COc1cccc(O)c1CN(C)CC1CCN(C)CC1 769327579 CMMHMNSUHWIQMO-UHFFFAOYSA-N 278.396 2.174 10 20 CECD CCCONC(=O)N[C@H](C)c1cc(OC)ccc1O 1345767494 VDVBUMXQNGVRIQ-SECBINFHSA-N 268.313 2.103 10 20 CECD CC(C)C[C@H](N)C(=O)NCc1cc(Cl)ccc1O 1573504157 NJUVTGZPWRKJSB-NSHDSACASA-N 270.760 2.035 10 20 CECD CCc1cccc(C(=O)NCCc2ccc(N)cc2)n1 1578265790 KQLUPTPEMNYECG-UHFFFAOYSA-N 269.348 2.199 10 20 CECD COc1cc(CN[C@@H]2CCNC2)c(O)c(C(C)(C)C)c1 1579154150 VHWAZVIBFCFUKJ-GFCCVEGCSA-N 278.396 2.150 10 20 CECD CCN(C)c1ccc(CNCC[C@H](F)C(=O)O)c(C)c1 1776856268 APYHUZDKJODNFT-AWEZNQCLSA-N 282.359 2.354 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCO2)[C@H](O)C(F)(F)F 922310710 ZPAVCBPBPSBJJA-RNCFNFMXSA-N 289.297 2.413 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](OC)[C@@H](C)C2)c1 824815329 LYHUPKZVHGFKQI-XHDPSFHLSA-N 265.353 2.258 10 20 CECD COc1cc(Cl)cc(CNCC[C@@H](O)C2CC2)c1O 898202422 BDTXVPJQXFNHKF-GFCCVEGCSA-N 285.771 2.305 10 20 CECD COc1cccc(O)c1CN1CCCN2CCC[C@@H]2C1 1319814968 KOPCXZWQKHRSIV-CYBMUJFWSA-N 276.380 2.071 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CCCN(C)C2)c1 44534959 RIDCNRAHBOMUQX-STQMWFEESA-N 278.396 2.393 10 20 CECD CC[C@@H](NCC1([S@@](C)=O)CC1)c1ccccc1O 282504003 YIXAUYMSDLWTMN-KZULUSFZSA-N 267.394 2.344 10 20 CECD Oc1cccc2c1[C@H](NCCN1CCSCC1)CC2 297493334 BNGLPMAYJMJVOM-CYBMUJFWSA-N 278.421 2.018 10 20 CECD COc1ccc(CNCCC2CCOCC2)c(O)c1 311430862 QYLPUEYXEWHIQF-UHFFFAOYSA-N 265.353 2.307 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)[C@H]1CCOC1 708438580 WURUMJUNYLBWJH-IUCAKERBSA-N 257.280 2.185 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ncccc1O 115725913 RFLGPABAPLMUMR-UHFFFAOYSA-N 285.347 2.092 10 20 CECD CN(C)C1(CNCc2c(O)cccc2Cl)CCOCC1 113959414 LYGXFTMQOFBIGU-UHFFFAOYSA-N 298.814 2.246 10 20 CECD Oc1ccc(F)cc1CN1CCS[C@H]2COCC[C@@H]21 180253990 UCFLJPKMCILRFK-JSGCOSHPSA-N 283.368 2.238 10 20 CECD CCCOc1ccc(CN[C@@H]2CCCOC2)c(O)c1 236838600 OJYADNZNDVOYGA-CYBMUJFWSA-N 265.353 2.450 10 20 CECD Nc1ccc(NC(=O)CCCNC(=O)c2ccccc2)cc1 238134785 RPIYNZAFMRKWHE-UHFFFAOYSA-N 297.358 2.418 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12 245767593 WOUPWVZQJRJQQT-BNXWJZHJSA-N 285.343 2.272 10 20 CECD COc1cccc(CN(C)C[C@H]2CCCC[C@@H]2O)c1O 272632786 NILHDQHRPQYXIJ-OCCSQVGLSA-N 279.380 2.384 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H](O)CCc1ccccc1 271058383 VGNGKYIUOGRTEY-QGZVFWFLSA-N 299.370 2.344 10 20 CECD COc1cc(O)c(CN[C@H]2CC2(C)C)cc1OC 272082941 LSVDJUOHERAICG-ZDUSSCGKSA-N 251.326 2.298 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCCCCC1 276748006 VOSWZQKTWXTROU-UHFFFAOYSA-N 253.273 2.253 10 20 CECD CC[C@H](O)CNC(=O)NCc1ccc(N(CC)CC)cc1 291892180 JNEOXPNCTFIEIK-HNNXBMFYSA-N 293.411 2.103 10 20 CECD CC[C@H](NC[C@@H](O)COC)c1cc(Cl)ccc1O 802310510 WRRXSLXEFRJPDW-PWSUYJOCSA-N 273.760 2.094 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cccnc2F)c1 806791706 HJQKNGQLPNXSBB-SECBINFHSA-N 290.294 2.426 10 20 CECD CCN(C)C(=O)[C@@H](NCc1ccc(N(C)C)cc1)C(C)C 295080905 QIQOAWAQGGOCCC-INIZCTEOSA-N 291.439 2.345 10 20 CECD C[C@@H](CN)N[C@H](C)c1cc(Br)cc(F)c1O 817970388 UKCZTBLQOQDLFS-NKWVEPMBSA-N 291.164 2.292 10 20 CECD CC[C@H](NCc1c(O)ccc(Cl)c1F)[C@@H](C)O 824921449 LYIQJHCCTGADPP-XCBNKYQSSA-N 261.724 2.434 10 20 CECD COc1cc(CN2CCC[C@@H](CC(=O)O)C2)c(O)cc1C 820763911 LPYIKEOAZULKBN-LBPRGKRZSA-N 293.363 2.396 10 20 CECD COc1ccc2c(c1)CCCCN2CC[S@](C)=O 828568564 FNGCUKUJIXBQJD-SFHVURJKSA-N 267.394 2.216 10 20 CECD CCOc1cccc(CN2C[C@H](C)[C@](C)(CO)C2)c1O 827699255 FUMZEXZIAVVANV-LRDDRELGSA-N 279.380 2.241 10 20 CECD CCOc1ccc(N(C)CC(=O)N[C@@H](C)CC)cc1 739924809 ZIXXMEZDGQSWDW-LBPRGKRZSA-N 264.369 2.436 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@H]1C[C@H]2CC[C@H]1C2 910951349 FYUVYWNJSNYAPQ-KWBADKCTSA-N 261.321 2.150 10 20 CECD COC(=O)c1cnc(SC[C@H]2CCCN2C)s1 917778783 UPIBNSMORMTGMM-MRVPVSSYSA-N 272.395 2.116 10 20 CECD O=C(NCc1cc(Cl)ccc1O)O[C@H]1CCOC1 916705168 VNUKRVCMKCMNGF-JTQLQIEISA-N 271.700 2.061 10 20 CECD CCC[C@@H]1CCCCN1C(=O)C(=O)Nc1ccc(N)cc1 841109143 JMQFBRIFDLKBRJ-CQSZACIVSA-N 289.379 2.389 10 20 CECD C[C@H]1C[C@@H](CN2CCCc3cc(CN)ccc32)CCN1 843058194 OFRIANREGZQVIK-ZFWWWQNUSA-N 273.424 2.286 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1=COCCC1 846473129 PCHOTTFCIJVWMI-UHFFFAOYSA-N 267.712 2.356 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CN)C2CC2)cc1F 841028217 MGKLDRVVINASFY-HNNXBMFYSA-N 279.403 2.499 10 20 CECD CCCSC[C@@H](NCc1ccc(N(C)C)cc1)C(=O)O 756341899 ZZAHWDQXITZELD-CQSZACIVSA-N 296.436 2.439 10 20 CECD COc1ccc2c(c1)CCCN2CC[C@@H]1CCOC1=O 753843384 SWGOSTXEAUUYFD-GFCCVEGCSA-N 275.348 2.401 10 20 CECD Cc1nc(CNC(=O)c2cc(O)cs2)ccc1[C@@H](C)O 753432982 HLXZKXHHPOXDHZ-SECBINFHSA-N 292.360 2.140 10 20 CECD Cc1ccc(O)c([C@H](C)NCCOC[C@@H]2CCOC2)c1 756564206 RIQGVGMXKVXKRW-UONOGXRCSA-N 279.380 2.404 10 20 CECD CC(C)NC(=O)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756359805 DLFCRROGXKYDKR-MWLCHTKSSA-N 280.343 2.194 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)[C@H]2CN(C)CCO2)c(O)c1C 756757866 FWCCERPFHNHHBV-SQWLQELKSA-N 292.423 2.379 10 20 CECD COC1CCN(CCN[C@H](C)c2ccc(F)cc2O)CC1 756641906 JLLGATRANICEQU-GFCCVEGCSA-N 296.386 2.293 10 20 CECD CCOc1ccc(CN2CCSCC2)c(O)c1 768236914 MGVSEJFDPJNPHX-UHFFFAOYSA-N 253.367 2.340 10 20 CECD CN(C)c1cccc(NC(=O)NCc2ccccc2O)n1 764725551 NISDICNSOCWIOI-UHFFFAOYSA-N 286.335 2.175 10 20 CECD COc1cc(O)c(CN(CCO)CC(C)(C)C)cc1OC 775682627 ZNMRAAUYPQQHOL-UHFFFAOYSA-N 297.395 2.250 10 20 CECD CC(C)(CCO)NCc1cc(Cl)cc(F)c1O 776175761 ZXXQCQYLFNHUIC-UHFFFAOYSA-N 261.724 2.435 10 20 CECD CC[C@@H](OC)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773006702 FHBYZSNZKBXSGS-BXUZGUMPSA-N 264.369 2.355 10 20 CECD COC[C@H](C)CNCc1cc(C)cc(OC)c1O 894210038 ZUSLAPKHRLUQBX-LLVKDONJSA-N 253.342 2.081 10 20 CECD CCOCCCNCc1ccc(N2CCC(O)CC2)cc1 76275573 XZTWEYTVADYRKB-UHFFFAOYSA-N 292.423 2.164 10 20 CECD OCCCCN(Cc1cc(F)cc(F)c1O)C1CC1 894021401 SDHPYPNPSAUULE-UHFFFAOYSA-N 271.307 2.407 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@@H]2CCC=CO2)cc1 780184784 SQPCPFAGDLECNY-HNNXBMFYSA-N 289.379 2.245 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](O)C(C)(C)C2)c1O 894535960 ZNUSSLAUEZZYJD-CQSZACIVSA-N 279.380 2.302 10 20 CECD C[C@H](NC(=O)N[C@H](C)c1ccccc1O)[C@H]1CCCNC1 891981521 LNIDZYWCTMKIFJ-XQQFMLRXSA-N 291.395 2.141 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCC(F)(F)C1 797743519 GWPNVHLQTIAGDM-SECBINFHSA-N 271.263 2.149 10 20 CECD O=C1CC[C@@H]2CN(Cc3ccc(N4CCCC4)cc3)CCN12 1204320759 AGQHCDUWKUTXSV-QGZVFWFLSA-N 299.418 2.093 10 20 CECD CC[C@]1(NCc2cc(OC)c(OC)cc2O)CCOC1 792193242 SNFSWFJRRMNIOW-HNNXBMFYSA-N 281.352 2.068 10 20 CECD COc1cccc(CN[C@H]2CCC[C@H]2CCO)c1O 189951089 PJGPTFHBFWIAQV-AAEUAGOBSA-N 265.353 2.042 10 20 CECD CN(C)c1ccc(CN2CC(O)(c3ccccc3)C2)cc1 796623277 HFDZCQXGXFIGIZ-UHFFFAOYSA-N 282.387 2.456 10 20 CECD CC[C@H](CO)NCc1ccc(Br)cc1O 691400949 HXSWIQRZBCPENM-SNVBAGLBSA-N 274.158 2.015 10 20 CECD Oc1cccc(Cl)c1CN1CCO[C@H]([C@@H]2CCCO2)C1 770304366 MLNIWOYNVCCFIS-GJZGRUSLSA-N 297.782 2.425 10 20 CECD CCCC[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1326324094 SIRHQCZBSXORPA-LLVKDONJSA-N 282.296 2.033 10 20 CECD O=C(O)c1cnc(SCC2CCC(O)CC2)s1 1602536931 HRWUSOGDMKXELU-UHFFFAOYSA-N 273.379 2.485 10 20 CECD CSC[C@H]1CCCN1C(=O)Cc1ccc(N)cc1 400432150 DUKDCBISBZJTCR-CYBMUJFWSA-N 264.394 2.165 10 20 CECD CC[C@H](NC)C(=O)N(CC)Cc1ccc(N(C)C)cc1 691991191 WTGAVAAZVQFQRK-HNNXBMFYSA-N 277.412 2.099 10 20 CECD Cc1ccc(C(=O)NC[C@@H](CCO)CC(C)C)c(O)c1O 179545735 NHHRZYQURJDGKY-LBPRGKRZSA-N 295.379 2.181 10 20 CECD COCc1ccccc1CNC(=O)c1cccc(O)c1O 186892520 IEYYELGJNIQZNH-UHFFFAOYSA-N 287.315 2.174 10 20 CECD C[C@@H](O)CCN(C)Cc1ccc(N(C)C)c(F)c1 127667140 XBBRVLDMGLQARD-LLVKDONJSA-N 254.349 2.094 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCC[C@@H]1CCO 188423556 WMQZGLCQQXMVBI-TZMCWYRMSA-N 292.379 2.085 10 20 CECD C[C@@H](NC[C@H]1CC[C@H](O)C1)c1ccc(F)cc1O 189307801 UCGPYFQZAAQSGT-SCVCMEIPSA-N 253.317 2.343 10 20 CECD CC(C)Oc1ccc(N(C)CCN2C(=O)CCC2=O)cc1 191589823 IVPCXLQJBLTOAJ-UHFFFAOYSA-N 290.363 2.059 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@@H](C)[C@@H]2C2CC2)c(O)c1 529225749 AHMQRFKYDWBQNB-TZTCFGBESA-N 275.348 2.309 10 20 CECD CCOC[C@@H]1CN(Cc2cc(C)cc(C)c2O)CCO1 530105674 ISZBSSDZMLUXJH-HNNXBMFYSA-N 279.380 2.246 10 20 CECD COc1ccc(N2CCN(c3ncc(C)cn3)CC2)cc1 270243305 RSZHDYWMJJIYAB-UHFFFAOYSA-N 284.363 2.120 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC[C@@H](C)OC)c1 273575704 LTHSBAYEHIHWBO-MNOVXSKESA-N 281.352 2.254 10 20 CECD Oc1ccccc1CNC[C@H]1CCCCN1C1CC1 277475168 KWXZLNHZESGJGL-OAHLLOKOSA-N 260.381 2.499 10 20 CECD CC[C@@H](C)N1CC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 285977946 PEVABBFRLKLUAL-GFCCVEGCSA-N 289.379 2.315 10 20 CECD C[C@@H](NC(=O)N(C)Cc1ccccc1O)C(F)(F)F 288727516 FIYSGUSZOSJDAA-MRVPVSSYSA-N 276.258 2.484 10 20 CECD Cc1ccc(C(=O)NCCSC(C)C)c(O)c1O 286587213 DBIUWSATXFUUKD-UHFFFAOYSA-N 269.366 2.278 10 20 CECD C[C@H]1[C@H](N2CCCC2)CCN1Cc1ccccc1O 289925655 WAPAWFKKSZUNND-DZGCQCFKSA-N 260.381 2.451 10 20 CECD O=C(NC[C@H](CO)C1CCCCC1)c1cccc(O)c1O 294552004 MHEVZLOSCKRETN-GFCCVEGCSA-N 293.363 2.016 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@@H](C)c1ccc(C)cc1O 724872450 LLMXUUUSYPHGON-NJZAAPMLSA-N 265.353 2.155 10 20 CECD CO[C@@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 298833489 YTYLGIILGVRLGD-LBPRGKRZSA-N 276.380 2.279 10 20 CECD CCCCN(Cc1cn(C)nn1)Cc1ccccc1O 801599669 YFVNVTYGAMFXKX-UHFFFAOYSA-N 274.368 2.323 10 20 CECD CC[C@H]1CN(C)CCN1Cc1ccc(N(C)C)cc1 816660916 UXQALDPEEASLPE-HNNXBMFYSA-N 261.413 2.279 10 20 CECD CC(C)C[C@H](CN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 817957581 DDQWFTPKSLZWIR-GHMZBOCLSA-N 281.356 2.324 10 20 CECD C[C@@H]1C[C@H](NC[C@H](N)c2ccc(N(C)C)cc2)c2nccn21 817942287 NPSXLTACOIAXJY-KCXAZCMYSA-N 299.422 2.245 10 20 CECD O=C(O)CCN(Cc1ccco1)Cc1ccccc1O 821524606 DRJGIKXAFNJYMA-UHFFFAOYSA-N 275.304 2.462 10 20 CECD Cc1cc(CNC(=O)NCc2ccc(N(C)C)cc2)ccn1 836225505 UIFRYSLECQOHLF-UHFFFAOYSA-N 298.390 2.455 10 20 CECD Nc1ccc(CC(=O)Nc2cnn(CC3CC3)c2)cc1 831993845 XZRAXUYIGPMCMP-UHFFFAOYSA-N 270.336 2.057 10 20 CECD COc1ccc(CNC(=O)C[C@@H]2CC[C@@H]3C[C@H]23)c(O)c1 831033488 WLZYKFVKXAKRLH-SUNKGSAMSA-N 275.348 2.453 10 20 CECD CC1(C)CCC[C@@]1(O)CNC(=O)c1cc(O)cs1 832870731 PBOQIYNIIGQBMV-CYBMUJFWSA-N 269.366 2.125 10 20 CECD C[C@@H]1CC(NC(=O)/C=C\c2ccc(O)c(O)c2)C[C@@H](C)O1 588407836 CDQKHWSWWJWMOO-DPIUTZRQSA-N 291.347 2.183 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@H](C)C(=O)N(C)C)cc1 741678368 PIWLYAVFZMPANK-AWEZNQCLSA-N 291.439 2.441 10 20 CECD CCCC[C@@H](CN)NCc1cc(OCC)ccc1O 841030233 VCDZCCZEUKIAEU-ZDUSSCGKSA-N 266.385 2.398 10 20 CECD Oc1c(Cl)cccc1CNC[C@@H]1CCCCN1 841032957 KRBCJSJXVNNPNO-NSHDSACASA-N 254.761 2.277 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CC[C@@]2(CCNC2)C1 843120274 CJVGSZJSIHMPQL-CQSZACIVSA-N 284.762 2.370 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C)[S@](=O)CC1 840941875 OZVJILKUWFNFCW-JLTOFOAXSA-N 294.464 2.404 10 20 CECD C[C@H](NC1CCN([C@@H]2CCOC2)CC1)c1ccccc1O 848919388 KHFYGQDKJAMMIR-DZGCQCFKSA-N 290.407 2.296 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)C[C@H]1CCC(=O)N1 925082539 XOOOKLJZPGPQGC-UKRRQHHQSA-N 289.423 2.208 10 20 CECD COC[C@@H](C)N(C)CCN(C)c1ccc(OC)cc1 844401309 LGTRJEVTVPCEBL-CYBMUJFWSA-N 266.385 2.098 10 20 CECD CO[C@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2C)C1 858984332 ORVMAEBJAVHXGE-CTYIDZIISA-N 291.395 2.038 10 20 CECD Cc1ccc(C(=O)N(C)CC2=CCSC2)c(O)c1O 856370613 ZAZDHUNDTGNRRI-UHFFFAOYSA-N 279.361 2.151 10 20 CECD C[C@H](N[C@@H](CO)CC1CC1)c1cc(F)cc(F)c1O 756768346 CZSJFVBBQRGMGH-GZMMTYOYSA-N 271.307 2.482 10 20 CECD CC[C@H](CCO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 756603710 JYODCPKKSJTVHD-NXEZZACHSA-N 268.313 2.112 10 20 CECD CCN(CC)C[C@H](C)NC(=O)N[C@H](C)c1ccccc1O 868361726 GKMLOPZCFMCISK-QWHCGFSZSA-N 293.411 2.483 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2[C@H]3[C@@H]4CC[C@@H](C4)[C@H]32)c1 934941231 DKAKPDQIIVPPEH-KURSZUGOSA-N 287.359 2.309 10 20 CECD Oc1cccc(Br)c1CN1CCC[C@H](O)C1 862211393 IJSBESMPHANZAY-VIFPVBQESA-N 286.169 2.111 10 20 CECD Cc1ccc(CN(C)C[C@H](O)C(F)(F)F)c(O)c1 877526905 GGQLPYYBPXLPGB-NSHDSACASA-N 263.259 2.056 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC/C=C/C2CC2)c1O 1117762107 LLBCADXFSZTYTK-NSCUHMNNSA-N 278.308 2.365 10 20 CECD Cc1ccc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)o1 779500835 ZFJPVBMOYPKRJP-QPJJXVBHSA-N 287.315 2.371 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CN1C1CC1 883034211 ODQGWYBMIXXTFQ-BXKDBHETSA-N 282.334 2.385 10 20 CECD Cc1ccc(C(=O)NCc2ccccc2O)c(O)c1O 780983511 DQSYGFSWRFEECT-UHFFFAOYSA-N 273.288 2.042 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)C[C@@H](C)OC 894577248 UNYSOJMBOSNZHH-LLVKDONJSA-N 283.368 2.266 10 20 CECD COc1ccc(CN(CCO)C2CCCC2)c(O)c1OC 891441522 VQWUVEFRGXOVOK-UHFFFAOYSA-N 295.379 2.146 10 20 CECD CCO[C@@H]1CCCN(Cc2cc(OC)ccc2O)C1 133650040 CWORGWWPTNVVJW-CQSZACIVSA-N 265.353 2.402 10 20 CECD CC[C@H](N[C@@H]1CCCN(C)C1=O)c1ccc(F)cc1O 796790599 SJRPIJGMEPBHTP-QWHCGFSZSA-N 280.343 2.193 10 20 CECD C[C@H](NC(=O)c1cccc(O)c1O)c1cccc(O)c1 189317966 AAXXIACSXGFKLC-VIFPVBQESA-N 273.288 2.294 10 20 CECD C[C@](CO)(NCc1c(O)ccc(Cl)c1F)C1CC1 790974288 RAUARFNRCOJGIX-CYBMUJFWSA-N 273.735 2.435 10 20 CECD CCCC(=O)NCCC1=CCN(c2ccc(C)nn2)CC1 1089804268 AWBLCJMZAZXPFU-UHFFFAOYSA-N 288.395 2.228 10 20 CECD CC[C@H](F)C(=O)N[C@H](C)c1cc(OC)ccc1O 1335820778 PCGDUVSCCJRUMS-KCJUWKMLSA-N 255.289 2.326 10 20 CECD CN(C)c1ccc(CN2CC(C)(C)C[C@H]2C(=O)O)cc1 1777039350 GRORYGIXMNJZCV-AWEZNQCLSA-N 276.380 2.438 10 20 CECD CO[C@]1(C(=O)O)CCN(Cc2cc(Cl)cc(C)c2O)C1 1606707063 VGPLKNVVYTXAFE-CQSZACIVSA-N 299.754 2.030 10 20 CECD Cc1cc(O)c(CN[C@H](C)CC(=O)O)c(Cl)c1 1605213535 ROFWNBLWQNXOAI-MRVPVSSYSA-N 257.717 2.307 10 20 CECD Cn1cc(/C=C2\C(=O)Nc3ccc(F)cc32)cc1C(=O)O 1600944594 BDHRLPXSRZHRGT-WCIBSUBMSA-N 286.262 2.355 10 20 CECD O=C(O)[C@H](CC(F)F)NCc1c(O)ccc(Cl)c1F 1601639394 RPHHVCNCYZIDEU-ZETCQYMHSA-N 297.660 2.383 10 20 CECD C[C@@H](NC(=O)c1ccccc1CCN)c1ccccc1O 1579415053 ZQRVYURPPZMTRE-GFCCVEGCSA-N 284.359 2.384 10 20 CECD C[C@@H](OC(=O)c1cccc(O)c1O)c1ccc(C(=O)O)o1 1593592329 BGUFLEJSCMUPCP-SSDOTTSWSA-N 292.243 2.307 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC(F)(F)CO 231792603 VLDLOIBUXAVEFF-VHSXEESVSA-N 271.307 2.466 10 20 CECD COc1ccccc1CNCc1ccc(C(=O)O)cc1O 1777387765 OPIUBNDJPCGSJG-UHFFFAOYSA-N 287.315 2.389 10 20 CECD C[C@H]1CC[C@](NCc2ccc3c(c2)CCO3)(C(=O)O)C1 1776629588 OZVWTYBQISJRGN-MEDUHNTESA-N 275.348 2.355 10 20 CECD COc1ccc(CNC[C@@H](CC(=O)O)C(F)F)cc1C 1777364235 YOFMTDNNXGXAQL-LLVKDONJSA-N 287.306 2.449 10 20 CECD CC[C@H](O)CCNCc1cc(Cl)cc(OC)c1O 169092224 AOEINUMSINOTQG-NSHDSACASA-N 273.760 2.305 10 20 CECD COc1cc(C)cc(CN2CCC(OC(C)=O)CC2)c1O 164602797 RKMAHROISHEOFF-UHFFFAOYSA-N 293.363 2.237 10 20 CECD C[C@H](CCO)CNCc1cc(Br)ccc1O 164931904 KJZZOGKYUOAHSF-SECBINFHSA-N 288.185 2.263 10 20 CECD COCC[C@@](C)(O)CN[C@@H](C)c1ccc(N(C)C)cc1 178371491 JTYFOKPCNGQMAY-XJKSGUPXSA-N 280.412 2.191 10 20 CECD C[C@H]1C[C@H](NCc2cc(Br)ccc2O)CO1 402293433 NPXQYYQPOLRZJZ-KWQFWETISA-N 286.169 2.422 10 20 CECD COCCCN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 20551035 OHRMMYACKIEWNK-CYBMUJFWSA-N 296.386 2.349 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCOC1 66097165 VPJAWJPHAQDSSC-CYBMUJFWSA-N 263.337 2.167 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H](C)C2CCC2)c1 124744393 GUZFCKKPRSMGRK-JTQLQIEISA-N 278.352 2.389 10 20 CECD C[C@@]1(NCc2cccc(Br)c2O)CCOC1 120151139 AMANCBARPMJRDA-GFCCVEGCSA-N 286.169 2.423 10 20 CECD CCOC(=O)CCCN(C)c1ccc2c(c1)OCO2 121245119 MVTCFDPLRZXIGN-UHFFFAOYSA-N 265.309 2.195 10 20 CECD CN(C)c1ccc(CNc2ccc(CC(N)=O)cc2)cc1 37074749 CRMIJJSVBUBGLG-UHFFFAOYSA-N 283.375 2.393 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCC[C@H]2CCO)c1 189958890 RBFISSNDQXNUTJ-SWLSCSKDSA-N 279.380 2.432 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC1(C)C 186381362 JNWKZQYKQZUQCK-MWLCHTKSSA-N 263.337 2.191 10 20 CECD C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CC(C)(C)O1 180982105 USFSCVUQKCFTML-OKPNEXGHSA-N 291.347 2.137 10 20 CECD CCNC(=O)CN(CC)Cc1c(O)cccc1Cl 133619268 JUIKWALCOARIEU-UHFFFAOYSA-N 270.760 2.004 10 20 CECD Cc1ocnc1CNC(=O)NCc1ccc(N(C)C)cc1 131931437 HOKRTMXGGYNJEK-UHFFFAOYSA-N 288.351 2.048 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)C1(O)CCCC1 194582492 BBCYIVODLNHXMZ-UHFFFAOYSA-N 288.391 2.208 10 20 CECD CC[C@](C)(O)CNCc1cccc(Br)c1O 82687155 YEIDAEMEIVHDBU-LBPRGKRZSA-N 288.185 2.405 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(F)cc1O 228946152 YCBJWIVHPPPCPR-NXEZZACHSA-N 268.332 2.095 10 20 CECD COc1cccc(CNC(=O)[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c1O 528861579 NMIPIMOEEYGTII-ZHPDPMBESA-N 293.363 2.077 10 20 CECD CCC[C@](C)(O)CNC(=O)NCc1ccc(N(C)C)cc1 264846476 KCWDJGPXKQHSCZ-INIZCTEOSA-N 293.411 2.103 10 20 CECD CCOc1ccc(O)c(CN(C)CCc2cnccn2)c1 273786476 UJRVILFPIODPFX-UHFFFAOYSA-N 287.363 2.255 10 20 CECD CN1CCCc2cc(CNC(=O)/C=C/c3c[nH]cn3)ccc21 276506563 ALIWXNSFXPBLJN-FNORWQNLSA-N 296.374 2.122 10 20 CECD Cc1ccc(C(=O)N2CCO[C@H](C(C)(C)C)C2)c(O)c1O 279753972 LITCDEXUJBFBQW-LBPRGKRZSA-N 293.363 2.293 10 20 CECD C[C@@H](NCc1cnnn1C)c1cc(Cl)ccc1O 287264982 IRRZEAATYVYKHG-MRVPVSSYSA-N 266.732 2.025 10 20 CECD Cc1ccc(O)c(CN[C@H]2COc3ccccc3[C@H]2O)c1 288507094 ILPRUTUVFDXGPK-WMLDXEAASA-N 285.343 2.285 10 20 CECD COc1ccc(N(CCC(C)C)CC(N)=O)cc1 280322059 HCRHPQJXZFJQIE-UHFFFAOYSA-N 250.342 2.033 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)NCc1ccccc1O 806717282 DOJPRJFRKZJONL-UHFFFAOYSA-N 293.363 2.378 10 20 CECD COc1ccc(N2CCC(N[C@H](C)C[C@@H](C)N)CC2)cc1 817903505 QBESFDDPOUIGSD-ZIAGYGMSSA-N 291.439 2.379 10 20 CECD C[C@@H](CN)N[C@H](C)c1cccc(C(F)(F)F)c1O 817970113 LIVYJOMIDLPOCU-JGVFFNPUSA-N 262.275 2.409 10 20 CECD C[C@@H](NC1CNC1)c1ccc(Cl)c(Cl)c1O 817956309 WGJAWZSBMQYLBH-ZCFIWIBFSA-N 261.152 2.321 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCC[C@H](C)OC)c1 729053494 JJABRAUNPPVWCT-QWRGUYRKSA-N 296.367 2.186 10 20 CECD O=C(CNCc1ccc2ccccc2c1O)NCC1CC1 816564433 GAOJMJXAAMHCGN-UHFFFAOYSA-N 284.359 2.161 10 20 CECD Cc1noc(C2CN(Cc3c(O)ccc(Cl)c3F)C2)n1 839130951 JMHMMOWOBYDOQS-UHFFFAOYSA-N 297.717 2.476 10 20 CECD C[C@H](NC(=O)C1(N(C)C)CC1)c1ccc(N(C)C)cc1 832431577 RCVJJSHJUKOSIP-LBPRGKRZSA-N 275.396 2.024 10 20 CECD CO[C@H](C1CC1)[C@H](C)NC(=O)N(C)Cc1ccccc1O 838700610 BJMMECNABPDMPN-NHYWBVRUSA-N 292.379 2.347 10 20 CECD CC1CCN([C@H](C)CNC(=O)c2cc(O)cs2)CC1 731871420 KBBUMTBZVLPFSN-LLVKDONJSA-N 282.409 2.304 10 20 CECD C/C=C/C(=O)N1CCCN(c2ccc(OC)cc2)CC1 917821597 YBKIFXYLBIAXAJ-HWKANZROSA-N 274.364 2.310 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCC[C@@H]3C[C@@H]32)c1 838474510 LKGQPXCPJCBEIW-DDTOSNHZSA-N 290.363 2.389 10 20 CECD CCc1ccnc(CNC(=O)NCCc2ccc(N)cc2)c1 841894781 VBLLSLDASKQBBA-UHFFFAOYSA-N 298.390 2.268 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CC(F)C1 840482275 VNAKZOSJLVPKFL-LBPRGKRZSA-N 293.386 2.355 10 20 CECD Nc1ccc(NC(=O)N2C[C@@]3(CCCO3)[C@@H]2C2CC2)cc1 841298747 FEURUQWLEIDYGJ-HOCLYGCPSA-N 287.363 2.444 10 20 CECD O=C(O)[C@@H]1CCCN1Cc1c(O)ccc(Cl)c1F 840995785 XBVLUJRJQDWTLV-VIFPVBQESA-N 273.691 2.234 10 20 CECD CCc1nc([C@H](C)N[C@H](C)c2cccc(OC)c2O)n[nH]1 846157389 MEMZANKEZUTMHL-ZJUUUORDSA-N 290.367 2.493 10 20 CECD C[C@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@H](C)N1 843049015 DKHRANRYGCFDCK-IUCAKERBSA-N 272.751 2.367 10 20 CECD COc1cccc(O)c1CNC[C@@H](C)C(=O)OC(C)(C)C 848565854 NGANITLXJOVTLG-LLVKDONJSA-N 295.379 2.468 10 20 CECD CN1CCc2cc([C@H]3NC4(CCCC4)C(=O)N3C)ccc21 751523461 AUSTVVDOWGHJNK-HNNXBMFYSA-N 285.391 2.052 10 20 CECD C[C@H](O)CCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756572583 NHYWLOHTPRVLCN-ATZCPNFKSA-N 253.317 2.440 10 20 CECD C[C@@H]1COCC[C@H]1CNC(=O)N[C@H](C)c1ccccc1O 868604779 RVFATVVBTJMZOP-UPJWGTAASA-N 292.379 2.425 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@H](O)C(C)(C)C)ccc21 764929387 IVGUCDHPKODPFA-OAHLLOKOSA-N 290.407 2.092 10 20 CECD CN(C)c1ccc(CNC[C@H](CO)Cc2ccco2)cc1 768841664 MRDXQNVVDIODRF-OAHLLOKOSA-N 288.391 2.286 10 20 CECD CC[C@@H](N[C@H]1CCC[C@@H]1O)c1ccc(F)cc1O 866489860 XTSZBCSOYSNFIK-AGIUHOORSA-N 253.317 2.485 10 20 CECD Cc1cc(O)c(CN2CCC3(CCNC3=O)CC2)cc1C 872787719 GREJDGKKDIQOGE-UHFFFAOYSA-N 288.391 2.111 10 20 CECD Cc1cccc(O)c1CN1CCS[C@H]2COCC[C@@H]21 876798151 FHHQRIOSJPFQPR-ZFWWWQNUSA-N 279.405 2.407 10 20 CECD COc1ccc(CNC[C@@H]2CN(C(C)=O)C[C@@H]2C)cc1C 1048092546 PHKJCIMWJQVKCJ-XJKSGUPXSA-N 290.407 2.208 10 20 CECD CCOc1ccc(CNCCC(C)(C)O)c(O)c1 775370600 QWVYYVONKYTMHA-UHFFFAOYSA-N 253.342 2.042 10 20 CECD COc1cccc(CN2CCCCC[C@@H]2CO)c1O 895152388 UPAWWAQRYWELHB-CYBMUJFWSA-N 265.353 2.138 10 20 CECD C[C@H](CNCc1c(O)ccc(Cl)c1F)N(C)C 790959054 DMQNZNJOQPVELU-MRVPVSSYSA-N 260.740 2.224 10 20 CECD O=C(Nc1ncc(Cl)s1)c1cccc(O)c1O 790787728 LGNPKXWGEMSSPA-UHFFFAOYSA-N 270.697 2.460 10 20 CECD C[C@H]1COC[C@@H]1NCc1cc(Br)ccc1O 829431592 ISZSPOWFXDWUDC-KWQFWETISA-N 286.169 2.279 10 20 CECD Oc1c(F)cc(Br)cc1CN[C@H]1CCOC1 715718419 MHLOTKBQZYWESK-VIFPVBQESA-N 290.132 2.172 10 20 CECD Oc1ccc(F)cc1CNCC1SCCS1 692863985 YYYJUORDIPERSV-UHFFFAOYSA-N 259.371 2.427 10 20 CECD Cc1cc(CNCc2ccc3c(c2)CCO3)ncn1 756991526 UWLBGOYZQGORBW-UHFFFAOYSA-N 255.321 2.010 10 20 CECD Nc1ccc(Cc2nc([C@@H]3CCCOC3)no2)cc1 87813544 SZXNVKJIJDLETM-LLVKDONJSA-N 259.309 2.137 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CCn2ccnc2C1 778188552 HSVQDFXBWNDJMI-SNVBAGLBSA-N 277.755 2.347 10 20 CECD CC[C@H](NCc1nnc(C)n1C)c1ccc(F)cc1O 1322447300 XBXRHRBYTPRWDG-LBPRGKRZSA-N 278.331 2.209 10 20 CECD O=C1N[C@@H](c2cc(O)ccc2O)Nc2cc(F)c(F)cc21 1331091300 KNWTUVOCSQHFTD-ZDUSSCGKSA-N 292.241 2.230 10 20 CECD Oc1ccc(Cl)cc1CNC1CCC(O)CC1 19918832 QXIYEIZITHKHAU-UHFFFAOYSA-N 255.745 2.439 10 20 CECD CC1(C)[C@@H]2NCCC[C@@H]2[C@H]1NCc1ccc2c(c1)CCO2 1576388741 AVPKSBIEBUKEEZ-USXIJHARSA-N 286.419 2.488 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(C(=O)O)CCC2)c1 1594106492 WTKQUBKIVQHXPN-SNVBAGLBSA-N 279.336 2.306 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@H](CC(=O)O)C2)cc1 1598320631 JNVXDZLSFZOPNC-KGLIPLIRSA-N 276.380 2.486 10 20 CECD COC(=O)CCN(Cc1cc(C)cc(OC)c1O)C(C)C 164330472 FSLLEMFUPFTKGV-UHFFFAOYSA-N 295.379 2.483 10 20 CECD CC[C@@H](NC(=O)Cc1ccc(N)cc1)c1ccncc1 168700677 FQNWSSFTMONSIC-OAHLLOKOSA-N 269.348 2.474 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cccc(F)n2)c1 152374520 LFTAMYWQZOSJQN-SECBINFHSA-N 290.294 2.426 10 20 CECD CN1CCN(Cc2cc(F)cc(F)c2O)C(C)(C)C1 894029820 DILKTLUNYHLTBX-UHFFFAOYSA-N 270.323 2.196 10 20 CECD CCn1cnnc1CN[C@@H](C)c1ccc(N(C)C)cc1 158384129 WWSWNXTWKBYRTE-LBPRGKRZSA-N 273.384 2.215 10 20 CECD COc1cc(CNCc2ccc3c(c2)CCO3)sn1 399018712 CVRWHIDOQFOMRB-UHFFFAOYSA-N 276.361 2.376 10 20 CECD C[C@@H](NC(=O)CCC1CCNCC1)c1ccccc1O 870988794 ZPIFUEJUYUKZJY-GFCCVEGCSA-N 276.380 2.349 10 20 CECD O=C(/C=C/c1ccco1)NCCc1ccc(O)c(O)c1 119570645 YMFOUAOFYFZNSH-GQCTYLIASA-N 273.288 2.063 10 20 CECD COc1cccc(CNc2c(C)c(C)nc3ncnn23)c1O 301543786 KNKKMTVUZRTMAY-UHFFFAOYSA-N 299.334 2.067 10 20 CECD C[C@@H](NCCCOCCO)c1cc2c(cc1O)CCCC2 186514370 XQNKZLGJGJBFDG-CYBMUJFWSA-N 293.407 2.321 10 20 CECD CCCN1CCC(N(C)C(=O)Cc2ccc(N)cc2)CC1 38100770 BZQSWTMEVHLINL-UHFFFAOYSA-N 289.423 2.144 10 20 CECD CCN(Cc1cc(OC)ccc1O)C[C@@H](O)C(F)(F)F 189868567 YJHOEXCSMFJXFB-GFCCVEGCSA-N 293.285 2.146 10 20 CECD CCCN(CCC)CCCNC(=O)c1cccc(O)c1O 193015628 MMJRDZQFRFYNSI-UHFFFAOYSA-N 294.395 2.340 10 20 CECD COc1cccc(CN2CCC[C@H](N3CCCC3)C2)c1O 92047215 PFMSJEOBEZEAHJ-HNNXBMFYSA-N 290.407 2.461 10 20 CECD CCN(CC)c1ccc(CN2CCNC(=O)C2(C)C)cc1 93084943 WCAODTPEOCYCKO-UHFFFAOYSA-N 289.423 2.243 10 20 CECD COCCc1nsc(NCc2cccc(OC)c2O)n1 91479252 SZSVCJUBJKGRSG-UHFFFAOYSA-N 295.364 2.053 10 20 CECD Cc1cccc(CN2CCN(C)C[C@@H]2C(C)C)c1O 182134232 BKBGYILXHPGHNQ-OAHLLOKOSA-N 262.397 2.473 10 20 CECD COCCOCCN[C@H](C)c1ccc(C)c(C)c1O 273391995 LAZDOULSUFWFMK-CYBMUJFWSA-N 267.369 2.323 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@@H](C)SC)c1O 278548902 YTIANUQEQLAKSK-MRVPVSSYSA-N 286.353 2.150 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CCS(=O)(=O)C2)c(O)c1C 273444058 ZJXMTRKCGDBIJT-STQMWFEESA-N 297.420 2.094 10 20 CECD CC[C@H](NCC1([S@](C)=O)CC1)c1ccc(F)cc1O 287500343 NRNFHCKEWIFVRV-BUXKBTBVSA-N 285.384 2.483 10 20 CECD CC[C@@H](NC[C@H](O)CN1CCCC1)c1ccc(C)cc1O 280117723 OCLLFHRNMZWVNN-GOEBONIOSA-N 292.423 2.198 10 20 CECD CC[C@@H](NCC1(C)OCCO1)c1ccc(F)cc1O 286200116 RHVJMSZLNGKYPJ-GFCCVEGCSA-N 269.316 2.335 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1cc(C)ccc1O 281220885 KIGLHMWUTOCUKX-GFCCVEGCSA-N 265.353 2.474 10 20 CECD CN(Cc1cccc(Cl)c1O)C[C@@H](O)C(F)(F)F 809751628 UTBCUFMNAMDDEO-SECBINFHSA-N 283.677 2.401 10 20 CECD COc1cccc(O)c1CNCc1ncnn1C(C)(C)C 800293997 RLAREMJDLHKIRQ-UHFFFAOYSA-N 290.367 2.037 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccoc1 808094418 NSQLJMRHVMORLD-UHFFFAOYSA-N 266.293 2.401 10 20 CECD Cc1cc(CN2CC[C@H](n3cncn3)C2)ccc1N(C)C 815094649 FOOAULLFQUGDJD-HNNXBMFYSA-N 285.395 2.100 10 20 CECD CCOCC[C@@H](O)CNc1ccccc1OCCF 819489365 UEAJWFALYIZQTP-GFCCVEGCSA-N 271.332 2.234 10 20 CECD C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cccc(C(F)(F)F)c1O 817977938 RVAPVPJSADPCBV-BXSSEVMYSA-N 286.297 2.279 10 20 CECD COc1cccc(CNC(=O)CC2CC(F)(F)C2)c1O 825702516 AXGICGHCRIMBJG-UHFFFAOYSA-N 285.290 2.452 10 20 CECD CC[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)[C@H](C)O 834889454 XYWGMWMYUIBPHW-PTRXPTGYSA-N 268.313 2.110 10 20 CECD O=C(NCc1ccc2c(c1)OCCO2)c1cc(O)cs1 731861595 GUSPJVSBWSDQJA-UHFFFAOYSA-N 291.328 2.155 10 20 CECD COc1cccc(CNC(=O)[C@H]2Cc3ccccc32)c1O 743331908 FCCKZXUBRRPHSN-AWEZNQCLSA-N 283.327 2.357 10 20 CECD N[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 843043767 GMGQSYPBVNIPCX-SNVBAGLBSA-N 258.724 2.108 10 20 CECD CCCC[C@H](COC)NC(=O)NCCc1ccc(N)cc1 841827715 CJJLBFIQKRYPIA-OAHLLOKOSA-N 293.411 2.316 10 20 CECD Cc1ccc(CCNC(=O)NCCc2ccc(N)cc2)nc1 841914402 DLMSALREBFRRBO-UHFFFAOYSA-N 298.390 2.057 10 20 CECD CCN1C(=O)C(C)(C)N[C@H]1c1cc(Cl)c(F)cc1O 840837250 HREWUTNQSMPQNE-LLVKDONJSA-N 286.734 2.414 10 20 CECD CCc1cccc(CNCC2(C(N)=O)CCCC2)c1O 848900765 QAGWSJBTPBEBNI-UHFFFAOYSA-N 276.380 2.090 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC2(OC)CCC2)c1 757635917 BSBOCOUHICPPPI-NSHDSACASA-N 293.363 2.399 10 20 CECD CCOc1cc(C(=O)NCc2cc(Cl)ccc2O)on1 857548602 PWGFHTJCBFDSHP-UHFFFAOYSA-N 296.710 2.362 10 20 CECD C[C@@H](CC(N)=O)N[C@H](C)c1cc2c(cc1O)CCCC2 756660144 JDPJQQDRMMYDFO-WDEREUQCSA-N 276.380 2.186 10 20 CECD O=C(c1cc(O)cs1)N1CCO[C@H](c2ccco2)C1 754018307 RIBJYJIEXZFCSK-NSHDSACASA-N 279.317 2.260 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H](O)CCOCC 769728416 LLWSKVFTLGGIQS-HNNXBMFYSA-N 281.396 2.392 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2cnn(CCF)c2)c1 861475474 YOAMTGPZQZBEAV-UHFFFAOYSA-N 292.314 2.188 10 20 CECD C[C@@H](NCc1ccc(N2CCCC2)cc1)c1ncnn1C 1116755605 OFZIFZXSYBLLEN-CYBMUJFWSA-N 285.395 2.266 10 20 CECD COc1cc(O)c(CN[C@@H]2C[C@H]2C(F)(F)F)cc1OC 877703495 MBQYZCBZIUXQEJ-RKDXNWHRSA-N 291.269 2.450 10 20 CECD CCN(CC(=O)N[C@H](C)c1ccc(N(C)C)cc1)C1CC1 775408614 AGCFGMLXKPLZEL-CYBMUJFWSA-N 289.423 2.414 10 20 CECD CCCOc1ccc(CN[C@H]2C(=O)NCC[C@H]2C)cc1C 873122547 SUCMNDSHNREMCT-MLGOLLRUSA-N 290.407 2.398 10 20 CECD CC[C@H](CO)C(=O)N(CC)Cc1ccc(N(C)C)cc1 779615513 JYGBTGJYSUKTNL-CQSZACIVSA-N 278.396 2.120 10 20 CECD CCOC1CC(O)(CN[C@H](C)c2c(O)cccc2F)C1 886601401 RUBJGMYZCMJTFP-RWWNRMGGSA-N 283.343 2.112 10 20 CECD CC[C@H](F)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1120669846 GKMBQODMXSRDHX-HNNXBMFYSA-N 294.370 2.012 10 20 CECD CCOc1cccc(CNCc2nc(C(F)F)no2)c1O 895727834 UWIQZILRUQBGFU-UHFFFAOYSA-N 299.277 2.401 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN3CCCC[C@@H]23)c1O 894181063 PAACHJLQFBUVAO-GJZGRUSLSA-N 290.407 2.426 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)C[C@@H]1CCCO1 891784443 XWORGDJNKIHGHM-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD Oc1c(F)cc(F)cc1CN1CCn2cccc2C1 896762977 JBNLETPDWSGABS-UHFFFAOYSA-N 264.275 2.488 10 20 CECD CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)CCCO1 894242993 BFGSYSHUBGJMGS-CYBMUJFWSA-N 295.379 2.410 10 20 CECD Cc1cccc(CN(C)Cc2cccc(O)n2)c1O 897392228 SIVOZYJSCXZGJF-UHFFFAOYSA-N 258.321 2.433 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)[C@@H](C)OC)c1 191655611 DEIUVXCYWVSRCT-GARJFASQSA-N 253.342 2.475 10 20 CECD COc1ccc(CNC(=O)Cc2csc(C)n2)c(O)c1 794381686 OGOFSFYZULRQDR-UHFFFAOYSA-N 292.360 2.025 10 20 CECD CC[C@@H](N[C@@H](CO)COC)c1cc(Cl)ccc1O 794839121 YVDCSWMHJJYMBG-CMPLNLGQSA-N 273.760 2.094 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@@H]2COC[C@@H]21 690771728 RHWMNUFDQSTMOI-MFKMUULPSA-N 251.301 2.142 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)c1nccn1C 775380247 DSKRNJLKRVOLPT-LLVKDONJSA-N 257.337 2.206 10 20 CECD COc1ccc(CNC2([C@H](C)C(=O)O)CC2)cc1C 1326705271 UTUINYCOWBOCKJ-LLVKDONJSA-N 263.337 2.347 10 20 CECD O=C(O)CC1(CNCc2cc([N+](=O)[O-])ccc2O)CCC1 1321907368 OEYFQDMYKIKIIT-UHFFFAOYSA-N 294.307 2.035 10 20 CECD COC(=O)CN(Cc1cc(C)ccc1O)CC(C)C 1324753851 XZYZBTZMBDYFMV-UHFFFAOYSA-N 265.353 2.332 10 20 CECD CCN(CC)c1ccc(CNC[C@H](F)C(=O)O)cc1 1333188000 QXLIRLXOTSYDBD-ZDUSSCGKSA-N 268.332 2.045 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)CC(C)(C)C)c1 1348156699 JXVPKMIIIHBVKZ-UHFFFAOYSA-N 271.382 2.166 10 20 CECD C=C=CCNC(=O)NCc1ccc(N(C)C)cc1C 1518997072 KDXBHPGVKNEZCN-UHFFFAOYSA-N 259.353 2.201 10 20 CECD C[C@H](NCC1(N)CCCC1)c1cc(C(=O)O)ccc1O 1604338183 QTAROWIWNSVVAP-JTQLQIEISA-N 278.352 2.013 10 20 CECD CC(C)COC(=O)CSc1ncc(C(=O)O)s1 1609699704 AIVXHVDUNPDGLB-UHFFFAOYSA-N 275.351 2.133 10 20 CECD O=C(O)[C@@H](CC1CC1)NCc1ccc(F)c(F)c1O 1601639714 NPFGUJAPSQEKII-SNVBAGLBSA-N 271.263 2.013 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)c1ncc(C(=O)O)s1 1604307415 HPHMFDKWFUILQO-RXMQYKEDSA-N 298.345 2.099 10 20 CECD Oc1ccc(F)cc1CNC[C@@H]1CCC[C@@H](O)C1 226611440 OUUIPSQCGNKDSD-ZWNOBZJWSA-N 253.317 2.172 10 20 CECD CCc1oc(C(=O)NCc2cccc(O)c2O)cc1C 1548791622 OIZXEAUAARBVHL-UHFFFAOYSA-N 275.304 2.492 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1ncn(C)n1 230670191 CVSWZZNBSTYRSF-QWRGUYRKSA-N 272.352 2.167 10 20 CECD Oc1cc(F)c(Cl)cc1CN[C@@H]1C[C@H]2CN[C@@H](C2)C1 1580887904 AUZGYTPMYGIASQ-INTQDDNPSA-N 284.762 2.415 10 20 CECD COc1cccc(O)c1CNc1cccc(CC(=O)O)n1 1599680314 LCTJVRLQAFIWIR-UHFFFAOYSA-N 288.303 2.035 10 20 CECD C[C@H](NCC(C)(F)F)c1cc(C(=O)O)ccc1O 1593241230 YEHBKQLVSSPJQL-ZETCQYMHSA-N 259.252 2.396 10 20 CECD O=C(O)[C@]1(NCc2cc(F)cc(F)c2O)CC[C@@H]2C[C@@H]21 1777600587 CQBWWLNMURUQTR-IMIVBSTGSA-N 283.274 2.013 10 20 CECD CCOc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1 158944598 UJAOUZORYSIMDS-UHFFFAOYSA-N 287.315 2.427 10 20 CECD Cc1ccc(O)c(CN[C@H](C)[C@H](O)C(F)(F)F)c1 865711140 JAAGJNLRVDRPNT-KCJUWKMLSA-N 263.259 2.102 10 20 CECD Cc1ccc(CNC[C@@](C)(O)C(F)(F)F)c(O)c1 877121394 SJYAPXYNMUMGLR-LLVKDONJSA-N 263.259 2.104 10 20 CECD c1cc2c(cc1CNCCN1CCCCC1)CCO2 48400304 GNBONLQZDWDMAB-UHFFFAOYSA-N 260.381 2.197 10 20 CECD C[C@H](NCCCCS(C)(=O)=O)c1ccc(F)cc1O 818348857 AFILIHZMVHMHBF-JTQLQIEISA-N 289.372 2.007 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1OC[C@@H]2CCC[C@@H]21 377762473 NVIXRVJRDIMBPX-KCQAQPDRSA-N 275.348 2.166 10 20 CECD CC(C)COC[C@H](O)CN[C@H](C)c1ccccc1O 179873560 JRLLXVLDAGLQHK-CHWSQXEVSA-N 267.369 2.076 10 20 CECD CC(C)N1CCC(C(=O)N(C)Cc2ccccc2O)CC1 177077730 ISQFPNMSCRNNTH-UHFFFAOYSA-N 290.407 2.471 10 20 CECD CC(C)CNCc1ccc(N2CCC(C(N)=O)CC2)cc1 62734525 YWWKZCPMHDWYQN-UHFFFAOYSA-N 289.423 2.134 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)Nc1ccc(C#N)cn1 183599486 GGHCHMCRSXJDFU-SNVBAGLBSA-N 269.304 2.408 10 20 CECD CCNC(=O)C(C)(C)CN[C@@H](C)c1ccccc1O 183666457 NQAIDTAUVPOKOJ-NSHDSACASA-N 264.369 2.205 10 20 CECD Cc1ccn(C)c1C(=O)NCc1ccc(N(C)C)c(F)c1 189484826 DLGDBWNJFFJDNW-UHFFFAOYSA-N 289.354 2.469 10 20 CECD COC[C@H](NCc1cc([N+](=O)[O-])ccc1O)c1ccco1 80263234 HFSKRQMGVAMFSB-LBPRGKRZSA-N 292.291 2.371 10 20 CECD CCCCN(CCOC)C(=O)c1ccc(C)c(O)c1O 272872193 WMPXMUYNWPIRFU-UHFFFAOYSA-N 281.352 2.295 10 20 CECD CN(Cc1ccccc1O)c1cc(N2CCCC2)ncn1 277273723 ABUNFICJMBOORM-UHFFFAOYSA-N 284.363 2.419 10 20 CECD COc1ccc2c(c1)CCCCN2CC1OCCO1 272307165 VXABNQLPVBWXNR-UHFFFAOYSA-N 263.337 2.211 10 20 CECD Cc1ccc(O)c(CN2C[C@@H](C)OC3(CCOCC3)C2)c1 280417846 IIWSJRGJRJBASK-CQSZACIVSA-N 291.391 2.471 10 20 CECD CC[C@@H](NCc1ncn(C)n1)c1ccc(C)cc1O 280269150 XTQQBYSEMVMVCG-GFCCVEGCSA-N 260.341 2.070 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@H]2COCCO2)c1O 808677838 FJSGHTMVBSNPPA-PWSUYJOCSA-N 285.771 2.420 10 20 CECD CCOC1CC(C(=O)N[C@@H](C)c2cc(OC)ccc2O)C1 806792294 LYYXJZLKQHPNCT-ZBOXLXRLSA-N 293.363 2.393 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1cn(C)cn1 808389177 PNDULGVVTNAALW-UHFFFAOYSA-N 258.369 2.084 10 20 CECD CN1CCC[C@]2(CCN(Cc3cc(F)ccc3O)C2)C1 293518946 AXINUHWDWIRQOJ-INIZCTEOSA-N 278.371 2.449 10 20 CECD C[C@@H](NCCN1CCC(O)CC1)c1cc(Cl)ccc1O 295813796 BGCRITFDLWGYRF-LLVKDONJSA-N 298.814 2.153 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(CO)c1 813454769 CHUKQNMKVBYCMI-UHFFFAOYSA-N 298.386 2.483 10 20 CECD CCOc1ccc(CN[C@H](CO)CC(C)C)c(O)c1 725846338 GDNQBFONBSSJLO-ZDUSSCGKSA-N 267.369 2.288 10 20 CECD COC(=O)c1cnc(S[C@@H](C)c2nc(C)no2)s1 829688638 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COc1ccc(O)c(CN[C@H](C)CCCCN)c1 841078789 GPQNBHODBZOANA-LLVKDONJSA-N 252.358 2.008 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@@H]2NCC[C@@H]2C1 843126607 LPYVMLNABLLSQC-SKDRFNHKSA-N 284.762 2.369 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCCC(F)(F)C1 846660983 ZMGRVXIQFCRBGN-UHFFFAOYSA-N 275.226 2.108 10 20 CECD O=C(NCc1ccccc1O)C1C[C@@H]2CCC[C@H](C1)C2=O 748345699 INSJSNWDFCQATA-ONXXMXGDSA-N 287.359 2.404 10 20 CECD Nc1ccc(CCNC(=O)NC[C@H]2CCCS2)cc1 841857187 FUCLRWBIPHICPI-CYBMUJFWSA-N 279.409 2.006 10 20 CECD CCOc1cccc(CN2CC[C@@H](C)[C@H](CO)C2)c1O 857061972 XESQPEPROHZYGH-OCCSQVGLSA-N 279.380 2.241 10 20 CECD O=C(NC[C@@H](CCO)c1ccccc1)c1cc(O)cs1 755853662 GYOOPVZUJOBSJY-GFCCVEGCSA-N 291.372 2.350 10 20 CECD C[S@](=O)[C@H]1CCC[C@H](NCc2ccccc2O)C1 850355440 IRNGHHUXORTRME-LXIYXOSZSA-N 267.394 2.172 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2CCN2C)cc1F 922575270 FTCLMCAGBCIJHH-CQSZACIVSA-N 279.403 2.466 10 20 CECD C[C@@H](NCc1cc(F)c(N(C)C)cc1F)c1ncn(C)n1 858158845 SHMCUBMCXIAVQY-SECBINFHSA-N 295.337 2.010 10 20 CECD C[C@@H](NCc1cocn1)c1cc([N+](=O)[O-])ccc1O 756832769 SXGGWGVDQNEKKA-MRVPVSSYSA-N 263.253 2.139 10 20 CECD CCN(C)c1ccc([C@H](C)NCCN(C)C(=O)OC)cc1 850550940 RWMVCLZQESSIMS-ZDUSSCGKSA-N 293.411 2.492 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCOC[C@@H]2CCOC2)c1 756564208 RIQGVGMXKVXKRW-ZIAGYGMSSA-N 279.380 2.404 10 20 CECD C[C@H](N[C@H]1C[C@@H](CO)C1)c1cc(Cl)ccc1O 866416659 YZDHHFIEHNETBY-ATZCPNFKSA-N 255.745 2.467 10 20 CECD Cc1ccc(O)c(CNC(=O)CC2(O)CCCCC2)c1 862760499 SRNFOIFMULAHKA-UHFFFAOYSA-N 277.364 2.402 10 20 CECD C[C@@H](NC(=O)[C@@]1(C)CCOC1)c1ccc(N(C)C)cc1 773011256 DYAKRFVYRZMPQU-WBMJQRKESA-N 276.380 2.356 10 20 CECD C[C@@H](Cc1ccncc1)NC(=O)/C=C/c1ccc(O)c(O)c1 779529411 PPGBBCBOCNTAAS-PYEVWLCESA-N 298.342 2.253 10 20 CECD Cc1c(C(=O)NCc2ccccc2O)ccc2cncn12 1116528369 YURSQCSVZDJKFY-UHFFFAOYSA-N 281.315 2.278 10 20 CECD COc1cccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)c1O 777220438 RHZDNWAZVOJXAU-LLVKDONJSA-N 294.395 2.136 10 20 CECD CNC(=O)C1(NCc2cc(C)c(C)cc2O)CCCC1 779176057 IUYYHKHJKRHSLK-UHFFFAOYSA-N 276.380 2.157 10 20 CECD CC[C@H](NCCN1CCO[C@H](C)C1)c1ccccc1O 775501088 BRXWFASMBSCOTI-HIFRSBDPSA-N 278.396 2.154 10 20 CECD CC(C)c1cc(NS(=O)(=O)c2ccnn2C)ccc1O 882798957 KDWLKMYIFIKZBL-UHFFFAOYSA-N 295.364 2.050 10 20 CECD COc1cccc(CNc2nnc(C)s2)c1O 71783723 KJERCVQJLWHKLO-UHFFFAOYSA-N 251.311 2.173 10 20 CECD Cc1csc(CCNC(=O)c2ccc(C)c(O)c2O)n1 780873376 TUCGKCNNGDNJDI-UHFFFAOYSA-N 292.360 2.144 10 20 CECD O=C(COC(=O)C12CCC(CC1)C2)c1ccc(O)c(O)c1 784676257 SRKMQKCTHKZYKM-UHFFFAOYSA-N 290.315 2.404 10 20 CECD COc1cc(C)cc(CN[C@H]2CN(C3CC3)C[C@H]2C)c1O 894344338 QJDGXGFBYXPVBP-DOMZBBRYSA-N 290.407 2.282 10 20 CECD CCC[C@@H](CCO)NCc1ccc(N(C)C)cc1 716889111 XSWDKRCVGKSNJX-AWEZNQCLSA-N 250.386 2.393 10 20 CECD CCOc1cccc(CN[C@@H]2C[C@]2(C)OC)c1O 694428285 UZLWFPOBSOYUKB-OCCSQVGLSA-N 251.326 2.058 10 20 CECD C[C@H](N[C@@H]1CCN(C)[C@H](C)C1)c1cc(C(=O)O)ccc1O 1593220070 QCFZBWAAXZRYIU-NTZNESFSSA-N 292.379 2.224 10 20 CECD CCN1CCc2cc(CN[C@H](C(=O)O)[C@H]3C[C@@H]3C)ccc21 1776884724 NCBHKPJNJZOTLV-PJODQICGSA-N 288.391 2.268 10 20 CECD CCN(CC(=O)NCc1ccc(N(C)C)cc1)CC(C)C 153753410 LXJYDZRTLVRSLN-UHFFFAOYSA-N 291.439 2.347 10 20 CECD Cc1cncc(C(=O)N(C)Cc2ccccc2O)c1 175505255 INFLHXIVQSXBNY-UHFFFAOYSA-N 256.305 2.368 10 20 CECD Cc1cccc(CNC2C[C@@H]3CC[C@H](C2)N3C)c1O 295042082 OVWCMGBWMAGQGO-GOOCMWNKSA-N 260.381 2.415 10 20 CECD CC1(C)CN(Cc2cc(Cl)ccc2O)CCN1 396116486 RNUXQFGQGHZGLP-UHFFFAOYSA-N 254.761 2.229 10 20 CECD COc1ccsc1C(=O)NCc1cccc(OC)c1O 106285325 ITKJVZUEUIVDBW-UHFFFAOYSA-N 293.344 2.401 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(F)cc2N)cc1 59928437 YFFYLHUPTSERED-UHFFFAOYSA-N 287.338 2.404 10 20 CECD CCCC[C@H](COC)NC(=O)NCc1ccc(N)cc1 1346634796 ZMROWAIDUKXJBG-CQSZACIVSA-N 279.384 2.273 10 20 CECD COC(=O)COc1ccc(N(C)CCCSC)cc1 183803126 KNXFRSDVSDDWKV-UHFFFAOYSA-N 283.393 2.428 10 20 CECD C[C@@]1(C(=O)O)CCN(Cc2cc(Cl)ccc2O)C1 86778752 ZIFMHASPOZWTCI-CYBMUJFWSA-N 269.728 2.342 10 20 CECD CCN1CCN(Cc2cccc(C)c2O)C(C)(C)C1=O 190027049 YFDARUPYEJFBKG-UHFFFAOYSA-N 276.380 2.143 10 20 CECD O=C1N=C(NC2CCCCC2)S/C1=C\c1csnn1 45745733 RTMYSRWZEUNABQ-POHAHGRESA-N 294.405 2.431 10 20 CECD CC(C)NC(=O)CCN[C@@H](C)c1ccc(F)c(F)c1O 191198062 ZUXKBJNWRCCGJJ-VIFPVBQESA-N 286.322 2.236 10 20 CECD CC(C)N(CCO)Cc1ccc(N(C)C)c(F)c1 271038173 MEOUIRYKCNEKRE-UHFFFAOYSA-N 254.349 2.094 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C)[S@@](=O)CC2)cc1C 277808545 YBHUHZBFPKGCLP-YJYMSZOUSA-N 281.421 2.352 10 20 CECD OC[C@H](Cc1ccc(F)cc1)NCc1ccccc1O 271194163 HICVXOAMHWCAET-HNNXBMFYSA-N 275.323 2.225 10 20 CECD Cc1cc(C)n(CCN(C)c2ccc3c(c2)OCO3)n1 270086693 AAVDYLOOVSDFIG-UHFFFAOYSA-N 273.336 2.365 10 20 CECD CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@@H](C)[S@]1=O 289953797 YSRZXTRWTPDJKC-BBEGDGIKSA-N 281.421 2.432 10 20 CECD CCN(CC)c1ccc(CN(C)CCOCCO)cc1F 282700964 JVUUQYLRUTWUOU-UHFFFAOYSA-N 298.402 2.113 10 20 CECD Cc1cc(O)c(CN2CCC[C@](F)(CO)C2)cc1C 289789019 LSYKNIFTTKLQDQ-OAHLLOKOSA-N 267.344 2.305 10 20 CECD CC[C@H](NCc1nncn1C)c1ccc(C)cc1O 280276091 YDGMHJMEPVKZCV-LBPRGKRZSA-N 260.341 2.070 10 20 CECD Cc1cnc(C(=O)NCc2ccc(N3CCCC3)cc2)cn1 298365742 BIMGCQXVTOTURX-UHFFFAOYSA-N 296.374 2.315 10 20 CECD CCc1oc(/C=C2/SC(=S)NC2=O)cc1C(=O)OC 800790194 FVHGWDAXNVQMER-WEVVVXLNSA-N 297.357 2.117 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H]2CC[C@@H](CO)O2)c(O)c1 294450960 VQBGGTMAUSDHGO-MJBXVCDLSA-N 279.380 2.200 10 20 CECD CCC1(CNC(=O)c2c(F)ccc(O)c2O)CCOCC1 295353624 QNAICQGYGRZHPD-UHFFFAOYSA-N 297.326 2.174 10 20 CECD CSc1cccc(NC(=O)c2cccc(O)c2O)n1 807783113 HTTDOKKJRSAGPO-UHFFFAOYSA-N 276.317 2.467 10 20 CECD CC[C@@H](CO)NCc1cc(Br)cc(F)c1O 715724247 ZQMMZWQPFANRAN-VIFPVBQESA-N 292.148 2.154 10 20 CECD COC[C@@]1(CN[C@H](C)c2ccc(C)cc2O)CCCN1 817974197 JIBZNEXUEWTQQY-CJNGLKHVSA-N 278.396 2.120 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H]2COCCO2)c(O)c1 815561483 IHKXOEZXWVJVDW-OLZOCXBDSA-N 265.353 2.075 10 20 CECD COc1cc(CN(C)C[C@H]2CCCN2C)c(O)cc1C 817371648 BAPCYLUJJWRQHS-CQSZACIVSA-N 278.396 2.235 10 20 CECD CON1CCC(NCc2cc(C)c(C)cc2O)CC1 817418853 JCRXTGCTZXEEKO-UHFFFAOYSA-N 264.369 2.124 10 20 CECD COc1ccc(O)c([C@H](C)NC(=S)NC(C)C)c1 728792957 NUMQFKMFAWWCTJ-VIFPVBQESA-N 268.382 2.334 10 20 CECD C[C@H](N)C[C@@H](C)NCc1ccc(N(C)C)c(F)c1 817901939 ZUUOWWDEFXQYFE-WDEREUQCSA-N 253.365 2.107 10 20 CECD CCCc1cc(C(=O)NCc2cc(OC)ccc2O)no1 825840232 RXXOHIAUSCGCTH-UHFFFAOYSA-N 290.319 2.271 10 20 CECD COc1cc(O)c(CNc2ccccc2CN)cc1OC 904485049 JZEZNEAFLFCLAS-UHFFFAOYSA-N 288.347 2.480 10 20 CECD Cc1cc(CNC2(CO)CCSCC2)ccc1N(C)C 839178601 FALOKBVRCFWPBH-UHFFFAOYSA-N 294.464 2.409 10 20 CECD CN(C(=O)/C=C\c1cnn(C)c1)c1c(F)cccc1F 918753397 CRYNKHRLBZQUDU-SREVYHEPSA-N 277.274 2.375 10 20 CECD CCc1cccc(CN[C@@H](CCO)CSC)c1O 848896430 ARKBXLWJDCWQIL-ZDUSSCGKSA-N 269.410 2.158 10 20 CECD CCc1cccc(CN2CCOC[C@H]2[C@H]2CCCO2)c1O 848910161 HLEDPOZKDFLBJP-JKSUJKDBSA-N 291.391 2.334 10 20 CECD Cc1cccc([C@@H]2C(=O)NCCN2Cc2ccccc2O)c1 848951422 ULEOHWDHKKLTMN-QGZVFWFLSA-N 296.370 2.374 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](N)[C@@H](C)C1 843052488 UPLZZGXAVSBEBT-XJKSGUPXSA-N 261.413 2.230 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1ccc2c(c1)CCO2 840959533 YFBRXDADIIJSJR-CQSZACIVSA-N 275.348 2.053 10 20 CECD Oc1c(Cl)cccc1CN1CCC[C@H]2CNC[C@H]21 841026759 CDZVXCGPHTUUQD-GXFFZTMASA-N 266.772 2.229 10 20 CECD CCN(CC)c1ccc(CNC2=NCCCN2C)cc1 848993309 YGXCZHHGHZEPBQ-UHFFFAOYSA-N 274.412 2.314 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@H](N)C2)cc1F 852867494 WGOVXGBALBTYHO-JOCQHMNTSA-N 293.386 2.025 10 20 CECD CNC[C@H](C)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 854231984 MOPWINSRVOOAAO-WCABBAIRSA-N 252.333 2.277 10 20 CECD C[C@@H](NCCN1CCCC1)c1cc([N+](=O)[O-])ccc1O 756356121 YRGDAOWPHSLRJL-LLVKDONJSA-N 279.340 2.047 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@H]2O)C[C@@H]1CC1(C)C 853628031 LTVMIQXMYVUHIE-SMDDNHRTSA-N 277.364 2.296 10 20 CECD C[C@@H](N[C@@H]1CC(=O)N(C)C1)c1cc2c(cc1O)CCCC2 756528721 VYZDYAIGRWPABG-BXUZGUMPSA-N 288.391 2.152 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)C(=O)N(C)C)c(O)c1C 756739842 QLXYHMLMZMNMHZ-VXGBXAGGSA-N 264.369 2.136 10 20 CECD COc1cccc(O)c1CN(CCO)Cc1ccccc1 768142124 IBDVZGVDQFFRTE-UHFFFAOYSA-N 287.359 2.395 10 20 CECD CCC[C@@H](OCC)C(=O)NCc1cc(OC)ccc1O 860242789 WVZFXIUXXIBTBT-CQSZACIVSA-N 281.352 2.222 10 20 CECD Cc1ncc(C)c(NC(=O)NCc2ccc(N(C)C)cc2)n1 1119318303 YOQSVWGCJUPZBR-UHFFFAOYSA-N 299.378 2.481 10 20 CECD CCCOc1ccc(CN[C@@H](C)CC(N)=O)cc1C 873080483 PPDVMXFYEDLKDO-LBPRGKRZSA-N 264.369 2.137 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCC(F)(F)F 779524652 FOUXIALMUSWVSP-RQOWECAXSA-N 275.226 2.180 10 20 CECD Nc1cc(C(=O)NCc2ccc(N3CCCC3)cc2)ccn1 1119237028 MRLZUKAXFHQULR-UHFFFAOYSA-N 296.374 2.194 10 20 CECD C[C@H](Nc1cncc2ncnn12)c1ccc(N(C)C)cc1 772295539 HKDQMRNSNMJDAM-NSHDSACASA-N 282.351 2.363 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H]1C1CCOCC1 777533400 KCPLBDCRDOQTJJ-LBPRGKRZSA-N 281.377 2.485 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCCCN1C)c1ccccc1O 1123746857 NAFHYKFROSFPIO-OLZOCXBDSA-N 291.395 2.237 10 20 CECD Cc1nc([C@@H](C)NCc2ccc(N(C)C)cc2C)n[nH]1 894779440 YNXLEWIGZOBOBN-LLVKDONJSA-N 273.384 2.338 10 20 CECD CO[C@@H]1CCOC[C@H]1NCc1cc(Cl)cc(F)c1O 897891392 DSNSNTKJMBTHAH-VXGBXAGGSA-N 289.734 2.078 10 20 CECD CC(C)[C@H](F)C(=O)NCc1ccc(N2CCOCC2)cc1 784144030 HHBQKHKCJACIIP-HNNXBMFYSA-N 294.370 2.134 10 20 CECD C[C@@H](NCc1ncnn1CCF)c1ccc(N(C)C)cc1 799323212 UMOBEDOWJBHGRU-GFCCVEGCSA-N 291.374 2.164 10 20 CECD COc1cccc(O)c1CNC[C@@H](OC)C(F)(F)F 733330225 SVTVGKNLSVJGGK-LLVKDONJSA-N 279.258 2.068 10 20 CECD CC[C@H](C)CC[C@@H](O)CC(=O)NCc1ccc(O)c(O)c1 793689058 IWZZZSHSIWIUEL-WCQYABFASA-N 295.379 2.291 10 20 CECD COc1cccc(CN[C@H]2CCCC[C@H]2N(C)C)c1O 1319832597 BMKAFSNIKSBLJS-UONOGXRCSA-N 278.396 2.363 10 20 CECD CC(=O)c1cc(F)cc(CN(CCO)C2CCC2)c1O 221140730 BZQUOEVHPHXNHG-UHFFFAOYSA-N 281.327 2.081 10 20 CECD C[C@@H](NC(=O)[C@@H]1CC[C@@H]1C(=O)O)c1ccc(N(C)C)cc1 1603234362 MXUWYDZONPXSHB-HONMWMINSA-N 290.363 2.041 10 20 CECD CCCN(c1ccc(CN)cc1)[C@H](C)[C@@H]1C[C@H]1C(=O)O 1605320798 PSGIDBDYPPUPJL-BYCMXARLSA-N 276.380 2.471 10 20 CECD CC(C)C[C@H](NCc1cc(F)c(F)cc1O)C(=O)O 1573539732 YUPSAZBECWTFEM-NSHDSACASA-N 273.279 2.259 10 20 CECD C[C@@H](NC[C@H]1COC(C)(C)O1)c1ccccc1O 230206250 QZZFOKUVORUCME-MNOVXSKESA-N 251.326 2.194 10 20 CECD O=C(O)C1CCN(Cc2cc(Cl)c(F)cc2O)CC1 1594934266 XASVKSQBTMOEHK-UHFFFAOYSA-N 287.718 2.481 10 20 CECD C[C@@H]1CCC[C@@]1(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776636390 LNRQZWGRQVDBNC-OTYXRUKQSA-N 294.307 2.033 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2sccc2C1 126194623 NAVLTCYRNPEQBB-UHFFFAOYSA-N 275.329 2.358 10 20 CECD Cn1cncc1CNCc1ccc2c(c1)CCCO2 922133668 AANKKYVGTLDYBM-UHFFFAOYSA-N 257.337 2.035 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCCN1C)c1ccccc1O 827936936 HHXXRBLQNPCBOT-DGCLKSJQSA-N 262.353 2.054 10 20 CECD CC(C)(C)NC(=O)CCN[C@@H]1CCc2cccc(O)c21 312651259 FNLNXBKJSVPHAC-GFCCVEGCSA-N 276.380 2.274 10 20 CECD CN(C)c1ccc(CNC[C@H](O)c2ccco2)cc1 78878420 KWJCDVGCOOARKT-AWEZNQCLSA-N 260.337 2.169 10 20 CECD CN(C)c1ccc(CNC2CCC(C(=O)O)CC2)cc1 86735087 XJBUXRPZSFBYLH-UHFFFAOYSA-N 276.380 2.486 10 20 CECD Cc1cccnc1C(=O)N(C)Cc1ccccc1O 383683657 CVOJPVPCNXDTMJ-UHFFFAOYSA-N 256.305 2.368 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](C)OCC2CC2)c1 103529204 ULFIBONWWZTXDV-QWRGUYRKSA-N 293.363 2.393 10 20 CECD COc1cccc(CNC[C@@H](c2ccco2)N(C)C)c1O 20122237 JKYUSFLZHBGFFM-ZDUSSCGKSA-N 290.363 2.386 10 20 CECD CN(C)c1ccnc(NCc2ccc(N(C)C)c(F)c2)n1 301738034 SCTWCXMLPAASGK-UHFFFAOYSA-N 289.358 2.360 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)OC 66096076 YQPWPMIJVHOKKD-LLVKDONJSA-N 251.326 2.166 10 20 CECD C/C=C(\C)C(=O)NCc1ccc(N(C)C)c(F)c1 175826395 JCUNUQZHHMWYGT-BJMVGYQFSA-N 250.317 2.474 10 20 CECD CC[C@H](C)CC(=O)NCc1cccc(OC)c1O 189552836 XVVULHYWTWZJKD-JTQLQIEISA-N 251.326 2.453 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(C2CC2)[nH]c(=O)c1 186102647 QGWOFSHTMHOXGP-UHFFFAOYSA-N 298.342 2.230 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(NC)CCC1 314423818 YDQYPQQFVATTNN-UHFFFAOYSA-N 289.423 2.243 10 20 CECD C[C@@H](CNC(=O)c1cccc(O)c1O)Oc1ccccc1 185654837 JKAJYFIWZVEREI-NSHDSACASA-N 287.315 2.295 10 20 CECD c1cc(N2CCOCC2)ccc1CNC[C@H]1CCCCO1 42813880 DMCKXYLZKBONNZ-QGZVFWFLSA-N 290.407 2.182 10 20 CECD CCCOc1ccc(CN2CC[C@](C)(O)C2)c(O)c1 180195664 UOHHTYXRPGCUIU-HNNXBMFYSA-N 265.353 2.138 10 20 CECD Cc1ccc(C(=O)N(C)c2cccnc2)c(O)c1O 182434213 VIHPTRQQFHFQQV-UHFFFAOYSA-N 258.277 2.078 10 20 CECD C[C@H](CCO)CNCc1cccc(Br)c1O 85126115 NENOQYVYXOKUGY-SECBINFHSA-N 288.185 2.263 10 20 CECD CCC[C@@H]1C[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272695565 VENUUNWQKKDJKD-ONYUAGEFSA-N 261.321 2.416 10 20 CECD Cc1ccc(O)c(CN2CCCC[C@H](S(C)(=O)=O)C2)c1 278634148 IJGGHNXSJSICPO-AWEZNQCLSA-N 297.420 2.100 10 20 CECD CC[C@H](N[C@H](CO)c1cnn(C)c1)c1ccc(C)cc1O 280245553 WGHBTXGVDRNHLL-LSDHHAIUSA-N 289.379 2.208 10 20 CECD COc1ccc(O)c([C@H](C)NCc2ccc(OC)nn2)c1 801529212 LYNYCQRICDYKKT-JTQLQIEISA-N 289.335 2.050 10 20 CECD COCC[C@@H]1COCCN1Cc1ccc(N(C)C)c(F)c1 291363687 YQWHPHBFWDIXAG-CQSZACIVSA-N 296.386 2.129 10 20 CECD O=C(NCCCN1CCCCC1)NCc1ccccc1O 299481765 HFGLYBAKFGAPNI-UHFFFAOYSA-N 291.395 2.067 10 20 CECD CCN(C)c1ccc(CN(CC)[C@H](C)CO)cc1 815121166 RPDOZHUMBAMMIE-CYBMUJFWSA-N 250.386 2.345 10 20 CECD COc1ccc(O)c(CN[C@@H](C2CC2)[C@@H](CO)C2CC2)c1 824845565 MEFKMEALFXPVGP-RDJZCZTQSA-N 291.391 2.288 10 20 CECD CN(CC[S@](C)=O)Cc1ccc(N2CCCCC2)cc1 827337368 VVWYZNAWZBIXHL-FQEVSTJZSA-N 294.464 2.487 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)Cc1cnc[nH]1 826769252 JXBFMRSJALMPOW-UHFFFAOYSA-N 258.369 2.416 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCC[C@@H](N)C2)c1 828667877 VSKFKLHIFKAIMS-QJPTWQEYSA-N 292.379 2.096 10 20 CECD CN1CCCc2cc(CNC(=O)NOC3CCC3)ccc21 836566307 UZWWTUYHWUWKDS-UHFFFAOYSA-N 289.379 2.352 10 20 CECD Cc1ccncc1N(C)C(=O)/C=C\c1cccnc1 492594247 RVRHCJMCZGKOBI-WAYWQWQTSA-N 253.305 2.461 10 20 CECD Cc1ccncc1CNC(=O)NCc1ccc(N(C)C)cc1 836236437 ZWDIBFHFDSDHOR-UHFFFAOYSA-N 298.390 2.455 10 20 CECD Cc1cc(CCc2nc(Cc3ccc(N)cc3)no2)no1 904505541 YFLDAJZVZNYXPB-UHFFFAOYSA-N 284.319 2.324 10 20 CECD COC[C@@H]1COCCN1Cc1c(O)ccc2ccccc12 902561843 CKWWCEBCPWJIHB-CQSZACIVSA-N 287.359 2.393 10 20 CECD COc1ccc(N(C)Cc2cc(C)nn2C)cc1OC 841873944 ITYPCEZQMRCMNA-UHFFFAOYSA-N 275.352 2.382 10 20 CECD COCCCCN(C)c1cc(OC)c(OC)cc1[N+](=O)[O-] 842050801 WEYHIAAPPOFWSU-UHFFFAOYSA-N 298.339 2.475 10 20 CECD CN(C)c1ccc(OCc2ccc(S(C)(=O)=O)o2)cc1 842043000 GEERZOXRPRNTNW-UHFFFAOYSA-N 295.360 2.328 10 20 CECD COc1cccc(CNCC2(N)CCCCC2)c1O 841039249 GZYYKVXPHGRFIN-UHFFFAOYSA-N 264.369 2.152 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCN[C@@H](C)[C@H]1C 843057236 HEHMSXPZAYGVTI-UONOGXRCSA-N 261.413 2.243 10 20 CECD C[C@H]1CN(Cc2cccc(Br)c2O)CC[C@@H]1N 843052862 WUOQABRWUAPKJP-CABZTGNLSA-N 299.212 2.324 10 20 CECD CCOc1cccc(CN[C@H]2CCC[C@@H](N)C2)c1O 841055214 MALFFMGZSUQANF-OLZOCXBDSA-N 264.369 2.150 10 20 CECD C[C@@H](C[C@@H](C)N)NCc1cc(Cl)cc([N+](=O)[O-])c1O 843130010 WODOWBATUACDEZ-SFYZADRCSA-N 287.747 2.169 10 20 CECD CO[C@H]1COCC[C@@H]1CNCc1ccc2c(c1)CCCO2 922157057 VNHZXWYIUVNEQI-WBVHZDCISA-N 291.391 2.153 10 20 CECD COC(=O)c1ccoc1CN(C)c1ccc2c(c1)OCO2 756654516 VICKDCNLFZNEKG-UHFFFAOYSA-N 289.287 2.431 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1cc(OC)ccc1O 756731551 CAWPDJSDTLJFIS-NWDGAFQWSA-N 283.368 2.103 10 20 CECD COCCN(C)CCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756528725 OZNJGXDDDMKMQN-WCQYABFASA-N 296.386 2.247 10 20 CECD NC(=O)[C@@H](NCc1ccc2c(c1)CCCO2)c1ccccc1 921522104 XVFREEGALFSPLH-KRWDZBQOSA-N 296.370 2.328 10 20 CECD CCOc1ccc(CN2C[C@@H](C)OC[C@@H]2C)c(O)c1 768537652 RIQGHVZKIQCGOW-NWDGAFQWSA-N 265.353 2.400 10 20 CECD Cc1cccc(O)c1CN1CCC[C@@H]1c1nncn1C 876780674 ICRQWWPWJQDUGU-CYBMUJFWSA-N 272.352 2.166 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)[C@H](C)CN1C 775983111 BCEMKENWEYEHSW-QWHCGFSZSA-N 279.403 2.416 10 20 CECD CCNc1ncc(C(=O)NCc2ccccc2O)s1 771003353 DOHAQERKFDYUJP-UHFFFAOYSA-N 277.349 2.211 10 20 CECD COc1ccc(CN[C@@H](CC2CC2)C(=O)O)cc1C 871882866 VLEGCBIJYKDJOO-ZDUSSCGKSA-N 263.337 2.347 10 20 CECD CC(C)C1CN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779536189 WPJRJJAFHYSJAO-XQRVVYSFSA-N 261.321 2.225 10 20 CECD Oc1ccccc1CN1CCN(c2ccccn2)CC1 62183915 IXXREPDAKPCIFM-UHFFFAOYSA-N 269.348 2.109 10 20 CECD CCOc1ccc(CN[C@@]2(CCOC)CCOC2)c(O)c1 775035357 YYCFALIWQSEUQK-INIZCTEOSA-N 295.379 2.076 10 20 CECD Cc1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)oc1C 784231675 SKXOVJDUCOQZFR-UHFFFAOYSA-N 290.271 2.347 10 20 CECD CO[C@H](CNCc1cc(C)ccc1O)C(F)(F)F 733328934 HVGWUHBOKUTMPL-LLVKDONJSA-N 263.259 2.368 10 20 CECD CO[C@@H](C)CNCc1cc(Br)ccc1O 191143152 LQKLGXQQDMWVCE-QMMMGPOBSA-N 274.158 2.279 10 20 CECD Cc1c[nH]nc1C(=O)NCc1ccc(N2CCCC2)cc1 799410460 QBTPGXPEQWGVDK-UHFFFAOYSA-N 284.363 2.248 10 20 CECD CCOC1CCN(Cc2c(O)cccc2OC)CC1 768527482 KTYPHVPOJNJKBV-UHFFFAOYSA-N 265.353 2.402 10 20 CECD OC[C@@H](CNCc1cc(F)ccc1O)CC1CCOCC1 1321296077 HQUOYGVRMMXGCE-CYBMUJFWSA-N 297.370 2.046 10 20 CECD Cc1ccc(C(=O)N=c2cc[nH]c3ccncc23)c(O)c1O 1320794034 ZXNIDKYLQMHBGT-UHFFFAOYSA-N 295.298 2.024 10 20 CECD COC(=O)CN(CCc1ccccc1)Cc1ccc(N)cc1 1336118658 ZNLBWOWXXCXYJI-UHFFFAOYSA-N 298.386 2.487 10 20 CECD O=C(NCc1cccc(O)c1O)c1ccoc1C1CC1 1521850819 ADIBISFTZHJJSQ-UHFFFAOYSA-N 273.288 2.498 10 20 CECD Cc1ccc(C(=O)NCc2ccccc2O)cc1C(=O)O 1607733643 UXLZUFVLDGJYCC-UHFFFAOYSA-N 285.299 2.329 10 20 CECD O=C(O)c1ccc(COC(=O)c2cccc(O)c2O)cc1 1602351643 QIWMADYWXIUKJC-UHFFFAOYSA-N 288.255 2.153 10 20 CECD O=C(O)c1ccc(NCc2cc(Cl)ccc2O)nn1 1602381830 OECZNUXAPPZIGS-UHFFFAOYSA-N 279.683 2.146 10 20 CECD C[C@@H](NC[C@H]1[C@H](C(=O)O)C1(F)F)c1ccccc1O 1607422519 ZAYBGJGBDGAQJP-POZPLHJXSA-N 271.263 2.009 10 20 CECD CCOc1ccc(CN(CC)CCC(=O)O)c(O)c1 1610044419 WJXZMQFGJDADKW-UHFFFAOYSA-N 267.325 2.088 10 20 CECD CC(C)NCC(=O)N(C)Cc1ccc(N2CCCC2)cc1 1575722304 MBWFFWAUPNWBAG-UHFFFAOYSA-N 289.423 2.243 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)C(=O)NC(C)(C)C 134493223 GRSFMCOLGFAJJA-VIFPVBQESA-N 284.787 2.438 10 20 CECD Cc1c(/C=C/C(=O)N(C)c2ccc3c(c2)OCO3)cnn1C 153456561 GTTQEJRQODJLGZ-QPJJXVBHSA-N 299.330 2.133 10 20 CECD CC[C@H]1C[C@@H](NCc2ccc(OC)cc2O)CCO1 824320397 HAKSOTMPBAUVTE-STQMWFEESA-N 265.353 2.448 10 20 CECD Cc1ccc(O)c([C@H](C)NCCS(=O)(=O)C(C)C)c1 290193934 GCQONKXTMYKQEI-LBPRGKRZSA-N 285.409 2.174 10 20 CECD CC(C)(C)N1CC[C@H](NCc2cc(F)ccc2O)C1 693857575 VAJGGZVPDLPCLX-ZDUSSCGKSA-N 266.360 2.494 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)[C@H]1CCCCN1 386111700 LOBGNYIJJXMDJT-CZUORRHYSA-N 261.413 2.373 10 20 CECD O=C(N[C@H]1CCC(F)(F)C1)c1cccc(O)c1O 394676087 VRWVWCCUEFBMOA-ZETCQYMHSA-N 257.236 2.015 10 20 CECD C[C@@H](NC(=O)c1c[nH]nc1C1CC1)c1ccccc1O 827940858 JMOSZNQRPWAUDQ-SECBINFHSA-N 271.320 2.484 10 20 CECD COCCN(CC(C)C)C(=O)c1ccc(C)c(O)c1O 177670654 JINSXXSPVGDWQK-UHFFFAOYSA-N 281.352 2.151 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cnc[nH]2)cc1F 66931687 ZBPNQYLPAZEAIM-UHFFFAOYSA-N 290.342 2.325 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1cc(F)ccc1O 182317575 HRFRGRRUKMJOPY-AWEZNQCLSA-N 266.316 2.152 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2c[nH]c(C#N)c2)c1 181282231 ALZAUCWUBUFJMR-SECBINFHSA-N 285.303 2.092 10 20 CECD CNC(=O)c1ccc(CN(C)c2ccc3c(c2)OCO3)cc1 121301462 CRCWJARSRFTNMH-UHFFFAOYSA-N 298.342 2.411 10 20 CECD C[C@@H](N)C1CCN(Cc2cc(F)ccc2O)CC1 219871501 ZHGMUDRJLHXCFZ-SNVBAGLBSA-N 252.333 2.091 10 20 CECD COc1ccc(O)c([C@H](C)NCC(=O)OCC(C)C)c1 181507193 WFXNIDXQVBTREX-NSHDSACASA-N 281.352 2.251 10 20 CECD Cc1cc(C(=O)NCc2ccc(O)c(O)c2)cc(Cl)n1 132337661 OKXOQLKXCWBMNK-UHFFFAOYSA-N 292.722 2.385 10 20 CECD CC[C@@H](NC(=O)c1cccc(O)c1O)c1ccncc1 187122282 RVQWPRDJNZFJJV-GFCCVEGCSA-N 272.304 2.374 10 20 CECD COC[C@@H](C)CN[C@H](C)c1cc(OC)ccc1O 45656222 UIWNBNQOJSPKRQ-WDEREUQCSA-N 253.342 2.334 10 20 CECD COCC[C@H](C)N[C@@H](C)c1cc(OC)ccc1O 81708024 NBIWOEVZHJPEJJ-QWRGUYRKSA-N 253.342 2.476 10 20 CECD CCOc1cccc(CNCCCCOC)c1O 44655534 SGMKRQMSTHCKTH-UHFFFAOYSA-N 253.342 2.307 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@H](C)c1ccccc1O 252819197 MTLSXTRHMBKFLG-CZIZLABSSA-N 255.383 2.200 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCOC1 266189852 YDSFSJJJVOPHJC-AAEUAGOBSA-N 266.360 2.406 10 20 CECD C[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)[C@@H]1C 295131809 ICNVMCPQOYNGTD-HTQZYQBOSA-N 253.273 2.107 10 20 CECD COc1ccc(CNc2ccnc3c2cnn3C)c(O)c1 804683084 VGSJITCUVONMEI-UHFFFAOYSA-N 284.319 2.295 10 20 CECD CCNC(=O)[C@@H](NCc1cc(C)c(C)cc1O)C(C)C 292920171 IDWAUHQYIZSSRO-HNNXBMFYSA-N 278.396 2.259 10 20 CECD COc1cccc(CNC(=O)c2ocnc2C2CC2)c1O 809659991 IINXZBXLDISSOK-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CC(C)(C)[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCO1 296256675 LRIWAMNGUSBTTB-LLVKDONJSA-N 297.326 2.124 10 20 CECD C[C@H](CN)N[C@H](C)c1cccc(C(F)(F)F)c1O 817966319 LIVYJOMIDLPOCU-HTQZYQBOSA-N 262.275 2.409 10 20 CECD CC[C@H](NCC1(N)CCC1)c1ccc(F)cc1O 817964774 IFEHIAOLLPUVJF-LBPRGKRZSA-N 252.333 2.453 10 20 CECD OC[C@H](NCc1cc(Cl)c(F)cc1O)C1CC1 816551852 QQLQSMCNQXOKEW-NSHDSACASA-N 259.708 2.045 10 20 CECD CCOc1ccc(CNC[C@@]2(O)CCC[C@@H]2C)c(O)c1 815160115 PYONITMESVRFMB-LRDDRELGSA-N 279.380 2.432 10 20 CECD COc1cc(O)c(CNCCc2ccoc2)cc1OC 827229913 ONOGFKIEHBXTLB-UHFFFAOYSA-N 277.320 2.335 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C)[C@](C)(CO)C2)cc1C 827700047 OTFCIXXGQNNCSZ-CJNGLKHVSA-N 263.381 2.459 10 20 CECD CC(C)[C@H](CO)[C@@H](NC(=O)c1cc(O)cs1)C(C)C 834044663 NMWCPMQOUIHDIF-AAEUAGOBSA-N 285.409 2.473 10 20 CECD CC[C@@H](CO)N(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 838560460 XHLLNHBAPUWUMU-JSGCOSHPSA-N 293.411 2.226 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=S)NC(C)C 734385504 NQXDPRDKTZEBAQ-UHFFFAOYSA-N 265.426 2.434 10 20 CECD COCC1(CNC(=O)c2ccc(C)c(O)c2O)CCCC1 837112972 OUZZBHHOBGQNPP-UHFFFAOYSA-N 293.363 2.343 10 20 CECD Oc1c(Br)cccc1CNC[C@@H]1CCOC1 42412418 ZOHSACVNJGHFQG-VIFPVBQESA-N 286.169 2.281 10 20 CECD C[C@@H](CN1CCOCC1)N[C@H](C)c1ccc(Cl)cc1O 841744683 JYIJYAFKKYIYNF-NWDGAFQWSA-N 298.814 2.417 10 20 CECD COc1cccc(CNCc2c(C3CC3)cnn2C)c1O 850380390 UFHFXCZZJXOHFU-UHFFFAOYSA-N 287.363 2.302 10 20 CECD Cc1ccc(C(=O)N2CC(C)(C)OC[C@@H]2C)c(O)c1O 754744986 MIINHJQAHWJKGK-JTQLQIEISA-N 279.336 2.046 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1ccc(OC)c(C)c1 759173564 QBOWMISSNDHGEC-ZBFHGGJFSA-N 279.380 2.287 10 20 CECD CCc1nc(C(=O)NCc2ccc(N(C)C)cc2)co1 753634135 QUKKYLQMNITFMJ-UHFFFAOYSA-N 273.336 2.233 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@@H]([S@](C)=O)C2)c1O 850356634 QUZYUIWBZBYZDK-IZDJOXEWSA-N 297.420 2.180 10 20 CECD Cc1nn(C)c(Cl)c1C(=O)NCc1ccccc1O 769358878 RUFGPMHTYNTZNC-UHFFFAOYSA-N 279.727 2.018 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)[C@H](C)C2)c1 862757912 IDRQCFWBGHNGGW-NEPJUHHUSA-N 275.348 2.322 10 20 CECD COc1ccc(CN[C@@H]2CCC[C@@H]2C(=O)O)cc1C 864525515 CMXNILLTHTUMEL-QWHCGFSZSA-N 263.337 2.347 10 20 CECD CC[C@@H](N[C@H]1CCCN(C)C1=O)c1ccc(N(C)C)cc1 766435873 BJVONMVJVRJFTI-CVEARBPZSA-N 289.423 2.414 10 20 CECD CCOc1ccc(CN(C)C[C@@H]2CCC[C@H]2O)c(O)c1 770291262 FRMVLVNITDECOV-SWLSCSKDSA-N 279.380 2.384 10 20 CECD COc1cc(O)c(CN2CCO[C@@H](C(C)C)C2)cc1OC 777967690 FIHABWTYMJXXIJ-MRXNPFEDSA-N 295.379 2.266 10 20 CECD Cc1nc[nH]c1C(=O)NCc1ccc(N2CCCC2)cc1 874001747 MCMBEAGDWIAVTD-UHFFFAOYSA-N 284.363 2.248 10 20 CECD Cc1ccc(CN[C@@H](C)C(=O)NCc2ccco2)c(O)c1 877150438 SFSMEZPYRFGFJT-LBPRGKRZSA-N 288.347 2.088 10 20 CECD C[C@H](N[C@H](CO)C[C@H]1CCCO1)c1ccc(N(C)C)cc1 886666002 KYZQNLBYYNNRGX-JLJPHGGASA-N 292.423 2.333 10 20 CECD CCOc1ccc(CN[C@H](COC)[C@@H]2CCCO2)c(O)c1 788533864 DDLIKVBBGZAOIA-ZBFHGGJFSA-N 295.379 2.075 10 20 CECD C[C@@H](NCCOC(F)(F)F)c1cc([N+](=O)[O-])ccc1O 788982723 YUMFYGPCLZSIPW-SSDOTTSWSA-N 294.229 2.487 10 20 CECD COc1ccc(CNC(=O)C2Cc3ccccc3C2)c(O)c1 794380790 CUJXBNOGDOAUNR-UHFFFAOYSA-N 297.354 2.432 10 20 CECD CCOC(=O)CN(C)c1ccc(OC(C)C)cc1 191580145 YLZCSLIXSMZPOJ-UHFFFAOYSA-N 251.326 2.473 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)C[C@@H](C)N1C 708383357 LNEYSMPLTLXQPB-AOOOYVTPSA-N 270.323 2.195 10 20 CECD COc1cccc(O)c1CN[C@@H]1C[C@@H](OC)C1(C)C 753374252 RMNXYMPLMLASPT-ZIAGYGMSSA-N 265.353 2.304 10 20 CECD COc1ccc(CN[C@H]2C[C@@H](CNC(C)=O)C2)cc1C 1086009075 RUTOTESIQNFDRY-GASCZTMLSA-N 276.380 2.008 10 20 CECD COC(=O)c1ccc(/C=C2\SC(=S)N(C)C2=O)cc1 14671569 TYCJVBWFKORJAZ-YFHOEESVSA-N 293.369 2.304 10 20 CECD COc1ccc(O)c([C@H](C)Nc2nccn3c(C)nnc23)c1 1336503649 QCJAPQGXQPLLMZ-VIFPVBQESA-N 299.334 2.320 10 20 CECD CC[C@H](F)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1335961790 MYBIRGVCNGNLPE-DOMZBBRYSA-N 294.370 2.386 10 20 CECD Nc1ccc(CN2CCN(Cc3cccc(O)c3)CC2)cc1 1352788748 GQGSZSLTKUYMCC-UHFFFAOYSA-N 297.402 2.292 10 20 CECD O[C@H](CNCc1ccc(N2CCCC2)cc1)C(F)(F)F 219435923 LOKKOWVWTVILND-CYBMUJFWSA-N 288.313 2.300 10 20 CECD CCCN(CC)CCNCc1cc(OC)ccc1O 224900075 UJCBEWNCBRTSAU-UHFFFAOYSA-N 266.385 2.222 10 20 CECD N[C@H]1C[C@H](C(=O)NCc2ccc(N3CCCCC3)cc2)C1 1580427031 QYTKAAMTVBFERG-SHTZXODSSA-N 287.407 2.030 10 20 CECD CC[C@@H](NCc1nncn1CC)c1ccccc1O 230971663 DTZRYHRZUNSZHG-GFCCVEGCSA-N 260.341 2.245 10 20 CECD C[C@@H](N[C@H](C)c1cc(C(=O)O)ccc1O)c1cnn(C)c1 1593196790 IPGAZKVFDOPMDT-NXEZZACHSA-N 289.335 2.236 10 20 CECD O=C(O)[C@@H]1CN(Cc2ccc(F)c(F)c2O)C[C@H]1C1CC1 1595191246 HHUKKPBAHHZYRD-WDEREUQCSA-N 297.301 2.213 10 20 CECD COc1cc(C)cc(CN2CCC(C)(C(=O)O)CC2)c1O 1594054574 WKEZALZPSOGGRC-UHFFFAOYSA-N 293.363 2.396 10 20 CECD Cc1ccc(CNCCCc2c[nH]nc2C)c(O)c1 876922818 MDEHVBKUSRYLET-UHFFFAOYSA-N 259.353 2.455 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](OC)C[C@H]2C)c1 282127232 BDVRIPFMPWNPSO-BXUZGUMPSA-N 265.353 2.400 10 20 CECD COc1ccc(O)c(CNC2(CO)CCCCC2)c1 53096237 PICCIIIFHVTNLU-UHFFFAOYSA-N 265.353 2.186 10 20 CECD COc1ccc(CN[C@H]2COC(C)(C)C2)c(O)c1 396522305 GVWBFRUSSPVGPK-LLVKDONJSA-N 251.326 2.058 10 20 CECD CN(CCNC(=O)OC(C)(C)C)Cc1ccc(N)cc1 1334775325 WBGQDNRMTVQUJY-UHFFFAOYSA-N 279.384 2.225 10 20 CECD COc1cccc(NC(=O)NCc2ccc(O)c(O)c2)c1 174373189 DJPYSFFUZCMAHV-UHFFFAOYSA-N 288.303 2.428 10 20 CECD COCCCN(C)C(=O)NCc1ccc(N(C)C)cc1C 115854610 NSYNRPCWGKDNDF-UHFFFAOYSA-N 293.411 2.239 10 20 CECD CCc1nn(C)cc1CN(C)Cc1ccccc1O 179770566 HDCFRSPLPCGIAQ-UHFFFAOYSA-N 259.353 2.320 10 20 CECD C[C@@H](O)C[C@H]1CCCCN1C(=O)NCc1ccc(N)cc1 1262603510 KZPZQGXEOFPUSY-IUODEOHRSA-N 291.395 2.104 10 20 CECD CCCCN(C)CCNC(=O)N(C)Cc1ccccc1O 112465045 TYALIABLFRMXDB-UHFFFAOYSA-N 293.411 2.266 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](O)COCC(C)C)c1 182316562 JPOQTBSSIIEDJQ-OLZOCXBDSA-N 297.395 2.085 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)N[C@@H](C)c1cc(OC)ccc1O 182343924 AUGLUFIVAZOBOG-SRVKXCTJSA-N 294.395 2.355 10 20 CECD CC1(C)CN(CCNCc2cccc(Cl)c2O)CCO1 182197242 ZGACVKFMGPAWOI-UHFFFAOYSA-N 298.814 2.246 10 20 CECD COc1ccc(N2CCC(NCc3cocn3)CC2)cc1 182066884 VNCUWNWXQIBDJI-UHFFFAOYSA-N 287.363 2.442 10 20 CECD CC[C@H](N)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 40855912 LQTPVDCOTBIFSM-INIZCTEOSA-N 289.423 2.373 10 20 CECD COCCCN(C)Cc1cc(F)cc(C(C)=O)c1O 62032675 UDMLZLFLGMXWOB-UHFFFAOYSA-N 269.316 2.202 10 20 CECD CNCCNC(=O)c1cc(C)n(-c2ccccc2)c1C 237106914 FTXRYPXCODPLCM-UHFFFAOYSA-N 271.364 2.043 10 20 CECD Nc1ccc(CC(=O)Nc2ccc(N3CCCC3)nc2)cc1 237921652 HOARLRUKEVSFMV-UHFFFAOYSA-N 296.374 2.445 10 20 CECD Cc1nc(CCNC(=O)Cc2ccc(N)cc2)sc1C 237633195 DOHWTRSEISRUPQ-UHFFFAOYSA-N 289.404 2.244 10 20 CECD COC(=O)CCCCCCNC(=O)Cc1ccc(N)cc1 237143446 GXTLVTAEUWVZJM-UHFFFAOYSA-N 292.379 2.051 10 20 CECD COCCN(Cc1cccc(OC)c1O)CC(F)(F)F 92645837 OMUNKXPQYJQJKD-UHFFFAOYSA-N 293.285 2.412 10 20 CECD CC(=O)N1CCC[C@@H](CNCc2cccc(Cl)c2O)C1 279679026 ISJQFCBSZMCFDK-LBPRGKRZSA-N 296.798 2.394 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@H]1[C@H](O)C(F)(F)F 272214344 AZXDYLMBUQEZTF-JQWIXIFHSA-N 293.260 2.419 10 20 CECD CC[C@@H](NC[C@@H](COC)OC)c1ccc(N(C)C)cc1 272725529 YOBPQWYRKALYLB-JKSUJKDBSA-N 280.412 2.455 10 20 CECD COc1cccc(CNCC2CCN(C3CC3)CC2)c1O 278497235 MUVQMSQSOPRFFR-UHFFFAOYSA-N 290.407 2.365 10 20 CECD C[C@@H]1[C@@H](N2CCCC2)CCN1Cc1ccccc1O 289925659 WAPAWFKKSZUNND-HIFRSBDPSA-N 260.381 2.451 10 20 CECD CC(=O)C(=O)CSc1nncn1[C@@H](C)c1ccccc1 289754727 VAYVPZOQMOYZBK-JTQLQIEISA-N 289.360 2.138 10 20 CECD C[C@@H](CN(C)C)N[C@@H](C)c1ccc(F)c(F)c1O 286904571 DSDSCKYWPNMUST-IUCAKERBSA-N 258.312 2.271 10 20 CECD COc1ccc(O)c(CN2CC[C@H](N3CCCC3)[C@@H]2C)c1 289141831 AITCMVXTHRFBQN-BBRMVZONSA-N 290.407 2.459 10 20 CECD CC[C@H](NCC1(CO)CCOCC1)c1ccc(F)cc1O 286200079 RHQGGPQPMBZQKM-AWEZNQCLSA-N 297.370 2.361 10 20 CECD CC(C)[C@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)CCO1 297548220 QMTXFNVNBOUGTN-JOYOIKCWSA-N 297.326 2.170 10 20 CECD CO[C@@]1(C)CCCN(C(=O)c2c(F)ccc(O)c2O)CC1 295040447 AHOFGHBQOGZMOH-HNNXBMFYSA-N 297.326 2.268 10 20 CECD O=C(NCc1ccccc1O)c1nc2cnccc2s1 816912265 QZGBXRXIJOKQLK-UHFFFAOYSA-N 285.328 2.327 10 20 CECD COC(=O)CC1CC(NCc2ccc(N(C)C)c(F)c2)C1 818331606 XFBODEDJCWFGEK-UHFFFAOYSA-N 294.370 2.323 10 20 CECD Cc1nccc(CCC(=O)N(C)Cc2ccccc2O)n1 815796662 GLSIAOIOPPVNEY-UHFFFAOYSA-N 285.347 2.082 10 20 CECD CCOc1ccc(CN(C)C[C@H]2CCCN2C)c(O)c1 817417588 PZFYCVXCICBJLY-CQSZACIVSA-N 278.396 2.317 10 20 CECD Cc1ccc(C(=O)OCc2cscn2)c(O)c1O 728344154 HMXQOXPHNYHVFH-UHFFFAOYSA-N 265.290 2.220 10 20 CECD CCOC(=O)[C@@H]1CCC[C@@H]1NCc1cc(F)ccc1O 825040527 MHLXKWOWLXGBFU-OLZOCXBDSA-N 281.327 2.353 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)Cc1cnnn1CC 838786442 JUPGTNOKXRRWLY-UHFFFAOYSA-N 287.411 2.386 10 20 CECD CC(C)[C@H](NC(=O)c1cc(O)cs1)[C@H](CO)C(C)C 834044667 NMWCPMQOUIHDIF-YPMHNXCESA-N 285.409 2.473 10 20 CECD COC1([C@H](C)NCc2ccc(N(C)C)cc2)CCOCC1 834496764 PPRRXPQQICUDEU-AWEZNQCLSA-N 292.423 2.426 10 20 CECD COc1ccc(O)c(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1 846112850 TVPNERYWZNWJQG-GHMZBOCLSA-N 255.264 2.098 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCNCC2)cc1F 841058588 TYVVRHWYNYRDSA-ZDUSSCGKSA-N 265.376 2.123 10 20 CECD C[C@@H]1C[C@@H](C)[C@H](C(=O)NCc2cc(Cl)ccc2O)O1 846477615 UEJXLJUCVDBFNE-JRKPZEMJSA-N 283.755 2.475 10 20 CECD Cc1cc(N(C)C)ccc1CNCCC1(O)CCC1 840942918 AIXIAKORSDATBX-UHFFFAOYSA-N 262.397 2.456 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NCC1CCOCC1 844936029 HQRHZBZFMHWPJP-UHFFFAOYSA-N 298.770 2.271 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1cc(Cl)cc(F)c1O 843064780 GZTTUWDWKMVXJD-DTORHVGOSA-N 272.751 2.367 10 20 CECD CCOc1ccc(CN[C@@H]2CCCC[C@H]2CN)c(O)c1 841028717 CPBBMTKNDOJMBH-SWLSCSKDSA-N 278.396 2.398 10 20 CECD COc1ccc(N(C)CCN(C)c2nc(C)ns2)cc1 845673534 RLYKLDVCZONCRG-UHFFFAOYSA-N 292.408 2.428 10 20 CECD C[C@@H](N[C@@H]1CCCN(C)C1=O)c1cc(Cl)ccc1O 756638366 OSSZWAZKOSYZCJ-BXKDBHETSA-N 282.771 2.317 10 20 CECD CCC(=O)N1CC[C@H](NCc2ccc3c(c2)CCCO3)C1 921848435 MLZUPUQYMYRVFJ-HNNXBMFYSA-N 288.391 2.112 10 20 CECD C[C@H](C[C@@H]1CCC(=O)N1)NCCCSc1nccs1 925104277 WZPYHGMSTNYDIE-MNOVXSKESA-N 299.465 2.272 10 20 CECD C[C@@H](N[C@H]1C[C@H](O)C1)c1cc2c(cc1O)CCCC2 850578082 GMBYVQRSUZESHF-LERXQTSPSA-N 261.365 2.445 10 20 CECD CC[C@@H](CO)NCc1cc(Cl)cc(C(C)=O)c1O 931769435 YVCBLKWETHXBSH-NSHDSACASA-N 271.744 2.109 10 20 CECD COC[C@H](CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21)OC 757638535 QMVUTPGSBFJIOW-JBLDHEPKSA-N 283.343 2.331 10 20 CECD COC/C=C/C(=O)NCc1c(O)ccc2c1CCCC2 866770817 GDKZSERVJVJYIS-QPJJXVBHSA-N 275.348 2.090 10 20 CECD Fc1cc(CN2C[C@H]3C[C@H]3C2)ccc1N1CCOCC1 862442187 YQHANTXNWFSECW-OKILXGFUSA-N 276.355 2.114 10 20 CECD O=C(NCc1ccccc1O)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@H]12 769087058 OVMDTDOLDMVLSC-NUZBWSBOSA-N 272.348 2.236 10 20 CECD OCC[C@H](NCc1cc(Cl)ccc1O)C1CCOCC1 763468364 XOWBVQAJBZEVSE-AWEZNQCLSA-N 299.798 2.313 10 20 CECD CCCCO[C@@H](C)C(=O)N(C)c1ccc(N)cc1 877078521 SHUUEHGSIVFHLR-NSHDSACASA-N 250.342 2.437 10 20 CECD COc1ccc(N2CCN(CCCF)CC2)c(OC)c1 879461901 ISNBFAGSSFIOSO-UHFFFAOYSA-N 282.359 2.185 10 20 CECD OCC1CCN(Cc2cc(Cl)cc(F)c2O)CC1 775648515 VWRBCTNRCPWUNO-UHFFFAOYSA-N 273.735 2.389 10 20 CECD C[C@H](N[C@@H]1CCN(C2CC2)C1=O)c1ccc(N(C)C)cc1 1116673899 QICMWGHIJBCKBL-BLLLJJGKSA-N 287.407 2.167 10 20 CECD C[C@@H]1C[C@H](O)CN(Cc2ccc(N3CCCC3)cc2)C1 1117947939 FYKISEAAKJSURW-PBHICJAKSA-N 274.408 2.490 10 20 CECD Cc1ccc2c(c1)CCN2C(=O)/C=C/c1cnn(C)c1 773380819 ZNARQFJEKVDUNC-GQCTYLIASA-N 267.332 2.331 10 20 CECD Cc1ccc(O)c(CN[C@H](CC(C)C)C(=O)O)c1 71408582 HXZKFWQPEXDOKC-GFCCVEGCSA-N 251.326 2.290 10 20 CECD C[C@H](Nc1nccn2cnnc12)c1ccc(N(C)C)cc1 772295571 HPCJHJFKUYGLNO-NSHDSACASA-N 282.351 2.363 10 20 CECD C[C@H](NC(=O)c1csnn1)c1ccc(N(C)C)cc1 773006746 FQRSJZSRASQGFQ-VIFPVBQESA-N 276.365 2.095 10 20 CECD C[C@H](N[C@@H](C)c1c(O)cccc1F)C(=O)NC(C)(C)C 886516538 MSYSIUAMONUZNN-UWVGGRQHSA-N 282.359 2.485 10 20 CECD Cc1nc(CNC(=O)Cc2ccc(N)cc2)sc1C 82698997 OWHAPKNFSWJJKX-UHFFFAOYSA-N 275.377 2.201 10 20 CECD CCC[C@@]1(C)C(=O)NCCN1Cc1cc(F)cc(F)c1O 894533416 IRJZCZLUFKMJEH-HNNXBMFYSA-N 298.333 2.161 10 20 CECD O=C1CCCN1[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 792186047 NTZVHJVEOOOOSR-ZDUSSCGKSA-N 294.782 2.242 10 20 CECD Oc1cc(Br)ccc1CN1C[C@H]2COC[C@H]2C1 718153160 IYACLMNMMLCOJK-PHIMTYICSA-N 298.180 2.233 10 20 CECD COc1cccc(COC(=O)c2cccc(O)c2O)c1 776282292 QITUDIAUWRMHKF-UHFFFAOYSA-N 274.272 2.463 10 20 CECD C[C@H](O)C[C@@H](C)NCc1cc(F)c(N(C)C)cc1F 1335157292 SMWMQCYANCOOCJ-ZJUUUORDSA-N 272.339 2.280 10 20 CECD CN1CCCc2cc(CNc3ccc(C(=O)O)nn3)ccc21 1606230254 ZIYSFZNXTOOXHI-UHFFFAOYSA-N 298.346 2.169 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](C(=O)O)[C@@H]2C)c1 1600163310 HUKKWRJOKGEVBL-AAEUAGOBSA-N 263.337 2.304 10 20 CECD Cc1cccc(CN[C@H](C(=O)O)c2cccc(O)c2)c1O 1610522088 QEHNWVNQEXSAPK-AWEZNQCLSA-N 287.315 2.322 10 20 CECD CCc1cccc(CN(C2CC2)[C@@H](C)C(=O)O)c1O 1573960701 MPJKWLNPKHBGCF-JTQLQIEISA-N 263.337 2.392 10 20 CECD C[C@@H](NCc1cccnc1O)c1cc(C(=O)O)ccc1O 1593305431 ZNIGWRAWLXOYKU-SECBINFHSA-N 288.303 2.042 10 20 CECD CCCCOC(=O)CSc1ncc(C(=O)O)s1 1595764641 VLPILJVZJIOSGZ-UHFFFAOYSA-N 275.351 2.277 10 20 CECD CCN(C)c1ccc(CN[C@]2(C(=O)O)C[C@@H](F)C2)c(C)c1 1776856484 UXSYTVSEOIRYNH-SAZUREKKSA-N 294.370 2.496 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC1CCNCC1 169102905 GXVGEFRCMRRNBH-UHFFFAOYSA-N 289.423 2.067 10 20 CECD Cc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1F 159122911 LUDHBOMGNJBDAX-UHFFFAOYSA-N 275.279 2.475 10 20 CECD Oc1ccccc1CNCCCOC[C@@H]1CCCO1 20146614 CASDELMNIAESFV-AWEZNQCLSA-N 265.353 2.068 10 20 CECD COC(=O)[C@@H](CC(C)C)NCc1cccc(OC)c1O 36980935 YIVNAWLTWXWHPQ-GFCCVEGCSA-N 281.352 2.078 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)[C@H](C)C(=O)O 707940618 KYEGLZVFGXINNU-LLVKDONJSA-N 250.342 2.048 10 20 CECD COc1ccc(CN[C@@H]2COC(C)(C)C2)c(O)c1 396522309 GVWBFRUSSPVGPK-NSHDSACASA-N 251.326 2.058 10 20 CECD Cc1cc(NC(=O)CCN(C)Cc2ccccc2O)no1 171925738 ATZPOUNJVICOBO-UHFFFAOYSA-N 289.335 2.149 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2c2cccnc2)c1 114543338 DEJZUELIHTTWLY-LSDHHAIUSA-N 298.342 2.216 10 20 CECD C[C@@H](NCC1(N(C)C)CCOCC1)c1ccccc1O 183512755 NBGJSVQJRRBPCL-CYBMUJFWSA-N 278.396 2.154 10 20 CECD CCCNC(=O)CN(C)c1ccc(OC)c(Cl)c1 121902584 VWJJQYZQXHTIOG-UHFFFAOYSA-N 270.760 2.311 10 20 CECD OC[C@@H]1CCC[C@@H]1NCc1c(O)cccc1Cl 230679913 KLLZHXXNHODBJO-CABZTGNLSA-N 255.745 2.296 10 20 CECD CCC(=O)N1CCCN(Cc2c(O)cccc2Cl)CC1 124299480 YTJJHXQQPGMAFE-UHFFFAOYSA-N 296.798 2.490 10 20 CECD CC(C)NC1CCN(Cc2cc(F)ccc2O)CC1 180030018 DLHZNJTVGBGCSK-UHFFFAOYSA-N 266.360 2.494 10 20 CECD CN(C)CC[C@@H](NC(=O)c1cccc(O)c1O)C(C)(C)C 185673182 VLOFCFYXPPMZNM-CYBMUJFWSA-N 294.395 2.194 10 20 CECD CCOC[C@@H](O)CN(C)c1ccc(OC(C)C)cc1 191591222 MPWZWFSMZPIUBZ-AWEZNQCLSA-N 267.369 2.307 10 20 CECD COc1ccc(N(C)CC[C@@H]2CCOC2=O)c(OC)c1 132062211 GDEAYXVVDTYICJ-LLVKDONJSA-N 279.336 2.093 10 20 CECD CNCC(=O)NCc1ccc(N(C)C2CCCCC2)cc1 237244798 LWICWUCFWSNDSS-UHFFFAOYSA-N 289.423 2.291 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)CC1(N(C)C)CCC1 97934142 BXTKULRQHKHMTM-UHFFFAOYSA-N 292.379 2.037 10 20 CECD CC(C)(F)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 271086064 UHBLYDLZRCWYKT-UHFFFAOYSA-N 298.333 2.027 10 20 CECD COC[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H](C)O1 275876572 ATGVBTCDJBRBAD-WDEREUQCSA-N 285.771 2.281 10 20 CECD CO[C@H](C)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273598069 RCWQRPOJENPYDL-NXEZZACHSA-N 268.313 2.376 10 20 CECD CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@@H](C)[S@@]1=O 289953788 YSRZXTRWTPDJKC-TVZGQMOCSA-N 281.421 2.432 10 20 CECD O=C(/C=C/c1ccc2c(c1)OCO2)NCc1ccccc1O 388332608 DWIIOQGMUDXELV-SOFGYWHQSA-N 297.310 2.451 10 20 CECD CCCCOCCOC(=O)/C=C/c1ccc(O)c(O)c1 805507943 CHJFKVLFSMJKCB-FNORWQNLSA-N 280.320 2.471 10 20 CECD CCN1C[C@H](N[C@@H]2C[C@H](C)c3c(C)ccc(O)c32)CC1=O 391498815 IEKORWIUEKREMU-YNEHKIRRSA-N 288.391 2.459 10 20 CECD CCC(=O)[C@H](C)Sc1ncc(C(=O)OC)s1 295151010 FGJFQFIFWPROTL-LURJTMIESA-N 259.352 2.389 10 20 CECD CC(C)ONC(=O)NCc1ccc(N(C)C)c(F)c1 297353186 UUIRUCWWFBVZJI-UHFFFAOYSA-N 269.320 2.031 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@H]1CCCN1C 817417950 WZUWEPSQNOBDDJ-CQSZACIVSA-N 279.403 2.418 10 20 CECD CCOc1ccc(CNCC(O)(CC)CC)c(O)c1 725850336 ZKLZKAQQXGRKFO-UHFFFAOYSA-N 267.369 2.432 10 20 CECD O=C1O[C@H]2C[C@H]1N(Cc1ccc3ccccc3c1O)C2 824630039 IKEONGZGZWQVFR-GXTWGEPZSA-N 269.300 2.045 10 20 CECD CCOc1cccc(CN(CC(F)F)C[C@@H](C)O)c1O 825098156 BLFGQVRHAHWIMM-SNVBAGLBSA-N 289.322 2.239 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCc3c[nH]nc3C1)CC2 834620983 ZTXMVVSAOPZDTH-CHWSQXEVSA-N 269.348 2.250 10 20 CECD COc1cc2c(c(OC)c1)N(Cc1ccnn1C)CCC2 839656748 RXBAYPXBZZGCDU-UHFFFAOYSA-N 287.363 2.390 10 20 CECD COc1ccc(CN[C@@H]2C[C@@H]3CCCCN3C2=O)cc1C 835072275 DZEUVLCEQDWVMP-LSDHHAIUSA-N 288.391 2.247 10 20 CECD Cc1ccc([C@H](C)NC[C@@]2(C)CCC(=O)N2)c(O)c1 834910397 WTMYTROICJGWRQ-XHDPSFHLSA-N 262.353 2.020 10 20 CECD Nc1ccc(Cc2noc(CC[C@@H]3CCCO3)n2)cc1 843159530 SCHVSLCFBANCBX-ZDUSSCGKSA-N 273.336 2.354 10 20 CECD C[C@@H](N)[C@H]1CCCCN1Cc1cccc(F)c1O 843045893 LMRPJZBWUYTYPX-ZWNOBZJWSA-N 252.333 2.233 10 20 CECD CCNCCNCc1ccc(N(C)C)cc1C(F)(F)F 841035784 LXHZVVQGPGBXOY-UHFFFAOYSA-N 289.345 2.471 10 20 CECD CCc1cccc(CN[C@H]2CCN(C(C)(C)C)C2=O)c1O 848919825 SYNYRZPPOVPURU-AWEZNQCLSA-N 290.407 2.444 10 20 CECD COC(=O)C1(CNC(=O)Nc2ccc(N)cc2)CCCC1 841299825 KMJDQJDUZDQGDL-UHFFFAOYSA-N 291.351 2.124 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1ccc(N(C)C)cc1C 840837686 KSTYLHBRJMWTJD-AWEZNQCLSA-N 275.396 2.290 10 20 CECD CCC(CC)(CN)C(=O)N[C@H](C)c1cc(OC)ccc1O 843489275 LWAVBYHJUWWTMO-LLVKDONJSA-N 294.395 2.343 10 20 CECD CN(C)c1ccc(CN2CCC(CCN)CC2)cc1F 844911852 PQSYRDKFXKDWCT-UHFFFAOYSA-N 279.403 2.453 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1ccc2c(c1)CCCO2 921996793 IHAUCGGDDIVJBJ-DOTOQJQBSA-N 291.391 2.295 10 20 CECD C[C@H](NCC1(N)CCCC1)c1cc([N+](=O)[O-])ccc1O 854224368 VPIDQDNULMDGDG-JTQLQIEISA-N 279.340 2.223 10 20 CECD C[C@H](CO)[C@H]1CCCCN1C(=O)c1cc(O)cs1 855468111 ZFNBMVVCEZKIRI-MWLCHTKSSA-N 269.366 2.077 10 20 CECD COc1ccc(N(C)Cc2nncs2)cc1F 929827411 RQLOBSDWQBKMCT-UHFFFAOYSA-N 253.302 2.322 10 20 CECD O=C(NC[C@H]1CCCN(CC2CC2)C1)c1cc(O)cs1 856480769 XMCJWJLHISZTII-GFCCVEGCSA-N 294.420 2.306 10 20 CECD Cc1ccc([C@@H](C)NCCNc2cnccn2)c(O)c1 756647959 XPNKGKSHYSFMFY-GFCCVEGCSA-N 272.352 2.253 10 20 CECD CCSCCOC(=O)/C=C/c1ccc(O)c(O)c1 759587757 DZWMMESQTONVFT-GQCTYLIASA-N 268.334 2.407 10 20 CECD COc1ccc(N2CC[C@H](CN[C@H]3COC[C@H]3C)C2)cc1 926610776 FULUCYWROOQLSN-CPUCHLNUSA-N 290.407 2.146 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(N)CCCC2)c1 854222656 JLPAVCHXYNWXOH-NSHDSACASA-N 264.369 2.323 10 20 CECD COc1cc(CN2CC[C@H](N3CC=CC3)C2)c(O)cc1C 768465789 LHVJNGUBGBMEJG-HNNXBMFYSA-N 288.391 2.155 10 20 CECD O=C(O)[C@H]1C[C@H](NCc2ccc(N3CCCC3)cc2)C1 1119038589 JNJBMWQJZCWORN-HDJSIYSDSA-N 274.364 2.240 10 20 CECD COc1ccc(CNC2CSC2)cc1Cn1cccn1 877633592 CPMDXXHKWXQABG-UHFFFAOYSA-N 289.404 2.145 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c(O)c1 877487039 UBSHXDBPRRLSAR-VBQJREDUSA-N 291.391 2.469 10 20 CECD CN1CCN(c2ccc(CN3CCC(F)(F)C3)cc2)CC1 776694997 SUGWYNFQMNEXRC-UHFFFAOYSA-N 295.377 2.279 10 20 CECD CC(C)[C@](C)(O)C(=O)NCc1ccc(N2CCCC2)cc1 771167106 CKKFCYBCXXBDLM-KRWDZBQOSA-N 290.407 2.310 10 20 CECD C[C@H](N[C@H]1CCn2ccnc2C1)c1c(O)cccc1F 886594724 SLCAIABDIFLJAZ-QWRGUYRKSA-N 275.327 2.393 10 20 CECD COc1cc(C)cc(CNCC(C)(C)N(C)C)c1O 894146219 QARCUWHPTBEPHP-UHFFFAOYSA-N 266.385 2.139 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2c(C)cccc2O)C1 896958671 MEAAEKKJHFDMET-GFCCVEGCSA-N 263.337 2.086 10 20 CECD O=C(COc1ccc(F)cc1)NCc1ccccc1O 701141726 JAZPWFMIDMMSPV-UHFFFAOYSA-N 275.279 2.227 10 20 CECD CN(CCc1cnccn1)Cc1ccc(N(C)C)cc1 272723222 FTFBLGXXIBUWGL-UHFFFAOYSA-N 270.380 2.217 10 20 CECD OCC[C@H](Cc1ccccc1)NCc1ccccc1O 799349819 KQJUARRLTXLCAC-MRXNPFEDSA-N 271.360 2.476 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@H]3CCC[C@H]32)c(O)c1 794378484 VZCTZJGURBJDRO-IMRBUKKESA-N 261.321 2.063 10 20 CECD COc1ccc(CNC(=O)c2cnn(C(C)C)c2)c(O)c1 794380755 BIYXRSXBULDESX-UHFFFAOYSA-N 289.335 2.108 10 20 CECD CC(=O)c1cc(F)cc(CN(C[C@@H](C)O)C2CC2)c1O 692184349 XFDWJZAVWILSHK-SECBINFHSA-N 281.327 2.079 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)C1CCS(=O)(=O)CC1 877755430 AXYFYPUTRJKCJI-NWDGAFQWSA-N 297.420 2.256 10 20 CECD CCCc1n[nH]cc1C(=O)NCc1cccc(OC)c1O 1320391452 WTKYIXZHWFUSEG-UHFFFAOYSA-N 289.335 2.006 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1ccc(N)cc1 1334774068 DJWZLLVLIJDGGC-LLVKDONJSA-N 250.342 2.042 10 20 CECD CC[C@@H](CCNCc1cc(F)cc(F)c1O)C(=O)O 1339239209 ALRBGJBLIOSJLO-QMMMGPOBSA-N 273.279 2.261 10 20 CECD CCn1c(-c2sccc2O)nnc1N1CCSCC1 1342571709 ZXBDODSRQPCNCZ-UHFFFAOYSA-N 296.421 2.285 10 20 CECD CSCCCN[C@@H](C)c1cc(C(=O)O)ccc1O 1607397920 AZQBBEZGONYFGS-VIFPVBQESA-N 269.366 2.494 10 20 CECD Cc1cc(CN(C)C(C)(C)C(=O)O)ccc1N(C)C 1600189440 YNJZWHURQVCXFE-UHFFFAOYSA-N 264.369 2.356 10 20 CECD C[C@H]1CCC[C@@]1(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776636391 LNRQZWGRQVDBNC-XPTSAGLGSA-N 294.307 2.033 10 20 CECD CCCN1CC[C@H](N[C@@H]2CCc3cccc(O)c32)C1 389205087 ATUONIACFVAWCX-UONOGXRCSA-N 260.381 2.453 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)[C@@H]1C[C@H]1C(=O)O 1593293710 XHNBQBOTQMZDBA-BKDNQFJXSA-N 269.728 2.244 10 20 CECD Cc1ccc([C@@H](C)NCC(C)(C)N2CCOCC2)c(O)c1 20120755 FKYJOJANCMMKQG-CQSZACIVSA-N 292.423 2.462 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)C(F)(F)F 174512291 ISFXUPCWAZHSAY-UHFFFAOYSA-N 273.254 2.450 10 20 CECD COCC(C)(C)NC(=O)NCc1ccc(N(C)C)cc1C 121632450 HDXKKUPAUKCGJJ-UHFFFAOYSA-N 293.411 2.285 10 20 CECD O=C(CC[C@H]1CCCCO1)NCCc1ccc(O)c(O)c1 122884625 AWKAIOYYJKRPDW-CYBMUJFWSA-N 293.363 2.106 10 20 CECD COc1ccc(O)c(CNC[C@]2(O)CCc3ccccc32)c1 182653494 QRLHYZKVTOCBBL-GOSISDBHSA-N 299.370 2.324 10 20 CECD CC(C)COC(=O)[C@H](C)NCc1cc(F)ccc1O 187904579 BOQUKUFAPRIBQL-JTQLQIEISA-N 269.316 2.209 10 20 CECD C[C@H](NCC1(C)OCCO1)c1ccc(F)c(F)c1O 187813382 VCQYJYAMSXUKQT-QMMMGPOBSA-N 273.279 2.084 10 20 CECD CCOc1cccc(CN2CCN(CC3CC3)CC2)c1O 130658261 FSJUXQWSKMMWKO-UHFFFAOYSA-N 290.407 2.319 10 20 CECD COCCN(CCOC)Cc1cc(Cl)ccc1O 133409491 YVQURMUHLLVQKB-UHFFFAOYSA-N 273.760 2.140 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(C)(C)N 40925575 IYYUWLWLMZELSZ-UHFFFAOYSA-N 289.423 2.373 10 20 CECD CCOc1cccc(CN2CC[C@H](OC)C2)c1O 233821221 TXXZQSYKVSYCQG-LBPRGKRZSA-N 251.326 2.012 10 20 CECD Cc1ccc(C(=O)N[C@H]2C[C@H](C)O[C@H](C)C2)c(O)c1O 248420405 WUJPMZBNQUZJHP-JGPRNRPPSA-N 279.336 2.092 10 20 CECD NC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1Cc1cccc(Cl)c1O 368974799 PEHTXSIPDAVFJP-NDMJEZRESA-N 294.782 2.131 10 20 CECD CC(=O)c1cc(F)cc(CN(C)c2ccn(C)n2)c1O 274841411 MGZPTMXSZAYKSO-UHFFFAOYSA-N 277.299 2.104 10 20 CECD Cc1ccc(C(=O)Nc2ccn(C(C)C)n2)c(O)c1O 281765206 KNRUFBPSFPZIFC-UHFFFAOYSA-N 275.308 2.436 10 20 CECD COCC1(CN[C@H](C)c2ccccc2O)CCOCC1 293865627 YAHDDDKGEARCGU-CYBMUJFWSA-N 279.380 2.486 10 20 CECD Nc1ccc(CNC(=O)C[C@H]2CSCCS2)cc1 297208923 NFAACPOEUCTGSI-LBPRGKRZSA-N 282.434 2.124 10 20 CECD O=C(/C=C\c1cccnc1)N1C[C@H](CO)Cc2ccccc21 816785831 VECYIYYIGMQNAE-ZPIQOJFGSA-N 294.354 2.293 10 20 CECD COc1ccc2ccc(O)c(CN(C)[C@@H](C)C(=O)O)c2c1 818614322 IXGROGQEEYGNQZ-JTQLQIEISA-N 289.331 2.459 10 20 CECD CC(C)(O)[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 832453564 MIMKSSNYDNRTSD-SECBINFHSA-N 269.366 2.077 10 20 CECD CCCN(C)C[C@@H]1CCN(C(=O)c2cc(O)cs2)C1 743783014 MNAZSJLNSICIKC-NSHDSACASA-N 282.409 2.258 10 20 CECD O=C(c1cc(O)cs1)N1CCC(c2cn[nH]c2)CC1 743460350 VKDOKSFTDXCBMQ-UHFFFAOYSA-N 277.349 2.197 10 20 CECD CC[C@@]1(C(=O)N[C@@H](C)c2cc(OC)ccc2O)CCCN1 843489467 PIRCSKKSPKCJJO-ZBEGNZNMSA-N 292.379 2.110 10 20 CECD CCc1cccc(CN(C)C[C@H](C)C(=O)OC)c1O 848882618 VXCIVVAAJQKTTM-NSHDSACASA-N 265.353 2.196 10 20 CECD COCC1(CNCc2cccc(Cl)c2O)CCNCC1 841067507 BEIMULVSAKZRSU-UHFFFAOYSA-N 298.814 2.151 10 20 CECD CC[C@@](C)(CC(=O)OC)NCc1ccc2c(c1)CCO2 748243359 YWFJYMCOLDVKTF-INIZCTEOSA-N 277.364 2.443 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@H](C)CC(=O)O)c1 911343661 SBXLFZGMFOFKRI-UWVGGRQHSA-N 295.335 2.079 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](CN2CCCC2)C1 743490409 UUYWZWPDACFNGE-LLVKDONJSA-N 280.393 2.012 10 20 CECD COc1cccc(CN[C@H]2CCCC[C@H]2CN)c1O 841030120 KJXIMGXNJCDEJD-AAEUAGOBSA-N 264.369 2.008 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC[C@@H](CN)C1 841083275 AKSYMQHCLAWDBS-HIFRSBDPSA-N 261.413 2.278 10 20 CECD O=C(OCC[C@@H]1CCCC1=O)c1cc(O)cs1 748187687 FJSXWWNZSZEQQH-QMMMGPOBSA-N 254.307 2.370 10 20 CECD N[C@H]1Cc2ccccc2N(Cc2cc(F)ccc2O)C1 841106260 IOLZOBBUBDLOCF-AWEZNQCLSA-N 272.323 2.421 10 20 CECD COc1ccc(N(C)CCN(C)c2cnccn2)cc1 845666056 AVZSKAQXKJZCQS-UHFFFAOYSA-N 272.352 2.058 10 20 CECD Cc1ccc([C@@H](C)NCc2nnnn2C2CC2)c(O)c1C 756731963 KASXRIVFRXNJTM-LLVKDONJSA-N 287.367 2.181 10 20 CECD CNC[C@H](C)N[C@@H](C)c1ccc(Br)cc1O 854232170 NVBVIRLDNDTUBK-IUCAKERBSA-N 287.201 2.413 10 20 CECD COCCCCCOC(=O)/C=C/c1ccc(O)c(O)c1 759598877 ZJJBZITWYBEPGG-SOFGYWHQSA-N 280.320 2.471 10 20 CECD COc1ccsc1/C=C1/SC(=S)NC1=O 764415050 ZBGCDSYHLUEGQN-QPJJXVBHSA-N 257.361 2.246 10 20 CECD Cc1nccc(NC(=O)NCc2ccc(N(C)C)cc2)n1 763268942 ZZXRLTVCWATVPU-UHFFFAOYSA-N 285.351 2.173 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CC23CCC3)c1 875290127 RKDHXRQTOQWYJY-ZDUSSCGKSA-N 276.336 2.143 10 20 CECD Cc1cc(CN2CCc3ncncc3C2)ccc1N(C)C 880600272 ZELGFGDQSBUVTD-UHFFFAOYSA-N 282.391 2.409 10 20 CECD Cn1c(-c2ccccc2)cnc1SCC[N+](=O)[O-] 899866877 NYVQSWXVHRSNEO-UHFFFAOYSA-N 263.322 2.456 10 20 CECD C[C@H](N[C@@H](C)c1cc(F)cc(F)c1O)c1ncn(C)n1 783300787 XNMXFZGGWDMTSG-YUMQZZPRSA-N 282.294 2.211 10 20 CECD C[C@@H](NC1CCN(C)CC1)c1cc(F)ccc1O 94617082 AQLHZAYEIVNBNK-SNVBAGLBSA-N 252.333 2.276 10 20 CECD COc1cc(C)cc(CNCCCCN(C)C)c1O 894208151 DOVVMMUVIGVJQL-UHFFFAOYSA-N 266.385 2.141 10 20 CECD CN(C)c1ccc(CNc2ncnc(N)c2Cl)cc1 302036872 FVMHREKQJKNYOQ-UHFFFAOYSA-N 277.759 2.390 10 20 CECD CCOc1cccc(CNCCC(C)(C)O)c1O 274722751 FIKRSYJINVUSIH-UHFFFAOYSA-N 253.342 2.042 10 20 CECD CCOC(CCNCc1cc(OC)ccc1O)OCC 276174494 JTPZQHZDCVJCOI-UHFFFAOYSA-N 283.368 2.280 10 20 CECD CCCN(Cc1ccccc1O)[C@H]1CCCN(C)C1=O 778945453 GRQKXUHBFMUNQQ-AWEZNQCLSA-N 276.380 2.225 10 20 CECD COCc1nocc1C(=O)N[C@H](C)c1ccccc1O 1330897230 ULPVSIFBMGFGFU-SECBINFHSA-N 276.292 2.018 10 20 CECD CC[C@@H](C)C[C@@H](N)C(=O)N[C@H](C)c1ccccc1O 1341541039 MNWIWLFCWVVVHB-NQBHXWOUSA-N 264.369 2.333 10 20 CECD CO[C@@H]1CCC[C@H]1C(=O)NCc1cc(C)ccc1O 1347202439 HKVHXMBFVZSEGW-TZMCWYRMSA-N 263.337 2.132 10 20 CECD COC(=O)N(C)CCNCc1ccc(N2CCCC2)cc1 1350143549 OSBOMHQEKPPEOZ-UHFFFAOYSA-N 291.395 2.075 10 20 CECD C[C@H](NC1CC(C)(C)C1)c1cccc(-c2nn[nH]n2)c1O 1603649351 COVOZFGYJVNKRW-VIFPVBQESA-N 287.367 2.412 10 20 CECD COc1cccc(CN2CCC[C@](C)(OC)C2)c1O 230300019 WTJLJSYQTNFWQI-HNNXBMFYSA-N 265.353 2.402 10 20 CECD CCCc1nc(CSc2ncc(C(=O)O)s2)no1 1596100428 OVQFCOZUGUMBPS-UHFFFAOYSA-N 285.350 2.469 10 20 CECD CNC(=O)C1CCN(Cc2cccc(Cl)c2O)CC1 124523467 ADWYDQJZIGLTGO-UHFFFAOYSA-N 282.771 2.004 10 20 CECD CC(C)C[C@@H](C(=O)O)N(C)Cc1ccccc1O 863526038 JMWZSGGTDIHCTL-LBPRGKRZSA-N 251.326 2.323 10 20 CECD COc1ccc(O)c([C@H](C)NCc2ccc(O)nc2)c1 392684107 NJOPKNZZHKXBQF-JTQLQIEISA-N 274.320 2.352 10 20 CECD COc1ccc(CNCc2ncc(Cl)n2C)c(O)c1 393319295 DPBRGUWJJXURGM-UHFFFAOYSA-N 281.743 2.078 10 20 CECD C[C@H](C(=O)O)N(Cc1ccc(Cl)cc1O)C1CC1 1588596184 CUPWSTKXVMNSHE-MRVPVSSYSA-N 269.728 2.483 10 20 CECD Cc1c(C(=O)N(C)Cc2ccc(N(C)C)cc2)cnn1C 28495202 PNDFZCGIPSTINF-UHFFFAOYSA-N 286.379 2.067 10 20 CECD Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)n(C)n1 174510787 FVRFABIPVUTRHC-UHFFFAOYSA-N 299.374 2.243 10 20 CECD Cc1ccc(C(=O)NC[C@@]2(C)CCCC[C@H]2O)c(O)c1O 179535790 XAMGGNAJOYEBEW-MLGOLLRUSA-N 293.363 2.077 10 20 CECD Cc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1 182542294 KQURVVPRUSCBHF-UHFFFAOYSA-N 257.289 2.336 10 20 CECD CSC[C@H](CCO)N[C@@H](C)c1cc(F)ccc1O 185530979 KVNLZPVSELAXLC-ONGXEEELSA-N 273.373 2.296 10 20 CECD Cc1ccc(CNC(=O)c2cccc(O)c2O)s1 126372448 QKISTCLPAQPHHW-UHFFFAOYSA-N 263.318 2.398 10 20 CECD CCOc1cc(NCc2cccc(OC)c2O)ncn1 123567190 WYUCONINCPUGJU-UHFFFAOYSA-N 275.308 2.202 10 20 CECD Oc1cc2c(cc1CNCCOCC1CCCC1)OCO2 313256547 YTKYVQRICPRFFE-UHFFFAOYSA-N 293.363 2.417 10 20 CECD C[C@@H](CNCc1cccc(Br)c1O)N(C)C 42412574 SHFJPBAUINXIAC-VIFPVBQESA-N 287.201 2.194 10 20 CECD C[C@H]1CC(=O)CC[C@H]1C(=O)N(C)Cc1ccccc1O 136462871 XFGHHJWPYGOXGT-SMDDNHRTSA-N 275.348 2.356 10 20 CECD CC(C)(C)[C@@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CCO1 279833101 NLPJMUYKDWDPCR-GWCFXTLKSA-N 293.363 2.421 10 20 CECD CN(C)c1ccc(CN2CCC(C)(CO)CC2)cc1F 273919097 ZHFWPJNKABHGCD-UHFFFAOYSA-N 280.387 2.486 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1cc[nH]n1 807838232 LNXPWBLUDYQAJO-UHFFFAOYSA-N 286.118 2.352 10 20 CECD CCOC(=O)c1cccc(SCC(=O)C(C)=O)c1 808036540 NQPCZXUHOILPOW-UHFFFAOYSA-N 266.318 2.114 10 20 CECD COc1ccc(C)cc1CC(=O)NCCc1ccc(N)cc1 818544805 OTOYJJGNBKXLDY-UHFFFAOYSA-N 298.386 2.487 10 20 CECD Cc1ncc([N+](=O)[O-])n1Cc1ccc(N(C)C)cc1 814744318 IGLHXMLIZNSYPQ-UHFFFAOYSA-N 260.297 2.214 10 20 CECD O=C(O)[C@H](C(=O)NCc1c(O)cccc1F)C1CCCC1 902854264 ZYVFTQGPZORKAZ-ZDUSSCGKSA-N 295.310 2.039 10 20 CECD CC[C@@H](C(=O)Nc1ccc(N)cc1)N1CCO[C@H](CC)C1 911660660 MODSIXCEWUJTQW-CABCVRRESA-N 291.395 2.097 10 20 CECD C[C@@](O)(C(=O)NCc1cc(Cl)ccc1O)C1CCC1 846477654 URSCNYGVMSQFHH-AWEZNQCLSA-N 283.755 2.213 10 20 CECD COC1([C@@H](C)NC(=O)/C=C\c2ccc(O)c(O)c2)CCC1 840530633 AIIOOVOZWQMKOA-JPVGGKMYSA-N 291.347 2.185 10 20 CECD COc1cccc([C@H](C)NCC[C@@H](C)CCO)c1O 846169658 JLHFLOGIMWUNEF-NEPJUHHUSA-N 267.369 2.460 10 20 CECD COc1cccc([C@H](C)NCCC(C)(C)O)c1O 846162219 CBLVULGHJFWIFB-JTQLQIEISA-N 253.342 2.212 10 20 CECD C[C@@H]1CCCc2ncc(C(=O)NCc3ccc(N)cc3)n21 846297538 HSVHKZOFDTUYEG-LLVKDONJSA-N 284.363 2.293 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H](N)C(C)C 841944432 HVODKUGHKXQFCS-CQSZACIVSA-N 293.411 2.297 10 20 CECD OC[C@@H](CCF)NCc1ccc(N2CCCCC2)cc1 846095586 BKWVXEQUJOXZSX-OAHLLOKOSA-N 280.387 2.487 10 20 CECD COC1CCN(CCN[C@H](C)c2cc(F)ccc2O)CC1 756643324 UDIITTRCSNSSDV-GFCCVEGCSA-N 296.386 2.293 10 20 CECD C[C@@H]1COC[C@H]1NCc1ccc(N2CCSCC2)cc1 924709598 YNKPMBLOIQCVTI-CZUORRHYSA-N 292.448 2.364 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@]2(C)CCOC2)c1 756570922 CGPASPDWLRXGLC-BZNIZROVSA-N 293.363 2.256 10 20 CECD CN(CC1=CCSC1)C(=O)c1cc(O)cs1 856369918 RUDUDTLTKBOJIX-UHFFFAOYSA-N 255.364 2.199 10 20 CECD C[C@H](NCc1cc(F)c(N(C)C)cc1F)c1nncn1C 858125683 KNKLWJMXKAXNFS-VIFPVBQESA-N 295.337 2.010 10 20 CECD C[C@@H]1COCCN(Cc2c(O)ccc3ccncc23)C1 753988103 ZWEDAIXQWDQVFC-LBPRGKRZSA-N 272.348 2.409 10 20 CECD CCC[C@@H](O)CNCc1cc(F)c(N(C)C)cc1F 858134416 BXIVMBMHQCOJIK-LLVKDONJSA-N 272.339 2.281 10 20 CECD COC[C@@H](C)[C@@H](C)C(=O)NCc1cc(C)ccc1O 862755909 NBGZUAUKYGTAOG-VXGBXAGGSA-N 265.353 2.235 10 20 CECD CCOc1cccc(CN(CCCO)C2CC2)c1O 769403562 DMFZQEXNWRQCKW-UHFFFAOYSA-N 265.353 2.138 10 20 CECD COC(=O)CC1CC(NCc2cc(C)ccc2O)C1 862478892 VQFJRTYWXSGIFT-UHFFFAOYSA-N 263.337 2.132 10 20 CECD CCOc1ccc(CN2CCC(OC)CC2)c(O)c1 768215298 CGBLYVBWGZDSKY-UHFFFAOYSA-N 265.353 2.402 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCNCC1CC1 870888439 MLQIILWBMCSJHQ-UHFFFAOYSA-N 289.423 2.067 10 20 CECD COc1ccc(CN2CCC[C@@H](CO)CC2)c(O)c1OC 894647513 CSTRNAUUNAPQBV-GFCCVEGCSA-N 295.379 2.004 10 20 CECD Oc1cc(Br)ccc1CN[C@@H]1CCOC1 691394641 GQZDBLXLHSXYOU-SNVBAGLBSA-N 272.142 2.033 10 20 CECD C[C@H]1COCCN1Cc1ccc(Br)cc1O 691738662 WRYUIHRXQVLMMB-VIFPVBQESA-N 286.169 2.375 10 20 CECD COc1ccc(O)c(CN2CCCCC[C@H]2C(=O)O)c1 86814949 YPSFIYUUVFWTOL-ZDUSSCGKSA-N 279.336 2.230 10 20 CECD O=C(NCc1ccc(O)cc1O)c1cnc(C2CC2)s1 1339585508 RAKVQSOJZUHSHP-UHFFFAOYSA-N 290.344 2.362 10 20 CECD C[C@@H]1CCN(c2nnc(-c3sccc3O)n2C)C1 1341281647 VMFGJPDWAISJIR-MRVPVSSYSA-N 264.354 2.095 10 20 CECD O=C(O)[C@@H](NCc1ccccc1O)c1cccc(O)c1 1601676284 MSOQGSCCAXSCOL-AWEZNQCLSA-N 273.288 2.013 10 20 CECD Nc1ccc(Cc2nc(C3(C(=O)O)CC3)cs2)cc1 1608272602 JMMSKPIHBPDYAX-UHFFFAOYSA-N 274.345 2.432 10 20 CECD Cc1cc(O)c(CN2CCOC[C@@H]2CC(=O)O)cc1Cl 1600285485 CPOVPZJQCMEKNU-NSHDSACASA-N 299.754 2.030 10 20 CECD CNC(=O)[C@]1(C)CCN(Cc2cccc(Cl)c2O)C1 228098969 CMYDAXHWVPVXKV-CQSZACIVSA-N 282.771 2.004 10 20 CECD CCN(C)c1ccc(CN(CC)[C@@H]2CCNC2)cc1 1577657539 NGOXVCXGHMYBLB-MRXNPFEDSA-N 261.413 2.327 10 20 CECD Fc1cc(-c2nn[nH]n2)cnc1Sc1nccs1 1592638371 PJAHMPJVZPYZIP-UHFFFAOYSA-N 280.313 2.009 10 20 CECD C[C@@H](NC(=O)CCNC(C)(C)C)c1ccccc1O 828539465 PFCMJSHOYGYOEM-LLVKDONJSA-N 264.369 2.348 10 20 CECD COc1ccc(N(C)CCOC[C@@H]2CCCO2)cc1 844353651 UBXMNSYEZNRQGS-HNNXBMFYSA-N 265.353 2.327 10 20 CECD O=C1c2ccccc2C(=O)c2c1ccc1nccnc21 39247546 DGLSEJAACVWJNU-UHFFFAOYSA-N 260.252 2.405 10 20 CECD in-vivo Cc1ccc([C@H](C)NCCc2n[nH]c(C)n2)c(O)c1 273418516 IWXXNCWHIFOZKU-JTQLQIEISA-N 260.341 2.020 10 20 CECD CC[C@H](C)C[C@H](N)C(=O)N(C)Cc1ccccc1O 400891236 HMOGLDVWEKELDP-AAEUAGOBSA-N 264.369 2.114 10 20 CECD Cc1cnc(Sc2ncc(C(=O)O)s2)nc1 309480577 VWKMJNBYCAUFBM-UHFFFAOYSA-N 253.308 2.091 10 20 CECD CC[C@](C)(CNCc1cc(OC)ccc1O)OC 322495067 DRSLEJXUKZQBIG-CQSZACIVSA-N 253.342 2.306 10 20 CECD Nc1ccc(NC(=O)N2CC[C@H]3[C@H](C2)C3(F)F)cc1 1580447616 HZHOYHSXVQUPDY-QWRGUYRKSA-N 267.279 2.388 10 20 CECD CCOCCCC(=O)N1CCOc2cc(N(C)C)ccc21 173195856 CQHJOYBUIZNIAY-UHFFFAOYSA-N 292.379 2.295 10 20 CECD CCN(CC)c1ccc(CN(CC(N)=O)C(C)C)cc1 179660507 HVZUQVHFHOYRSX-UHFFFAOYSA-N 277.412 2.229 10 20 CECD CN(C)c1ccc(CNC(=O)C(F)(F)C(F)F)cc1 175769820 YTCSKXZHIBZMRT-UHFFFAOYSA-N 278.249 2.269 10 20 CECD COc1cccc(CNC(=O)c2cncc(C)c2)c1O 175930210 QTFPNIUJXCFJSV-UHFFFAOYSA-N 272.304 2.034 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cccnc1Cl 120178612 HJNXFDKKMCNYCB-UHFFFAOYSA-N 292.722 2.119 10 20 CECD C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)N1CCCC1 135674104 FTBZSNZBBPPLSG-KBPBESRZSA-N 289.423 2.414 10 20 CECD CN1C(=O)/C(=C/c2cccc3c2OCCO3)SC1=S 48642754 NYIWPUHMWFGJIG-YFHOEESVSA-N 293.369 2.289 10 20 CECD O=C(NCc1ccccc1O)c1cccnc1N1CCCC1 269166692 WYSPJPCCJFONCJ-UHFFFAOYSA-N 297.358 2.317 10 20 CECD CC1(C)NC(=O)N(Cc2ccc(N3CCCC3)cc2)C1=O 272315026 SFBHQEKXEUZPPM-UHFFFAOYSA-N 287.363 2.117 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCS1 274934286 OGICWSMSORNFQF-HZMBPMFUSA-N 295.404 2.431 10 20 CECD Cn1cc(CN2CCCc3n[nH]cc32)c(-c2cccnc2)n1 279698920 VOGLLJKDEMBORY-UHFFFAOYSA-N 294.362 2.158 10 20 CECD CC(C)(C)[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCO1 296256680 LRIWAMNGUSBTTB-NSHDSACASA-N 297.326 2.124 10 20 CECD Cc1nc(C(=O)NCc2ccc(N(C)C)cc2C)co1 801621342 NHRKFFFHOLUFHA-UHFFFAOYSA-N 273.336 2.287 10 20 CECD COCc1cnc(NC(=O)NCc2ccccc2O)s1 806601754 BAKAZCYYZBDHAB-UHFFFAOYSA-N 293.348 2.317 10 20 CECD COCC[C@@H](CO)N[C@@H](C)c1cc(Cl)cc(C)c1O 808717599 FVRMRDNFTKJKKK-JQWIXIFHSA-N 287.787 2.402 10 20 CECD C[C@@H](N[C@@H]1CCNC1)c1cccc(C(F)(F)F)c1O 817945275 YSIHXDKKYWHDAB-RKDXNWHRSA-N 274.286 2.424 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)C(C)(F)F 816028428 FUKFFESWRRMZJN-IUCAKERBSA-N 287.306 2.436 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)COC(C)C)c1 728981845 FZYNAXBBHUMKGA-JTQLQIEISA-N 267.325 2.003 10 20 CECD C[C@@H](NC(=O)C[C@H]1CCCOC1)c1ccccc1O 827947028 YNAAQTHMTOLBKH-VXGBXAGGSA-N 263.337 2.386 10 20 CECD Cc1cc(Br)cc(CN[C@H]2C[C@H](N)C2)c1O 906516308 CCIMVGMTPWVSQE-XYPYZODXSA-N 285.185 2.042 10 20 CECD CCOC1CN(Cc2cccc(Br)c2O)C1 839132414 PFXSLQAFMKAVOX-UHFFFAOYSA-N 286.169 2.375 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)Cc1cnn(CC)n1 838781440 JOMWXFAEKTZMEM-UHFFFAOYSA-N 287.411 2.386 10 20 CECD Oc1ccc2ccncc2c1CN1CCN(CC2CC2)CC1 917479450 IUWPHFSMLXQXET-UHFFFAOYSA-N 297.402 2.468 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@H]1C(=O)O 833629707 LOOUTVMDJPUMCX-GMSGAONNSA-N 287.718 2.337 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)CCCC3)C[C@H]1C(=O)O 833630864 XUKSYJQVBSRZHI-IAQYHMDHSA-N 289.375 2.424 10 20 CECD O=C(OCc1ccoc1C(=O)O)c1cc(O)cs1 740298109 WEYYBKHCSBKKDH-UHFFFAOYSA-N 268.246 2.102 10 20 CECD COc1cc2c(c(OC)c1)N(Cc1nnc(C)o1)CCC2 839655006 QBLPKBUSRFJOJF-UHFFFAOYSA-N 289.335 2.348 10 20 CECD COc1ccc(N(C)CCN(C)C(=S)NC2CC2)cc1 844580684 MUVXGOUPWSGUDK-UHFFFAOYSA-N 293.436 2.100 10 20 CECD CC1(CCC(=O)OCC(=O)c2ccc(O)c(O)c2)CC1 910037867 LIWSBCMOLZKLDU-UHFFFAOYSA-N 278.304 2.404 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1N 843052331 OPTXIDQXOITQHN-HIFRSBDPSA-N 279.403 2.451 10 20 CECD CC(C)[C@@H](C(=O)O)C(=O)NCc1cc(Cl)ccc1O 911332574 YLRYRZZIYVEISM-LLVKDONJSA-N 285.727 2.019 10 20 CECD CCOCc1cc(CN[C@@H]2CCNC2(C)C)ccc1OC 841085394 AZNXIXKQUNHRFW-MRXNPFEDSA-N 292.423 2.462 10 20 CECD CCOC(=O)C1(CNC(=O)Nc2ccc(N)cc2)CCC1 841300859 XLEZXCZMCVSOQR-UHFFFAOYSA-N 291.351 2.124 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@H]3CNC[C@@H]3C2)cc1F 843342784 ONWQFGIGBYGQFR-QLFBSQMISA-N 291.414 2.369 10 20 CECD Nc1ccc(CCNC(=O)N2CCC(F)(F)CC2)cc1 841957512 CKEHYKKYSMMGOZ-UHFFFAOYSA-N 283.322 2.252 10 20 CECD COC/C(C)=C\C(=O)N1CCOc2cc(N(C)C)ccc21 844413044 PNDAEKYQIRCQTO-XFXZXTDPSA-N 290.363 2.071 10 20 CECD O=C(COCCc1ccccc1)NCc1ccccc1O 748347076 UTNKWWKXLIIZIN-UHFFFAOYSA-N 285.343 2.268 10 20 CECD Cc1cc(N(C)C)ccc1CNCCOC[C@@H]1CCCO1 840933725 IFSFVIGCNJSSHC-KRWDZBQOSA-N 292.423 2.346 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1cc(OC)ccc1O 756731554 CAWPDJSDTLJFIS-RYUDHWBXSA-N 283.368 2.103 10 20 CECD CCOc1ccc(O)c(CN2C[C@H]3CCC[C@]3(N)C2)c1 857226301 KISNRORGNISBMM-CJNGLKHVSA-N 276.380 2.104 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H]3CCC[C@@]3(N)C2)c1O 857085805 HTKUGHLCKXYJLU-MLGOLLRUSA-N 292.354 2.047 10 20 CECD C[C@H](NCC1(O)CCCC1)c1cc([N+](=O)[O-])ccc1O 756573448 JWFXDKFHRACZFU-JTQLQIEISA-N 280.324 2.256 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)[C@H](C)C2)c1 862757915 IDRQCFWBGHNGGW-VXGBXAGGSA-N 275.348 2.322 10 20 CECD CO[C@@H](C)[C@H](C)NC(=O)N[C@H](C)c1ccccc1O 868529616 UITWSWHAUBOAHY-AXFHLTTASA-N 266.341 2.176 10 20 CECD C[C@H](Nc1cc(N2CCNCC2)ccn1)c1ccccc1O 873244720 JBOYGEDZWQDZLC-ZDUSSCGKSA-N 298.390 2.370 10 20 CECD CC[C@@]1(C)COCCN1Cc1cc(OC)c(OC)cc1O 775981993 WYXKPLONSSXONY-INIZCTEOSA-N 295.379 2.410 10 20 CECD CO[C@@H]1CCN(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 776245743 IGZUYHIWWQTCHX-SWLSCSKDSA-N 291.395 2.244 10 20 CECD Nc1ccc(CCNC(=O)C2[C@H]3CCCC[C@H]23)cc1 132694151 FEUPAWWKXFSJKT-KBPBESRZSA-N 258.365 2.364 10 20 CECD Cc1cc(NC(=O)[C@H](C)N[C@H](C)c2ccccc2O)on1 879649316 QILPLDACNGOXCK-MNOVXSKESA-N 289.335 2.366 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@@H]1C(=O)N(C)c1ccc(N)cc1 884441908 SHPNSGSKHSXUKF-MEBBXXQBSA-N 284.363 2.321 10 20 CECD COc1cccc(CNC(=O)NC[C@H]2C=CCC2)c1O 883837010 WTELESVIDMHWAS-NSHDSACASA-N 276.336 2.166 10 20 CECD CCc1onc(C)c1/C=C1\SC(=S)NC1=O 899336633 XAHWRAGQVLWGDV-YWEYNIOJSA-N 254.336 2.034 10 20 CECD Nc1ccc(CN2CCNC[C@H]2c2ccccc2)cc1 1120371793 QUUIFBKUQNXXKP-KRWDZBQOSA-N 267.376 2.415 10 20 CECD COc1ccc(CN[C@H](CO)CCC(C)C)c(O)c1OC 895584806 MQZBCPCUHDDTML-ZDUSSCGKSA-N 297.395 2.296 10 20 CECD CN(Cc1ccccc1O)c1nccc(N2CCCC2)n1 786796941 NHVYTZNTPSVWHH-UHFFFAOYSA-N 284.363 2.419 10 20 CECD CN(C)c1ccc([C@@H](CNC(=O)C(C)(F)F)N(C)C)cc1 891250225 VJLUJFMEWUYVNN-CYBMUJFWSA-N 299.365 2.127 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)CCCF)c1O 895896506 VSQOIYZUYLJHLD-UHFFFAOYSA-N 272.276 2.100 10 20 CECD CC(C)(O)CN(Cc1cc(F)cc(F)c1O)C1CC1 894496140 XHUGUEPIJUTWRO-UHFFFAOYSA-N 271.307 2.406 10 20 CECD COCCC1(NC(=O)/C=C/c2ccc(O)c(O)c2)CCC1 794163932 MKVAIPNOIPZGMW-GQCTYLIASA-N 291.347 2.186 10 20 CECD CCc1cccc(CNCC2CCN(C)CC2)c1O 691522020 JQDXSVMAJGYXTI-UHFFFAOYSA-N 262.397 2.386 10 20 CECD C[C@H]1CN(Cc2cc(F)ccc2O)[C@@H](C)CN1C 775988542 YRJYZZSSQILFQT-QWRGUYRKSA-N 252.333 2.056 10 20 CECD Cc1ccc(CN2C[C@H](C(=O)O)CC[C@@H]2C)c(O)c1 1605273133 JBRPNHLRZIBQOJ-WCQYABFASA-N 263.337 2.386 10 20 CECD COCc1nc(NCc2cc(C)ccc2O)cc(OC)n1 1329194364 XIQIZJXWIPYPDV-UHFFFAOYSA-N 289.335 2.258 10 20 CECD COC1CCC(N(C)C(=O)NCc2ccc(N)cc2)CC1 1337079180 YLOYQLBXBZYHKS-UHFFFAOYSA-N 291.395 2.368 10 20 CECD CN(C)c1cc(F)c(CNC[C@H]2CC[C@@H](O)C2)cc1F 1261813901 JUWSIGBBIIQNJY-CMPLNLGQSA-N 284.350 2.281 10 20 CECD C[C@@H](C(=O)O)N(Cc1ccc(F)c(F)c1O)C1CCC1 1589486664 JMRKLKCFXDIFFZ-QMMMGPOBSA-N 285.290 2.498 10 20 CECD COc1cccc(CNCc2cc(C)c(C(=O)O)[nH]2)c1O 1599673771 JLILYVIZWWNGOY-UHFFFAOYSA-N 290.319 2.025 10 20 CECD CC(C)[C@H](O)CNCc1cc(Br)ccc1O 164088139 CKDUBXUWSBNVFR-GFCCVEGCSA-N 288.185 2.261 10 20 CECD CCc1nnc(CNCc2ccc(N(C)C)cc2)s1 289411000 AGHSLZATZYHTGX-UHFFFAOYSA-N 276.409 2.456 10 20 CECD CS[C@@H]1CCCCN(C(=O)c2cccc(O)c2O)C1 193142866 SIBHAISNVYIGIQ-SNVBAGLBSA-N 281.377 2.456 10 20 CECD CCOC(=O)c1cnc(SC[C@H](C)C(=O)O)s1 1596739781 KDEMDRHCCDCKAA-LURJTMIESA-N 275.351 2.133 10 20 CECD CCN1CC(=O)N[C@@H]1c1cc(Cl)cc(Cl)c1O 189891319 KJYACZZWXLZBQD-NSHDSACASA-N 275.135 2.149 10 20 CECD Cc1cccc(CN2CCC[C@@H](Cn3ccnn3)C2)c1O 180773525 HSRSUXHMHMKIME-CQSZACIVSA-N 286.379 2.204 10 20 CECD C/C=C\C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 312151413 BITMENRRXLSCRB-ARJAWSKDSA-N 274.364 2.058 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1ccncn1 191157673 UTAIMQXPRYQNDG-UHFFFAOYSA-N 298.390 2.134 10 20 CECD CCOc1nnc(CN(C)Cc2ccccc2O)s1 264575380 ANNMKWPGXGLTHN-UHFFFAOYSA-N 279.365 2.274 10 20 CECD CCCN(CC(=O)O)Cc1cccc(OCC)c1O 86776122 FEKNVDYAHAODRF-UHFFFAOYSA-N 267.325 2.088 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1nncs1 530185508 PTVYBOZDDBBICD-UHFFFAOYSA-N 289.360 2.053 10 20 CECD Cc1cccc(CN(C)CCN2CCOC(C)(C)C2)c1O 279398018 KSSXQTXZPXQALI-UHFFFAOYSA-N 292.423 2.243 10 20 CECD COc1cccc(CN2CCC[C@H]2c2ncon2)c1O 371376664 ZDGWEICSVKYPHX-NSHDSACASA-N 275.308 2.121 10 20 CECD Cc1cc[nH]c1C(=O)NCc1ccc(N(C)C)c(F)c1 280859429 ZBIANBWHYWCHKP-UHFFFAOYSA-N 275.327 2.458 10 20 CECD Cc1cc(C)c([C@@H](C)NCC2(CO)CCOCC2)c(O)c1 294802333 PAYXVUBVCFKENQ-CQSZACIVSA-N 293.407 2.449 10 20 CECD Cc1cc(CNC(=O)NCCc2ccc(N)cc2)cc(C)n1 817877724 CVZXRZTZKUFAQU-UHFFFAOYSA-N 298.390 2.323 10 20 CECD CCOC(=O)CCN(C)Cc1ccc(N(C)C)c(C)c1 815034407 NLALKPHRIAHOLK-UHFFFAOYSA-N 278.396 2.446 10 20 CECD C[C@H](N[C@H](CN)C1CC1)c1cc(F)cc(F)c1O 817959582 HGEKQLIMBABFBL-JVXZTZIISA-N 256.296 2.058 10 20 CECD CCCN1C[C@@H](CN[C@H]2CCc3cccc(O)c32)CC1=O 817589904 RELKNDQVEJPLDC-OCCSQVGLSA-N 288.391 2.228 10 20 CECD Cc1nccnc1[C@H](C)NC[C@@H](N)c1ccc(N(C)C)cc1 817944175 XUUGNMMEBXEZOK-XJKSGUPXSA-N 299.422 2.202 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H]1CO[C@H](C)C1 828426677 BLLYCOOFWCKFHM-TZMCWYRMSA-N 292.379 2.491 10 20 CECD O=C(c1cc(O)cs1)N1C[C@H](O)C[C@@H]1c1ccccc1 821161862 JLNUOIIMHNLAPJ-DGCLKSJQSA-N 289.356 2.402 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C(=O)O)C(C)(C)C)c1O 825946520 CFEBSLWJEFRGSA-ZDUSSCGKSA-N 297.326 2.323 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@H](F)C1 836320746 SGIZKBGHYKYQDZ-AWEZNQCLSA-N 289.354 2.316 10 20 CECD COc1cc(O)c(CNC[C@@H]2CC[C@H](C)O2)cc1OC 835086751 JGRBVBMHUACGNX-JQWIXIFHSA-N 281.352 2.067 10 20 CECD Nc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccccc3)C2)cc1 746478604 DLATWIYXHDFEMN-GFCCVEGCSA-N 295.342 2.260 10 20 CECD C[C@H](CO)C1CCN(C(=O)Nc2ccc(N)cc2)CC1 846310259 KLRULTWKOPPKHQ-LLVKDONJSA-N 277.368 2.141 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 843057674 QNWRQSALDOKRMO-RKDXNWHRSA-N 272.751 2.354 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2CCc3n[nH]cc3C2)c1O 846153067 FDYOGDGXHXERPG-ZYHUDNBSSA-N 287.363 2.332 10 20 CECD CN(C(=O)c1cn(C)nc1-c1cccnc1)c1ccccn1 675036516 LHTHJVRERPVJLH-UHFFFAOYSA-N 293.330 2.154 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)CC[S@@](C)=O)c1O 846152854 FBHJHVPEBZCGTE-ZHYXMNDGSA-N 285.409 2.209 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](N)[C@H](C)C2)c1O 842475824 VBPVOLQPKCKLNS-AMIZOPFISA-N 282.771 2.027 10 20 CECD CCN(C(=O)c1cnn2c1[C@H](CN)CCC2)c1ccccc1 592478010 STQQLCIQBJUEQE-ZDUSSCGKSA-N 298.390 2.386 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1Cc1cc(OC)ccc1O 131499020 QLQJGZPPLXZEMO-WCQYABFASA-N 265.353 2.400 10 20 CECD CCC[C@H](O)CCN[C@H](C)c1cc(C(=O)OC)ccc1O 927015012 DRKGHTILNAXAGS-YPMHNXCESA-N 295.379 2.381 10 20 CECD Cc1cc(CN2CC[C@H](N)[C@H](C)C2)ccc1N(C)C 923291451 SQMIGAFBIGEWPD-HIFRSBDPSA-N 261.413 2.230 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCCO2 921951038 HKNAGFIZBNXAQJ-CABCVRRESA-N 288.391 2.016 10 20 CECD CCCN(Cc1ccccc1O)C[C@H](O)CN(C)C(C)C 851792041 JXFHFYFUNHOUIT-MRXNPFEDSA-N 294.439 2.305 10 20 CECD CN(C)c1ccc(CNC[C@@H](CO)CC2CC2)cc1F 850389403 WNWAPGNHSBHJOR-AWEZNQCLSA-N 280.387 2.390 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@H](O)C(F)(F)F 865712467 YHSMYVMMLVPYEX-PELKAZGASA-N 294.292 2.293 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnc([C@@H](C)O)s2)c1 862755131 DUHYZYWEGLOOKT-SECBINFHSA-N 292.360 2.140 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccc(C)n2C)c1 862760839 XDGXAJFVFPGYDF-UHFFFAOYSA-N 258.321 2.278 10 20 CECD CCC[C@@H](OC)C(=O)NCc1cc(C)ccc1O 862754786 KIHNNJGBJQVQPF-CYBMUJFWSA-N 251.326 2.132 10 20 CECD CC[C@@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O 768450984 KYMOPICSBJEAQF-BXUZGUMPSA-N 263.337 2.192 10 20 CECD CCCOc1ccccc1NC[C@H](O)CN1CCCC1 863556213 OVCMBBQQJQDZMO-AWEZNQCLSA-N 278.396 2.344 10 20 CECD C[C@@H](Cn1ccnc1)NC(=O)N[C@H](C)c1ccccc1O 864423131 AIAFELICPOQROZ-NWDGAFQWSA-N 288.351 2.038 10 20 CECD C[C@H](NCCN1CCOC[C@@H]1C)c1ccc(N(C)C)cc1 765728638 NOFQTORRCMGKMH-GJZGRUSLSA-N 291.439 2.124 10 20 CECD CCc1cccc(CN2CCCC[C@@H]2CNC(C)=O)c1O 877676283 ZULVUCSZAYHGML-MRXNPFEDSA-N 290.407 2.445 10 20 CECD C[C@H](NC(=O)C[C@@](C)(O)C1CC1)c1ccc(N(C)C)cc1 775404177 LWEJIVCSRIRKHI-YVEFUNNKSA-N 290.407 2.481 10 20 CECD CCN(C)c1ccc(Cn2cc(C(C)(C)NC)nn2)cc1 881313279 GTUXBUOQGCFLSF-UHFFFAOYSA-N 287.411 2.237 10 20 CECD C[C@H](N[C@H](C)CC[S@](C)=O)c1c(O)cccc1F 886551201 DJSQZKRYLPAPMP-JJQCHNSYSA-N 273.373 2.339 10 20 CECD CN(Cc1ccccc1O)c1ccc([N+](=O)[O-])cn1 89635663 XTJQOQOAHOZNDS-UHFFFAOYSA-N 259.265 2.332 10 20 CECD Nc1ccc(NC(=O)[C@@H]2COc3ccccc3O2)cc1 16857426 SEOPGQORIJOUPZ-AWEZNQCLSA-N 270.288 2.047 10 20 CECD CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)CCO1 891563089 WRVUMULPKNJNRJ-GFCCVEGCSA-N 281.352 2.020 10 20 CECD Cc1nc([C@H]2CCN(Cc3c(C)cccc3O)C2)n[nH]1 895011327 DDXIYRWJDVRGCQ-LBPRGKRZSA-N 272.352 2.117 10 20 CECD Cc1ccc(C(=O)OCc2cncc(F)c2)c(O)c1O 795484791 RHBMJEYMOZYSPN-UHFFFAOYSA-N 277.251 2.297 10 20 CECD Cc1c[nH]nc1C(=O)NCc1ccc2c(c1)CCCN2C 799413583 UWJWNSXYNOJVJN-UHFFFAOYSA-N 284.363 2.031 10 20 CECD CN(C)CCCNCc1c(O)cccc1Br 706863868 UWBHMZBNOGSTPS-UHFFFAOYSA-N 287.201 2.196 10 20 CECD C[C@H](CNCc1c(O)cccc1Br)N(C)C 706863376 FLLVJHCJAPKAAA-SECBINFHSA-N 287.201 2.194 10 20 CECD CC[C@@H](O)CCCNCc1cc(F)cc(F)c1O 708480857 MYDQTHLJXRHHAW-LLVKDONJSA-N 259.296 2.311 10 20 CECD OC[C@H](CC(F)F)NCc1ccc(N2CCCC2)cc1 717770144 YUICBDDCBSNCDY-ZDUSSCGKSA-N 284.350 2.393 10 20 CECD COC(=O)[C@@H]1CCC[C@H]1NCc1cc(C)c(C)cc1O 1320838199 XKKRPVMDLKFTFI-ZIAGYGMSSA-N 277.364 2.440 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)[C@@H]1CCNC1 1326201234 VCJJBIHFYBYFMU-MRXNPFEDSA-N 259.397 2.081 10 20 CECD Nc1ccc(CCNC(=O)NC/C=C/C2CC2)cc1 1328725713 QORUJHYGFLJYOX-OWOJBTEDSA-N 259.353 2.077 10 20 CECD C[C@H]1CCCN(c2nnc(-c3sccc3O)n2C)C1 1339459035 SYGNSDAECHONAY-VIFPVBQESA-N 278.381 2.486 10 20 CECD C[C@@H](N[C@H](CO)CC(F)(F)F)c1c(O)cccc1F 1262077945 URJCVEUQRWOHPA-SFYZADRCSA-N 281.249 2.495 10 20 CECD C[C@H](NC1C[C@@H]2C[C@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589955871 NBAIXZSJOAFGKK-GUBZILKMSA-N 285.351 2.021 10 20 CECD C[C@H]1OCC[C@@H]1COc1ccc(N(C)C)c(C(=O)O)c1 1594646476 XYLPIYAHFDHTEK-GHMZBOCLSA-N 279.336 2.255 10 20 CECD CCCC[C@H](NCc1cc(C)cc(OC)c1O)C(=O)O 1595638023 CLEZKBWNKPRIHT-LBPRGKRZSA-N 281.352 2.442 10 20 CECD COc1cccc(CNC(=O)NCC2(C3CC3)CC2)c1O 152256824 QHHQNIOFDNMCEB-UHFFFAOYSA-N 290.363 2.390 10 20 CECD CCN(C)c1ccc([C@H](C)NCCN(C)CCOC)cc1 159332473 TWNMYSAUOZPZEV-HNNXBMFYSA-N 293.455 2.372 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)[C@H](O)C(F)(F)F)c1 865711141 JAAGJNLRVDRPNT-KWQFWETISA-N 263.259 2.102 10 20 CECD CN1CCC[C@@H](CN[C@H]2CCc3cccc(O)c32)C1 381742122 PIOZBCPDFONMRL-JSGCOSHPSA-N 260.381 2.311 10 20 CECD CC[C@H](C)NC(=O)NCc1ccc(N(C)C)c(F)c1 58482941 VPQYFVVUIVWKKL-JTQLQIEISA-N 267.348 2.489 10 20 CECD CN(C)c1ccc(CNS(=O)(=O)CC2CCCC2)cc1 177739786 BJWLQHYNYAERPC-UHFFFAOYSA-N 296.436 2.362 10 20 CECD OCCO[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 179574613 HMYNIBDSSFRULX-CYBMUJFWSA-N 285.771 2.019 10 20 CECD COc1cc(O)c(CN2C[C@H]3[C@H](C2)C3(C)C)cc1OC 179445099 UBDKTDMMIKBJKC-RYUDHWBXSA-N 277.364 2.497 10 20 CECD Cc1ccc(O)c(CN2CCC3(CC2)OCCO3)c1 126133426 SYNWRYNFPIAQPU-UHFFFAOYSA-N 263.337 2.040 10 20 CECD CS[C@H](CO)[C@@H](C)NCc1c(O)cccc1Cl 152451128 CIAMCBCNGCWLQU-PRHODGIISA-N 275.801 2.248 10 20 CECD CC(C)C(=O)NCCN[C@@H](C)c1cc(Cl)ccc1O 184869200 CBSAUMPJBPXHHQ-JTQLQIEISA-N 284.787 2.468 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](CN(C)C)C2)c1O 79435161 LUIZXYUNMCOJOV-LBPRGKRZSA-N 294.370 2.117 10 20 CECD CC(=O)N(C)C1CCN(Cc2c(O)cccc2Cl)CC1 120478801 PIYWBSAFFPHUEC-UHFFFAOYSA-N 296.798 2.488 10 20 CECD CCC[C@@](C)(O)C(=O)NCc1ccc(N(C)C)c(F)c1 124527463 BQMKMWWMQIRFBJ-OAHLLOKOSA-N 282.359 2.059 10 20 CECD Cc1cc(O)c(CN[C@H](C)c2nnnn2C2CC2)cc1C 191833271 NUSCYUMVPLMBAL-LLVKDONJSA-N 287.367 2.181 10 20 CECD CSC(C)(C)CNCc1cc2c(cc1O)OCO2 135382493 BEGWUQCIEAYZFS-UHFFFAOYSA-N 269.366 2.352 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H]2CC(=O)O)cc1 86790768 ZPRZYEJCTYRDCB-CQSZACIVSA-N 262.353 2.192 10 20 CECD COCCCNC(=O)CN(C)c1ccc(OC(C)C)cc1 191599798 QCVFPZAJTJEPTQ-UHFFFAOYSA-N 294.395 2.063 10 20 CECD CCOc1ccc(N(CC)C[C@H]2CCS(=O)(=O)C2)cc1 279914068 FLWIVNCVHQAVBM-CYBMUJFWSA-N 297.420 2.346 10 20 CECD Cc1ccc(C(=O)N2Cc3ccccc3CO2)c(O)c1O 366223543 YNHWHDSCXLAINB-UHFFFAOYSA-N 285.299 2.494 10 20 CECD CCC(C)(C)N[C@H](C)C(=O)NCc1cccc(OC)c1O 274906616 GDXZWLPHRXRMPT-LLVKDONJSA-N 294.395 2.184 10 20 CECD C[C@H](NC(=O)N(C)Cc1ccccc1O)[C@H]1CCCCO1 272177835 ZTGVLVWBOPPAAP-SWLSCSKDSA-N 292.379 2.491 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@@](O)(C2CC2)C1 373324768 QRJUEQADRKWUHE-AWEZNQCLSA-N 267.756 2.392 10 20 CECD CC[C@H](NCCCOCCO)c1ccc(C)cc1O 280095473 MSKZNLOHLRRPMB-AWEZNQCLSA-N 267.369 2.140 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@@H]2CCCCO2)cc1 299214821 DYMXQRJKIPHMPH-HNNXBMFYSA-N 291.395 2.121 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC[C@H](C)CCO)c1 297284337 LNERKJWZIXTHJG-NWDGAFQWSA-N 295.379 2.238 10 20 CECD CCCN(CC(=O)OC)Cc1ccc(N(C)C)c(C)c1 815020569 DIRCRGTXPGFYBM-UHFFFAOYSA-N 278.396 2.446 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCC[C@@H](N)C2)c1 817970445 VQKVHVNDHREJHG-UHTWSYAYSA-N 292.379 2.099 10 20 CECD CN(Cc1c(O)ccc2ccncc12)C[C@@H]1CCCN1C 817372160 HGQMNKZJHJWPNK-AWEZNQCLSA-N 285.391 2.466 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)[C@@H](C)N 818608179 QIBGHBLIPDKBRH-ZIAGYGMSSA-N 291.439 2.473 10 20 CECD C[C@@H]1SCC[C@H]1NC(=O)NCc1ccccc1O 826036009 SKLCIUYJYNCTMR-GXSJLCMTSA-N 266.366 2.085 10 20 CECD Cc1ccc(C(=O)NCCCCCCC(=O)O)c(O)c1O 832912047 RMMTVCYKDGESHQ-UHFFFAOYSA-N 295.335 2.171 10 20 CECD CC(C)C[C@@H](CCO)CNC(=O)NCc1ccccc1O 745789285 IVMSGVFYLMSUCD-CYBMUJFWSA-N 294.395 2.236 10 20 CECD CCc1cccc(CN2CCO[C@H](C(F)F)C2)c1O 848909040 JGHBAQAMSINQQW-LBPRGKRZSA-N 271.307 2.421 10 20 CECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2)o1 846783638 BNWPCTYNNGYXAN-UHFFFAOYSA-N 274.320 2.284 10 20 CECD O=C1C[C@H]2C[C@@H]1[C@H](C(=O)NCc1cc(Cl)ccc1O)C2 846476886 PKUZYRRPOIWDKX-XXILOJSOSA-N 293.750 2.277 10 20 CECD C[C@@H](NCC(=O)NCC1CC1)c1ccc(Cl)cc1O 841754636 UGEYFGPUTSDYCF-SECBINFHSA-N 282.771 2.222 10 20 CECD CS[C@H](CO)[C@H](C)NCc1ccc(N(C)C)cc1C 840933936 KYYZRAHCGQJVCC-SWLSCSKDSA-N 282.453 2.263 10 20 CECD O=C(NCc1ccccc1O)c1ccc(NC2CC2)nc1 748346560 MIWCVOIDDHLESG-UHFFFAOYSA-N 283.331 2.292 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCCC[C@@H]1O 840938850 HRXVWZORNQCLQK-HOTGVXAUSA-N 262.397 2.454 10 20 CECD COc1cccc([C@H](C)N[C@H](C)CCCO)c1O 846150470 POCPKWMVJCFMJZ-MNOVXSKESA-N 253.342 2.212 10 20 CECD COc1ccc(O)c(CNCc2ccnn2CC2CC2)c1 850137343 NFSIDFSYUFKZJX-UHFFFAOYSA-N 287.363 2.297 10 20 CECD C[C@H]1CCN(C(=O)c2cc(O)cs2)C[C@H]1n1ccnc1 759469549 LQYUCGXBKDZYHD-CMPLNLGQSA-N 291.376 2.374 10 20 CECD C[C@@H]1C[C@H](NCCCOCCO)c2c(O)ccc(F)c21 757637684 MHYVOTFSJPCASI-PWSUYJOCSA-N 283.343 2.068 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCC[C@@H]2CCOC2)c1 858523117 NHDPIUSMEVZXKC-CYBMUJFWSA-N 292.379 2.317 10 20 CECD Clc1ccc(CNCc2ccc3c(c2)CCO3)nn1 876995221 CAWOBHWZMSHTCQ-UHFFFAOYSA-N 275.739 2.355 10 20 CECD COc1ccc(O)c([C@H](C)NCCOC[C@H]2CCCO2)c1 775369986 JQEPAPUWHBEDMP-GXTWGEPZSA-N 295.379 2.247 10 20 CECD CN(C)CC1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 873860829 ZIEUHNGZBNDMHD-UHFFFAOYSA-N 289.423 2.053 10 20 CECD CC(=O)NC[C@H]1CCCCN1Cc1cc(F)ccc1O 877674606 NBPCREXTLZBXNW-CQSZACIVSA-N 280.343 2.022 10 20 CECD C[C@H](NC(=O)c1cnco1)c1ccc(N(C)C)cc1 775409454 GBKVERYZNXEWLB-JTQLQIEISA-N 259.309 2.232 10 20 CECD O=C1NCCc2ccc(NCc3ccccc3O)cc21 770577452 AVHJAMPPFYTZKQ-UHFFFAOYSA-N 268.316 2.290 10 20 CECD COCCOC[C@@H](C)N[C@H](C)c1c(O)cccc1F 886549504 IYSHNLZKNTXOHG-GHMZBOCLSA-N 271.332 2.233 10 20 CECD CN(C)c1ccc(CNC(=O)N2C[C@H]3C[C@H]3C2)cc1F 888004987 DVIVYFYZMQVOFT-TXEJJXNPSA-N 277.343 2.053 10 20 CECD O=C(Nc1cccc(-n2cnnc2)c1)c1cc(O)cs1 1123921032 FHIVAWNSHAWDNS-UHFFFAOYSA-N 286.316 2.287 10 20 CECD C[C@@H](NCCOC[C@@H]1CCOC1)c1ccccc1O 783507884 CAIDFDZUUADXNL-CHWSQXEVSA-N 265.353 2.096 10 20 CECD CC1=NO[C@@H](CNCc2c(O)cccc2Br)C1 895299412 CTALVIAJOXIQKF-SECBINFHSA-N 299.168 2.409 10 20 CECD C[C@H]1CCCN1CCNC(=O)N[C@H](C)c1ccccc1O 897518235 HVINPPGMCYLDJC-QWHCGFSZSA-N 291.395 2.237 10 20 CECD C[C@H]1COCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1O 796498608 XSEVWSCJWJKBQM-WDEREUQCSA-N 280.324 2.063 10 20 CECD C[C@H]1CCN(CCNCc2c(O)cccc2Cl)C1 744450296 QOECRTRKBLBUHQ-NSHDSACASA-N 268.788 2.477 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C2CC2)O1 792670381 QSICSTFMQRHVTE-KWQFWETISA-N 267.350 2.093 10 20 CECD CN(C)CC(C)(C)NCc1ccc2c(c1)CCCO2 698057681 KFUTZFXMRAIHNN-UHFFFAOYSA-N 262.397 2.441 10 20 CECD COC(=O)CN(Cc1cc(OC)ccc1O)CC(C)C 1319825317 CQXHGHXNIIAJFT-UHFFFAOYSA-N 281.352 2.032 10 20 CECD COc1cc(C)cc(CN2CCC[C@@](C)(CO)C2)c1O 1338236464 YCMGZXPNUPXEGO-MRXNPFEDSA-N 279.380 2.304 10 20 CECD C[C@H]1CC[C@@H](CCC(=O)NCc2cccc(O)c2O)O1 1347543127 WXARMUSKPPAKGM-JQWIXIFHSA-N 279.336 2.062 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@H]1F)c1ccc(N(C)C)cc1 1349583181 GGZVHMIGXHTNPP-ZWKOPEQDSA-N 250.317 2.288 10 20 CECD COCn1ncc(C)c1CN(C)Cc1ccccc1O 1351949340 RQUREGNFNHJTBD-UHFFFAOYSA-N 275.352 2.133 10 20 CECD C[C@@H](NC[C@]1(C)CCCNC1)c1cc(C(=O)O)ccc1O 1593250125 REBABYHSQKSAFI-BDJLRTHQSA-N 292.379 2.131 10 20 CECD CCN(C)c1ccc(CN[C@@H](C)CC(=O)O)c(C)c1 1776857145 RVMSOQVWTUVUPQ-LBPRGKRZSA-N 264.369 2.404 10 20 CECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)CC(C)C)c1 161158186 LBRVVSWDKIFFGQ-SNVBAGLBSA-N 287.381 2.037 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCC(=O)N(C)C 37751636 OYYOYODILRPBDJ-VXGBXAGGSA-N 276.380 2.317 10 20 CECD CCCNC(=O)CCN[C@@H](C)c1ccc(F)cc1O 62748373 VPEKPIKBNJOAGI-JTQLQIEISA-N 268.332 2.098 10 20 CECD CC(C)O[C@@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 404747947 KVCGTCJKMIZGRT-OAHLLOKOSA-N 276.380 2.227 10 20 CECD O=C(c1cccc(O)c1O)N1CCC2(CC1)CC2(F)F 404796996 TYZRKVGSJZAUGO-UHFFFAOYSA-N 283.274 2.359 10 20 CECD C[C@H](NC[C@@H](C)O)c1ccc(Br)cc1O 134899584 AUKPKTLUXGEFII-SFYZADRCSA-N 274.158 2.186 10 20 CECD CSC[C@@H](CCO)N[C@H](C)c1ccc(F)cc1O 185530288 BXJPESPSYRFVHC-MWLCHTKSSA-N 273.373 2.296 10 20 CECD CC[C@H](NC(=O)c1cccc(O)c1O)c1ccncc1 187122262 RVQWPRDJNZFJJV-LBPRGKRZSA-N 272.304 2.374 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccsc1 183462861 NOJBGBDQLGLXPF-JTQLQIEISA-N 291.372 2.449 10 20 CECD Cc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1O 182521217 AISAIMCCWOWFFA-UHFFFAOYSA-N 273.288 2.042 10 20 CECD Cc1ccc(C(=O)NCC(C)(C)[C@@H](O)C(C)C)c(O)c1O 182900002 TXDJASFXCIIBGB-AWEZNQCLSA-N 295.379 2.179 10 20 CECD CC(C)N1CC[C@H](N[C@H](C)c2ccc(N(C)C)cc2)C1=O 89729017 ROMNGQXXKAVRHQ-CJNGLKHVSA-N 289.423 2.413 10 20 CECD COc1cccc(CNC(=O)CC(C)(C)CC(C)=O)c1O 191923320 GXHHGLIZMDZGHS-UHFFFAOYSA-N 293.363 2.412 10 20 CECD C[C@@H](CN(C)C)NCc1cc(Br)ccc1O 235110148 JAUKYWNHMBTBNC-VIFPVBQESA-N 287.201 2.194 10 20 CECD CCN(C)c1ccc([C@H](C)NCC[C@H](O)COC)cc1 90953007 NBISAXNUFLYTCR-BBRMVZONSA-N 280.412 2.191 10 20 CECD COc1ccc(N(C)CC(=O)N2CCCCC2)cc1OC 140280626 AMEPZSPMWHXEDD-UHFFFAOYSA-N 292.379 2.153 10 20 CECD CCn1nncc1CNCc1cc(Cl)cc(F)c1O 529638615 MGHRGBCLYLGZAU-UHFFFAOYSA-N 284.722 2.086 10 20 CECD O=C(CCn1ccnc1)NCc1c(O)ccc2c1CCCC2 266448577 CHORSPWXIPOOPP-UHFFFAOYSA-N 299.374 2.174 10 20 CECD COc1ccc(CNCCCCCS(C)(=O)=O)cc1C 274761030 OSONPCUIYIYCTL-UHFFFAOYSA-N 299.436 2.308 10 20 CECD C[C@H]1[C@@H](C)N(Cc2ccc(N(C)C)cc2)CC[S@@]1=O 271196721 OAABMCWMIRXIPT-NQCMUKECSA-N 280.437 2.094 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1C(=O)c1ccc(C)c(O)c1O 272751956 OKXXILFZTPUCTP-WDEREUQCSA-N 279.336 2.046 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[S@@](=O)C1 277434131 JRAZDKYESPOOOZ-MPBGBICISA-N 298.427 2.092 10 20 CECD C[C@@H]1[C@H](N2CCCC2)CCN1Cc1ccccc1O 289925662 WAPAWFKKSZUNND-UKRRQHHQSA-N 260.381 2.451 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H](O)CN2CCCC2)c(O)c1 293248539 BMPJZVWGLFAQPU-CABCVRRESA-N 292.423 2.116 10 20 CECD Cc1nccnc1CCNCc1ccc2c(c1)CCO2 292951638 IRBFSCQCWMMKKP-UHFFFAOYSA-N 269.348 2.052 10 20 CECD CC(C)(C)c1cc(C(=O)NCc2ccc(N)cc2)no1 297296734 VHAKYSYVBFWPOI-UHFFFAOYSA-N 273.336 2.484 10 20 CECD C[C@@H](NC[C@H](N)C1CC1)c1cc(Cl)ccc1O 817964918 JGSLEFWURCMBGK-PELKAZGASA-N 254.761 2.434 10 20 CECD Cc1nn(C)cc1[C@H](C)NCCc1ccc(N)cc1 817955675 FGPGBSZCUYSSRW-NSHDSACASA-N 258.369 2.204 10 20 CECD CCOC(=O)CN(C)Cc1ccc(N(C)C)c(C)c1 815031608 YGCCNGUYXCULDB-UHFFFAOYSA-N 264.369 2.056 10 20 CECD Cc1cc(O)c(CNC[C@H](O)C(C)C)cc1Cl 825278234 JCUUYHPCTGOORE-ZDUSSCGKSA-N 257.761 2.461 10 20 CECD CC1=NO[C@H](CNCc2c(O)cccc2Cl)C1 822324377 JWEHNICFKYTPFM-VIFPVBQESA-N 254.717 2.300 10 20 CECD C[C@@H](CC(=O)O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 820072806 YISAXDVJGKJFRW-STQMWFEESA-N 292.379 2.037 10 20 CECD O=C(NCc1ccc2c(c1)CCO2)NCc1ccccc1O 726272473 LWSSHFBGRQFNKL-UHFFFAOYSA-N 298.342 2.327 10 20 CECD C[C@@H](NCCCON)c1cccc(C(F)(F)F)c1O 902426629 WFJDQJAESGAZJU-MRVPVSSYSA-N 278.274 2.342 10 20 CECD C[C@H]1C[C@H](C)N(CC(=O)NCc2ccc(N(C)C)cc2)C1 839495660 UALSJOLRPLHLDJ-KBPBESRZSA-N 289.423 2.099 10 20 CECD CC[C@](C)(CNC(=O)NCc1ccccc1O)OC 836579830 QNWMITJFZIIEPW-CQSZACIVSA-N 266.341 2.007 10 20 CECD CCOC[C@H]1CCCN(C(=O)c2cc(O)cs2)C1 733807008 QKAHTQBQJHFPIN-JTQLQIEISA-N 269.366 2.342 10 20 CECD COC1CN(Cc2cc(Br)cc(C)c2O)C1 839131342 SLXDQKDPKNAZCK-UHFFFAOYSA-N 286.169 2.294 10 20 CECD CC/C=C(/C)C(=O)N(CC(=O)O)Cc1ccccc1O 911485686 JZCPXMPOOTWSCH-WDZFZDKYSA-N 277.320 2.162 10 20 CECD COCCN(C)CCCN[C@@H](C)c1cccc(OC)c1O 846139643 PXOLLJLNEJEHHM-ZDUSSCGKSA-N 296.411 2.020 10 20 CECD CCc1ncc(C(=O)NCc2ccccc2O)s1 748347072 UJOMGKGHHINNMR-UHFFFAOYSA-N 262.334 2.341 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H]1CCCCN1 841034267 WTPAMLGMABDECI-HNNXBMFYSA-N 261.413 2.293 10 20 CECD CCN(CC(C)C)C(=O)NCCc1ccc(N)cc1 841962377 OPXRBIWIVMSHED-UHFFFAOYSA-N 263.385 2.499 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C)[C@H](CN)C2)c1 841100810 KPQKJDHVXKXCBT-GXTWGEPZSA-N 278.396 2.208 10 20 CECD CC(C)[C@H](O)C(C)(C)CNC(=O)c1cc(O)cs1 754489634 SRCGOUCTTUQEBB-NSHDSACASA-N 271.382 2.227 10 20 CECD CCn1cnnc1CCN[C@@H](C)c1cc(F)ccc1O 756734596 YGFGZOLHQFMKHY-JTQLQIEISA-N 278.331 2.036 10 20 CECD C[C@@H](CNCc1cc(F)c(N(C)C)cc1F)CN(C)C 858167294 PQRDTCNKHTYTGE-NSHDSACASA-N 285.382 2.318 10 20 CECD CN(C)c1ccc(/C=C/CNCC23CC(CN2)C3)cc1 853245932 CYVSZSMNVRBABA-ONEGZZNKSA-N 271.408 2.107 10 20 CECD CC[C@@H](O)CCCN[C@H](C)c1cc(C(=O)OC)ccc1O 756731595 CJJLEMOQPOKARN-DGCLKSJQSA-N 295.379 2.381 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 860243620 RQZHFXDVUAIDBS-RRQGHBQHSA-N 295.338 2.300 10 20 CECD Cc1ccc2c(c1)CCN2C(=O)/C=C\c1cn(C)cn1 935230102 QBOVZBWIOHABTR-XQRVVYSFSA-N 267.332 2.331 10 20 CECD CCCOc1ccc(CN[C@@H](C)C(=O)N(C)C)cc1C 873114233 YWHMTDIEFMXQDR-ZDUSSCGKSA-N 278.396 2.350 10 20 CECD O=C(NC[C@H]1COC2(CCCCC2)O1)c1cc(O)cs1 776249744 WPWUTWHRPYDFSH-NSHDSACASA-N 297.376 2.259 10 20 CECD Cc1ncc(S(=O)(=O)Nc2ccc(O)c(C(C)C)c2)[nH]1 882798805 FCIVAXKHGOAPSL-UHFFFAOYSA-N 295.364 2.348 10 20 CECD C[C@]1(CO)CCCN1Cc1cc(Cl)ccc1O 789558328 WYXGIKQAQLBBFU-CYBMUJFWSA-N 255.745 2.392 10 20 CECD O=C1CN(Cc2cc(Cl)cc(F)c2O)CN1CC1CC1 789774487 FODPQCWYVYJGTP-UHFFFAOYSA-N 298.745 2.196 10 20 CECD O=C(c1cccc(O)c1O)N(CC(F)F)C1CCC1 899784684 FKGXMHTTWWVLQZ-UHFFFAOYSA-N 271.263 2.358 10 20 CECD CCN(CC(=O)O)Cc1c(O)ccc2ccccc12 86775035 CGRBMPBVLYLERR-UHFFFAOYSA-N 259.305 2.452 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)N1CCCCC1 790415141 ADPGCZRLFAUUNG-UHFFFAOYSA-N 284.381 2.097 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CC2(Cl)Cl)c(O)c1 794381369 LLNDTICGNLAAGH-VIFPVBQESA-N 290.146 2.211 10 20 CECD Cc1cc(CNCc2cc(Cl)ccc2O)ncn1 756990216 IZAGYEMKYAUABC-UHFFFAOYSA-N 263.728 2.434 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCC[C@H](F)C2)c1O 1329252240 GMIBMBHXDAYHGQ-NWDGAFQWSA-N 296.342 2.481 10 20 CECD C[C@H](CNC(=O)NCc1ccc(N)cc1)c1ccncc1 1353368507 YNLUOTWZPHNYCV-GFCCVEGCSA-N 284.363 2.267 10 20 CECD Cc1ccccc1CCNC(=O)Cc1ccc(N)cc1 110375065 WZBAKVYAORZIJH-UHFFFAOYSA-N 268.360 2.479 10 20 CECD Oc1ccc(F)cc1CNC[C@@H]1CCC[C@H](O)C1 226611453 OUUIPSQCGNKDSD-MFKMUULPSA-N 253.317 2.172 10 20 CECD CCN(CCC(=O)O)Cc1cc(Cl)cc(OC)c1O 229118388 AEJDZSCZOKPHSK-UHFFFAOYSA-N 287.743 2.351 10 20 CECD CC[C@](C)(CC(=O)O)NCc1ccc(OC)c(OC)c1O 1594825868 WDSBXLSTVJRONV-OAHLLOKOSA-N 297.351 2.142 10 20 CECD Cc1cc(CNCc2ccc3c(c2)CCCO3)n[nH]1 921757049 ARFKYPWBTXVKKU-UHFFFAOYSA-N 257.337 2.333 10 20 CECD CCCN(CC[C@H]1CCNC1=O)Cc1ccccc1O 846807300 BYFQMJQNXXRBBQ-CYBMUJFWSA-N 276.380 2.130 10 20 CECD COc1cc(Cl)cc(CNCC2=CCN(C)CC2)c1O 273792684 VOXGUCKZHWWUFU-UHFFFAOYSA-N 296.798 2.406 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)CCN(C)C)c1 49553252 GGRPWUHBVLYWTI-VXGBXAGGSA-N 266.385 2.392 10 20 CECD COC[C@@H]1CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 81072268 PMLSRYJEDAJEPX-LLVKDONJSA-N 281.327 2.202 10 20 CECD Oc1ccccc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 713573529 YCZKZSRIQGFJSF-CFVMTHIKSA-N 259.349 2.439 10 20 CECD COCCCCN(C)Cc1cc(OC)ccc1O 397213335 YTMHVMWMVWVWJV-UHFFFAOYSA-N 253.342 2.259 10 20 CECD CCc1c(C(=O)N[C@H](C)c2ccccc2O)cnn1C 827930439 KFEXQROLRPPADH-SNVBAGLBSA-N 273.336 2.179 10 20 CECD NC(=O)c1ccc(CNCc2c(O)cccc2Cl)cc1 113313319 GPBSBWRZLFZGGE-UHFFFAOYSA-N 290.750 2.434 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccccc1 26248431 JBDQTGJGXFAHIQ-VQHVLOKHSA-N 269.300 2.427 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2C[C@@H]2C2CC2)c1 176146891 FATSVMMXPUVWSN-CHWSQXEVSA-N 261.321 2.063 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCCOC1 171030289 CBTUTYWPZGUBCR-HNNXBMFYSA-N 288.391 2.330 10 20 CECD CCC1=C(C(=O)NCc2cc(OC)ccc2O)CCCO1 189554266 ASVKOAKTNANHSH-UHFFFAOYSA-N 291.347 2.492 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCCCO2)cc1F 121341222 YOMNGCZJKFAYKW-CQSZACIVSA-N 280.343 2.077 10 20 CECD CN(Cc1ccccc1O)C(=O)Nc1ccc(C(N)=O)cc1 42903813 XJMWLDXKWOSLKB-UHFFFAOYSA-N 299.330 2.155 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C[C@H]1COC(=O)C1 137070768 ACRIEWINMBGAQG-GFCCVEGCSA-N 291.347 2.084 10 20 CECD CN(CC(F)(F)F)C(=O)CSc1nccs1 193955195 RYSZIDCKGSPVGZ-UHFFFAOYSA-N 270.301 2.256 10 20 CECD COc1ccc(O)c(CN[C@@H](C)c2nnc3ccccn23)c1 237362536 TUIMGEYALBAUIT-NSHDSACASA-N 298.346 2.294 10 20 CECD C[C@H]1CC[C@H](CCC(=O)NCCc2ccc(N)cc2)O1 237561030 FALJBZHXVAGNLM-SWLSCSKDSA-N 276.380 2.275 10 20 CECD COc1cccc(CNC[C@H](O)c2ccc(C)o2)c1O 265971692 KZSXTAUFZFMORX-LBPRGKRZSA-N 277.320 2.125 10 20 CECD CCN(CC(=O)N1CCCC1)c1ccc(OC)c(OC)c1 269646600 UEABWSIZZYLLHI-UHFFFAOYSA-N 292.379 2.153 10 20 CECD C[C@@H](CF)NC(=O)NCc1ccc(N2CCCC2)cc1 287495305 IYWDLFMVSLXDKC-LBPRGKRZSA-N 279.359 2.444 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1c(C)cc(C)cc1O 285089198 JXEMMPSXEVCGNX-LBPRGKRZSA-N 278.396 2.432 10 20 CECD CN(C)c1ccc(CNCc2c[nH]c3nccnc23)cc1F 290898399 NRENFQGWXWBRAO-UHFFFAOYSA-N 299.353 2.453 10 20 CECD Cc1nc2cccc(C(=O)NCc3ccc(O)c(O)c3)c2[nH]1 801927901 GGLKHVOLQAPDFE-UHFFFAOYSA-N 297.314 2.213 10 20 CECD CNC(=O)[C@@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 293193807 TZTWQSHEBYZRGT-OAHLLOKOSA-N 289.423 2.019 10 20 CECD C[C@H](NCC[C@H]1CCNC1)c1cc(F)cc(F)c1O 817955558 YUBWLQLWILUYQT-VHSXEESVSA-N 270.323 2.321 10 20 CECD COc1ccc(O)c(CNCCN2CCCC2(C)C)c1 825325398 CGCBMRWMTMWXBX-UHFFFAOYSA-N 278.396 2.365 10 20 CECD COc1cccc(O)c1CN1CC[C@H](SC)C1 824683575 QIIHLBVHQKEYQM-JTQLQIEISA-N 253.367 2.338 10 20 CECD Cc1cccc(NC(=O)/C=C\c2ccc(O)c(O)c2)n1 588405970 PWSJRUSAXZWJEZ-VURMDHGXSA-N 270.288 2.453 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCCC[C@H]2CCOC2)c1 825133722 LUVHLFOKXYKXHU-NSHDSACASA-N 280.324 2.207 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@H]2CC[C@H]1O2 734407271 KVYOBTARKGBLHD-OWCLPIDISA-N 288.391 2.245 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2cc(F)cc(F)c2O)C1=O 903392383 RJUDWBXUWRENQK-ZANVPECISA-N 298.333 2.332 10 20 CECD C[C@@H](NCC1(O)CCN(C)CC1)c1ccc(Cl)cc1O 841748937 CDNXSQDWIGNXNJ-LLVKDONJSA-N 298.814 2.153 10 20 CECD COc1ccc(O)c(CN[C@H](C)COCC2CC2)c1 846073897 SRJKRQTYHOXYLO-LLVKDONJSA-N 265.353 2.306 10 20 CECD CCc1cccc(CN2CC[C@@H](C)C[C@@H]2C(N)=O)c1O 848904261 OSBXTBHFYIUPQA-BXUZGUMPSA-N 276.380 2.040 10 20 CECD COc1cccc([C@H](C)NC[C@H](OC)C2CC2)c1O 846171453 SUSNBBBUXMYOIB-HZMBPMFUSA-N 265.353 2.476 10 20 CECD COc1cc(C)cc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1O 840130089 VQXLEIRTTPTILJ-KBUPBQIOSA-N 287.359 2.094 10 20 CECD Cc1ccc(O)c(CNCc2ccc(CN)cc2)c1 843129728 ZCEPMPVZORFNEA-UHFFFAOYSA-N 256.349 2.449 10 20 CECD CCCCN(C)C[C@H](C)NC(=O)c1ccc(C)c(O)c1O 752932853 RURKMPSKTNVDIO-LBPRGKRZSA-N 294.395 2.256 10 20 CECD CC[C@@H](NCc1cn(CC)nn1)c1ccc(F)cc1O 850522178 GQWSQVVJTHHIOI-CYBMUJFWSA-N 278.331 2.384 10 20 CECD OCC1(CNCc2cc(Cl)cc(F)c2O)CCC1 753590738 CDIDCZFJWZFVIU-UHFFFAOYSA-N 273.735 2.437 10 20 CECD CC[C@@H](C)[C@H](OC(=O)c1cc(O)cs1)C(=O)OC 922437622 JVROYQJTOOZPMZ-XCBNKYQSSA-N 272.322 2.198 10 20 CECD C[C@H](NC[C@@H](C)N(C)C)c1cc(F)cc(F)c1O 756533447 HUBOOKDLNXWMJN-BDAKNGLRSA-N 258.312 2.271 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCCF)c1 756765976 UPDAZSNDMKIYQP-SECBINFHSA-N 255.289 2.189 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@H]2CCSC2)c1 858407098 CNGRESMRJAOJNJ-LLVKDONJSA-N 280.393 2.253 10 20 CECD COc1cc(CN[C@H]2C[C@H](O)C2)c(O)c(C(C)(C)C)c1 850417801 MQYBXNDUPMUINL-HAQNSBGRSA-N 279.380 2.311 10 20 CECD COc1ccc(N(C)CCCc2nc(C)no2)cc1OC 763500403 DCUDJGHRIFERNX-UHFFFAOYSA-N 291.351 2.464 10 20 CECD CN(C)[C@H]1CCCN(C(=O)c2cc(O)cs2)CC1 760921069 MFENKIURVKIAQY-JTQLQIEISA-N 268.382 2.010 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@@H](CO)C2)cc1Cl 877667257 LXILXOFRHGGYFI-JGZJWPJOSA-N 255.745 2.215 10 20 CECD C[C@H](CC(=O)N(C)c1ccc(N)cc1)n1ccnc1 877075985 KSZHOMUESCYEGR-LLVKDONJSA-N 258.325 2.079 10 20 CECD CC1(NCc2c(O)cccc2Br)COC1 877691306 MKKRZCNKJLVYBN-UHFFFAOYSA-N 272.142 2.033 10 20 CECD CC[C@@H](NCCOC[C@H]1CCOC1)c1ccccc1O 775503359 GHPDAMJJNXIOBG-DZGCQCFKSA-N 279.380 2.486 10 20 CECD Cc1cccc(O)c1CNCCCN1CCCCC1=O 877022645 OXTPSPSVGALJCV-UHFFFAOYSA-N 276.380 2.193 10 20 CECD C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccc[nH]1 779539542 HCNAUUGFXMEJDM-ONRRBMGISA-N 272.304 2.317 10 20 CECD CN(Cc1cnc(Cl)cn1)c1ccc2c(c1)OCO2 788485071 HMHDNUQHBNRSDH-UHFFFAOYSA-N 277.711 2.495 10 20 CECD CC(C)(NCc1c(O)ccc(Cl)c1F)C(=O)O 789897414 IXDNDDSBKNOXMO-UHFFFAOYSA-N 261.680 2.138 10 20 CECD COc1cc(C)cc(CNCCC[C@H](C)CO)c1O 894368720 SJLUFMXLULDZGK-NSHDSACASA-N 267.369 2.207 10 20 CECD O=C(NC[C@@H](CO)CC1CCCC1)c1cccc(O)c1O 799052729 JIJAHFZAPDEPJN-LBPRGKRZSA-N 293.363 2.016 10 20 CECD CCN(Cc1cc(OC)ccc1O)C[C@H]1CCOC1 775653276 CEVQOTHLQKZIEQ-GFCCVEGCSA-N 265.353 2.259 10 20 CECD CCOc1cccc(CN2C[C@@H](C)N(C)C[C@@H]2C)c1O 775981341 PNLOAFFFRLBDNL-OLZOCXBDSA-N 278.396 2.315 10 20 CECD COc1ccc(CNc2cncc(Cl)n2)c(O)c1 795290740 VYUUWJQRLVCIEQ-UHFFFAOYSA-N 265.700 2.456 10 20 CECD CCCN(CC(=O)O)Cc1ccc(Cl)cc1O 1603667454 WQMHLLNJTUNOSE-UHFFFAOYSA-N 257.717 2.342 10 20 CECD CCc1ncoc1C(=O)N[C@@H](C)c1cc(OC)ccc1O 1336404819 KPYZQBKTSJEVFI-VIFPVBQESA-N 290.319 2.442 10 20 CECD CC[C@H](F)C(=O)N(C)CCN(C)c1ccc(OC)cc1 1353725987 HYNISHZFEGHCQA-AWEZNQCLSA-N 282.359 2.338 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@H]1C(=O)O 1600236023 GBZZOEISKNWEMP-CABCVRRESA-N 276.380 2.404 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cccc(C(=O)O)c2)c1 1574374840 DQPQLVGRIAEDOS-UHFFFAOYSA-N 285.299 2.329 10 20 CECD C[C@@H](N[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589955870 NBAIXZSJOAFGKK-CHWFTXMASA-N 285.351 2.021 10 20 CECD Nc1ccc(C(=O)NCc2cccc(Cl)c2O)c(O)c1 1580440216 YHVKQQHXVYKJOM-UHFFFAOYSA-N 292.722 2.263 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@@H]1CCCO1 161794574 JKVJEIUXEGUAFE-KRWDZBQOSA-N 290.407 2.134 10 20 CECD Oc1ccc(Br)cc1CNCc1cc[nH]n1 164067150 JWDUTOHKCIZHRT-UHFFFAOYSA-N 282.141 2.168 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCO2)[C@@H](O)C(F)(F)F 922310709 ZPAVCBPBPSBJJA-NOZJJQNGSA-N 289.297 2.413 10 20 CECD C[C@@H](Cn1cccn1)NCc1cc(Cl)ccc1O 37155664 QJXXHBMCMTTZFA-JTQLQIEISA-N 265.744 2.420 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2ccc(O)nc2)c1 392684108 NJOPKNZZHKXBQF-SNVBAGLBSA-N 274.320 2.352 10 20 CECD CCOC(=O)c1cnc(S[C@H](C)CC(=O)O)s1 1596739951 LIGSLTWPBPICFW-ZCFIWIBFSA-N 275.351 2.275 10 20 CECD CC(C)CNCc1ccc(N2CCC[C@H](C(N)=O)C2)cc1 58062731 KMSQXONDCLVLKK-HNNXBMFYSA-N 289.423 2.134 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CCC[C@H]2C)c1 114596461 ALFPHOOLWTZXSO-MFKMUULPSA-N 278.352 2.389 10 20 CECD C[C@H](NC1CCN(C)CC1)c1ccc(F)cc1O 62745786 OTBPMEROWZAUEQ-JTQLQIEISA-N 252.333 2.276 10 20 CECD CCCNC(=O)[C@@H]1CCCN(Cc2ccccc2O)C1 179566398 VMRCWFPFDRMMBU-CQSZACIVSA-N 276.380 2.130 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(F)c(F)c2O)C1 187761275 HXFPLFGTRYUNIV-VHSXEESVSA-N 298.333 2.332 10 20 CECD Cc1c[nH]nc1CN(C)Cc1ccc(N(C)C)cc1 284034305 LIXXMVALAGJTNJ-UHFFFAOYSA-N 258.369 2.416 10 20 CECD COc1ccc(O)c(CN2CCC(OC)CC2)c1 132143255 DWTNSQIXHNBMHJ-UHFFFAOYSA-N 251.326 2.012 10 20 CECD CN(C)c1ccc(CNC2(C(N)=O)CCCCC2)cc1 180045800 DVNXSBDFENLZFS-UHFFFAOYSA-N 275.396 2.030 10 20 CECD CCOc1cccc(CN[C@H](CC)C(C)(C)O)c1O 293011471 NZOXHMFNZWWOGV-CYBMUJFWSA-N 267.369 2.430 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CCCCNC2=O)c(O)c1C 273411827 PVMRHEGWJAZVOF-GXTWGEPZSA-N 276.380 2.328 10 20 CECD CC[C@H](NC[C@@]1(O)CCO[C@@H]1C)c1ccc(N(C)C)cc1 278890240 TXZCBNJFWJLRSZ-COXVUDFISA-N 292.423 2.333 10 20 CECD COc1cc(O)c(CN[C@@H]2CCO[C@H](C)C2)cc1OC 271794270 HQRSXLQFHNRNSX-ZYHUDNBSSA-N 281.352 2.067 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@H](C)c1ccc(C)c(C)c1O 273445328 DYDTXPZDFPWZFA-WCQYABFASA-N 299.436 2.483 10 20 CECD COc1cc(N2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OC 271038788 MMFBDKQCVRVZLZ-SECBINFHSA-N 266.297 2.458 10 20 CECD CC[C@H](CO)N(C)Cc1cc(Br)ccc1O 295210026 ZYWMEYNDBIOWRI-LLVKDONJSA-N 288.185 2.357 10 20 CECD Cc1ccoc1CNC(=O)/C=C\c1ccc(O)c(O)c1 816983474 ZLBKCNCBAOLTKK-HYXAFXHYSA-N 273.288 2.329 10 20 CECD C[C@H](C(=O)N[C@H](C)c1ccccc1O)c1cnn(C)c1 827937613 ZROIZCSHFWHGTO-WDEREUQCSA-N 273.336 2.107 10 20 CECD C[C@H]1C[C@@H]1c1cc(NC(=O)Cc2ccc(N)cc2)n[nH]1 827930175 HQXADVXCQXGAPE-CABZTGNLSA-N 270.336 2.297 10 20 CECD CC(=O)C(=O)COc1cccc(C(F)(F)F)c1[N+](=O)[O-] 901652134 DDDWPUAUYXXXIQ-UHFFFAOYSA-N 291.181 2.151 10 20 CECD CCOC1CN(Cc2cc(Cl)cc(F)c2O)C1 839130364 CEQGCQWYQYCJJI-UHFFFAOYSA-N 259.708 2.405 10 20 CECD CCC[C@@H]1CNCCN1Cc1cc(OCC)ccc1O 843058657 ZOSYJVMRTSRCBG-CQSZACIVSA-N 278.396 2.365 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CC[C@H]2NCC[C@@H]2C1 843127088 OKBQKYXXIDNHAB-NOZJJQNGSA-N 284.762 2.369 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1cc2c(cc1O)OCO2 842754604 QSWDLJPRPYGNJB-ZYHUDNBSSA-N 281.352 2.008 10 20 CECD CO[C@H]1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)C1 858982279 VXIMZYDTCOVDKF-XYPYZODXSA-N 284.743 2.022 10 20 CECD CCCN1CC[C@@H](NCc2ccc(OCC)cc2O)C1 850395069 NHBGUXYTMIQCDQ-CQSZACIVSA-N 278.396 2.365 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](C)c1ccc(C)cc1O 756773635 AMDAVXGQSUOMTN-YUTCNCBUSA-N 276.380 2.266 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCO[C@H](C)C2)c1 756542503 ASPMNNACGPEWHV-KGLIPLIRSA-N 278.396 2.072 10 20 CECD Cc1ccc(COC(=O)c2cccc(O)c2O)nc1 758547629 MQDARJPQNLVVHB-UHFFFAOYSA-N 259.261 2.158 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CC23CCOCC3)c1 862758228 SZLPAUPZBKZNTQ-ZDUSSCGKSA-N 275.348 2.134 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)[C@H](O)Cc1ccccc1 764996849 DGYKEVLHQCHLTN-ZWNOBZJWSA-N 291.372 2.176 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cncnc2C2CC2)c1 862755856 ZYBUKDDIGRBERT-UHFFFAOYSA-N 283.331 2.298 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C1=COCC1 769289072 BRSRDHPPFCVSIY-UHFFFAOYSA-N 261.321 2.435 10 20 CECD CC(C)CNC(=O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 1116569039 YZVDGZXHPRECKY-PWSUYJOCSA-N 294.370 2.441 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC2OCCCO2)c1 775372704 GPFMSMCVTPMCQS-LLVKDONJSA-N 281.352 2.205 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)C1(O)CCC1 772514043 HWYRLLDUTGRBOC-UHFFFAOYSA-N 288.391 2.208 10 20 CECD CC[C@@H]1CC[C@H](C(=O)N(C)Cc2ccccc2O)O1 268201648 GFAZZQDPEHWNTQ-TZMCWYRMSA-N 263.337 2.308 10 20 CECD O=C(CCNCc1cc(F)ccc1O)Nc1ccccn1 779061414 OQAPNLWWKUOGRK-UHFFFAOYSA-N 289.310 2.045 10 20 CECD CON1CCC(N[C@@H](C)c2c(O)cccc2F)CC1 886628508 SNDDHRGAOWHEFF-JTQLQIEISA-N 268.332 2.208 10 20 CECD C[C@@H]1NC(=O)[C@H](C)N(Cc2cccc(Cl)c2O)[C@H]1C 895119447 YQVHPVXLIPKLCX-GUBZILKMSA-N 282.771 2.143 10 20 CECD Cc1cccc(O)c1CN1CCO[C@@H](c2ccnn2C)C1 897563544 WSDNLHJATNDEPY-MRXNPFEDSA-N 287.363 2.008 10 20 CECD COc1ccc(N(CCC(C)C)Cc2nnnn2C)cc1 796506832 ZUWWPSRZRPBNNJ-UHFFFAOYSA-N 289.383 2.271 10 20 CECD CC(C)[C@H](N)CNCc1ccc(N2CCCC2)cc1 1325610228 GVNVMRNJQRUDAV-MRXNPFEDSA-N 261.413 2.360 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cnc(N)s1 1340223274 WMNXOLGALSCDQH-UHFFFAOYSA-N 290.392 2.030 10 20 CECD Nc1ccc(NC(=O)NCC[C@H]2CCCCO2)cc1 224124672 MCGPFQNLIUBTOY-CYBMUJFWSA-N 263.341 2.350 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)[C@H]1C[C@@H]1C(=O)O 1600236046 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CC[C@H](NCC(=O)NCC1CC1)c1ccc(N(C)C)cc1 181290703 QYXSHEHBVDVWSB-INIZCTEOSA-N 289.423 2.320 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H](C)N1 70075302 LTGGPBGPUYDDLZ-AOOOYVTPSA-N 254.761 2.228 10 20 CECD C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)CCO1 271422467 ZSLGNTLBOAWIBT-AAEUAGOBSA-N 278.352 2.101 10 20 CECD COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1cccc(C)c1O 274923151 MSMYVFJGEUYBRV-FZMZJTMJSA-N 277.364 2.474 10 20 CECD Cc1cc(C(=O)NC[C@H]2CCNC2)c(C)n1-c1ccccc1 272988720 FDBXEIPWFAKLIB-HNNXBMFYSA-N 297.402 2.433 10 20 CECD Cc1cc(C)c([C@@H](C)NCC(=O)NC(C)C)c(O)c1 284162723 PXXRMOZKSABISR-GFCCVEGCSA-N 264.369 2.184 10 20 CECD C[C@H](N[C@@H]1CCc2cccc(O)c21)[C@@H](C)N1CCOCC1 297766280 OZZGNGZRFFHAOB-GZBFAFLISA-N 290.407 2.078 10 20 CECD COC[C@H](O)CN[C@@H](C)c1cc(Cl)cc(C)c1O 808717009 BRDCSOWUGIKDBH-GXSJLCMTSA-N 273.760 2.012 10 20 CECD CCCCN(C)C[C@H](C)NC(=O)c1c(F)ccc(O)c1O 295918702 FDSIJKKRUBAVLE-JTQLQIEISA-N 298.358 2.087 10 20 CECD CC(C)COc1ccccc1NC[C@@H](O)Cn1cccn1 819416047 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CC[C@H](C)[C@@](C)(O)CNC(=O)/C=C/c1ccc(O)c(O)c1 779525843 SUIPCFBZOVHNEM-NSNHRWCXSA-N 293.363 2.024 10 20 CECD C[C@]1(CCCO)CCCN1C(=O)NCc1ccc(N)cc1 1120676754 BLZFCSZDDMBPIH-MRXNPFEDSA-N 291.395 2.105 10 20 CECD O=C(COC(=O)[C@H]1CCCCS1)c1ccc(O)c(O)c1 784660649 OOLKMCYXKATYLR-CYBMUJFWSA-N 296.344 2.109 10 20 CECD COc1ccc(CN2C[C@H]3[C@@H](C2)C3(C)C)c(O)c1OC 892112921 CUOHRYGTMDGEGR-TXEJJXNPSA-N 277.364 2.497 10 20 CECD CCN(CCC(=O)NC)Cc1cccc(Cl)c1O 897709615 GYIPYECMINWBSF-UHFFFAOYSA-N 270.760 2.004 10 20 CECD OC[C@]12C[C@@H]1CN(Cc1ccc(N3CCCCC3)cc1)C2 783745889 WXPUTUNYBDOFDU-SJLPKXTDSA-N 286.419 2.491 10 20 CECD COCc1nsc(NCc2ccc(OC)cc2O)n1 795283583 COGZFZBEVYAIMU-UHFFFAOYSA-N 281.337 2.011 10 20 CECD Cc1[nH]nc(NC(=O)c2cc(O)cs2)c1Cl 790996699 VVHUNMBMKCBJRP-UHFFFAOYSA-N 257.702 2.391 10 20 CECD C[C@H](N[C@H](C)c1cc(F)ccc1O)c1ncn(C)n1 275774197 VFFSEGNROMTZHP-BDAKNGLRSA-N 264.304 2.072 10 20 CECD CCc1noc(C)c1C(=O)NCc1ccc(OC)cc1O 794377335 RZLZBWUMXKUZME-UHFFFAOYSA-N 290.319 2.190 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CC23CCC3)c(O)c1 794378615 ZTYNVSHHTLNQBD-LBPRGKRZSA-N 261.321 2.207 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCC[C@@H]2CCO)c1O 1332004594 LYUBEQRRIXBRIG-TZMCWYRMSA-N 279.380 2.350 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1ccc(Cl)cc1O 1589444440 ZLKSSZDYVNUQHH-SNVBAGLBSA-N 257.717 2.341 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1C[C@@H]1F 1351666305 LJBODPDYTFCTMO-YPMHNXCESA-N 263.312 2.245 10 20 CECD O=C(O)c1cnc(Sc2ncnc3c2CCC3)s1 1608979363 WXVUFAARBHXRQS-UHFFFAOYSA-N 279.346 2.271 10 20 CECD Cc1cccc(O)c1CNCCc1ncc(C(=O)O)s1 1607858033 BTOVMLQMNPRWKE-UHFFFAOYSA-N 292.360 2.188 10 20 CECD CCCC(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1754257985 OIEURBVJZPDUJD-ZDUSSCGKSA-N 278.396 2.398 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)[C@H](CC(=O)O)C2)c1O 1599392564 NVMTXESRLFCYDY-VXGBXAGGSA-N 293.363 2.252 10 20 CECD CC[C@H](C)[C@H](O)CNCc1cc(F)cc(F)c1O 882993709 FPQZSWGYJXNWGR-QPUJVOFHSA-N 259.296 2.167 10 20 CECD COc1cccc(CNC[C@@H]2CCN(C(C)C)C2)c1O 40621435 SZGLJYKYQGYKGD-ZDUSSCGKSA-N 278.396 2.221 10 20 CECD CCOc1cccc(CNCC2([S@](C)=O)CCC2)c1O 280616967 KOXLYKZAGCQQSJ-FQEVSTJZSA-N 297.420 2.182 10 20 CECD CSC[C@H](C)NCc1ccc(N2CCOCC2)cc1 76768852 VTOUTZXRQKDQRU-ZDUSSCGKSA-N 280.437 2.364 10 20 CECD Oc1ccc(Cl)cc1CN1CCO[C@H]([C@H]2CCCO2)C1 245724957 DRFJROCLRRZGKU-CABCVRRESA-N 297.782 2.425 10 20 CECD CCOCCO[C@H]1CCN(Cc2ccccc2O)C1 179587078 UXQIYMIIPGSPQT-AWEZNQCLSA-N 265.353 2.020 10 20 CECD COc1cccc(CN2CCC(NC(C)C)CC2)c1O 179836083 BBMFAZCNXCDWSX-UHFFFAOYSA-N 278.396 2.363 10 20 CECD C[C@H](NC(=O)[C@H]1C[C@H]1F)c1ccc(N(C)C)cc1 1349583179 GGZVHMIGXHTNPP-TVYUQYBPSA-N 250.317 2.288 10 20 CECD OCCOCCNCc1cc(-c2ccccc2)ccc1O 67697425 JYYLMVFMBASJKY-UHFFFAOYSA-N 287.359 2.158 10 20 CECD CCN(CC)CCC[C@@H](C)NC(=O)c1cccc(O)c1O 126211249 BRDXEMKLDMDWTA-GFCCVEGCSA-N 294.395 2.338 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N[C@@H]3CCNC3)c2C)c1 127219799 UTXYHCDWZZENCO-OAHLLOKOSA-N 297.402 2.494 10 20 CECD C[C@H](N[C@H](C)[C@@H](C)N1CCOCC1)c1ccc(F)cc1O 185375858 NIPUSZWDPYICIS-FRRDWIJNSA-N 296.386 2.291 10 20 CECD C[C@@H](NCCN1CCC(N(C)C)CC1)c1ccccc1O 183544380 DMNDDVIVQONJHR-CQSZACIVSA-N 291.439 2.069 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1OCCc2ccccc21 182548462 NSWOIBYJLXAUFF-MRXNPFEDSA-N 299.326 2.028 10 20 CECD O=C1[C@@H](NCc2ccccc2O)CCN1C1CCCCC1 131593486 OMMNRCJLKXSGTO-HNNXBMFYSA-N 288.391 2.415 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCN[C@H]1C 92954121 BKFQCUQWGSKQFQ-XJKSGUPXSA-N 289.423 2.099 10 20 CECD COc1ccncc1CNCc1cccc(OC)c1O 292784311 UMQAFVHEMHIEID-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CO[C@@H](C)[C@H](C)NCc1ccc(N2CCOCC2)c(F)c1 268877904 QVFCRPANTAPWFV-STQMWFEESA-N 296.386 2.175 10 20 CECD C[C@H](N[C@H](C)c1nncn1C)c1ccc(F)c(F)c1O 276896655 INBQECQIBGRBQX-JGVFFNPUSA-N 282.294 2.211 10 20 CECD COC(=O)C(C)(C)CNCc1ccc(N(C)C)c(F)c1 272371821 BVHUDIDPRCPUBB-UHFFFAOYSA-N 282.359 2.181 10 20 CECD O=C1Nc2ccccc2[C@@]12CCN(Cc1ccccc1O)C2 375299754 MQOCKNOTUVPNGR-SFHVURJKSA-N 294.354 2.488 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](O)C(C)C 292215742 QGRQQCYILUQBGT-AWEZNQCLSA-N 265.353 2.148 10 20 CECD C[C@H](N[C@H]1CCc2cccc(O)c21)[C@@H](C)N1CCOCC1 297766274 OZZGNGZRFFHAOB-GUTXKFCHSA-N 290.407 2.078 10 20 CECD Cc1cc(CN(C)C[C@@H](O)C(F)(F)F)ccc1N(C)C 815080003 DESSQJDZUOLJGR-CYBMUJFWSA-N 290.329 2.416 10 20 CECD Cc1nc(CCNCc2cc(Cl)c(C)cc2O)n[nH]1 825469026 UAYYWSCFKGLOQI-UHFFFAOYSA-N 280.759 2.113 10 20 CECD COc1cccc(CNCc2cccc(C(=O)O)c2)c1O 820865136 AKJVLXRYJCNQHO-UHFFFAOYSA-N 287.315 2.389 10 20 CECD CCn1ccnc1[C@@H](C)NCc1c(O)cccc1OC 825006203 ZZBOJJDQXDAWNI-LLVKDONJSA-N 275.352 2.468 10 20 CECD C[C@@H](CC(=O)NCc1ccccc1O)C1CCNCC1 828016059 SMQUHALBHFPXQS-LBPRGKRZSA-N 276.380 2.034 10 20 CECD CCOc1ccc(N(C)C[C@H]2CCNC(=O)CC2)cc1 827873177 PJLWMSARAUABEZ-CYBMUJFWSA-N 276.380 2.438 10 20 CECD O=C(COC(=O)c1cc(O)cs1)NC1CCCCCC1 731909099 AFWCNSMBMRMJRZ-UHFFFAOYSA-N 297.376 2.450 10 20 CECD C[C@@H](NCCCSc1nccs1)c1cn(C)nn1 902808921 OAMDWHZNSOYTHW-SECBINFHSA-N 283.426 2.105 10 20 CECD C[C@@H](NC(=O)C(=O)Nc1ccc(N)cc1)C1CCCCC1 841048034 KFIQPZQYLUSIAK-LLVKDONJSA-N 289.379 2.292 10 20 CECD CCOc1ccc(CN[C@@H](C)[C@@H]2CCCNC2)c(O)c1 841033070 KABMCBQLZKZCAK-QWHCGFSZSA-N 278.396 2.269 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1c(O)ccc(Cl)c1F 843068471 KNYSXDIZUCYTJW-DTORHVGOSA-N 272.751 2.367 10 20 CECD CC1(C)[C@H](NC(=O)Nc2ccc(N)cc2)[C@H]2CCO[C@H]21 841299842 IVVSNMDYZZYVNV-JHJVBQTASA-N 275.352 2.204 10 20 CECD CCC[C@@H](C)S(=O)(=O)NCc1ccc(OC)cc1O 845927999 LGUVNJKKIZASCW-SNVBAGLBSA-N 287.381 2.009 10 20 CECD CC(=O)N1CCCN(Cc2ccc(N(C)C)cc2C)CC1 840909290 GJWYTQOVMBGRCN-UHFFFAOYSA-N 289.423 2.115 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H]2[C@H](C)CCN[C@@H]2C)c1O 842476090 GHKPCWVEZFYJPI-IQMDTDKHSA-N 294.370 2.210 10 20 CECD CN1CCCc2cc(CNC(=O)c3cncs3)ccc21 746811522 KALWRAOCWXNORS-UHFFFAOYSA-N 287.388 2.456 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](CN)C2)cc1F 843048560 HKJWSRVLSMMOBE-CQSZACIVSA-N 279.403 2.453 10 20 CECD COc1ccc2c(c1)CCCN2C(=O)/C=C\c1cn(C)cn1 929699607 BTOLLMAMDBSAEJ-YVMONPNESA-N 297.358 2.421 10 20 CECD CCc1cccc(CN2CCC[C@H](n3ccnn3)C2)c1O 848917701 JSSQVGNRKIMXCA-HNNXBMFYSA-N 286.379 2.383 10 20 CECD COc1cccc(O)c1CNCCc1ccc(N)cc1 841037777 XGWZNPUWOMPAKG-UHFFFAOYSA-N 272.348 2.315 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CCCN2)cc1 844166547 DRZZGBQYLBYHDW-INIZCTEOSA-N 289.423 2.243 10 20 CECD CCOC(=O)C(CC)(CC)NC(=O)c1cc(O)cs1 854609304 NYLUNGQUQUUELH-UHFFFAOYSA-N 285.365 2.305 10 20 CECD CO[C@H]1CCCN(C(=O)c2cc(O)cs2)CC1 753466382 DSELPCKNGHKXIG-JTQLQIEISA-N 255.339 2.095 10 20 CECD Cc1cc(NC(=O)c2cc(O)cs2)cnc1O 757921360 VOLUSGDYWLBACD-UHFFFAOYSA-N 250.279 2.115 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)c1cnn(C)n1 925082044 TXJKGVDDTLPSDM-GFCCVEGCSA-N 273.384 2.040 10 20 CECD C[C@H](N[C@@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 756770116 RTKOJPYYWDOGSD-GXSJLCMTSA-N 280.324 2.112 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@]1(C)CO 852701877 GPJNPSRCEIZMJC-CJNGLKHVSA-N 262.397 2.203 10 20 CECD C[C@@H]1C[C@H](NC/C=C\CO)c2c(O)ccc(F)c21 850507748 HPGJXTGHONBQET-WUIHGDLDSA-N 251.301 2.218 10 20 CECD CCOc1cncc(CNCc2ccc(OC)cc2O)c1 857040698 AKFMVIRIDJVQMV-UHFFFAOYSA-N 288.347 2.484 10 20 CECD CCOCCOCCN[C@H](C)c1c(O)cccc1F 927087788 UWFBRYKGGVHAJO-LLVKDONJSA-N 271.332 2.235 10 20 CECD Cc1nccn1CCNCc1cc(F)c(N(C)C)cc1F 858117501 QDSYAEBTLURTOT-UHFFFAOYSA-N 294.349 2.326 10 20 CECD Cn1cccc1CNCc1ccc(N2CCC(O)CC2)cc1 850406019 OLXWXXGVOYVJQJ-UHFFFAOYSA-N 299.418 2.276 10 20 CECD CON(C)CCN[C@@H](C)c1c(C)cc(C)cc1O 850478677 WMLYFHSUNBHPCN-LBPRGKRZSA-N 252.358 2.153 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc(=O)cc[nH]1 934706084 CMNCVTXJJIULCW-UHFFFAOYSA-N 286.331 2.133 10 20 CECD C[C@H](N[C@@H](CO)CC(F)F)c1cc(F)cc(F)c1O 760036934 GIKGDAYUAPUJOC-POYBYMJQSA-N 281.249 2.337 10 20 CECD CCOCC[C@@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 769790061 UHQOBAYFBBBMKR-CZUORRHYSA-N 280.412 2.191 10 20 CECD Cc1ccc(CN2CC[C@@H](C)[S@@](=O)CC2)c(O)c1 877476771 MWHNYQITGBLTMJ-XIKOKIGWSA-N 267.394 2.044 10 20 CECD CCn1nccc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773286367 WYLHARVGENXYOX-GFCCVEGCSA-N 286.379 2.460 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@](C)(O)C2)cc1 773822310 UNLWISYFEIZJFK-MRXNPFEDSA-N 262.397 2.490 10 20 CECD Cc1nn(C)c(NC(=O)/C=C/c2ccc(O)c(O)c2)c1C 779513544 HLNQMDAKAZJYCZ-FNORWQNLSA-N 287.319 2.100 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CN(C2CC2)C[C@@H]1C 877094191 IAGQRVDSDZSGDE-SWLSCSKDSA-N 260.381 2.273 10 20 CECD CCN(C)c1ccc(CN2CCSC[C@@H]2CO)cc1 773810864 CKLRFYZHOLFQBR-HNNXBMFYSA-N 280.437 2.052 10 20 CECD O=C(C=C1CCSCC1)NCc1ccccc1O 772801705 JETQMTVYYHCKRR-UHFFFAOYSA-N 263.362 2.462 10 20 CECD Oc1ccccc1CN=c1cc[nH]c2ccncc12 774523181 GQZOLFGKACLFQO-UHFFFAOYSA-N 251.289 2.369 10 20 CECD Cc1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n(C)n1 773023465 YINFFRLAZSFBGS-LBPRGKRZSA-N 286.379 2.286 10 20 CECD Oc1ccc(F)cc1CNCc1cccc(F)n1 779102327 JYYBMJSEJRLDGX-UHFFFAOYSA-N 250.248 2.355 10 20 CECD C[C@H](NCC1(CO)CCC1)c1c(O)cccc1F 886587882 HUJKGVPQVMOABG-JTQLQIEISA-N 253.317 2.345 10 20 CECD COCCCN(C)CCN[C@@H](C)c1c(O)cccc1F 886532885 QGOJRGFLFMZXMH-LBPRGKRZSA-N 284.375 2.150 10 20 CECD Cc1cc(CCNC(=O)[C@H](C)O)c(C)n1-c1ccccc1 786710320 YOWAHTTVZQIILZ-AWEZNQCLSA-N 286.375 2.134 10 20 CECD COCC1=CCN(Cc2ccc(OC)c(OC)c2O)CC1 893680626 ZNUCRFGWGHURQU-UHFFFAOYSA-N 293.363 2.188 10 20 CECD COCC(C)(C)NCc1cc(C)cc(OC)c1O 894217487 ADQGHFZQCWCUIW-UHFFFAOYSA-N 253.342 2.224 10 20 CECD COc1ccc(CNC[C@H]2CCC[C@H]2OC)c(O)c1OC 893285323 NATCHUWBJIPYSX-DGCLKSJQSA-N 295.379 2.314 10 20 CECD CC1CCC(NC(=O)CN(C)c2ccc(N)cc2)CC1 702064493 LNEVOGDDQQCINB-UHFFFAOYSA-N 275.396 2.400 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1cc(F)ccc1O 188494536 VNCAPQCYUJVBIB-VHSXEESVSA-N 268.332 2.049 10 20 CECD C[C@H](O)C[C@H](C)NCc1c(O)ccc(Cl)c1F 790986792 VFLIXGWTQTXCOJ-YUMQZZPRSA-N 261.724 2.434 10 20 CECD C[C@H](Oc1ccccc1)C(=O)NCc1ccccc1O 72051911 CEWYUWZXRUCZLV-LBPRGKRZSA-N 271.316 2.476 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@@H]1O 1204324908 PGVPQXWLDRVDJW-BBRMVZONSA-N 260.381 2.099 10 20 CECD COc1ccc(CNc2ncc(C)c(C)n2)c(O)c1 795285972 XAFCSZWLEDVHAW-UHFFFAOYSA-N 259.309 2.420 10 20 CECD CCN(CC)c1ccc(CNCC2OCCCO2)cc1 716351380 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WQGBWLIOMOVIMN-CYBMUJFWSA-N 260.341 2.245 10 20 CECD COC1(C(=O)NCc2ccc(N)cc2)CCCCC1 297237994 POHWQJACSKGEDZ-UHFFFAOYSA-N 262.353 2.234 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](C3OCCO3)C2)cc1 179365688 BHKUWECRHPNSHP-OAHLLOKOSA-N 290.407 2.338 10 20 CECD C[C@@H](NCc1cc[nH]n1)c1ccc(N2CCOCC2)cc1 66989829 SMSXTYBYARIVOC-CYBMUJFWSA-N 286.379 2.097 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)c2nnnn2C2CC2)c(O)c1 189114172 VBIDRMAAWCUABO-QWRGUYRKSA-N 287.367 2.434 10 20 CECD CSC[C@@](C)(O)CNCc1cccc(Cl)c1O 182430958 ZIGNBQKRYJNYIT-LBPRGKRZSA-N 275.801 2.249 10 20 CECD Cc1cnc2c(c1)N(C(=O)/C=C/c1cccnc1)CCO2 127121146 KNWJPQPSWJZZSJ-SNAWJCMRSA-N 281.315 2.224 10 20 CECD CSC[C@@H]1CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 181222557 ZOZWWTVFOZZOKQ-PZBABLGHSA-N 293.388 2.465 10 20 CECD Cn1cccc1C1=NN=C(Nc2ccccn2)SC1 128408458 YIILVFHXBKGBIR-UHFFFAOYSA-N 271.349 2.339 10 20 CECD CCN(C)C(=O)CN[C@H](C)c1cc2c(cc1O)CCCC2 186811923 DCOYOCCLXPECAV-GFCCVEGCSA-N 290.407 2.400 10 20 CECD C[C@H](O)[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1 92971139 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C[C@@H](NCc1ccc2c(c1)CCCN2C)[C@H]1CCCN1 817900617 OPWNDVQHCHIXFA-CZUORRHYSA-N 273.424 2.299 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc(F)c[nH]2)cc1F 815151389 NRLIXPNGYHICBZ-UHFFFAOYSA-N 279.290 2.289 10 20 CECD O=C(OCCC1CCOCC1)c1cc(O)cs1 814453969 XALPIJGGFPODBH-UHFFFAOYSA-N 256.323 2.427 10 20 CECD CN(Cc1ccccc1O)C(=O)c1nn(C)c2c1CCCC2 825481598 OQNITXSQOWAVOY-UHFFFAOYSA-N 299.374 2.277 10 20 CECD CC[C@@H]1CN(CC)CCN1Cc1cc(F)ccc1O 825005720 QLCANRQMLBIRDZ-CQSZACIVSA-N 266.360 2.447 10 20 CECD COc1ccc(N2CCN([C@@H]3CC[C@H](OC)C3)CC2)cc1 821386707 MXPTUYABFQFZDN-WBVHZDCISA-N 290.407 2.385 10 20 CECD CC1=C(C(=O)N[C@H](C)c2ccccc2O)C(=O)OC1(C)C 827930621 NJHBLQASHPQCTM-SNVBAGLBSA-N 289.331 2.221 10 20 CECD CCN(CCn1ccccc1=O)c1ccc(OC)cc1 726185129 ITQXMOHWLCDORS-UHFFFAOYSA-N 272.348 2.383 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)C1CCC1 820782567 OQHSFBDPPLTBJL-UHFFFAOYSA-N 296.436 2.457 10 20 CECD CC[C@@H](NCc1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H](C)O 824921552 NDUWEYRCTSFXAM-GMSGAONNSA-N 288.731 2.203 10 20 CECD C[C@H]1CC=C(C(=O)NCc2ccc(O)c(O)c2)CC1 836778288 VUNXAMFUYJQMPP-JTQLQIEISA-N 261.321 2.460 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@H](C)c1cc(F)ccc1O 834881025 YFPNTPITQMQABI-UEKVPHQBSA-N 283.343 2.233 10 20 CECD Oc1cccc2c1[C@@H](NC[C@@H](O)c1ccco1)CC2 834502164 NFZGTMGAVHOWCU-WCQYABFASA-N 259.305 2.296 10 20 CECD Cc1cc([C@](C)(O)CNC(=O)c2cc(O)cs2)c(C)o1 743517113 QBUUDUANHBCMGO-CQSZACIVSA-N 295.360 2.301 10 20 CECD C[C@@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(F)cc1O 846205627 IOHVYNZRNIQFFI-MNOVXSKESA-N 292.354 2.193 10 20 CECD C[C@H](N[C@H](C)c1ccc(Cl)cc1O)C(=O)N(C)C 841753786 WJSQPVHHQYUYLR-BDAKNGLRSA-N 270.760 2.173 10 20 CECD Cc1cc(CN(C)C2CCNCC2)ccc1N(C)C 923280335 XETBTERZVHCBSD-UHFFFAOYSA-N 261.413 2.245 10 20 CECD Nc1ccc(NC(=O)N2CCn3nc(C4CC4)cc3C2)cc1 926142505 JWOGHKISGXATLC-UHFFFAOYSA-N 297.362 2.390 10 20 CECD Cc1ccc(O)c(CNC(=O)NOCC(C)C)c1 858314556 UZXZKMOEZKUZQZ-UHFFFAOYSA-N 252.314 2.087 10 20 CECD COc1ccc(CNC(=O)NCc2ccc(C)o2)c(O)c1 868970278 YTTFCXBIAOEHNL-UHFFFAOYSA-N 290.319 2.302 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@H](C)c1cc(F)ccc1O 760886901 OTPJDYHDOLMNGW-WDBKCZKBSA-N 283.343 2.376 10 20 CECD CCOCC[C@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 769790057 UHQOBAYFBBBMKR-BBRMVZONSA-N 280.412 2.191 10 20 CECD CC1(C)CN(Cc2cc(Cl)cc(F)c2O)CCN1 775665973 PIQPZCQSFGGARS-UHFFFAOYSA-N 272.751 2.369 10 20 CECD Cc1cc(C(=O)NC2(C)COC2)c(C)n1-c1ccccn1 870664025 ZCHWEOMCYZIMMS-UHFFFAOYSA-N 285.347 2.008 10 20 CECD COC(=O)C[C@@H](NC(=O)c1cc(O)cs1)C(C)(C)C 889171705 BTNUQGNNFPCHJF-SNVBAGLBSA-N 285.365 2.161 10 20 CECD C[C@H](NCc1cc(Cl)cc(F)c1O)c1ncnn1C 789595402 UFAVXNHBKXNFMD-ZETCQYMHSA-N 284.722 2.164 10 20 CECD C[C@H](N[C@H](CO)C[C@@H]1CCCO1)c1c(O)cccc1F 886672933 XIEVMJPWMVLAND-SRVKXCTJSA-N 283.343 2.112 10 20 CECD COc1cc(C)cc(CN(C)[C@@H]2CC(C)(C)OC2=O)c1O 894850469 IRPQFEDUKBGTNI-GFCCVEGCSA-N 293.363 2.235 10 20 CECD Oc1c(F)cc(F)cc1CN1CC[C@@H](n2cccn2)C1 894816836 WTYIKXYJDVLTNK-GFCCVEGCSA-N 279.290 2.314 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCCCS1 272833517 FSTGKNDYYXYJQW-ZDUSSCGKSA-N 281.377 2.042 10 20 CECD COc1ccc(CNCc2scnc2C)c(O)c1OC 892919675 CETCDPHPUMIIDK-UHFFFAOYSA-N 294.376 2.464 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1cc(C)ccc1O 185467068 RMQAWVNUUXPQNI-IUODEOHRSA-N 267.369 2.139 10 20 CECD COc1ccc(O)c(CNCc2ncccc2C)c1 71339544 IBWQJCRAVRDGRH-UHFFFAOYSA-N 258.321 2.394 10 20 CECD C[C@H](N[C@H](C)c1cc(F)cc(F)c1O)C(=O)N1CCCC1 798936242 ANMJJBCBUXDUEK-ZJUUUORDSA-N 298.333 2.332 10 20 CECD C[C@H](NC(=O)CCc1cnccn1)c1ccc(N(C)C)cc1 793856349 PRPLKUKSDQHPSG-ZDUSSCGKSA-N 298.390 2.353 10 20 CECD OC[C@H](CC(F)F)NCc1c(O)cccc1Cl 717713313 LWKFPPQJZHYKHX-ZETCQYMHSA-N 265.687 2.151 10 20 CECD C[C@H](CCO)NCc1ccc(Br)cc1O 691405461 UTWRCUVTCOGPSO-MRVPVSSYSA-N 274.158 2.015 10 20 CECD COc1cccc(O)c1CN(C)CC1(N(C)C)CCC1 783743363 BWKIBAOJWXIFJD-UHFFFAOYSA-N 278.396 2.317 10 20 CECD NC[C@H]1CN(Cc2ccc(N)cc2)CC[C@H]1C(F)(F)F 1337838937 VZAQQGOVFUFFNX-WCQYABFASA-N 287.329 2.228 10 20 CECD CC(C)[C@@H]1C[C@@H](NC(=O)NCc2ccc(N)cc2)CCO1 1335546101 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841044676 XNPJGYNHCRBVPW-AWEZNQCLSA-N 290.436 2.307 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](C)[C@@H]2CN)c1O 843353398 HIPLHNNOIJZURT-BMIGLBTASA-N 294.370 2.293 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)CC[S@](C)=O)c1O 846152850 FBHJHVPEBZCGTE-ADWYPQAOSA-N 285.409 2.209 10 20 CECD COc1ccc(O)c(CNC[C@H]2CC[C@H](CN)CC2)c1 841083173 PHNZUVPTDVTKBI-JOCQHMNTSA-N 278.396 2.256 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)CC[C@H]1N 843052216 PLMIXPLVQROOPZ-PRHODGIISA-N 272.751 2.354 10 20 CECD CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(Cl)cc1O 841745312 XHHWYAKLABWUSS-IUCAKERBSA-N 270.760 2.221 10 20 CECD C[C@@](O)(CNC(=O)c1cc(O)cs1)c1ccsc1 740937562 OLWXCZLHPNLDGH-GFCCVEGCSA-N 283.374 2.153 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCNC(=O)[C@H]1C(C)C 840915018 ZADCHUBGMXVOEH-MRXNPFEDSA-N 289.423 2.017 10 20 CECD CCN(CC)c1ccc(CN[C@H](CN)C2CC2)cc1F 841028218 MGKLDRVVINASFY-OAHLLOKOSA-N 279.403 2.499 10 20 CECD CCN1C(=O)/C(=C/c2cncc(OC)c2)SC1=S 849175815 WQSVHACTYQHNOW-YHYXMXQVSA-N 280.374 2.311 10 20 CECD CCc1cccc(CN[C@@H]2CCN(C(C)(C)C)C2=O)c1O 848919826 SYNYRZPPOVPURU-CQSZACIVSA-N 290.407 2.444 10 20 CECD COC[C@H](O)CCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756780235 XSJQCOYRFFDSGM-FOGDFJRCSA-N 283.343 2.067 10 20 CECD CCC(CC)(C(=O)O)C(=O)NCc1ccc(N(C)C)cc1 920251557 CCMKROBBRWHARL-UHFFFAOYSA-N 292.379 2.260 10 20 CECD Cc1cc(CN(C)[C@H]2CCNC2=O)c(O)c(C(C)(C)C)c1 758398232 IHFMWYOCBBSOOV-AWEZNQCLSA-N 290.407 2.318 10 20 CECD Cc1cnccc1CNC[C@@H](N)c1ccc(N(C)C)cc1 863641428 BRPGGGNSUHPVJL-QGZVFWFLSA-N 284.407 2.246 10 20 CECD C[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@@]1(C)CO 862418025 KCLMVKZOZUOQNN-BZNIZROVSA-N 298.377 2.481 10 20 CECD Cc1ccc(CNCCCCN2CCC[C@H]2CO)c(O)c1 877041943 PLIGVHCAFHTXRT-INIZCTEOSA-N 292.423 2.027 10 20 CECD c1cc2c(cc1CNCc1cc3c(cn1)OCCO3)CCO2 876996226 PVJDHUOMYDEXCX-UHFFFAOYSA-N 298.342 2.078 10 20 CECD C[C@H](Cn1cccn1)N[C@H](C)c1c(O)cccc1F 886543186 LMZNOCFXWFOUHW-GHMZBOCLSA-N 263.316 2.467 10 20 CECD Oc1ccc(Cl)cc1CNCC1(O)CCCC1 96479017 VVQBEKZRQKHRCA-UHFFFAOYSA-N 255.745 2.440 10 20 CECD CC[C@@H]1CN(C(=O)NCc2ccc(N)cc2)[C@H](CC)CO1 1120677072 IKDQDAAESXDAFK-HUUCEWRRSA-N 291.395 2.368 10 20 CECD COc1ccc(CN2CCC[C@@H]2C)c(O)c1OC 892020622 ZSUGGZLYTBOHHN-JTQLQIEISA-N 251.326 2.394 10 20 CECD COc1ccc(CNCCNC(=O)[C@H](F)C(C)C)cc1C 1132556146 BHJCOEAYJJFMAV-OAHLLOKOSA-N 296.386 2.204 10 20 CECD COc1ccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2C3)c(O)c1 794377670 TZSONGCRFQCXDW-MJVIPROJSA-N 275.348 2.453 10 20 CECD CN(C)[C@H]1CCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 1327676391 WYXSPCRBLKUMRD-KBPBESRZSA-N 293.367 2.263 10 20 CECD CC(C)n1ccc(CNC(=O)NCc2ccc(N)cc2)n1 1336975315 MPVQJVBMODAJGT-UHFFFAOYSA-N 287.367 2.046 10 20 CECD CSCC(C)(C)NC(=O)NCCc1ccc(N)cc1 1336907178 RDRPCUKUPNMLMV-UHFFFAOYSA-N 281.425 2.252 10 20 CECD CSC[C@H](O)CNCc1ccc(N2CCCCC2)cc1 1336704905 XRXJIPQWBBVCDX-MRXNPFEDSA-N 294.464 2.490 10 20 CECD CC(C)OCC(=O)Nc1c(Cl)ccc2nonc12 1342951821 NEDQMTRDRPLNMB-UHFFFAOYSA-N 269.688 2.240 10 20 CECD Cc1ocnc1-c1nnc(N(C)Cc2ccccc2O)n1C 1262926311 AKFFRSYJLZTKII-UHFFFAOYSA-N 299.334 2.121 10 20 CECD C[C@@]1(NC(=O)NCc2ccc(N)cc2)CCO[C@@H]1C1CC1 1262603756 ULSJGTRTPPBHPW-GDBMZVCRSA-N 289.379 2.026 10 20 CECD CC[C@H]1C[C@H](C(=O)NCc2ccc(N)cc2)CCO1 1356228217 POOIDAJHVYLEGX-OCCSQVGLSA-N 262.353 2.090 10 20 CECD Cc1ccc(CN2C[C@@H]3CCC[C@H]3[C@@H]2C(=O)O)c(O)c1 1600413669 VTGFUSQWIFXYIW-NJZAAPMLSA-N 275.348 2.386 10 20 CECD CC1(C)[C@@H](NCc2ccc3c(c2)CCO3)[C@@H]2CCCN[C@H]21 1576388739 AVPKSBIEBUKEEZ-OIISXLGYSA-N 286.419 2.488 10 20 CECD CC[C@@H](NC1CC(C)C1)c1cccc(-c2nn[nH]n2)c1O 1590467053 QDPCGUGFVUQKAC-SRHKJQAYSA-N 287.367 2.412 10 20 CECD COc1cc(CN(C[C@@H](C)C(=O)O)C2CC2)c(O)cc1C 1599406655 JTUHFZYEHKCHQL-LLVKDONJSA-N 293.363 2.394 10 20 CECD CNC(=O)[C@H]1CCCCN1Cc1cccc(Cl)c1O 124536782 UFCNHUKJAYRUFL-GFCCVEGCSA-N 282.771 2.146 10 20 CECD CS(=O)(=O)N(Cc1ccccc1O)C1CCCCC1 151224922 LYVJAZMLHJYXLU-UHFFFAOYSA-N 283.393 2.487 10 20 CECD CC(=O)c1cc(F)cc(CN2CCO[C@@H](C)[C@H]2C)c1O 156367406 RFURAEGLFNIJKG-KOLCDFICSA-N 281.327 2.343 10 20 CECD Nc1ccc(CC(=O)NC[C@H]2Cc3ccccc32)cc1 37566171 VORKISUPXHPZQG-CQSZACIVSA-N 266.344 2.267 10 20 CECD CCC[C@@]1(NCc2cc3c(cc2O)OCO3)CCOC1 285564408 RULSCZLUDWUEHX-OAHLLOKOSA-N 279.336 2.170 10 20 CECD Oc1ccccc1CNCC1CCC2(CC1)OCCO2 193162263 WDMRISPYZNZMCM-UHFFFAOYSA-N 277.364 2.415 10 20 CECD OCC[C@H](N[C@H]1CCc2cccc(O)c21)C(F)(F)F 886802873 AKPQQEQVCVQNKK-ONGXEEELSA-N 275.270 2.282 10 20 CECD Cc1cccc(NS(=O)(=O)c2cccc3nonc23)c1 212882 HMWHBHVEAXUNOI-UHFFFAOYSA-N 289.316 2.332 10 20 CECD C[C@H](O)CN[C@H](C)c1ccc(Br)cc1O 134899609 AUKPKTLUXGEFII-JGVFFNPUSA-N 274.158 2.186 10 20 CECD Cc1ccc(O)c(CN2CCNC(=O)[C@H]2CC(C)C)c1 188920572 AIEAFWDBHUDISF-CQSZACIVSA-N 276.380 2.047 10 20 CECD CC[C@@H](NCC(=O)NCC1CC1)c1ccc(N(C)C)cc1 181290722 QYXSHEHBVDVWSB-MRXNPFEDSA-N 289.423 2.320 10 20 CECD C[C@H](NCc1ncn(C)n1)c1cc(Cl)ccc1O 186214028 ROMWEEJVIWZENA-QMMMGPOBSA-N 266.732 2.025 10 20 CECD CCCCOC(=O)CN[C@@H](C)c1cc(OC)ccc1O 182431119 GMVTXBFARFMHCJ-NSHDSACASA-N 281.352 2.395 10 20 CECD COC(=O)COc1ccc(N(C)CC[C@H]2CCCO2)cc1 189925626 QFZJLXJZXUFNCR-CQSZACIVSA-N 293.363 2.244 10 20 CECD COCCN(C)CCCN[C@@H](C)c1cc(OC)ccc1O 185008571 BQYNPKNTEAQQPM-ZDUSSCGKSA-N 296.411 2.020 10 20 CECD CN1CC[C@H]2[C@@H](CCCN2Cc2cc(F)ccc2O)C1 290649392 YZNPDKXCKXZZIA-WFASDCNBSA-N 278.371 2.447 10 20 CECD COCCN1[C@@H](C)CN(Cc2cc(C)ccc2O)C[C@H]1C 93479190 MCUAVWGONWZAIM-GASCZTMLSA-N 292.423 2.242 10 20 CECD C[C@@H]1C[C@H](CNC(=O)N(C)Cc2ccccc2O)CCO1 271491388 FOCCDGYRNQJJOO-CHWSQXEVSA-N 292.379 2.349 10 20 CECD CC(=O)CCCC(=O)N1CCOc2cc(N(C)C)ccc21 273301402 ZSLZTISMRXLFTE-UHFFFAOYSA-N 290.363 2.237 10 20 CECD CC[C@H]1CN(Cc2cc(C)ccc2O)C[C@H](C)S1(=O)=O 289966748 YUYJVHRIPCQRHV-JSGCOSHPSA-N 297.420 2.098 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c1 280574171 WCOFVRXRIBNDPG-GRDNDAEWSA-N 291.391 2.469 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCC(CF)CC1 295551111 DPVDGZKNEUTVLG-UHFFFAOYSA-N 271.263 2.059 10 20 CECD COc1ccc(O)c(CNc2cnnc(O)c2Cl)c1 811806480 ZAIMYPCRZIKYLY-UHFFFAOYSA-N 281.699 2.162 10 20 CECD Cc1c(C)n(C)c2ccc(OC(=O)CCc3nc[nH]n3)cc12 817761351 LNQJSLUHPAUQEH-UHFFFAOYSA-N 298.346 2.451 10 20 CECD CCOC(=O)C[C@H](NCc1ccccc1O)C(F)(F)F 827005661 IFDUSUCKTBWJLN-NSHDSACASA-N 291.269 2.366 10 20 CECD CCN(CC)c1ccc(CN2CCCN(C=O)CC2)cc1 827877644 RTEWKYCDZDCEGJ-UHFFFAOYSA-N 289.423 2.197 10 20 CECD CCN(C)c1ccc(CN2CCC(C(=O)O)CC2)cc1 737841247 HDKWQSKCZFWHOU-UHFFFAOYSA-N 276.380 2.439 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cc(OC)ccc2O)[C@H]1SC 838948541 UDVCEJSMYQOADF-BPLDGKMQSA-N 297.420 2.399 10 20 CECD CC[C@H](N[C@H](C)c1cc(F)cc(F)c1O)[C@@H](C)O 834888403 OUJUKAOTNFMWRC-RWYTXXIDSA-N 259.296 2.480 10 20 CECD CC(C)(O)C(C)(C)CNC(=O)/C=C/c1ccc(O)c(O)c1 837093866 JQNKDDNLMGZVHQ-SOFGYWHQSA-N 293.363 2.024 10 20 CECD O=C(O)c1ccc2c(c1)CN(C(=O)c1cc(O)cs1)C2 740201217 UTRZDQUNAMBVKZ-UHFFFAOYSA-N 289.312 2.308 10 20 CECD CCn1nc(C)c(CNCCc2ccc(N)cc2)c1C 841034437 BCQBWFJFBMSOPZ-UHFFFAOYSA-N 272.396 2.434 10 20 CECD C[C@@]1(C(=O)NCc2ccc(O)cc2O)CC=CCC1 910945400 UYHZIXSWJOWNTM-OAHLLOKOSA-N 261.321 2.460 10 20 CECD CCOc1ccc(O)c(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)c1 843060219 YEJMOBGIXJVJQV-APHBMKBZSA-N 290.407 2.350 10 20 CECD CCc1cccc(CN2CC[C@H](C)C[C@H]2C(N)=O)c1O 848904262 OSBXTBHFYIUPQA-FZMZJTMJSA-N 276.380 2.040 10 20 CECD CC1CCN(c2ccc(CN=c3nc[nH]n3C)cc2)CC1 846750620 XFVDRMIDOQCVEW-UHFFFAOYSA-N 285.395 2.085 10 20 CECD COc1ccc(CN[C@H](CCN)C(F)(F)F)cc1C 841089908 BRUPOSBTITWLSL-GFCCVEGCSA-N 276.302 2.373 10 20 CECD CCNC(=O)CN(C)Cc1cc(C(C)C)c(C)cc1O 747073939 KCKQMITYJVGGIQ-UHFFFAOYSA-N 278.396 2.392 10 20 CECD Cc1nc(CNC[C@H](N)c2ccc(N(C)C)cc2)cs1 841042431 JOKYHRMRGWPTJA-HNNXBMFYSA-N 290.436 2.307 10 20 CECD CC(C)NC(=O)[C@H](C)NCc1cc(Cl)cc(F)c1O 840975468 YNTCISQMXNQYRK-QMMMGPOBSA-N 288.750 2.187 10 20 CECD Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1cc(O)cs1 759464204 FBELZAPPWJPMNH-GFCCVEGCSA-N 291.376 2.473 10 20 CECD CC(C)(C)c1cnc(Sc2nccn3nnnc23)s1 759715505 WQIOOLWABMZKIE-UHFFFAOYSA-N 292.393 2.425 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@](C)(O)C(C)C)c1 756578030 VLHVNGMOKWALDJ-BZNIZROVSA-N 295.379 2.236 10 20 CECD CCOC1CCN(Cc2cc(OC)ccc2O)CC1 132468317 OLSNJQYLQKRHKN-UHFFFAOYSA-N 265.353 2.402 10 20 CECD Cc1cccc(O)c1CN(C)Cc1ncnn1CC(F)F 877482007 AJKVJEMCPNKNRW-UHFFFAOYSA-N 296.321 2.189 10 20 CECD COc1ccc(N2CC[C@H](CNCc3ccon3)C2)cc1 873132510 WJIXAGFHNJHHHX-CYBMUJFWSA-N 287.363 2.299 10 20 CECD COC[C@H](C)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773276320 KQJUMRRSNPNLME-CHWSQXEVSA-N 293.411 2.395 10 20 CECD CC(C)Nc1ccccc1NCc1nnnn1C1CC1 871847865 YMFLCUXKCJXHAD-UHFFFAOYSA-N 272.356 2.440 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccncc2C)c1 771417986 OZDKYAJONPNDRX-UHFFFAOYSA-N 272.304 2.034 10 20 CECD C[C@H](NC(=O)c1cncc(O)c1)c1ccc(N(C)C)cc1 776269607 LMTUANQGXSBVOL-NSHDSACASA-N 285.347 2.344 10 20 CECD Cc1cccc(O)c1CN1CCC(NC(=O)C(C)C)CC1 876578796 BLHVMMQBFFAKOO-UHFFFAOYSA-N 290.407 2.437 10 20 CECD CCN(Cc1ccc(C)cc1O)C[C@@H](O)C(F)(F)F 877429418 XYJBBKLTLLPQFT-GFCCVEGCSA-N 277.286 2.446 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@@H]1C(=O)NCCc1ccc(N)cc1 884028518 JDGRRFWDBGQXOG-MEDUHNTESA-N 298.390 2.017 10 20 CECD Oc1ccccc1CN=c1[nH]ccnc1C(F)F 385696776 ISGOHRYRZPAAJW-UHFFFAOYSA-N 251.236 2.154 10 20 CECD O=C(O)C[C@H](CNCc1ccc2c(c1)CCCO2)C(F)F 1120087435 INPFQGWOEJVQIV-GFCCVEGCSA-N 299.317 2.457 10 20 CECD N[C@@H](CC1CC1)C(=O)NCc1c(O)ccc2c1CCCC2 884315051 FBCFXGWDPSXPRK-HNNXBMFYSA-N 288.391 2.015 10 20 CECD CC[C@H](C(=O)NCc1ccc2c(c1)CCCN2C)[C@@H](C)O 789964078 SHTLYKSSXAAYIJ-DOMZBBRYSA-N 290.407 2.092 10 20 CECD Cc1cccc(O)c1CNCC(=O)N1CCc2ccccc21 895488783 UGXMVSUQHVELBB-UHFFFAOYSA-N 296.370 2.380 10 20 CECD COc1ccc(CNCCNC(=O)C[C@@H]2C[C@@H]2C)cc1C 1133357362 XEJDDESSABZSTA-WFASDCNBSA-N 290.407 2.256 10 20 CECD C[C@@]1(O)CCN(Cc2ccc(N3CCCC3)cc2)C1 1204323706 HUPGOYRPLGIAKI-MRXNPFEDSA-N 260.381 2.244 10 20 CECD OC[C@H]1C[C@H](NCc2ccc3ccccc3c2O)C1 897357332 IPGVHJOSPRYDQK-YEORSEQZSA-N 257.333 2.406 10 20 CECD CC[C@H](N[C@H]1CCCN(C)C1=O)c1ccc(F)cc1O 796790600 SJRPIJGMEPBHTP-STQMWFEESA-N 280.343 2.193 10 20 CECD CC(C)N(CCNC(=O)c1c(F)ccc(O)c1O)C(C)C 790065078 HPTDAKKNRFQJCL-UHFFFAOYSA-N 298.358 2.086 10 20 CECD C[C@@H]1CC[C@H](NCc2ccc(Br)cc2O)CN1 1246341646 BLZIIHOGVRATCZ-SKDRFNHKSA-N 299.212 2.385 10 20 CECD O=C(C[C@H]1CCCO1)Nc1c(Cl)ccc2nonc12 1324859267 SRIGTTXGTLIOQL-SSDOTTSWSA-N 281.699 2.384 10 20 CECD CC[C@@H](CSC)NC(=O)NCc1ccc(N)cc1 1336238413 CRKSQQXCIAMJJV-LBPRGKRZSA-N 267.398 2.210 10 20 CECD COC/C(C)=C\CN1CCCc2cc(CN)ccc21 1578954872 WRJNLBCCGQPCMR-QPEQYQDCSA-N 260.381 2.491 10 20 CECD COc1cc(C)cc(CNC2(CC(=O)O)CCC2)c1O 1599391941 HFPGVZUMAITOPI-UHFFFAOYSA-N 279.336 2.196 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(F)c(F)c1 156633303 DXPANISMCMPMFM-UHFFFAOYSA-N 293.269 2.349 10 20 CECD CCn1nccc1CN[C@@H]1CCc2cccc(O)c21 853242020 ZENNSFVTJMGHOP-CYBMUJFWSA-N 257.337 2.386 10 20 CECD CSC[C@@H]1CCCN(C(=O)c2cccc(O)c2O)C1 294701218 QZCJEXMFFMIWDZ-SNVBAGLBSA-N 281.377 2.313 10 20 CECD COc1ccc(CN[C@H]2C[C@@H](OC)C23CCC3)c(O)c1 713480346 HRFXCZQJGRTXCJ-LSDHHAIUSA-N 277.364 2.448 10 20 CECD CCCCOCCNC(=O)NCc1cccc(OC)c1O 174401799 DQLLOGYIYHFFBJ-UHFFFAOYSA-N 296.367 2.017 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCO1 179861894 NADLGRPHGXECJV-QMMMGPOBSA-N 286.715 2.175 10 20 CECD CN(C)C(=O)c1ccc(NC(=O)Cc2ccc(N)cc2)cc1 66153967 GBLJFXIFAHIADG-UHFFFAOYSA-N 297.358 2.152 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)c1nnc2n1CCC2 37363552 VNDKEQHTTLJZON-LLVKDONJSA-N 284.363 2.010 10 20 CECD Cc1cncc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)c1 186384278 ZVDAXEQTHQADFA-NSHDSACASA-N 286.331 2.162 10 20 CECD COc1ccc(O)c([C@H](C)NCCCN2CCCC2=O)c1 182346012 KYDMPVGVCOTKHC-LBPRGKRZSA-N 292.379 2.064 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CC1=CCCOC1 154913089 AAOJUZGPVNWPQY-UHFFFAOYSA-N 274.364 2.298 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)COCC(C)C)c1 182316514 JPOQTBSSIIEDJQ-QWHCGFSZSA-N 297.395 2.085 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2snnc2C)c1 190512151 OPHRVWHLGIQBHN-ZETCQYMHSA-N 293.348 2.052 10 20 CECD CC(C)C[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 43434292 TXWYWYBJXGVTFI-CYBMUJFWSA-N 263.337 2.210 10 20 CECD O=C(NC[C@H]1[C@H]2c3ccccc3C[C@H]21)c1cccc(O)c1O 193138265 HGFLDTDVMMWBPT-LZWOXQAQSA-N 295.338 2.414 10 20 CECD C[C@H](CO)CCCNCc1ccc(N2CCOCC2)cc1 230160444 YNPUQUMMDCVLCU-HNNXBMFYSA-N 292.423 2.021 10 20 CECD COC[C@H](C)CC(=O)N1CCOc2cc(N(C)C)ccc21 446030281 VCJBCSLHBFAMGR-GFCCVEGCSA-N 292.379 2.151 10 20 CECD C[C@H](N[C@H]1CCSC1)c1cc([N+](=O)[O-])ccc1O 273488179 NRSLSBMMOUYCMF-IUCAKERBSA-N 268.338 2.457 10 20 CECD C[C@H](N[C@H]1CCO[C@H]1C)c1ccc(F)c(F)c1O 276894757 IGBWSPNDGRUOPH-LAEOZQHASA-N 257.280 2.498 10 20 CECD OCCCC1CCN(Cc2cc3c(cc2O)OCO3)CC1 272977938 UEOWPMHAHPTAQK-UHFFFAOYSA-N 293.363 2.105 10 20 CECD CCCN(CC(=O)N(C)C)Cc1ccc(N(C)C)c(C)c1 293625582 WJYNFAFUMZBRJK-UHFFFAOYSA-N 291.439 2.361 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(N)CCC2)cc1F 296112146 SKZZJGVWOZVEFH-UHFFFAOYSA-N 293.386 2.170 10 20 CECD CC(=O)C(=O)COc1ccc(F)cc1Br 808016064 VDJWVRXDPAYQTD-UHFFFAOYSA-N 275.073 2.125 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@H]2CCCN2)cc1F 292104153 OSVBKIHMSVCEBQ-CYBMUJFWSA-N 293.386 2.040 10 20 CECD CO[C@H]1COCC[C@@H]1CNCc1cc(Cl)ccc1O 824708397 GCLBFIPHHSRGFR-YGRLFVJLSA-N 285.771 2.187 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCCN1C 734557536 HKPDNIURJGNALO-INIZCTEOSA-N 289.423 2.162 10 20 CECD O=C(NCc1ccccc1O)NCC1CCSCC1 733645784 NBPCSESMHJKWJQ-UHFFFAOYSA-N 280.393 2.335 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1[C@@H]2CCC(=O)[C@@H]12 907059291 IVZWIUZVAZKBOB-DQYPLSBCSA-N 299.370 2.112 10 20 CECD Cc1ccc(O)c(CNc2cc(C)cn(C)c2=O)c1 902254713 ABHJZYLCFRRWIH-UHFFFAOYSA-N 258.321 2.320 10 20 CECD CC[C@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C)O1 732301705 GTDGNVRAKDBQDW-SCZZXKLOSA-N 255.339 2.093 10 20 CECD COc1cc(O)c(CN2CCC[C@H](CO)[C@@H]2C)cc1OC 840979894 VKSDWLJPABONDV-NWDGAFQWSA-N 295.379 2.002 10 20 CECD Oc1cc2c(cc1CN[C@H]1COCc3ccccc31)OCO2 841891328 OHIXOCQUYVKNMX-AWEZNQCLSA-N 299.326 2.482 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCN1C1CC1 846474564 VDLFJDHAAJEAQE-ZDUSSCGKSA-N 294.782 2.289 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCN[C@H](C)C2)c1O 841061224 HCBSJSHTXICCGT-BXKDBHETSA-N 284.787 2.284 10 20 CECD C[C@H]1C[C@H](CN)CN1Cc1c(O)ccc(Cl)c1F 843058858 ZPQHOUWNHZZWPV-DTWKUNHWSA-N 272.751 2.354 10 20 CECD C[C@@H]1C[C@H](CN)CN1Cc1cc(Cl)cc(F)c1O 843056881 BIJRZTCMVKMMQT-RKDXNWHRSA-N 272.751 2.354 10 20 CECD CCN(C)c1ccc(CN2CC3CC2(C(=O)O)C3)cc1 849344439 MHGCZEOIOZEXCK-UHFFFAOYSA-N 274.364 2.192 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@]2(CCNC2)C1 843120458 LHMJBZWZAXFEPZ-KRWDZBQOSA-N 273.424 2.246 10 20 CECD CC[C@@H](C)[C@@H](C(=O)OC)N(C)Cc1ccccc1O 929975642 HUEHEBDYNXVNJH-RISCZKNCSA-N 265.353 2.412 10 20 CECD CN(C)c1cc(F)c(CNCC(C)(C)N(C)C)cc1F 858086425 HZGGDOVLHIYGFK-UHFFFAOYSA-N 285.382 2.461 10 20 CECD C[C@@H](NCCO[C@@H]1CCOC1)c1cc(F)cc(F)c1O 927081881 YAWXVNYTFRGSPO-MWLCHTKSSA-N 287.306 2.127 10 20 CECD CN1CCC[C@H](CNCc2cc(F)c(N(C)C)cc2F)C1 858132193 VZURBURXGJJFMY-GFCCVEGCSA-N 297.393 2.462 10 20 CECD COC(=O)/C=C(\C)CN(C)c1ccc(OC)c(F)c1 929827019 QELBAXURNQLTJU-JXMROGBWSA-N 267.300 2.390 10 20 CECD C[C@@H]1COC[C@H]1NCc1ccc2c(c1)CCCN2C 699460942 CMTQYQZNNBSGCB-IUODEOHRSA-N 260.381 2.194 10 20 CECD COc1cc(CN2CCC[C@@H](N(C)C)C2)c(O)cc1C 768446388 NOFGUVBOHGNCJR-CQSZACIVSA-N 278.396 2.235 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)COC(F)(F)F 932942407 CZVIFNKOWPAYRH-UHFFFAOYSA-N 290.285 2.214 10 20 CECD CNC[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1118242038 VAJAKFOPJPQYOE-INIZCTEOSA-N 273.424 2.328 10 20 CECD CN(C(=O)c1ccnc(C2CC2)n1)c1ccc(N)cc1 877078486 RFEFUPFISKXOPZ-UHFFFAOYSA-N 268.320 2.213 10 20 CECD CCOc1ccc(CN[C@@H]2CCCC[C@H]2O)c(O)c1 775360996 OIODVUCGXNQCOH-ZIAGYGMSSA-N 265.353 2.184 10 20 CECD CCC1(CC)[C@@H](NC(=O)c2cccc(O)c2O)C[C@@H]1OC 776678324 SQGPWJOCDHNRRY-STQMWFEESA-N 293.363 2.421 10 20 CECD CN1CCN(c2ccc(/C=C\c3ccncn3)cc2)CC1 771527164 FTUSBYWLFQYNDQ-DJWKRKHSSA-N 280.375 2.399 10 20 CECD C[C@H](NC[C@H](O)C1CCC1)c1c(O)cccc1F 886621987 HNHWJOUUVWFANO-ZANVPECISA-N 253.317 2.343 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1c(O)cccc1F 886598576 FMJCOEZPEQBLEX-VHSXEESVSA-N 268.332 2.049 10 20 CECD C[C@H]1C[C@H](O)CN1Cc1cc(Br)ccc1O 788269415 NITHILVXFLXPDM-KWQFWETISA-N 286.169 2.110 10 20 CECD CCCCN(CCO)Cc1cc(C)cc(OC)c1O 893878061 QFMGNFPYCGSVPO-UHFFFAOYSA-N 267.369 2.304 10 20 CECD COC[C@H]1CN(CCN=[N+]=[N-])C[C@@H]1C(F)(F)F 409436247 YVYPBCLQDNOEBE-SFYZADRCSA-N 252.240 2.053 10 20 CECD C[C@@H](CN(C)C)NCc1ccc(N2CCCC2)cc1 168670175 HOWKVTKNHMBXOT-AWEZNQCLSA-N 261.413 2.327 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)c1ncnn1C 276443260 IYRYOOPIIBSDFQ-QMMMGPOBSA-N 266.732 2.025 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)c1ccc(O)nn1 796771972 NNYJHVSPMHEMDK-LBPRGKRZSA-N 286.379 2.407 10 20 CECD C[C@@H](Oc1ccccc1)C(=O)NCc1ccccc1O 72051912 CEWYUWZXRUCZLV-GFCCVEGCSA-N 271.316 2.476 10 20 CECD Cc1nnc(NCc2ccc(N(C)C)cc2)nc1C 772611733 MZPIALQTVCQRJR-UHFFFAOYSA-N 257.341 2.167 10 20 CECD CCn1nnnc1N(Cc1ccco1)Cc1ccccc1O 1335328611 WWKFOPMHBRANPO-UHFFFAOYSA-N 299.334 2.198 10 20 CECD Nc1ccc(CN2CCC(C(=O)N3CCCC3)CC2)cc1 1336116940 ILTOUWVBPGNZIJ-UHFFFAOYSA-N 287.407 2.103 10 20 CECD Nc1ccc(CNC[C@H]2NCCc3ccccc32)cc1 1345159346 GNUJYKDHMKATFL-QGZVFWFLSA-N 267.376 2.245 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@@H]3C[C@H]3C2)cc1F 1350479962 MLVKIBXOVRLDKI-OLZOCXBDSA-N 291.370 2.443 10 20 CECD Cc1cc(CC(=O)OCC(=O)O)c(C)n1-c1ccccc1 1607635631 DVYPRXIQUAFFSF-UHFFFAOYSA-N 287.315 2.264 10 20 CECD CC(C)[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)O 1609943257 MLIKXZJSBKAHBV-QPUJVOFHSA-N 282.296 2.060 10 20 CECD CC(C)CCO[C@H](C)C(=O)NCCc1ccc(O)c(O)c1 156729028 RZJHHNGSRMGLKL-GFCCVEGCSA-N 295.379 2.208 10 20 CECD Cc1ccc([C@H](C)NC[C@@]2(O)CCSC2)c(O)c1 185639130 WKHGAAJWXDBJEL-FZMZJTMJSA-N 267.394 2.219 10 20 CECD C[C@@H](NC[C@H](O)C1CCC1)c1ccc(F)cc1O 316068305 ZJCHXHWVTRURBC-OTYXRUKQSA-N 253.317 2.343 10 20 CECD COc1cccc(CN[C@@H]2COC(C)(C)C2)c1O 396560426 WGLLALQNLLEBIQ-NSHDSACASA-N 251.326 2.058 10 20 CECD CCc1cccc(CN(C)Cc2nccn2C)c1O 821982769 MPOKZCFVJGNDGO-UHFFFAOYSA-N 259.353 2.320 10 20 CECD COc1cccc(CNC[C@H](c2ccco2)N(C)C)c1O 20122236 JKYUSFLZHBGFFM-CYBMUJFWSA-N 290.363 2.386 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2Cc3ccccc3O2)c1 173580570 XCNJCIVCTVOZME-MRXNPFEDSA-N 299.326 2.021 10 20 CECD Nc1ccc(CC(=O)NCC2CCSCC2)cc1 156899108 UEQXVAWMSHSQPA-UHFFFAOYSA-N 264.394 2.071 10 20 CECD CCCN(Cc1ccccc1O)C(=O)COCC 136976877 ALPJNNMPRAANNQ-UHFFFAOYSA-N 251.326 2.167 10 20 CECD C[C@H](O)CCN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 268877618 KTNWCLICJFPSPF-QWHCGFSZSA-N 296.386 2.084 10 20 CECD CC1(C)CN(CCNCc2c(O)cccc2Cl)CCO1 264946659 IXCGYEGHKZVPFR-UHFFFAOYSA-N 298.814 2.246 10 20 CECD CO[C@H](C)[C@H](C)NCc1ccc(N2CCOCC2)c(F)c1 268877902 QVFCRPANTAPWFV-QWHCGFSZSA-N 296.386 2.175 10 20 CECD C[C@H](NCC1(C(N)=O)CCCC1)c1ccccc1O 272888033 SCJFVQAYBGWELS-NSHDSACASA-N 262.353 2.089 10 20 CECD CC[C@H](C)NC(=O)CN(CC)c1ccc(OC)cc1 299343472 FMWVQETUVHVELK-LBPRGKRZSA-N 264.369 2.436 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1ccon1 816822147 ANLRMSZQSUXXCP-UHFFFAOYSA-N 287.363 2.332 10 20 CECD COCC1(CN[C@H](C)c2ccc(C)cc2O)CCNCC1 817975685 XTYXRRPRGAXEME-CQSZACIVSA-N 292.423 2.367 10 20 CECD CN(C)c1ccc(CNCCC(C)(C)C(=O)O)cc1F 818629079 NZOAYMVELDITPY-UHFFFAOYSA-N 282.359 2.482 10 20 CECD C[C@H](N[C@@H]1CCc2cccc(O)c21)[C@@H]1CCCNC1 817947502 OTMHCDQAECZQQF-IACUBPJLSA-N 260.381 2.357 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1n[nH]cc1C 810146668 URNIEGZYSGAMJR-UHFFFAOYSA-N 258.369 2.382 10 20 CECD C[C@H](CCCCN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 817976653 QMZIPGNAQRSQFA-GHMZBOCLSA-N 281.356 2.469 10 20 CECD Cc1cc(O)c(CNCC2([S@@](C)=O)CC2)cc1Cl 825773741 OUQIISHAXPLDNK-GOSISDBHSA-N 287.812 2.355 10 20 CECD CC(=O)C(=O)COc1c(C(C)=O)cccc1C(F)(F)F 829538827 FZDVCMNUQVDYQU-UHFFFAOYSA-N 288.221 2.445 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccnc1 588403696 WEXOTYMWLNRDHU-XQRVVYSFSA-N 256.261 2.145 10 20 CECD CN(C)c1ccc(/C=C/CNCC(C)(C)C(=O)O)cc1 901507524 XTGVEYJFDOBZFT-AATRIKPKSA-N 276.380 2.466 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H](N2CCCC2)C1 733806345 ZGVZHPVXMJWJGG-NSHDSACASA-N 280.393 2.154 10 20 CECD C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccccn1 588406118 WVKMUTOEOSYBAC-BPOWMSRESA-N 284.315 2.383 10 20 CECD CCOc1ccc(O)c([C@H]2NC3(CCCC3)C(=O)N2C)c1 731854573 ZXFKMXMEGZOCKD-AWEZNQCLSA-N 290.363 2.164 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cccc(Cl)c1O 844937957 QZRULSRIYCGCKA-SNVBAGLBSA-N 257.717 2.341 10 20 CECD COc1cc(CN2[C@H]3CC[C@H]2COC3)c(O)cc1C 840161859 MVIWCRGGAUYYCV-STQMWFEESA-N 263.337 2.072 10 20 CECD CC[C@]1(CO)CCCN1C(=O)Nc1ccc(N)cc1 841296166 PLGMDDBHQMSFJT-CQSZACIVSA-N 263.341 2.038 10 20 CECD C[C@@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1(C)C 841088002 WWNGAUXSJZIJTP-LLVKDONJSA-N 289.379 2.102 10 20 CECD CC[C@H](NCc1cccc(OC)c1O)[C@@H](O)C(C)C 840968132 VTOWULYUKAARKP-JSGCOSHPSA-N 267.369 2.286 10 20 CECD O=C(O)CN(Cc1cccc(Cl)c1O)C1CCC1 848639702 JSEKSNFIUKLCIU-UHFFFAOYSA-N 269.728 2.485 10 20 CECD N[C@@H]1CCC[C@@H]2CN(Cc3cccc(F)c3O)C[C@@H]21 843059280 JBZZVXGKYFFZAD-SCDSUCTJSA-N 264.344 2.091 10 20 CECD CC(C)N(C(=O)NCCc1ccc(N)cc1)C1CC1 841959669 ZKZHNQLUOOKBEM-UHFFFAOYSA-N 261.369 2.394 10 20 CECD O=C1NC2(CCN(Cc3cc(Cl)ccc3O)CC2)CO1 753588088 ZSFFLVZUGJFCNQ-UHFFFAOYSA-N 296.754 2.120 10 20 CECD CCN(CC)c1ccc(CNC(=O)N2CC(F)C2)cc1 753113462 PIAUQFDZPAUGGK-UHFFFAOYSA-N 279.359 2.396 10 20 CECD CC(C)(C)OC(=O)N1CCO[C@@H](CN=[N+]=[N-])CC1 1898242715 FJECMHXKGJIDPR-SECBINFHSA-N 256.306 2.323 10 20 CECD COCC[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 756524589 HJNQXPOOINVAKD-VHSXEESVSA-N 268.313 2.376 10 20 CECD CCO[C@H](CC(=O)NCCc1ccc(O)c(O)c1)C(C)C 762274643 JNDWTBUVLRKHAL-OAHLLOKOSA-N 295.379 2.208 10 20 CECD CC(C)[C@H]1C[C@H](C(=O)NCc2ccc(O)c(O)c2)CCO1 934944964 WSTNVNIWJMZJAE-IUODEOHRSA-N 293.363 2.165 10 20 CECD CC[C@H](NCCS(C)(=O)=O)c1cc(Cl)ccc1O 775496592 JUAIRPSCFOXECO-NSHDSACASA-N 291.800 2.131 10 20 CECD COCCN1[C@@H](C)CN(Cc2ccc(C)cc2O)C[C@H]1C 877606102 OMHPWIKHROAIJE-GASCZTMLSA-N 292.423 2.242 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)O[C@]2(CCO[C@@H]2C)C1 877487084 UQZVMEZTZKNZEF-JJRVBVJISA-N 291.391 2.469 10 20 CECD Cc1cccc(O)c1CN1CCN(c2ccccn2)CC1 876528021 PBWCYTVTSDQVTM-UHFFFAOYSA-N 283.375 2.418 10 20 CECD CC[C@@H](O)CCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776239945 SLGQWUFBERWASL-IUODEOHRSA-N 293.411 2.274 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCN(CC(F)F)C1 883147454 VUXARQNEUBHQAJ-SNVBAGLBSA-N 292.276 2.099 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@@H]1C(=O)Nc1ccc(N)cc1 884009133 MXEHBNGJSHNKIY-YMTOWFKASA-N 270.336 2.297 10 20 CECD COCCSCCCOC(=O)c1cc(O)cs1 783608389 PWJJICUFEFGVGL-UHFFFAOYSA-N 276.379 2.380 10 20 CECD CC[C@H](O)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881378158 HGUOOYUNPOAAPC-HNNXBMFYSA-N 274.368 2.144 10 20 CECD CN1C[C@@H]2CCCN(Cc3cc(F)cc(F)c3O)[C@@H]2C1 895055699 VRQFTTHZWWYROZ-IINYFYTJSA-N 282.334 2.196 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H]1C[C@@H](N)C1 892563450 WIFZKEXWNKGCHO-XBXGTLAGSA-N 291.395 2.051 10 20 CECD CN(C)c1ccc(CNCC(C)(C)CCO)cc1 80535645 UTZOTIIQJMZXIP-UHFFFAOYSA-N 250.386 2.251 10 20 CECD COc1ccc(CNCc2cccc(OC)c2O)c(O)c1 793389098 VPDFWBAHRIXFBO-UHFFFAOYSA-N 289.331 2.405 10 20 CECD CC(C)(CNC(=O)c1cc(O)cs1)CN1CCCC1 792520533 DMADBTDUJHWCSI-UHFFFAOYSA-N 282.409 2.306 10 20 CECD C[C@H](Cc1cnn(C)c1)NCc1ccc2c(c1)CCO2 768404075 USQNUELOECQGPQ-GFCCVEGCSA-N 271.364 2.076 10 20 CECD C[C@H](N[C@H]1CCn2ccnc2C1)c1ccc(F)cc1O 779063684 CAHNFQXJBWPBHJ-JQWIXIFHSA-N 275.327 2.393 10 20 CECD Oc1ccc2ccncc2c1CN1C[C@H]2CC[C@H]1[C@@H](O)C2 1337233827 CPDCKCCMSPTGDW-KCTSRDHCSA-N 284.359 2.286 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 1334909495 UISAHHWIORBBTO-IATRGZMQSA-N 290.407 2.428 10 20 CECD Nc1ccc(CNC(=O)CCc2ccc3c(c2)CCO3)cc1 1356239146 OJOIKJYDUXDUBT-UHFFFAOYSA-N 296.370 2.453 10 20 CECD CC1(C)C[C@H](NC(=O)NCc2ccc(N)cc2)CCO1 1353379440 ZSNVPUSUIDIAPL-CYBMUJFWSA-N 277.368 2.026 10 20 CECD COCC[C@H](C)N[C@H](C)c1cc(C(=O)O)ccc1O 1606852356 ITEPQQHMWBLBIH-VHSXEESVSA-N 267.325 2.166 10 20 CECD CO[C@@H]1CCN(Cc2cc(Cl)ccc2O)[C@H](C(=O)O)C1 1610238126 TZVRKBJJFBBDQZ-NEPJUHHUSA-N 299.754 2.110 10 20 CECD CC(C)(C)OC(=O)NCCNCc1ccc2c(c1)CCO2 121642643 WMFDARWNBFHGRC-UHFFFAOYSA-N 292.379 2.236 10 20 CECD CC(C)(C)C[C@H](NC(=O)c1cc(O)cs1)C(=O)O 1589751106 IFWGECWXKJQOMQ-QMMMGPOBSA-N 271.338 2.073 10 20 CECD C[C@H](NC[C@@H]1C[C@H]1C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589965535 JGUSKKVWKLRCPH-CHIMOYNISA-N 299.378 2.269 10 20 CECD Oc1c(CNCCC2=CCNCC2)ccc(F)c1F 1580886005 URIAUFDXJPXQNC-UHFFFAOYSA-N 268.307 2.070 10 20 CECD CCC[C@H](CCO)CNCc1cccc(OC)c1O 231391936 FDTGMITVKDLDDA-GFCCVEGCSA-N 267.369 2.289 10 20 CECD CC[C@H](C)[C@@H](NCc1cc(F)cc(F)c1O)C(=O)O 1776687520 ZAKCOFXJLAZHJA-WRWORJQWSA-N 273.279 2.259 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(C#N)[nH]2)c1 153916576 GYQKZWNKSLSUGK-VIFPVBQESA-N 285.303 2.092 10 20 CECD CCCn1nccc1CNCc1cccc(OC)c1O 825915984 GKRNBWDRJJIDHH-UHFFFAOYSA-N 275.352 2.297 10 20 CECD CC(C)CO[C@H]1CCN(C(=O)Cc2ccc(N)cc2)C1 236640982 AZANVSQFXIAAAT-HNNXBMFYSA-N 276.380 2.085 10 20 CECD C[C@@H]1C[C@H](C(=O)O)CN(Cc2cc(F)cc(F)c2O)C1 708090174 PANVFOMRVBENCZ-SCZZXKLOSA-N 285.290 2.213 10 20 CECD COCC(COC)N[C@H](C)c1cc(C)ccc1O 388402841 PPVQUOXLYGRNJE-LLVKDONJSA-N 253.342 2.013 10 20 CECD CNC[C@@H]1CCCN1Cc1cc(Cl)ccc1O 133023888 MPGDRGUTAABVCN-LBPRGKRZSA-N 254.761 2.229 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCCO1 20208533 IEBBKHYDBSJTRF-YOEHRIQHSA-N 290.407 2.180 10 20 CECD Cc1cc(O)c(C(C)C)cc1NS(=O)(=O)c1c[nH]cn1 123909540 PVNLXDATJAOTIL-UHFFFAOYSA-N 295.364 2.348 10 20 CECD O=C(NCCCF)NCc1ccc(N2CC=CC2)cc1 120611154 NQTZVDMXYDLWGD-UHFFFAOYSA-N 277.343 2.222 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(F)cn1 180944980 QNFRGXIFEHDRCG-QHHAFSJGSA-N 274.251 2.284 10 20 CECD CN1CCN(Cc2cccc(Cl)c2O)C(C)(C)C1=O 180420474 XYDAZKICLNQKEU-UHFFFAOYSA-N 282.771 2.098 10 20 CECD COc1cccc([C@H](O)CNCc2ccccc2O)c1 134521945 BCPHWVBLRISSPF-MRXNPFEDSA-N 273.332 2.224 10 20 CECD O=C(NCCCNc1ccccc1)c1cccc(O)c1O 187070261 LITVMBOLBMIFHD-UHFFFAOYSA-N 286.331 2.330 10 20 CECD C[C@H]1CCCC[C@H]1OCCNC(=O)c1cccc(O)c1O 186944738 YNHTVGKMSJAHIJ-SMDDNHRTSA-N 293.363 2.423 10 20 CECD O=C(O)[C@@H]1[C@H]2CCC[C@@H]2CN1Cc1ccccc1O 229240208 WMYDXHOLOBUQMB-OSMZGAPFSA-N 261.321 2.077 10 20 CECD CCC[C@@](C)(NCc1cc(OC)ccc1O)C(=O)O 86732497 MBYNBPRFNLJOQA-CQSZACIVSA-N 267.325 2.134 10 20 CECD Nc1ccc(CC(=O)N2CCCC[C@H]2c2cn[nH]c2)cc1 237882357 DDXYMCOUOXUBBA-HNNXBMFYSA-N 284.363 2.288 10 20 CECD CN(C)c1ncccc1CNCc1ccccc1O 237066531 LDADXKOLWMPILH-UHFFFAOYSA-N 257.337 2.143 10 20 CECD Cc1c(CNC(=O)c2cncnc2)n(C)c2ccccc12 348666007 KYSFMSNICOCIAA-UHFFFAOYSA-N 280.331 2.207 10 20 CECD CO[C@@H]1[C@H](C)[C@@H](NC(=O)NCc2ccccc2O)C1(C)C 271979419 PVDGHFIMBQMDOU-LERXQTSPSA-N 292.379 2.251 10 20 CECD Cc1ccc(O)c(CNC(C)(C)c2nc(C)no2)c1 283968465 KZDZWMOMBHXEMT-UHFFFAOYSA-N 261.325 2.417 10 20 CECD COc1cc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])cc1OC 294910182 FPJCLFLVTPGNET-OCAPTIKFSA-N 288.250 2.108 10 20 CECD CSC[C@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 295294403 JQHYFXURMAFXNV-VIFPVBQESA-N 299.367 2.452 10 20 CECD CCCN(CC)CC(=O)N(C)Cc1ccc(N(C)C)cc1 299341525 ALMVAUJVUHDQKT-UHFFFAOYSA-N 291.439 2.443 10 20 CECD CC(C)[C@@H]1NCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 290158707 LTMAFXWMRVIMGF-HOTGVXAUSA-N 289.423 2.003 10 20 CECD CCNCC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 818608247 WBTAREKKGZXATG-UHFFFAOYSA-N 277.412 2.099 10 20 CECD CCOc1ccc(CN2C[C@H](C)C[C@@H](CO)C2)c(O)c1 817412576 MVWFCQXTLISADQ-CHWSQXEVSA-N 279.380 2.241 10 20 CECD C[C@@H](CN)CN[C@@H](C)c1ccc(Br)cc1O 817963018 QFUTXYMEFYOXBG-IUCAKERBSA-N 287.201 2.400 10 20 CECD Cc1nonc1CNCc1cc(Cl)c(F)cc1O 816611290 MAUVCZWIDTZXJI-UHFFFAOYSA-N 271.679 2.166 10 20 CECD COc1ccc(O)c(CNc2nnc(C3CC3)o2)c1 811806160 KLFXFUCXSTZDRM-UHFFFAOYSA-N 261.281 2.273 10 20 CECD Cc1nocc1CN(C)c1ccc(OCC(=O)O)cc1 902014941 ASNPGCCMHKNVFQ-UHFFFAOYSA-N 276.292 2.083 10 20 CECD O=C(O)[C@@H]1CN(C(=O)c2cc(O)cs2)c2ccccc21 739613951 MEXOGQZHDWAHRS-SNVBAGLBSA-N 289.312 2.282 10 20 CECD CC(C)NCCC(=O)NCc1c(O)ccc2c1CCCC2 830597532 MXXBDBQTQRGNJD-UHFFFAOYSA-N 290.407 2.275 10 20 CECD CCOCCOCCCC(=O)N(C)Cc1ccccc1O 830140954 KVUJDWISYMBHAZ-UHFFFAOYSA-N 295.379 2.184 10 20 CECD CC(C)CN(Cc1cnn(C)c1)C(=O)c1cc(O)cs1 839792095 GSMIKXBHZBPRFF-UHFFFAOYSA-N 293.392 2.486 10 20 CECD C[C@H](NC[C@@H]1CCCN1CCCO)c1cc(F)ccc1O 834850761 OYOJBXJYAGGTKU-JSGCOSHPSA-N 296.386 2.029 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)CC2CCC2)cc1 832267093 MVOVYFHYFBFSQN-OAHLLOKOSA-N 275.396 2.059 10 20 CECD Cc1ccc(C(=O)N(C)[C@@H](CO)CC(C)(C)C)c(O)c1O 836972095 OCZZPTUOHPQUGW-LLVKDONJSA-N 295.379 2.275 10 20 CECD O=C(c1cc2cc(O)c(O)cc2s1)N1CCCCN1 908157153 LNTOCPROXVBTKP-UHFFFAOYSA-N 278.333 2.053 10 20 CECD C[C@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(Cl)cc1O 841752973 DHIWAEPOJAKDHW-ATZCPNFKSA-N 282.771 2.350 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2C[C@H](F)CN2)cc1F 841079653 OANRWYLLTBKKEI-KBPBESRZSA-N 297.393 2.462 10 20 CECD CCOCCCN(C)CCN(C)c1ccc(OC)cc1 844402086 UMDCNEKFODAWKW-UHFFFAOYSA-N 280.412 2.490 10 20 CECD CCc1cccc(CN(C)[C@H](CO)COC(C)C)c1O 848911503 GGCWJAOMAFKGKO-OAHLLOKOSA-N 281.396 2.172 10 20 CECD COC(=O)/C=C(\C)CSc1ncc(C(=O)OC)s1 917777517 JCVLYYWFNCMENU-QPJJXVBHSA-N 287.362 2.141 10 20 CECD Cc1cc(Br)c(O)c(CN(C)CCCN)c1 843050610 LYKFMTIIUGOXKG-UHFFFAOYSA-N 287.201 2.244 10 20 CECD C[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)CS1 840276683 MVWDCKJAXUJFKS-KOLCDFICSA-N 266.366 2.085 10 20 CECD Cc1cc(Br)cc(CN(C)C2CC(N)C2)c1O 843125263 QEBBCNFBGFKJGO-UHFFFAOYSA-N 299.212 2.385 10 20 CECD CCOCCCOC(=O)/C=C\c1ccc(O)c(O)c1 759592870 BBAZBCVXRHOTJF-ALCCZGGFSA-N 266.293 2.081 10 20 CECD CONC(=O)NCc1cc(C)n(-c2ccccc2)c1C 858907298 CCZKUIRAIRIJFW-UHFFFAOYSA-N 273.336 2.455 10 20 CECD CC(C)CC[C@@H](CO)NC(=O)/C=C\c1ccc(O)c(O)c1 862778167 DKQVNMJHHOFYDR-UJZCVKTISA-N 293.363 2.024 10 20 CECD CCOc1ccc(CN2CCOC[C@H]2C2CC2)c(O)c1 769485385 PWELTUXIAWRNPB-HNNXBMFYSA-N 277.364 2.402 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@@H]2CCC(=O)[C@@H]2C)c1 862756127 QVUNYRZUYWMNFN-NEPJUHHUSA-N 275.348 2.322 10 20 CECD CCOc1ccc(O)c(CN[C@H](CO)C(C)(C)C)c1 1116812083 WTYJLDJXZDKLSS-CQSZACIVSA-N 267.369 2.288 10 20 CECD C[C@@H](NC(=O)NCCC(C)(C)O)c1ccc(N(C)C)cc1 773613406 QRJUZUJWNMFPHY-GFCCVEGCSA-N 293.411 2.274 10 20 CECD CS[C@H](C)CCC(=O)NCCc1ccc(O)c(O)c1 773471453 SOWIWOXZCVNOMO-SNVBAGLBSA-N 283.393 2.288 10 20 CECD CNCc1cn(Cc2ccc(N3CCCCC3)c(C)c2)nn1 881381494 AXJKAASXMXFLMN-UHFFFAOYSA-N 299.422 2.345 10 20 CECD COC[C@@H](CO)N[C@@H](C)c1cccc(C(F)(F)F)c1O 788804551 IRIGGKJPLKMNEH-DTWKUNHWSA-N 293.285 2.069 10 20 CECD CN1CCCc2cc(CNC(=O)N3C[C@H]4C[C@H]4C3)ccc21 888004889 APLNSUGHHAAMLJ-GASCZTMLSA-N 285.391 2.230 10 20 CECD OC[C@@H]1Cc2ccccc2N1Cc1cc2c(cc1O)OCO2 895243636 AFUPWHBCWYFCJR-ZDUSSCGKSA-N 299.326 2.045 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 896963192 WBXLZBVYRWPRIM-CYBMUJFWSA-N 294.370 2.277 10 20 CECD Cc1noc2ncc(NC(=O)c3cccc(O)c3O)cc12 790773636 RUVPEXPOXRNINP-UHFFFAOYSA-N 285.259 2.195 10 20 CECD O=C(Nc1ccc2c(c1)CCO2)c1cccc(O)c1O 192975500 INPOKMZNZKNOGM-UHFFFAOYSA-N 271.272 2.285 10 20 CECD CN(C)c1ccc(CNC(C)(C)CC(=O)O)cc1 737376755 WYMQABRMFLPWKB-UHFFFAOYSA-N 250.342 2.096 10 20 CECD C[C@@H](NCCCSc1nccs1)c1ccc(O)nn1 796773088 YYEPCGHLPBBIOU-SECBINFHSA-N 296.421 2.472 10 20 CECD COc1cccc(O)c1CN1CCO[C@@H](C(C)C)C1 779149231 CITHFFBHAUCQJF-OAHLLOKOSA-N 265.353 2.258 10 20 CECD CC[C@@H](F)C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 1335961795 MYBIRGVCNGNLPE-SWLSCSKDSA-N 294.370 2.386 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@H]1CCCCCN1 1353511962 CCODRFRLOYVBBQ-CQSZACIVSA-N 291.395 2.066 10 20 CECD CCN(CC)[C@H]1CCN(C(=O)Nc2ccc(N)cc2)C1 110380162 XQZLRSLGLNJYTO-AWEZNQCLSA-N 276.384 2.217 10 20 CECD COc1cc(C)c(CN2CC[C@H]3CC[C@@H](C2)N3)c(O)c1 1579144361 BURNPHFDTURLFK-OLZOCXBDSA-N 276.380 2.036 10 20 CECD CS[C@@H]1CC[C@@H](NCc2cc3c(cc2O)OCO3)C1 230696804 OXLWITISXQRVJC-GHMZBOCLSA-N 281.377 2.495 10 20 CECD Cc1ccc(O)c(CNc2cc(-c3nn[nH]n3)cc(C)n2)c1 1592185869 FFJFLZJESXKCKX-UHFFFAOYSA-N 296.334 2.196 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1COc2ccccc21 134789865 VTBBVXWFOZIQDL-CYBMUJFWSA-N 269.300 2.185 10 20 CECD CCCc1nccn1CC(=O)c1ccc(O)c(O)c1 158150917 WCCXXVPLASSZCI-UHFFFAOYSA-N 260.293 2.130 10 20 CECD COc1cc(O)c(CN(C)Cc2nccs2)cc1OC 160339853 PIQFYLVZEFHSFE-UHFFFAOYSA-N 294.376 2.498 10 20 CECD CC(C)N1CCC[C@@H](CNC(=O)Cc2ccc(N)cc2)C1 166350765 YMIFNPKIKMPABI-HNNXBMFYSA-N 289.423 2.048 10 20 CECD COc1ccc(C(=O)NCc2ccccc2O)c(F)c1 82293996 PLMUBPLLVZDKTK-UHFFFAOYSA-N 275.279 2.470 10 20 CECD CO[C@@H](C1CC1)[C@@H](C)NCc1cc2c(cc1O)OCO2 388208345 FCWAJWYMPQJABG-RFAUZJTJSA-N 279.336 2.024 10 20 CECD Cc1cnc(C(=O)NCc2ccc(N(C)C)cc2C)cn1 115282291 OTTLZDLQPZNUBR-UHFFFAOYSA-N 284.363 2.089 10 20 CECD Cn1cccc1C1=NN=C(NCCc2ccccn2)SC1 171046819 NGBHYQKLNZIVKU-UHFFFAOYSA-N 299.403 2.059 10 20 CECD COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@H]3F)CC2)cc1 1348487397 LMVQYSQARVWNBD-HUUCEWRRSA-N 292.354 2.092 10 20 CECD Cc1cccc(CN2CCC[C@H](CCC(N)=O)C2)c1O 179905071 DRODICFFAYYELT-CYBMUJFWSA-N 276.380 2.178 10 20 CECD CCc1ncsc1C(=O)NCCc1ccc(O)c(O)c1 122796507 IRXGAYLJRGBDJC-UHFFFAOYSA-N 292.360 2.089 10 20 CECD CC[C@H]1CCCCN1CCNC(=O)c1cccc(O)c1O 187091526 KEDIIYMBFGKJIV-LBPRGKRZSA-N 292.379 2.092 10 20 CECD CN(CCc1ccccn1)C(=O)/C=C/c1ccc(O)c(O)c1 180749654 OYVPAFWBBGEUHV-SOFGYWHQSA-N 298.342 2.207 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)c(O)c1 185317980 PXPFIGTYLHINSK-WCQYABFASA-N 286.379 2.266 10 20 CECD CN(C)C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 125489200 FPNCWNYEDWOWPG-CQSZACIVSA-N 279.403 2.275 10 20 CECD CCOC(=O)N1CC[C@@H](N[C@H](C)c2cc(F)ccc2O)C1 186456440 NRAYLTUKMVDDST-ZYHUDNBSSA-N 296.342 2.413 10 20 CECD Oc1ccccc1CNC[C@]1(O)CCc2ccccc21 132108585 FPVNSADWQZDMAU-QGZVFWFLSA-N 269.344 2.316 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@H](N)C(C)(C)C 136891806 YFCUMYZBNHAMQU-ZDUSSCGKSA-N 264.369 2.114 10 20 CECD Cc1c(C)n(C)c2ccc(OCC(=O)NC3CC3)cc12 421194987 HJEFSVIEBLMXDN-UHFFFAOYSA-N 272.348 2.453 10 20 CECD CO[C@H]1C[C@H](NCc2cc(F)ccc2O)C1(C)C 226613509 GFCYOCWAXQRSML-STQMWFEESA-N 253.317 2.434 10 20 CECD Cc1cc(O)c(CN2CCOC[C@]23CCOC3)cc1C 195015278 NNERZTILEQTRBJ-MRXNPFEDSA-N 277.364 2.000 10 20 CECD Cc1ccc(O)c(CNc2ncn(CC(F)(F)F)n2)c1 195169656 JQHLPUDJIXBMCY-UHFFFAOYSA-N 286.257 2.467 10 20 CECD CNCCNC(=O)c1cc(C)n(-c2ccc(F)cc2)c1C 237106666 VMRRIDWPUILXJE-UHFFFAOYSA-N 289.354 2.182 10 20 CECD CN(C)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 298841401 HTEVVJZZRVPULJ-UHFFFAOYSA-N 261.369 2.399 10 20 CECD CCCNC(=O)CN(CC)c1ccc(OC)c(OC)c1 299298984 XUSLOUMRUSLQMP-UHFFFAOYSA-N 280.368 2.056 10 20 CECD CCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)C[C@@H](C)OC 291105870 SCVCCTFNHRRPPQ-SNVBAGLBSA-N 298.339 2.166 10 20 CECD CC[C@@H](NCC1(CC(N)=O)CC1)c1ccc(F)cc1O 817587174 VRTVWFBKCNIFMW-GFCCVEGCSA-N 280.343 2.228 10 20 CECD Cc1cc(Br)cc([C@H](C)N[C@@H](C)CN)c1O 817970417 VBHDUXMXQCNFIH-IUCAKERBSA-N 287.201 2.461 10 20 CECD CCOc1ccc(CN2CC[C@@H](n3cccn3)C2)c(O)c1 812780322 ACRCPZNIYQPBDY-CQSZACIVSA-N 287.363 2.434 10 20 CECD Cc1cc(Br)cc([C@H](C)N[C@@H]2CCNC2)c1O 817944986 QUYBGIWGOTXVMP-GXSJLCMTSA-N 299.212 2.476 10 20 CECD COc1ccc(N2CCC(NC(=O)C3CC3)CC2)cc1 726562153 HFGCCPQHGODCDL-UHFFFAOYSA-N 274.364 2.190 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)Cc2cnn(C)c2)c1 825045563 HBNFKRPAMFZQTD-RYUDHWBXSA-N 289.379 2.416 10 20 CECD CCn1cnc(C(=O)NCc2ccc(N(C)C)c(F)c2)c1 824669019 BRYWUKZATKLRNI-UHFFFAOYSA-N 290.342 2.038 10 20 CECD CCc1cccc(C(=O)NCc2cccc(OC)c2O)n1 825703136 KESSYVQCNDJECX-UHFFFAOYSA-N 286.331 2.288 10 20 CECD Cc1ccnc([C@@H](C)NC(=O)c2cc(O)cs2)n1 823703480 JDCGLPHNXRBHKO-MRVPVSSYSA-N 263.322 2.043 10 20 CECD COc1ccnc(COC(=O)c2cc(O)cs2)c1 732353065 LJIMDQOVNWPGGT-UHFFFAOYSA-N 265.290 2.214 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 843056808 AICTXFDFMZVADI-DTWKUNHWSA-N 272.751 2.354 10 20 CECD CC[C@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841011927 XATXSBBURXODFY-SMDDNHRTSA-N 289.379 2.292 10 20 CECD C[C@@H](NCC[C@]1(O)CCCOC1)c1ccc(N(C)C)cc1 846214250 LJEDTOAZYSDCRG-RHSMWYFYSA-N 292.423 2.335 10 20 CECD COc1cccc([C@H](C)NCCc2nnc(C)s2)c1O 846174053 WJKDOSFFDRWRDD-VIFPVBQESA-N 293.392 2.454 10 20 CECD C[C@@H](C(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1O 840396493 PZMSOKFHPDJABY-LLVKDONJSA-N 293.363 2.328 10 20 CECD CCc1cccc(CN2CCOC[C@H]2[C@@H]2CCCO2)c1O 848910159 HLEDPOZKDFLBJP-HOTGVXAUSA-N 291.391 2.334 10 20 CECD COc1cc(O)c(CN[C@H]2CS[C@H](C)C2)cc1OC 840958829 OLZJOGMFWYKJHO-MWLCHTKSSA-N 283.393 2.393 10 20 CECD CC(C)(C)N1CC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1=O 842882259 PPJFXOYLJKDBQV-CHWSQXEVSA-N 288.391 2.369 10 20 CECD Cc1nc(CCN[C@H](C)c2ccc(Cl)cc2O)n[nH]1 841753982 OWGXGICWCBKZIO-MRVPVSSYSA-N 280.759 2.365 10 20 CECD C[C@H](NCc1cccc(F)c1O)[C@@H]1CCCNC1 841032716 FNZLQYLFLNTKFS-WDEREUQCSA-N 252.333 2.009 10 20 CECD Nc1ccc(NC(=O)NC2CCN(CC3CC3)CC2)cc1 841301355 MCGZGNRYWVKRNI-UHFFFAOYSA-N 288.395 2.265 10 20 CECD Cc1cc(N(C)C)ccc1CN=c1nc[nH]n1C(C)(C)C 840883530 FABURWRNLXASIL-UHFFFAOYSA-N 287.411 2.442 10 20 CECD COC(=O)N1CCC[C@@H](N[C@H](C)c2ccc(F)cc2O)C1 756526075 FHFUHPJQTOYGGO-ZYHUDNBSSA-N 296.342 2.413 10 20 CECD OC[C@@H](C[C@@H]1CCCO1)NCc1ccc2c(c1)CCCO2 922341572 SEYRQVJKKMUDJF-CVEARBPZSA-N 291.391 2.031 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H](C(=O)O)C1CCCC1 852947576 LTMWBKKLTAPZME-AWEZNQCLSA-N 291.347 2.242 10 20 CECD c1cc2c(cc1CN[C@@H]1[C@H]3OC[C@H]4C[C@@H]1C[C@@H]43)CCO2 924899446 FUCIVZHYRFDJEQ-BJMQQELFSA-N 271.360 2.135 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2(C(C)C)COC2)c1 934940544 OUDWAGRHVXUKGW-NSHDSACASA-N 293.363 2.251 10 20 CECD C[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C[C@@H]1CO 862425496 YEBQUKAOYPJWKF-DGCLKSJQSA-N 298.377 2.481 10 20 CECD CCCCN(CC(N)=O)Cc1cc(F)c(N(C)C)cc1F 862228616 SZBZELYONGQAKV-UHFFFAOYSA-N 299.365 2.118 10 20 CECD COC(=O)[C@H]1CC12CCN(Cc1ccc(C)cc1O)CC2 876739623 DQLMPTPWKIEOOR-CQSZACIVSA-N 289.375 2.476 10 20 CECD CCCOc1ccc(CN[C@]2(CCO)CCOC2)cc1C 873115098 GGKTYCWVAUZRQQ-QGZVFWFLSA-N 293.407 2.415 10 20 CECD CS/C=C/C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773749634 RUVXFJFKIKXRIY-VUHVRTRXSA-N 267.350 2.022 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H](CO)C2CC2)c1O 771807798 LXHYBVXELUDHDQ-CYBMUJFWSA-N 283.755 2.109 10 20 CECD CC[C@@H]1C(=O)N(CC)CCN1Cc1cc(C)ccc1O 779218220 PDWAOBZVQIJAAN-CQSZACIVSA-N 276.380 2.143 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)[C@@H](O)c1ccc(F)cc1 777525950 OKGIRASJRPIPNB-ISVAXAHUSA-N 295.335 2.445 10 20 CECD CN(C)c1ccc(CNC(=O)N2C[C@H]3C=C[C@H]2C3)cc1 883077754 VBPYVCUEMOQLTQ-ZFWWWQNUSA-N 271.364 2.223 10 20 CECD CCOc1ccc(CN[C@]2(C)CCO[C@@H]2C)c(O)c1 784641319 XKDNJWVPEOVHPS-IAQYHMDHSA-N 265.353 2.448 10 20 CECD CCc1ncsc1NC(=O)c1cccc(O)c1O 790899019 GUWACIYQCMMUFM-UHFFFAOYSA-N 264.306 2.369 10 20 CECD CCc1cncc(C(=O)NCc2ccc(OC)cc2O)c1 794373098 GNMKHGFDIJJXMZ-UHFFFAOYSA-N 286.331 2.288 10 20 CECD CCOC[C@@H]1CCN(Cc2cccc(OC)c2O)C1 93839184 LUNSTJJPPSMMMF-GFCCVEGCSA-N 265.353 2.259 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H](C)C(=O)NCCF 1322652771 PWUSZINSXXQVGA-WOPDTQHZSA-N 294.370 2.313 10 20 CECD O=C(O)CCCCNCc1cc(F)cc(F)c1O 1334055975 MSSHRNPXNQGAAB-UHFFFAOYSA-N 259.252 2.015 10 20 CECD CC1(C)C[C@@H](CNC(=O)NCc2ccc(N)cc2)CCO1 1353414595 WWOIRRXFBZBZDC-ZDUSSCGKSA-N 291.395 2.273 10 20 CECD N[C@@H]1CCC[C@@H]2CN(Cc3cc(F)ccc3O)C[C@@H]21 220350612 KHRRLUPFSIWSQB-DDTOSNHZSA-N 264.344 2.091 10 20 CECD CCN(C)c1ccc(CN[C@](C)(COC)CC(=O)O)cc1 1605410916 PNGOFRZSNSDJJY-INIZCTEOSA-N 294.395 2.112 10 20 CECD Cc1cccc(O)c1CN1C[C@H]2CC[C@H]1[C@@H](C(=O)O)C2 1600543347 SHRRUIFAAPYMJI-OBJOEFQTSA-N 275.348 2.386 10 20 CECD CSc1ncc(OCc2cc(C(=O)O)oc2C)cn1 1607415265 KNICNWBOQXPCTJ-UHFFFAOYSA-N 280.305 2.377 10 20 CECD CCOc1cccc(CN[C@H](C(=O)O)C(C)(C)C)c1O 1605707956 XDMUGCJNDJMXTJ-CYBMUJFWSA-N 281.352 2.380 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](C(=O)O)[C@H]2C)c1 1600163313 HUKKWRJOKGEVBL-YPMHNXCESA-N 263.337 2.304 10 20 CECD CC(C)(CCN1CCCc2cc(CN)ccc21)C(=O)O 1609674613 UBHWCUGXWHUJEV-UHFFFAOYSA-N 276.380 2.399 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@]2(C)C(=O)O)c1O 229119170 DCSFJFXEPGBOJS-CQSZACIVSA-N 299.754 2.493 10 20 CECD CC[C@H](F)C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1754278679 IYGABNFCKIHZON-JSGCOSHPSA-N 296.386 2.346 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@H]2C(=O)O)cc1 1598320788 SONKRHOSLINDBE-ZIAGYGMSSA-N 262.353 2.096 10 20 CECD CCc1cccc(CN(CC(=O)O)C2CCOCC2)c1O 1597586225 BHXHVCOSTJMKCH-UHFFFAOYSA-N 293.363 2.020 10 20 CECD CN(C)c1ccc(CN2C[C@@H](C(=O)O)C3(CCC3)C2)cc1 1777039413 YMNFWTHVDKUMFE-HNNXBMFYSA-N 288.391 2.439 10 20 CECD Oc1ccccc1CN(Cc1cc[nH]n1)C[C@@H]1CCCO1 160206815 ANBXGLJUTDGXSM-HNNXBMFYSA-N 287.363 2.297 10 20 CECD OCC1(CNCc2cc(Br)ccc2O)CC1 165126919 OOBKTLBSBVTYJQ-UHFFFAOYSA-N 286.169 2.017 10 20 CECD NCc1ccc2c(c1)CCCN2CCOCC(F)F 843350937 YDWQKCNSOZOSEX-UHFFFAOYSA-N 270.323 2.180 10 20 CECD CCc1cccc(CN(C)[C@@H]2CCCCNC2=O)c1O 848884746 JNMPSHTZCWSPRA-CQSZACIVSA-N 276.380 2.055 10 20 CECD CO[C@H](CNCc1c(C)cccc1O)C(F)(F)F 877028009 UVRZKNXGSHIIKQ-LLVKDONJSA-N 263.259 2.368 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)c1ccsc1 714385876 VFQXNHPXQKUAOZ-UHFFFAOYSA-N 283.374 2.274 10 20 CECD O=C(O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1cc(F)ccc1O)C2 394672223 SXVKRICTYAQEMA-OASPWFOLSA-N 279.311 2.216 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1cccc(C(N)=O)c1 51588401 ZHAZKCOANSLRED-UHFFFAOYSA-N 297.402 2.484 10 20 CECD COC[C@@H](C)CNC(=O)N[C@@H](C)c1cc(OC)ccc1O 170888415 YBNQPZZWSYORTR-QWRGUYRKSA-N 296.367 2.044 10 20 CECD CCN(CC)c1ccc(CNC(=O)NOC)cc1F 66928598 ZTGJRCPLWUGPTM-UHFFFAOYSA-N 269.320 2.033 10 20 CECD COC[C@H](O)CN(c1ccc(OC)cc1)[C@H](C)C1CC1 127936236 PIXKMGFMWLETFI-IUODEOHRSA-N 279.380 2.307 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)CCS1 182529204 GJGJZBGIOJIRDH-JTQLQIEISA-N 281.377 2.374 10 20 CECD COc1ccc(N(C)CC(=O)N[C@H](C)C(C)C)cc1F 121809877 OILHQDQGZJVRMA-LLVKDONJSA-N 282.359 2.431 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)OCC(F)(F)F 186664251 NYMDLKLPEYEABB-SSDOTTSWSA-N 293.241 2.317 10 20 CECD CC[C@@H](NCCOCCOC)c1ccccc1O 44693699 JPRCUQASKYBTOB-CYBMUJFWSA-N 253.342 2.096 10 20 CECD CC(C)[C@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 131276075 WWQDPRRVXYHHOF-SWLSCSKDSA-N 250.386 2.420 10 20 CECD CCn1nccc1C(=O)N[C@H](C)c1cc(OC)ccc1O 131834647 HYFFBIVGQDYQEK-SNVBAGLBSA-N 289.335 2.108 10 20 CECD COc1cccc(CNC[C@H](O)c2ccc(F)cc2)c1O 237213629 VGRSMBQUDJUETH-AWEZNQCLSA-N 291.322 2.363 10 20 CECD C[C@@H]1CCCN([C@H](C)CNC(=O)Cc2ccc(N)cc2)C1 237566651 AEQDWMSFTBERDZ-ZIAGYGMSSA-N 289.423 2.048 10 20 CECD C[C@H](C[S@](C)=O)N(C)Cc1ccc(N(C)C)c(F)c1 275321166 SIQHJYGTSMJPQV-WYRIXSBYSA-N 286.416 2.091 10 20 CECD CO[C@@H]1CCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 278632277 FPRJSBNRECHSEB-TZMCWYRMSA-N 280.324 2.348 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)CC[S@@](=O)C1 375950184 ZWZBSUYJWDCDMM-MLCYQJTMSA-N 287.812 2.246 10 20 CECD COc1ccc(CNC(=O)C(C)(C)C2CC2)c(O)c1 807453942 INYAUAASNYNZHU-UHFFFAOYSA-N 263.337 2.453 10 20 CECD CO[C@@H]1CCC[C@H](NC[C@H](N)c2ccc(N(C)C)cc2)C1 817943276 TWELOXKFWTWTJZ-UAGQMJEPSA-N 291.439 2.300 10 20 CECD C[C@H]1C[C@H](CO)CN(Cc2c(O)cccc2Cl)C1 817413329 WKPKYSJEJLZCIT-QWRGUYRKSA-N 269.772 2.496 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCC[C@@H](OC)C2)c(O)c1 816550664 XUPKEKKNLNEVIR-DGCLKSJQSA-N 293.363 2.222 10 20 CECD C[C@H](N[C@@H](CN)C1CC1)c1cc(F)cc(F)c1O 817959585 HGEKQLIMBABFBL-MADCSZMMSA-N 256.296 2.058 10 20 CECD O=C(/C=C\c1cccnc1)N1C[C@@H](CO)c2ccccc21 492939953 GXJZXAVJZAMNPS-DANTVBBOSA-N 280.327 2.218 10 20 CECD CN(C[C@@H]1CCSC1)c1ccc(OCC(=O)O)cc1 902015187 CUVIBLPHXPEXJU-NSHDSACASA-N 281.377 2.339 10 20 CECD CN1C(=O)/C(=C\c2ccc(F)nc2)SC1=S 588523277 QCUXOHYLJASQAG-QPJJXVBHSA-N 254.311 2.052 10 20 CECD COc1ccc(N(CCN2CCOCC2)CC2CC2)cc1 831587748 JXAZVERRWNAVMP-UHFFFAOYSA-N 290.407 2.244 10 20 CECD C[C@@H](NC(=O)[C@]1(C(=O)O)CC=CCC1)c1ccccc1O 902517971 YKCTXUHXVOHVPO-BZNIZROVSA-N 289.331 2.381 10 20 CECD C/C(=C(/F)C(=O)NCCc1ccc(O)c(O)c1)C1CC1 901121856 KXMJJHLWSFDQEL-ZROIWOOFSA-N 279.311 2.410 10 20 CECD CN1CC[C@H](N(C)Cc2c(O)ccc3ccccc23)C1=O 738265526 HPMWQFVFEYQNGW-HNNXBMFYSA-N 284.359 2.208 10 20 CECD O=C(NCC1(Br)CC1)c1cc(O)cs1 910218871 UDLQFPQBLCCLHX-UHFFFAOYSA-N 276.155 2.111 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2cc(F)ccc2O)C1 840976500 WYPGGBJGTOKECW-HNNXBMFYSA-N 281.327 2.306 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@@]2(CCCN2)C1 841105306 JOTHAELHZPGYQN-AWEZNQCLSA-N 266.772 2.374 10 20 CECD C[C@H](O)CN(Cc1ccccc1)C(=O)c1cc(O)cs1 741296652 SKVMJEZGWKMKRH-NSHDSACASA-N 291.372 2.477 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@H](CN)C2CC2)c1O 843387238 QUJITRCPLRKMDD-CQSZACIVSA-N 296.798 2.417 10 20 CECD CCc1cccc(CNC[C@@H](CO)Cc2ccco2)c1O 848898442 CMTCCTPLHGEQHG-ZDUSSCGKSA-N 289.375 2.488 10 20 CECD COc1cccc([C@@H](C)NC2CCN(OC)CC2)c1O 846171829 IDNHXBHIVIJLHC-LLVKDONJSA-N 280.368 2.077 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@](C)(O)C(F)(F)F 840936230 HCRUDQHSBVQPFW-CYBMUJFWSA-N 290.329 2.464 10 20 CECD C[C@](O)(CC(=O)NCc1cc(Cl)ccc1O)C1CC1 846476365 NYEPIVMJKLJYFR-AWEZNQCLSA-N 283.755 2.213 10 20 CECD Cc1ccc([C@H](C)NCCO[C@H]2CCOC2)c(O)c1C 927081853 XOPCSSJYZOCAIP-KBPBESRZSA-N 279.380 2.465 10 20 CECD CN(C)c1ccc(/C=C/CN2CCC[C@@H]2C(=O)O)cc1 840995597 XTFHROFFGGBTIW-SJDLMVEWSA-N 274.364 2.315 10 20 CECD C[C@H](NC/C=C\CO)c1ccc(Br)cc1O 850507912 IXKQIKFBZNZGSM-XADBCAIWSA-N 286.169 2.354 10 20 CECD C[C@@H](N[C@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O 756735937 JHKXQDRYNJWPEL-SCZZXKLOSA-N 296.317 2.084 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](C)c1cc(F)ccc1O 756776130 WPRGWVYLXLGWBX-NDMJEZRESA-N 280.343 2.097 10 20 CECD CN(C)c1ccc(CNC(=O)OCCF)cc1F 858925510 HOYYKUANFHANEL-UHFFFAOYSA-N 258.268 2.087 10 20 CECD C[C@H]1C[C@H](N[C@H]2C[C@@H](CO)C2)c2c(O)ccc(F)c21 866415919 IKSAVTGBIUBVEL-GUDRVLHUSA-N 265.328 2.440 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ncnc2[nH]ccc12 762799794 BARCZSJJSRVTSX-VIFPVBQESA-N 284.319 2.412 10 20 CECD CCC(CC)NC(=N)NCc1cccc(OC)c1O 864457478 TZXYBRNPCWIDKD-UHFFFAOYSA-N 265.357 2.203 10 20 CECD Cc1cccc(CN(C)Cc2nnc3ccccn23)c1O 775667553 KUTWHSIEYRVLBL-UHFFFAOYSA-N 282.347 2.375 10 20 CECD CCn1cnnc1CCN[C@@H](C)c1ccc(N(C)C)cc1 773011388 TXJGKIXLMZFFNG-ZDUSSCGKSA-N 287.411 2.257 10 20 CECD Cc1ccc(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)o1 773762792 KGFVOXKEYRYRFH-SNVBAGLBSA-N 289.331 2.289 10 20 CECD CCc1nnc2ccc(NCc3ccccc3O)nn12 771184201 HDHKBTLDXBUIEG-UHFFFAOYSA-N 269.308 2.004 10 20 CECD CCOc1ccc(CN[C@H](C)[C@H]2CCOC2)c(O)c1 776220362 WJXPZFGRSFFJHO-YPMHNXCESA-N 265.353 2.306 10 20 CECD C[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)C1CC1 779498750 JRXJKDXPBJEFAQ-HTZNOQTFSA-N 261.321 2.273 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@@H](C)C2)c1 780461669 NFKYLRJBLDDSHV-ZYHUDNBSSA-N 278.352 2.389 10 20 CECD CCC1(CNCc2cc(C)cc(OC)c2O)COC1 894917630 OOXNTLHNPXAGKU-UHFFFAOYSA-N 265.353 2.225 10 20 CECD COc1cc(C)cc(CN[C@H](C)[C@H]2CCOC2)c1O 894303625 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921728641 CRZCFNFSCMJPQO-MRXNPFEDSA-N 261.365 2.262 10 20 CECD C[C@H](NCCN1CCCC1)c1ccc(N(C)C)cc1 37228656 NGQUMTYTFRZCAB-AWEZNQCLSA-N 261.413 2.499 10 20 CECD CN1[C@H]2CC[C@H]1CC(NCc1ccc3c(c1)CCO3)C2 278647187 HYKDXXSLSFBOJH-HOTGVXAUSA-N 272.392 2.336 10 20 CECD C[C@H](NCc1cccc(Br)c1O)C(C)(C)O 309814590 VAALDRBTRGLHPX-QMMMGPOBSA-N 288.185 2.404 10 20 CECD CN(C)C[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1 708386417 UZZFLAPLXFDGTR-SNVBAGLBSA-N 270.323 2.054 10 20 CECD Cc1ccc([C@H](C)NCCc2cnccn2)c(O)c1 390105349 ITQQEMZHCSOBIV-LBPRGKRZSA-N 257.337 2.384 10 20 CECD CN(CC1CC1)C(=O)NCc1ccc(N(C)C)cc1 56332730 KLFSRFMZERUAKU-UHFFFAOYSA-N 261.369 2.304 10 20 CECD Cc1ccc(C(=O)Nc2ccc3c(c2)CC(=O)N3)c(O)c1O 179498486 DGFYQMMZMZNFRS-UHFFFAOYSA-N 298.298 2.153 10 20 CECD CN1CCCc2cc(CNC(=O)c3cccnc3)ccc21 58768475 GYDHOPVWBACWCH-UHFFFAOYSA-N 281.359 2.394 10 20 CECD C[C@@H]1CN(Cc2cc(Br)ccc2O)[C@H](C)CN1 300438270 UPOAQIGUTSYDOS-NXEZZACHSA-N 299.212 2.337 10 20 CECD COC(=O)CN(Cc1ccc(N(C)C)cc1)C(C)C 121627368 DTZYCJHHIQRIOT-UHFFFAOYSA-N 264.369 2.136 10 20 CECD CNC(=O)[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 125076161 VOQVACIDKHHYNO-JTQLQIEISA-N 282.771 2.004 10 20 CECD CN(C)C(C)(C)CNCc1cccc(Cl)c1O 124655065 PJHVRQIUCNDYKT-UHFFFAOYSA-N 256.777 2.475 10 20 CECD CC[C@H](CSC)NC(=O)NCc1cc(OC)ccc1O 183629155 SNCQZCOHYKIEHF-LLVKDONJSA-N 298.408 2.342 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](C)S(=O)(=O)CC2)c1 191317082 ZEEQWKDWDSASMN-ZDUSSCGKSA-N 297.420 2.018 10 20 CECD CCOc1ccc(O)c(CN2CCCC[C@@H]2C(=O)OC)c1 93441119 MNIUDPRSHJKHDS-CQSZACIVSA-N 293.363 2.318 10 20 CECD COC[C@@H](NCc1cccc(Cl)c1O)[C@H]1CCCO1 279440076 PDBDBPLHZGJZPA-CHWSQXEVSA-N 285.771 2.329 10 20 CECD CCCCOCCNCc1ccc([N+](=O)[O-])c(OC)c1O 278627510 GNLWOQBHZFXGIF-UHFFFAOYSA-N 298.339 2.215 10 20 CECD CO[C@@H]1[C@H](C)[C@H](NC(=O)NCc2ccccc2O)C1(C)C 271979415 PVDGHFIMBQMDOU-DDTOSNHZSA-N 292.379 2.251 10 20 CECD O=C1CCCCN1[C@H]1CCCN(Cc2ccccc2O)C1 374905840 ADMWPUPASAYDEH-HNNXBMFYSA-N 288.391 2.369 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@](F)(CO)C2)c1 289771062 KNIHIKFUSRQTKC-HNNXBMFYSA-N 283.343 2.087 10 20 CECD Nc1ccc(CNC(=O)CSC(F)(F)F)cc1 297237579 PKUWSLWGRODACA-UHFFFAOYSA-N 264.272 2.138 10 20 CECD COc1cccc(CNCc2cnc([C@@H](C)O)s2)c1O 809741160 LFYGYDDCJNCRFP-SECBINFHSA-N 294.376 2.200 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCc3cccnc32)c(O)c1 819962829 GQKKICVKPGDNKK-CQSZACIVSA-N 298.342 2.142 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc2c([nH]1)CCCC2 827317082 NZWUOAONVPBXJA-UHFFFAOYSA-N 286.331 2.235 10 20 CECD COC(=O)C1(NC(=O)c2cc(O)cs2)CCCCCC1 820676568 DZURENOHYBWONG-UHFFFAOYSA-N 297.376 2.450 10 20 CECD CCN1CCC[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)C1=O 903391976 KDVIAXXSSDKXAP-CZUORRHYSA-N 289.423 2.414 10 20 CECD C[C@H]1CC[C@@H](CCC(=O)NCc2ccc(O)cc2O)O1 910951256 QIMQBLBYWWBYCI-GWCFXTLKSA-N 279.336 2.062 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C(=O)O)[C@@H]2C)cc1 846283372 DRQBKNOSBVVEDA-WFASDCNBSA-N 276.380 2.438 10 20 CECD CCN1CCCN(C(=O)c2cc(O)cs2)[C@H](C)C1 910275446 VSHVSLJWDHCVAV-SNVBAGLBSA-N 268.382 2.010 10 20 CECD 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CECD CC[C@@H](N[C@H](C)CC(N)=O)c1cc(Cl)ccc1O 775514006 QMVCMVOXGVYEOJ-LDYMZIIASA-N 270.760 2.350 10 20 CECD CCn1nccc1C(=O)NCc1ccc(N2CCCC2)cc1 775784418 DJDHBGLWMWEHKF-UHFFFAOYSA-N 298.390 2.433 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC=CCC2)c1O 775057246 NBMRWCBWJRXKFG-UHFFFAOYSA-N 264.281 2.071 10 20 CECD CCOCCN(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776247919 XIDBSENQJVBEHH-ZDUSSCGKSA-N 293.411 2.492 10 20 CECD Cc1cccc(O)c1CN1CC[C@@H](Cc2cnn(C)c2)C1 876797714 UEBYDECSZPGTGB-AWEZNQCLSA-N 285.391 2.499 10 20 CECD C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc[nH]1 779539539 HCNAUUGFXMEJDM-BREXMAIKSA-N 272.304 2.317 10 20 CECD O=C1NC(=S)S/C1=C/c1cnn(CC2CCC2)c1 899335566 DWYTYFBMVDUBNE-ONNFQVAWSA-N 279.390 2.172 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H](O)COCC 76074345 TXXHTBMHLSSVMC-CQSZACIVSA-N 267.369 2.002 10 20 CECD COc1cc(C)cc(CN[C@H](C)[C@@H]2CCOC2)c1O 894303628 FKWVXUUYWSQOMP-VXGBXAGGSA-N 265.353 2.224 10 20 CECD COc1ccc(CN[C@@H]2C[C@@H](OC)C2(C)C)c(O)c1OC 893096527 MWPZUSAZIUTTFF-CHWSQXEVSA-N 295.379 2.313 10 20 CECD CNC(=O)[C@@H](C)CN(C)Cc1ccc(N2CCCC2)cc1 1323317916 BXKGFCLPOUQFSW-AWEZNQCLSA-N 289.423 2.101 10 20 CECD CN[C@H](C)CCNCc1cc(Cl)cc([N+](=O)[O-])c1O 1325321701 YRPZMEQZCCLPPL-MRVPVSSYSA-N 287.747 2.041 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCOC1)c1ccc(N(C)C)cc1 1320381949 PUUPSLFQZHCIJH-OLZOCXBDSA-N 291.395 2.149 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)cc2)[nH]c1C(=O)O 1600209616 RXGIBHCIPLKQNX-UHFFFAOYSA-N 287.363 2.377 10 20 CECD Cc1cc(CNC(C)(C)C(=O)O)ccc1N(C)C 1605173313 XMRABSLHYHMGMD-UHFFFAOYSA-N 250.342 2.014 10 20 CECD O=C(O)[C@@H](NCc1ccccc1O)c1ccccc1F 1608550787 BUJGVILIPBAPCQ-AWEZNQCLSA-N 275.279 2.447 10 20 CECD CCC[C@@](C)(NCc1cc(OC)c(OC)cc1O)C(=O)O 1595560072 RQZUXSHPGCDQGB-OAHLLOKOSA-N 297.351 2.142 10 20 CECD CCN1CCCc2cc(CNC(C)(C)C(=O)O)ccc21 1776875303 XHCZBHYIJBUZSB-UHFFFAOYSA-N 276.380 2.412 10 20 CECD Nc1ccc(OCc2cn(CCC(F)(F)F)nn2)cc1 881428005 ADLBMMADHUHONO-UHFFFAOYSA-N 286.257 2.392 10 20 CECD CN(Cc1ccccc1O)C(=O)CC[C@@H]1CCOC1 176014955 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CC(C)OC(=O)[C@@H](NC(=O)c1cc(O)cs1)C(C)C 833992876 DYMKMOXVRDIZFT-NSHDSACASA-N 285.365 2.160 10 20 CECD C[C@H](N[C@H]1C[C@@H]2CCCCN2C1=O)c1ccc(F)cc1O 834916161 VRIWYWBFONDWME-JKOKRWQUSA-N 292.354 2.335 10 20 CECD CC(C)C[C@@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841056657 HRDBQJGQJSOORL-LBPRGKRZSA-N 289.379 2.102 10 20 CECD CCOC(=O)CCCCOC(=O)c1ccc(C)c(O)c1O 740957490 CRKWTGUPKSYRJF-UHFFFAOYSA-N 296.319 2.296 10 20 CECD Cc1cc(NC(=O)NCc2ccc(N(C)C)cc2)nn1C 748637359 QIIFGHYPWSUKRH-UHFFFAOYSA-N 287.367 2.116 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C)[S@@](=O)CC1 840941877 OZVJILKUWFNFCW-VLIAUNLRSA-N 294.464 2.404 10 20 CECD CCC[C@@H](O)CC(=O)NCc1ccc(N(C)C)c(F)c1 750263962 WIXGLCHFWHEHME-GFCCVEGCSA-N 282.359 2.059 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@@H]3C[C@@H]3C2)cc1 853245259 WLAIMEVRBPNYCC-ZIAGYGMSSA-N 273.380 2.304 10 20 CECD Cc1cc(CN[C@@H]2C[C@H](N)C2(C)C)ccc1N(C)C 923423628 YBCHCOISJFJVRY-LSDHHAIUSA-N 261.413 2.276 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCCN2CC[C@@H](O)C2)c1O 858547230 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824042795 GMRDIJXCAKRYDR-SNVBAGLBSA-N 294.351 2.493 10 20 CECD CC[C@H]1CN(CC)CCN1Cc1cc(F)ccc1O 825005719 QLCANRQMLBIRDZ-AWEZNQCLSA-N 266.360 2.447 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)NC(=O)CC 727168668 UJMRMZWWYKRLFO-LBPRGKRZSA-N 292.379 2.046 10 20 CECD CC[C@@](C)(O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 822834518 XXZYXRGBMDOPER-SUMWQHHRSA-N 292.423 2.269 10 20 CECD Oc1ccccc1CNc1ccc(-c2nn[nH]n2)cc1F 826511168 FJUZNOIPLXEXCY-UHFFFAOYSA-N 285.282 2.324 10 20 CECD CCOc1ccc(CN[C@H](CC)COC)c(O)c1 738441050 ZZIWDDKUWNQALS-GFCCVEGCSA-N 253.342 2.306 10 20 CECD CC[C@H](NC(=O)NCc1ccc(N(C)C)cc1C)[C@H](C)O 838480653 ZIRKTMGOMCZYKR-WFASDCNBSA-N 293.411 2.020 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2C[C@H]3CC[C@H]2O3)cc1 836240474 VJWARTPFXWVREC-FVQBIDKESA-N 288.391 2.326 10 20 CECD CCc1cccc(CN[C@@H](C)C(=O)OC(C)C)c1O 848915030 QJWYHCFRQXHXKZ-NSHDSACASA-N 265.353 2.384 10 20 CECD CCC(=O)N1CC[C@@H](NCc2ccc(N(C)C)cc2C)C1 840936351 CULPDQLQJKFYHF-OAHLLOKOSA-N 289.423 2.162 10 20 CECD CC(=O)NCCCN[C@H](C)c1ccc(Cl)cc1O 841744216 MWEVGTTZFHEODS-SECBINFHSA-N 270.760 2.222 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)C[C@H](C)N)c1O 843129892 SRXJBXQYGXYVLA-IUCAKERBSA-N 272.776 2.270 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2ccc(N(C)C)cc2C)C1 840916048 DTRDNSWXVXEYRW-KRWDZBQOSA-N 290.407 2.446 10 20 CECD CCOc1ccc(O)c(CN[C@@H](CCN)C(F)(F)F)c1 841091252 VVWOHXLMTODTKU-LBPRGKRZSA-N 292.301 2.160 10 20 CECD CCN(C)C(=O)[C@H](C)NCc1ccc(N(C)C)cc1C 840941884 PHRDEJIHAFHTIH-ZDUSSCGKSA-N 277.412 2.017 10 20 CECD CCOc1ccc(CN[C@H]2CCCNCC2)c(O)c1 841057049 HHFXWNBNLHKVNV-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H]3CNC[C@@H]32)cc1 841026557 IIAVACFZNXMEON-WBVHZDCISA-N 273.424 2.327 10 20 CECD C[C@@H](N)CN(C)Cc1ccc(N2CCCCC2)cc1 844221074 SIPLYYZMZWYJKL-CQSZACIVSA-N 261.413 2.456 10 20 CECD CC[C@H](NC1CCN(c2ccc(OC)cc2)CC1)C(=O)O 843039298 PCADBNSEMFUFCY-HNNXBMFYSA-N 292.379 2.117 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1cnn2c1CCC2 846477598 SYMLIGZQMDOVTG-UHFFFAOYSA-N 291.738 2.118 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@H](O)CC2)cc1F 753851403 URLNGUCGRZMPAY-JOCQHMNTSA-N 266.360 2.285 10 20 CECD CCC[C@@H](O)CC(=O)NCc1c(O)ccc2c1CCCC2 750422898 BCCRUAOSJNPBJN-CYBMUJFWSA-N 291.391 2.438 10 20 CECD COC(C)(C)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756645646 HPKFFWDVYCTTCT-VIFPVBQESA-N 268.313 2.376 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(C)CCC(=O)CC2)c1 862754941 LXKWXSRJGDLMLO-UHFFFAOYSA-N 275.348 2.466 10 20 CECD Cc1nocc1CNC(=O)NCc1ccc(N(C)C)cc1 866046452 YGKJFAFSMCWYML-UHFFFAOYSA-N 288.351 2.048 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)C[C@H](C)N)cc1 861562089 SGDBIZVYSQPMPK-ZDUSSCGKSA-N 292.427 2.021 10 20 CECD CN(C[C@@H]1CC(C)(C)CO1)c1ccc(OCC(=O)O)cc1 872160393 GKJAUBDKQKZTOD-AWEZNQCLSA-N 293.363 2.401 10 20 CECD C[C@@]1(CO)CCCN1Cc1cc(F)cc(F)c1O 1119449455 WQDKINSNVPWFHO-ZDUSSCGKSA-N 257.280 2.017 10 20 CECD Cc1ccc(CN(C)Cc2nnc3ccccn23)c(O)c1 876655940 ZJRYOHWEIIUHFY-UHFFFAOYSA-N 282.347 2.375 10 20 CECD Cc1ccc(CN2C[C@@H](C)OC3(CCOCC3)C2)c(O)c1 877485705 DJDBLQXUUUNDOD-CQSZACIVSA-N 291.391 2.471 10 20 CECD COCCOC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 885246549 MLXORJBZRGQYDP-CYBMUJFWSA-N 294.395 2.365 10 20 CECD COC[C@@H](C)CNCc1cc(C)cc(OC)c1O 894210039 ZUSLAPKHRLUQBX-NSHDSACASA-N 253.342 2.081 10 20 CECD CCCN(Cc1nnc(C)o1)Cc1ccccc1O 75829183 VMYPMXSCWUSYEI-UHFFFAOYSA-N 261.325 2.496 10 20 CECD COc1cc(C)cc(CNCCN2CC=CCC2)c1O 894617392 KHMIZORYLRBSSQ-UHFFFAOYSA-N 276.380 2.061 10 20 CECD CO[C@H](C)CN(C)Cc1c(O)ccc2ccncc12 795750687 VADHFDQHIHNMNT-LLVKDONJSA-N 260.337 2.407 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CCN(C2CC2)C1 83552449 SQZRPVJYTIUQTH-JTQLQIEISA-N 266.772 2.372 10 20 CECD COc1ccc(CNC(=O)C[C@@H]2CCC(=O)[C@@H]2C)c(O)c1 794374431 SYOKSGAZXHCHII-MNOVXSKESA-N 291.347 2.022 10 20 CECD CC[C@@H](N[C@@H]1CCN(CCOC)C1)c1ccccc1O 274931803 RAHCNESVELSBJS-UKRRQHHQSA-N 278.396 2.154 10 20 CECD O=C(O)[C@H]1C=C[C@@H](NCc2ccc3c(c2)CCCO3)C1 1336928124 KNBNNUVGOQZGOB-UONOGXRCSA-N 273.332 2.131 10 20 CECD C[C@@H]1NC[C@@H](C)N(Cc2ccc(F)c(F)c2O)[C@H]1C 1576881975 NQONKBYINPGMSS-UTLUCORTSA-N 270.323 2.241 10 20 CECD c1csc(SC[C@H]2C[C@]3(CCNC3)CO2)n1 1580897028 BVTHFCXXVSNQIQ-KOLCDFICSA-N 256.396 2.004 10 20 CECD CN(C)c1ccc(OCCCc2cnoc2)cc1C(=O)O 1598328648 WSFPIXREYYEADW-UHFFFAOYSA-N 290.319 2.450 10 20 CECD COc1cccc(OC)c1/C=C1\SC(=S)NC1=O 200562587 RNOUONDABARLQH-POHAHGRESA-N 281.358 2.193 10 20 CECD CCOc1cccc(CNCCC(=O)N[C@H](C)CC)c1O 38013683 NCMWZISPAKNLFC-GFCCVEGCSA-N 294.395 2.185 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccccc1N 40331946 DOUMAIUVRPXLHH-UHFFFAOYSA-N 270.332 2.176 10 20 CECD C[C@@H]1CCCCN1C(=O)CN(C)c1ccc(N)cc1 702092635 KSJLHNUWNWNCMJ-GFCCVEGCSA-N 261.369 2.106 10 20 CECD CC1(C)CN(Cc2cc(F)ccc2O)[C@@H]2COC[C@@H]21 384788468 SMHCHNNGXODNFM-QWHCGFSZSA-N 265.328 2.388 10 20 CECD COc1ccc(O)c(CN[C@@H]2CSC[C@@H]2C)c1 397880779 KGZYWSXCCOTDQN-JOYOIKCWSA-N 253.367 2.242 10 20 CECD C[C@H](NCC(C)(C)N1CCOCC1)c1ccc(F)cc1O 62744978 BHZSWGWWBUHUDZ-LBPRGKRZSA-N 296.386 2.293 10 20 CECD CNC1=NC(=O)/C(=C/c2ccc3ncccc3c2)S1 28821250 OTTNNAIKNUBBIR-WQLSENKSSA-N 269.329 2.425 10 20 CECD COCCCCN(C)c1ccc(OCC(=O)OC)cc1 183800844 VTFLDRQAVPHKSM-UHFFFAOYSA-N 281.352 2.101 10 20 CECD CCN(Cc1cccc(OC)c1O)C[C@H](O)C(F)(F)F 189863443 VBALBDCHYAAMEH-NSHDSACASA-N 293.285 2.146 10 20 CECD CN(C(=O)/C=C\c1cnn(C)c1)c1ccc(F)cc1 48656450 BJGXKDLYZHOYIJ-BAQGIRSFSA-N 259.284 2.235 10 20 CECD C[C@@H](CC(=O)Nc1ccc(N)cc1)NC(=O)C1CCCC1 237596515 QHDXPLXMPGXHHI-NSHDSACASA-N 289.379 2.292 10 20 CECD CN(CCOCc1ccccc1)C(=O)Cc1ccc(N)cc1 163021186 YUXLWTKHOVKQOJ-UHFFFAOYSA-N 298.386 2.487 10 20 CECD C[C@H](NC[C@H]1COCCN1)c1ccc2ccccc2c1O 530221799 DJTSRTULJGBMSG-JSGCOSHPSA-N 286.375 2.184 10 20 CECD CCN(C)c1ccc([C@H](C)NCCc2n[nH]c(C)n2)cc1 272598320 TUWWHEZZIOOWIO-LBPRGKRZSA-N 287.411 2.463 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]2c2ncc[nH]2)c1 377016324 WQJRGGFCNVENMS-CYBMUJFWSA-N 273.336 2.461 10 20 CECD Cc1cc(C)c([C@H](C)NCC2(S(C)(=O)=O)CC2)c(O)c1 284859305 AMYBFSDQSZVBGO-LBPRGKRZSA-N 297.420 2.237 10 20 CECD COc1ccc(O)c(CNc2cnc3c(c2)COCC3)c1 377233037 QUELPSGPKJJGSL-UHFFFAOYSA-N 286.331 2.481 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@]3(CCN(C)C3)C2)c1 292802300 NSKDGNRXRTZUKA-QGZVFWFLSA-N 290.407 2.319 10 20 CECD CCNC(=O)[C@@H](NCc1ccc(N(C)C)c(F)c1)C(C)C 292848789 BQNMGPPSEFQMTP-HNNXBMFYSA-N 295.402 2.142 10 20 CECD Cc1nnc(N[C@@H](C)c2ccc(N3CCOCC3)cc2)o1 804378537 VINSCEKJJOIIOO-NSHDSACASA-N 288.351 2.388 10 20 CECD CC[C@H](O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 813885324 SRANUMIRXQFOQA-YWVKMMECSA-N 253.317 2.440 10 20 CECD CCOCc1nnc(N(C)Cc2ccccc2O)n1CC 812027226 UQBOMQLRZGVXGB-UHFFFAOYSA-N 290.367 2.177 10 20 CECD CC[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@@H](CC)O1 817765539 CKNJIGQHGXGRIF-AOOOYVTPSA-N 297.326 2.267 10 20 CECD CC[C@H]1CN(C(=O)c2cc(O)cs2)C[C@H](CC)O1 817766714 OHNUEOKRXYMICV-QWRGUYRKSA-N 269.366 2.483 10 20 CECD COc1cccc(CNC(=O)NCCC(C)(C)F)c1O 822101668 LWRVFGIEVSNJJH-UHFFFAOYSA-N 284.331 2.338 10 20 CECD Cc1cc(O)c(CN[C@H](C)C[S@@](C)=O)cc1Cl 825498104 VJEXKPKCKMDXFQ-VVVCHXIZSA-N 275.801 2.211 10 20 CECD C[C@@H](NC(=O)CN1[C@H](C)CC[C@H]1C)c1ccccc1O 827936716 AYZPMLQHZYLOLQ-JHJVBQTASA-N 276.380 2.442 10 20 CECD CCOc1ccc(CNC[C@@H](O)C2CCC2)c(O)c1 825239988 FGGFFJRABZTLTP-OAHLLOKOSA-N 265.353 2.042 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](O)C2CC2)cc1F 826941675 JWNRDSBFTAJZSP-OAHLLOKOSA-N 294.370 2.059 10 20 CECD O=C(NCc1ccc(O)c(F)c1)c1cc(O)cs1 738552566 SQQMKLGJDCBFLD-UHFFFAOYSA-N 267.281 2.228 10 20 CECD COCCC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 839917432 CWJAVMXQRFCIKH-CYBMUJFWSA-N 278.396 2.145 10 20 CECD CC[C@H](NC(=O)N[C@H](C)c1ccc(N(C)C)cc1)[C@H](C)O 838560009 SDZYIBXIPSWZFM-XUJVJEKNSA-N 293.411 2.272 10 20 CECD CCOc1ccc(CN2CC[C@@H](N)[C@H](CC)C2)c(O)c1 843053874 VRRZMOWPNWPWHX-IUODEOHRSA-N 278.396 2.350 10 20 CECD NC[C@@H]1CC[C@@H](NCc2cc(Cl)ccc2O)C1 841085211 XBATVYFPUSDYIF-BXKDBHETSA-N 254.761 2.263 10 20 CECD CCc1nnc(C(=O)NCc2cc(Cl)ccc2O)s1 911898251 NWYLICXOHXBKML-UHFFFAOYSA-N 297.767 2.390 10 20 CECD CCc1cccc(CN2CC[C@H](C(=O)OC)[C@@H]2C)c1O 848905011 FPZSMFCSBDODSS-FZMZJTMJSA-N 277.364 2.338 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@H]3CCC(=O)C3)ccc21 843778096 AQRACHCPSUATBA-CQSZACIVSA-N 286.375 2.054 10 20 CECD CO[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)CC(C)C 841446603 VBRHGHUCMMVPCG-VUDGCMKMSA-N 293.363 2.288 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 841298579 QWFNFUWFACRITP-MCIONIFRSA-N 287.363 2.348 10 20 CECD C[C@@H](NC(=O)OCCF)c1ccc(N2CCOCC2)cc1 858918081 NUDDWIMJRHWCNY-GFCCVEGCSA-N 296.342 2.280 10 20 CECD COC[C@H](CCO)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756595692 YCRGDGJLMNGJND-JFGNBEQYSA-N 283.343 2.067 10 20 CECD CCn1cnc2c1CCN(C(=O)Nc1ccc(N)cc1)C2 926143786 OYUBGJYRTPOXQN-UHFFFAOYSA-N 285.351 2.075 10 20 CECD C[C@@H](CN(C)C)NCc1cc(F)c(N(C)C)cc1F 858163734 IWBHZLBBVMQBMM-JTQLQIEISA-N 271.355 2.071 10 20 CECD COc1ccc(N(C)CC(=O)NCC(C)(C)C)cc1OC 859091171 DZKWZZJQDBMPBO-UHFFFAOYSA-N 294.395 2.302 10 20 CECD CN(Cc1ccc(N(C)C)cc1)CN1CC(C)(C)OC1=O 755701671 RKJNJWFUKWVUEB-UHFFFAOYSA-N 291.395 2.373 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CN(C)C1CCC1 863876310 UUIRYONKPXSFRU-UHFFFAOYSA-N 289.423 2.162 10 20 CECD CN(C)c1cc(F)c(CN[C@H](CC(=O)O)C2CC2)cc1F 864510389 WADWIJKPTNIOSA-CYBMUJFWSA-N 298.333 2.374 10 20 CECD Cc1ccc(O)c(CNC(=O)OC2CCOCC2)c1 1118877822 LUXAZCVSXRHSNA-UHFFFAOYSA-N 265.309 2.106 10 20 CECD C[C@H](C(=O)NCc1ccco1)N(C)Cc1ccccc1O 1116346195 GOOYBWWFEATYIZ-GFCCVEGCSA-N 288.347 2.122 10 20 CECD C[C@@H](NC[C@H](O)CC1(O)CCCCC1)c1ccccc1O 879650411 ZYAHQMPHQMNQQS-ZIAGYGMSSA-N 293.407 2.489 10 20 CECD CC(C)CC(=O)N1CCCN(Cc2ccccc2O)CC1 877774875 PGVAYSSKTVDOFB-UHFFFAOYSA-N 290.407 2.473 10 20 CECD N[C@@H]1CC=C(C(=O)N2CCCc3cc(F)ccc32)C1 876586446 FFTFRMVGJMLCGN-CYBMUJFWSA-N 260.312 2.152 10 20 CECD Cc1ccc(O)c(CNC(=O)NCC(C)(C)CCCO)c1 875451756 FIWULLHKWBNTAX-UHFFFAOYSA-N 294.395 2.299 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)[C@H](O)c1cccc(F)c1 777534566 RNVMBKWLKMANID-OQPBUACISA-N 295.335 2.445 10 20 CECD CN(C)c1ccc(CN2CCC(O)(C(F)F)CC2)cc1 779208081 AWFQTTYIPHHLRB-UHFFFAOYSA-N 284.350 2.345 10 20 CECD C[C@H](O)c1ncc(C(=O)N(C)Cc2ccccc2O)s1 774044615 SAJQLQISQYWHJS-VIFPVBQESA-N 292.360 2.174 10 20 CECD COc1cccc(CN=c2cc[nH]c3ccncc23)c1O 774525018 XAOZHSSJDNXUJI-UHFFFAOYSA-N 281.315 2.378 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCN1C)c1ccc(N(C)C)cc1 773021711 BJOUXAQYAAFXPV-DOMZBBRYSA-N 275.396 2.024 10 20 CECD CC[C@@H](F)C(=O)NCc1ccc(N(C)C)cc1C 1120950410 XNHIQXYPWRFYQY-CYBMUJFWSA-N 252.333 2.425 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)NCc1cc(F)cc(F)c1O 882941027 GGZIDBBMDNDDGN-DTWKUNHWSA-N 286.322 2.063 10 20 CECD NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1Cc1c(O)cccc1Cl 787423984 OPKQROCPRMGDAK-RULNRJAQSA-N 294.782 2.131 10 20 CECD COc1ccc(O)c(CN2CCCCC[C@@H]2CO)c1 895150219 ICYCFIZLZFWMRL-CYBMUJFWSA-N 265.353 2.138 10 20 CECD CN(C)CCC1CCN(Cc2ccc(N)cc2)CC1 700972091 GKEACCKERFASEC-UHFFFAOYSA-N 261.413 2.433 10 20 CECD OCC[C@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2 189985579 VYIHFUHXRYLIHP-HIFRSBDPSA-N 261.365 2.262 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)N1C[C@H](C)C[C@@H](C)C1 743259479 AESRRHUZHCHSHX-GHMZBOCLSA-N 298.408 2.335 10 20 CECD CCCN(Cc1ccccc1O)[C@@H]1CCN(C2CC2)C1=O 1330962451 GLWNUYWZEMRKOP-OAHLLOKOSA-N 288.391 2.368 10 20 CECD C[C@@H](CCC(=O)O)CNCc1cc(F)cc(F)c1O 1334841448 MTIUXPFIBWFPQE-QMMMGPOBSA-N 273.279 2.261 10 20 CECD COc1cccc(CN[C@H]2CC[C@@H](CC(=O)O)C2)c1O 1607322730 FHVOYELVTPQAJG-PWSUYJOCSA-N 279.336 2.134 10 20 CECD Cc1cccc(CNCCNC(=O)OC(C)(C)C)c1O 225927244 FTOGZYZXDXMJFW-UHFFFAOYSA-N 280.368 2.315 10 20 CECD O=C(O)CN(Cc1ccc(N2CCCC2)cc1)C1CC1 1610780826 FHSUOMRZSBLYQH-UHFFFAOYSA-N 274.364 2.336 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2C[C@H]3C[C@@]3(C(=O)O)C2)c1 1597130516 RETCWKDUWKLODE-HWWQOWPSSA-N 291.347 2.134 10 20 CECD COc1ccc(O)c(CNc2ncccc2C(=O)O)c1 1777367668 CTLFLIQPIPDQBW-UHFFFAOYSA-N 274.276 2.106 10 20 CECD Cc1cccc(O)c1CN1CC[C@@]2(CCN(C)C2)C1 877545964 NDHJRPZMJWXDPI-MRXNPFEDSA-N 260.381 2.228 10 20 CECD Cc1noc(CN[C@H](C)c2ccc(N(C)C)cc2)n1 38034085 KAJHUDWUZQPEOP-SNVBAGLBSA-N 260.341 2.295 10 20 CECD COc1ccc(O)c([C@@H](C)NCCN2CC=CCC2)c1 280972450 LKUFESRJCBAWOD-CYBMUJFWSA-N 276.380 2.313 10 20 CECD COC[C@@H]1CCCCN1Cc1cc(OC)ccc1O 307783676 QXQYHBATLLVWHD-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@@H]1CCCCO1 708558333 FQJCCHWUUOHPEX-NSHDSACASA-N 257.280 2.329 10 20 CECD CCOc1ccc(N(C)C[C@H](O)COC(C)C)cc1 304305324 PJJKABSFDMUNGA-AWEZNQCLSA-N 267.369 2.307 10 20 CECD CC(C)n1cccc1C(=O)NCc1cccc(O)c1O 1349079618 ONBUWMFXEHWPGS-UHFFFAOYSA-N 274.320 2.410 10 20 CECD COc1csc(C(=O)NCCc2ccc(O)c(O)c2)c1 122307565 NPMQMHSIVNMPIH-UHFFFAOYSA-N 293.344 2.140 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](N(C)C)[C@@H]2C)c1O 314399511 XASFWSBKQGRZTI-BONVTDFDSA-N 294.370 2.258 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccc(O)cc2)c(O)c1O 182586162 AZDUDTJYPJNYHO-UHFFFAOYSA-N 287.315 2.384 10 20 CECD CCC[C@@H](C)CS(=O)(=O)NCCc1ccc(N)cc1 193338774 UESAUJIJAZIUIW-GFCCVEGCSA-N 284.425 2.167 10 20 CECD Oc1ccccc1CNCCCOCC(F)(F)F 134226375 RJRAGGMQHALXHJ-UHFFFAOYSA-N 263.259 2.451 10 20 CECD C[C@H](N[C@H](C)CO)c1cc(Br)cc(F)c1O 134913861 OEWSZEMGQZUQTB-RQJHMYQMSA-N 292.148 2.325 10 20 CECD C[C@@H]1CN(C)CC[C@@H]1N(C)Cc1cc(F)ccc1O 290599282 VUXCMXPXPHQSAF-RISCZKNCSA-N 266.360 2.303 10 20 CECD N[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 50227688 YMYMPYXOMLYYBY-VIFPVBQESA-N 261.152 2.232 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@@H](C)[C@H]2C2CC2)c(O)c1 529225753 AHMQRFKYDWBQNB-ULKVUYOBSA-N 275.348 2.309 10 20 CECD Cc1ccc(O)c(CN[C@@]2(CO)COc3ccccc3C2)c1 527768499 BLQZWBKAWUEROI-SFHVURJKSA-N 299.370 2.156 10 20 CECD CO[C@@H](C)CCNC(=O)N(C)Cc1ccc(N(C)C)cc1 263758861 LKUUZBTYMROLER-ZDUSSCGKSA-N 293.411 2.319 10 20 CECD CC(C)C[C@@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CCO1 279800890 JSRXZQFCXUNGMN-NWDGAFQWSA-N 293.363 2.421 10 20 CECD NC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1Cc1cc(Cl)ccc1O 373739231 VOHJHMFYEHLAQR-LQJRIPTKSA-N 294.782 2.131 10 20 CECD CC1=CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 280851709 ZQJWIUODRZLJAU-FNORWQNLSA-N 259.305 2.290 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1cc(OC)ccc1O 293808709 DYESNGWREZUUJP-LBPRGKRZSA-N 294.395 2.043 10 20 CECD CN(C)c1ccc(CN(Cc2ccco2)C(N)=O)cc1 299033295 CUDCJUJEQOOACN-UHFFFAOYSA-N 273.336 2.427 10 20 CECD CCC1(NCc2cc(OC)c(OC)cc2O)CC1 294700579 CYLVOUUONDCMHM-UHFFFAOYSA-N 251.326 2.442 10 20 CECD CCOc1ccc(N(CC)CC(=O)N2CCC2)cc1 299365453 DNQAELVJCDKLMI-UHFFFAOYSA-N 262.353 2.144 10 20 CECD O=C(O)C[C@@H]1CCCN(Cc2cccc(F)c2O)C1 821515688 MKICEGFMYMCJQS-JTQLQIEISA-N 267.300 2.218 10 20 CECD Cc1cccc(N(C)C(=O)/C=C/c2cnn(C)c2)c1 727093650 UTOFRNNXUUMFIE-BQYQJAHWSA-N 255.321 2.405 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](CO)C2)cc1Cl 824655837 AOXGZARJNWSCSB-SNVBAGLBSA-N 255.745 2.168 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCN2C)c1cn(C)nn1 902779237 PCKSRHORZOQXBU-LBPRGKRZSA-N 285.395 2.048 10 20 CECD CCN(C)c1ccc(/C=C2\SC(=S)N(C)C2=O)cn1 588578156 VRJRYNUNJUUIRC-YFHOEESVSA-N 293.417 2.369 10 20 CECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1cc(O)cs1 731870015 HVWYFBYIDGDIAR-MNOVXSKESA-N 282.409 2.304 10 20 CECD Cc1cc(O)c(CN2CC[C@](C)(C(=O)O)C2)cc1C 832900347 ZBNLDOSHDOCLRP-HNNXBMFYSA-N 263.337 2.306 10 20 CECD C[C@@H]1C[C@@H](NCC2(N)CC2)c2c(O)ccc(F)c21 902406119 LTSKDBWQBAQYGC-PSASIEDQSA-N 250.317 2.161 10 20 CECD CCOC(=O)[C@@H](CC)N(C(=O)c1cc(O)cs1)C1CC1 832824004 RJYCLFYNZNGSPN-LLVKDONJSA-N 297.376 2.400 10 20 CECD CCCCC(=O)OCC(=O)c1ccc(O)c(O)c1 916589949 MGYNPLHFGJERQN-UHFFFAOYSA-N 252.266 2.014 10 20 CECD C[C@H](N[C@@H](CO)CCF)c1ccc(Cl)cc1O 846209986 VEPJRASIVAFROI-WCBMZHEXSA-N 261.724 2.417 10 20 CECD CCc1cccc(CN2CCC[C@@H](CCC(N)=O)C2)c1O 848884091 WZZDSTQWOQZGMC-ZDUSSCGKSA-N 290.407 2.432 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H](C)N[C@H](C)C1 843049002 CTZRWDODUUJBFC-ZIAGYGMSSA-N 261.413 2.243 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCCNC1 841032358 BMMJMXDAOYUVEZ-TZMCWYRMSA-N 279.403 2.369 10 20 CECD CC(C)(C)c1[nH]cnc1C(=O)NCc1ccc(O)cc1O 910944186 MCFYMSJWAUVYMB-UHFFFAOYSA-N 289.335 2.048 10 20 CECD C[C@@H](NCc1nnn(C(C)(C)C)n1)c1cc(F)ccc1O 848561234 RWASKKAHKRKZBJ-SECBINFHSA-N 293.346 2.124 10 20 CECD CC[C@H](CN(C)CCN(C)c1ccc(OC)cc1)OC 844402248 QVRVJYHTYOPDEL-OAHLLOKOSA-N 280.412 2.488 10 20 CECD CC[C@H](C)NC(=N)NCc1cc(Cl)ccc1O 849048793 LMAUKUVYEUZMHN-QMMMGPOBSA-N 255.749 2.458 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CCNC(=O)C(C)C 840919922 DOCYDJOTWFZAPI-UHFFFAOYSA-N 291.439 2.265 10 20 CECD COc1ccc(CN[C@H]2CCN(C(C)=O)C[C@H]2C)cc1C 742218426 HOZPOLYMTPGJRK-CJNGLKHVSA-N 290.407 2.350 10 20 CECD Cc1cccc(CN2CCNC[C@H]2c2ccncc2)c1O 843120474 MGHHWXOPVOQXIL-INIZCTEOSA-N 283.375 2.242 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H](C)c2ccco2)c1 743412710 LOHGUGQKAFWEJT-SNVBAGLBSA-N 275.304 2.414 10 20 CECD C[C@H](Cc1ccccn1)NCc1cc([N+](=O)[O-])ccc1O 848566568 BCXIVFHIXGZISL-LLVKDONJSA-N 287.319 2.416 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCC(C)(C)N 841949860 HZJKKDRBWSDJDK-UHFFFAOYSA-N 279.384 2.051 10 20 CECD CCOC(=O)/C=C\CN(C)c1ccc(OC)c(F)c1 929824151 DCAMTMWMEWCIDD-WAYWQWQTSA-N 267.300 2.390 10 20 CECD CCNC(=O)[C@H](C)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756355142 JMQLDYWDMHFPPD-YWVKMMECSA-N 280.343 2.194 10 20 CECD CC(C)NC(=O)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756359798 DLFCRROGXKYDKR-GXSJLCMTSA-N 280.343 2.194 10 20 CECD CC[C@@H](O)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 850529756 SRANUMIRXQFOQA-IQJOONFLSA-N 253.317 2.440 10 20 CECD Cc1cccnc1COC(=O)c1cccc(O)c1O 758547759 NKKWONXWELRPQF-UHFFFAOYSA-N 259.261 2.158 10 20 CECD CN(C)CCN(Cc1ccco1)C(=O)c1cc(O)cs1 755870291 BJADBPQMERBYRF-UHFFFAOYSA-N 294.376 2.251 10 20 CECD C[C@@H]1OCC[C@@H]1COC(=O)/C=C\c1ccc(O)c(O)c1 869441986 ABGNNZQVVKDFQO-CNNPOGIWSA-N 278.304 2.079 10 20 CECD C[C@H](NC(=O)NCc1cccnn1)c1ccc(N(C)C)cc1 767860888 NOUKEVHEWAKUPV-LBPRGKRZSA-N 299.378 2.103 10 20 CECD Cc1cccc(O)c1CNC[C@H]1CC(=O)N(C(C)(C)C)C1 877636013 KKFOIPRYJGEHGT-CYBMUJFWSA-N 290.407 2.437 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1ccc(C)cc1O 877549161 IAQLMNYTUIYRFI-ZDUSSCGKSA-N 278.396 2.343 10 20 CECD COc1ccc2c(c1)CCCN2Cc1ccn(C)n1 775936695 WRTRHKHBOYFJQO-UHFFFAOYSA-N 257.337 2.382 10 20 CECD C[C@@H](NS(=O)(=O)c1ccco1)c1ccc(N(C)C)cc1 782483757 PVRKNJQEBOUGLZ-LLVKDONJSA-N 294.376 2.385 10 20 CECD CC[C@@H](COC)NCc1cc(C)cc(OC)c1O 894287354 DUIAFXIAHLYIEB-LBPRGKRZSA-N 253.342 2.224 10 20 CECD Cc1ccc(CN[C@H]2c3ccccc3C[C@H]2O)c(O)c1 83514125 FZYNUAGGOMIEGA-SJORKVTESA-N 269.344 2.449 10 20 CECD CCN1CCN(Cc2cc(C)cc(OC)c2O)C[C@H]1C 894013252 BEBFFDBVYCLELQ-CYBMUJFWSA-N 278.396 2.235 10 20 CECD Cc1ncccc1CCNC(=O)N(C)Cc1ccccc1O 898934419 NKLBGZSYEFPQGV-UHFFFAOYSA-N 299.374 2.480 10 20 CECD COc1ccc(CNCCNC(=O)C[C@@H]2C[C@H]2C)cc1C 1133357359 XEJDDESSABZSTA-DOMZBBRYSA-N 290.407 2.256 10 20 CECD CC[C@@H](CO)NCc1c(O)cccc1Br 706829171 OKOICPTYJSSILG-QMMMGPOBSA-N 274.158 2.015 10 20 CECD COc1cc(Cl)cc(CN2CCC(C)(N)CC2)c1O 707778615 BIRJUJGNOGJEOT-UHFFFAOYSA-N 284.787 2.367 10 20 CECD CC[C@@]1(C)CN(Cc2cccc(OC)c2O)CCO1 191153454 UCXYDISFOVLTBK-HNNXBMFYSA-N 265.353 2.402 10 20 CECD COc1ccc(CNC(=O)OCC(F)(F)F)c(O)c1 794761102 FAVVQORVTGAHEF-UHFFFAOYSA-N 279.214 2.189 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@@H](c3cc[nH]n3)C2)cc1 1335729556 FFYQGINIKBVVKX-CYBMUJFWSA-N 299.378 2.081 10 20 CECD Nc1ccc(CNC(=O)N2CC[C@@H](c3cccnc3)C2)cc1 1338793979 VOWZLEWNNRMROY-OAHLLOKOSA-N 296.374 2.363 10 20 CECD CC[C@@H](NC[C@H](C)CNC)c1ccc(F)cc1O 1345481599 DPQJVBJVTLFKQI-ZWNOBZJWSA-N 254.349 2.428 10 20 CECD COc1cccc(CNC(=O)/C=C/c2nccs2)c1O 1348007088 SLSCZKNGGXUNNZ-AATRIKPKSA-N 290.344 2.187 10 20 CECD C[C@H](CNCc1cc(F)ccc1O)N(C)C1CC1 226607797 XYWKXBZZPMCWSE-SNVBAGLBSA-N 252.333 2.104 10 20 CECD CCC(CC)(CN)NCc1cc(OC)c(OC)cc1O 1577059252 PLUWPIAQDLHLLN-UHFFFAOYSA-N 282.384 2.017 10 20 CECD C[C@H](NC[C@H](C)C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589958808 LSTUQJAUMCBHEC-UWVGGRQHSA-N 287.367 2.269 10 20 CECD CN(Cc1cccnc1)c1ccc(OCC(=O)O)cc1 1598532087 NRUVEYIAOZWYBV-UHFFFAOYSA-N 272.304 2.181 10 20 CECD CN(C)c1ccc(CNC(=O)NC2(C)CCC2)cc1 165677175 SKHDPKPSRSLTRW-UHFFFAOYSA-N 261.369 2.494 10 20 CECD Cn1ccc(NC(=O)NCc2ccc(N3CC=CC3)cc2)n1 151344451 ZJKKEMPPMJGKDM-UHFFFAOYSA-N 297.362 2.118 10 20 CECD C[C@@H](Cc1ccco1)NC(=O)c1cccc(O)c1O 126300927 JRKXEWBNNAZOSH-VIFPVBQESA-N 261.277 2.052 10 20 CECD COc1cc(Cl)cc(CN2CCO[C@@H](CF)C2)c1O 840954148 HJBJYGGWIMHTLH-NSHDSACASA-N 289.734 2.225 10 20 CECD C[S@](=O)C1(CN[C@@H]2CCc3cccc(O)c32)CCC1 296240945 AUUXTQBWMRWVEP-BLVKFPJESA-N 279.405 2.270 10 20 CECD CN(Cc1ccccc1O)C(=O)CC[C@H]1CCCO1 77258393 BMOKPFLBWXSSRY-CYBMUJFWSA-N 263.337 2.310 10 20 CECD O=C(NCc1ccccc1O)c1csc([N+](=O)[O-])c1 701115650 UDFGRNPRVZXANK-UHFFFAOYSA-N 278.289 2.292 10 20 CECD CCc1cccc(CNCCC(C)(C)CO)c1O 691433957 KIYUTOURNDNZNE-UHFFFAOYSA-N 251.370 2.453 10 20 CECD CCc1ccnc(CNC(=O)Cc2ccc(N)cc2)c1 831961633 YRBAXXJPFHYQCA-UHFFFAOYSA-N 269.348 2.085 10 20 CECD Cc1ccc(C(=O)NC2CCN(C(C)C)CC2)c(O)c1O 179395190 RDGSJZMKPONMGG-UHFFFAOYSA-N 292.379 2.009 10 20 CECD CCOc1cccc(CN2CCC[C@@H]2CC(=O)OC)c1O 179891222 SMQGFBAAOGQFCL-CYBMUJFWSA-N 293.363 2.318 10 20 CECD COc1cccc(CNC(=O)Cc2ccccc2F)c1O 68488621 MICCMSJMYJRJPM-UHFFFAOYSA-N 289.306 2.399 10 20 CECD COCCC[C@H](C)C(=O)NCc1ccc(N(C)C)cc1 182253474 HQPWFQWJXUYEPD-ZDUSSCGKSA-N 278.396 2.432 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccc(O)cc2C1 126574493 JQAXGXCHLYUOBK-UHFFFAOYSA-N 285.299 2.002 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2ccc(C)cc2O)C1 185788533 UHGFOBPWLBJWAZ-STQMWFEESA-N 276.380 2.362 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1ccc(F)c(F)c1O 187723560 VDMHTLGKUKIXQY-OTYXRUKQSA-N 289.322 2.109 10 20 CECD C[C@H]1SCCN(C(=O)c2cccc(O)c2O)[C@@H]1C 126564904 ZDEPKSJRAPYXFR-RKDXNWHRSA-N 267.350 2.064 10 20 CECD CSCC[C@H](C)N(C)C(=O)Cc1ccc(N)cc1 157128773 DTMLIJHZRHGGOR-NSHDSACASA-N 266.410 2.411 10 20 CECD Cc1ccc(C(=O)NCCC[C@@H]2CCCCO2)c(O)c1O 184354351 XZMZCPODZDROBK-LBPRGKRZSA-N 293.363 2.485 10 20 CECD COC(=O)[C@H](C)N(Cc1cccc(OC)c1O)C1CCC1 191649345 MMGMPTKVVDTVAN-NSHDSACASA-N 293.363 2.317 10 20 CECD C[C@@]1(NCc2ccc(N3CCOCC3)cc2)CCCOC1 221340725 JEKATRYEFLQCTR-QGZVFWFLSA-N 290.407 2.182 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2CO)c1O 50152209 JWRQGFYTPPBHKA-CYBMUJFWSA-N 281.327 2.081 10 20 CECD CC[C@@H](NCc1ccc2c(c1)CCO2)[C@H](O)C(F)(F)F 270966532 ILMXHBLJAMGBIY-YPMHNXCESA-N 289.297 2.413 10 20 CECD Nc1cccc(C(=O)NCc2c(O)ccc3c2CCCC3)n1 272518423 YVEVTKSXWUSTKM-UHFFFAOYSA-N 297.358 2.178 10 20 CECD Oc1ccc2c(c1)OCCN(Cc1ccccc1O)C2 289262610 FTGVMZABHBZYDY-UHFFFAOYSA-N 271.316 2.492 10 20 CECD COC(=O)c1cnc(SCCn2ccnc2C)s1 295370235 SGNSQNRYWLXRPO-UHFFFAOYSA-N 283.378 2.227 10 20 CECD CCOc1ccc(O)c(CN(C)[C@H](CO)COC(C)C)c1 809768774 WOOWJMOPJZLJAM-CQSZACIVSA-N 297.395 2.009 10 20 CECD CCOc1ccc(CN[C@@H](CO)C2CCCC2)c(O)c1 810178601 SINUFJPDSCWKSM-HNNXBMFYSA-N 279.380 2.432 10 20 CECD O=C(/C=C\c1cccnc1)N1C[C@@H](CO)Cc2ccccc21 816785829 VECYIYYIGMQNAE-LZNQSLFOSA-N 294.354 2.293 10 20 CECD C[S@](=O)CCCNCc1ccc2ccccc2c1O 816552806 XQWLMBSAXWDLQD-IBGZPJMESA-N 277.389 2.404 10 20 CECD CO[C@@](C)(C(=O)N[C@H](C)c1ccccc1O)C1CC1 827946534 LBMDRSLPSGCYHH-MEBBXXQBSA-N 263.337 2.385 10 20 CECD CN1CCCc2cc(CNC(=O)c3ncccc3O)ccc21 725893706 SJARPPQCTIXLND-UHFFFAOYSA-N 297.358 2.100 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Cc1cscn1 827956031 NIVPNZLNZQKAQM-UHFFFAOYSA-N 289.404 2.376 10 20 CECD Cc1noc(C)c1CN(C)C(=O)c1cc(O)cs1 731869393 QVRPDILTRLPZDH-UHFFFAOYSA-N 266.322 2.331 10 20 CECD CC1(C)CC(NC(=O)c2cc(O)cs2)CC(C)(C)N1 732263302 NPPYKOFVAXKBSW-UHFFFAOYSA-N 282.409 2.493 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Cl)c(F)cc2O)CO1 843432935 RMLDUNKOSBUZKV-VXNVDRBHSA-N 259.708 2.452 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)CCN)cc1F 841049749 GXAYVWPXLUYWAJ-GFCCVEGCSA-N 267.392 2.499 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](N)C2)cc1F 843046807 CTPKZAGSXCAIEY-ZDUSSCGKSA-N 265.376 2.205 10 20 CECD CCOCc1cc(CN[C@@H](CO)CCF)ccc1OC 846096405 HLEHPWSVTHUDHE-CQSZACIVSA-N 285.359 2.042 10 20 CECD Oc1c(F)cccc1CN(C1CCNCC1)C1CC1 843044182 WRUVIJPSWWZMGJ-UHFFFAOYSA-N 264.344 2.248 10 20 CECD CCN[C@H](C)CNCc1cc(Cl)cc(F)c1O 841067030 ZKFDYWBXVHTZSN-MRVPVSSYSA-N 260.740 2.272 10 20 CECD CCCN(CC(=O)O)Cc1ccc(N(C)CC)cc1 846265348 GXIWQJRHKBLOIF-UHFFFAOYSA-N 264.369 2.439 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(C)(C)CO 848227042 YRBXNTPDYGFYIT-CYBMUJFWSA-N 292.423 2.127 10 20 CECD NC[C@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 843047772 TWNPNMSCGGIMSV-SECBINFHSA-N 272.751 2.355 10 20 CECD N[C@@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 843047747 ZAGBIRGGWRBNND-MRVPVSSYSA-N 258.724 2.108 10 20 CECD CC[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)[C@H](C)CO1 846175292 YITPUCDZYZPBTM-IUODEOHRSA-N 291.395 2.020 10 20 CECD C[C@@H](N[C@H](CO)CCF)c1ccc(N(C)C)cc1 846208776 KZGRNKOEEXXRGW-YPMHNXCESA-N 254.349 2.124 10 20 CECD CCN(Cc1ccc(N(C)C)c(C)c1)[C@@H]1CCNC1 923424899 IHJMGQWIZNUBFQ-OAHLLOKOSA-N 261.413 2.245 10 20 CECD C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)NC2(CCC2)C1=O 761579898 QFFIFILOBBOQJT-NSHDSACASA-N 287.363 2.288 10 20 CECD CCOc1ccc(CN(C)Cc2cnn(C)c2)c(O)c1 768200202 LNULYYRAUKQEOU-UHFFFAOYSA-N 275.352 2.156 10 20 CECD C[C@H]1CN(CCN[C@H](C)c2ccc(N(C)C)cc2)CCO1 765789095 OWVSXOMMYYTSJM-LSDHHAIUSA-N 291.439 2.124 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@@H](C)S1 768465239 DJTZYHQLFUYBAI-RULNRJAQSA-N 295.404 2.144 10 20 CECD CCOc1ccc(O)c(CN[C@@]2(CCOC)CCOC2)c1 775033205 NJJLAARGMDDVRG-INIZCTEOSA-N 295.379 2.076 10 20 CECD C[C@H](CC(=O)O)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 872859758 SCBBPUVYCZAPOK-NWDGAFQWSA-N 292.379 2.431 10 20 CECD C[C@H](NC(=O)NCc1cc[nH]n1)c1ccc(N(C)C)cc1 773369352 UIDZGCAZCDSLHY-NSHDSACASA-N 287.367 2.036 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCC(C)(C)C(=O)O)c1 1121815300 GDRQFMUFBVAKKC-UHFFFAOYSA-N 294.351 2.001 10 20 CECD O=C(c1cc(O)cs1)N1CCC([C@@H]2CCCO2)CC1 784798565 RLMTXRSNKBGEHV-LBPRGKRZSA-N 281.377 2.485 10 20 CECD OCCc1ccc(CNCc2ccccc2O)cc1 898172466 KCNVVPYHQWPRMG-UHFFFAOYSA-N 257.333 2.217 10 20 CECD CO[C@@]1(CNCc2c(O)ccc(Cl)c2F)CCOC1 790990035 IGIWXQOTOPNZCO-CYBMUJFWSA-N 289.734 2.080 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CCN(C2CC2)C1 83552447 SQZRPVJYTIUQTH-SNVBAGLBSA-N 266.772 2.372 10 20 CECD CCc1ccnc(CNC(=O)c2cc(O)cs2)c1 798123484 OGNYAGDKZBWJRJ-UHFFFAOYSA-N 262.334 2.341 10 20 CECD C[C@H]1CCCN1CCNC(=O)N(C)Cc1ccccc1O 897478085 KEBCOLNEAIZCQS-ZDUSSCGKSA-N 291.395 2.018 10 20 CECD CNC(=O)c1ccc(NCc2c(O)cccc2OC)cc1 796367780 SCMVNHWTDGLERI-UHFFFAOYSA-N 286.331 2.373 10 20 CECD CCc1cccc(CNCC(=O)NCc2ccccc2)c1O 691438645 QNVZVEDUTPNHDQ-UHFFFAOYSA-N 298.386 2.361 10 20 CECD CCN1CCN(C(=O)/C=C/[C@@H]2CCCNC2)c2ccccc21 1333335071 AUHZKTVSKLHZMI-FEAKQIBJSA-N 299.418 2.415 10 20 CECD COCCCc1cn(Cc2ccc(N(C)C)c(C)c2)nn1 1333125114 MGPWEQAYBUAJLF-UHFFFAOYSA-N 288.395 2.280 10 20 CECD CN(C(=O)c1c2c(nn1C)CCCC2)c1ccc(N)cc1 1342335590 ZXWSGNDAJGMEIM-UHFFFAOYSA-N 284.363 2.158 10 20 CECD C[C@@H](NC(=O)[C@@]1(F)CCOC1)c1ccc(N(C)C)cc1 1261087330 NHVTVMPOYDYCJR-IAQYHMDHSA-N 280.343 2.058 10 20 CECD O=C(N[C@H](C(=O)O)c1ccccc1)c1cc(O)cs1 1601568904 WDUKNFURMBKPIE-NSHDSACASA-N 277.301 2.009 10 20 CECD C[C@H](CCCCN)N[C@H](C)c1cc(C(=O)O)ccc1O 1609738990 ZIAXGZMEIDYYSN-GHMZBOCLSA-N 280.368 2.259 10 20 CECD CC[C@H](C)C[C@@H](NCc1cc(OC)ccc1O)C(=O)O 1604952177 OXVUMPKHWMSAPL-GXFFZTMASA-N 281.352 2.380 10 20 CECD O=C(O)[C@H](NCc1cc(F)ccc1O)c1cccc(O)c1 1610720791 SZFMZDPEQGVGPR-CQSZACIVSA-N 291.278 2.152 10 20 CECD COc1cc(Cl)cc(CNCCN(C)C(C)C)c1O 228672903 KFTLQYGGKAGSBE-UHFFFAOYSA-N 286.803 2.484 10 20 CECD C[C@H](N[C@H](C)C(=O)NC1CC1)c1ccc(N(C)C)cc1 228949547 ODLDMVFUABIEDL-NWDGAFQWSA-N 275.396 2.070 10 20 CECD C[C@H]1CCCN(Cc2ccc(F)c(F)c2O)[C@H]1C(=O)O 1589333887 FBYMVLWUQUCQTH-QPUJVOFHSA-N 285.290 2.356 10 20 CECD C[C@@H]1CCCC[C@H]1OCC(=O)NCc1ccc(O)c(O)c1 159140743 NLJMGVVJAIRXDI-IAQYHMDHSA-N 293.363 2.309 10 20 CECD CCn1nccc1CN[C@@H](C)c1cc(OC)ccc1O 845971931 OFUINVHULBAWQJ-NSHDSACASA-N 275.352 2.468 10 20 CECD C[C@@H](NC(=O)C1(N)CCCCC1)c1ccccc1O 877255212 AGTYZHXSRYSXIM-LLVKDONJSA-N 262.353 2.231 10 20 CECD CCN(CC)CCN[C@@H](C)c1cc(OC)ccc1O 19919479 TZECVXSRSGFAKP-LBPRGKRZSA-N 266.385 2.393 10 20 CECD CN1CCC[C@H](CN(C)Cc2cc(F)ccc2O)C1 179938717 QBDLKILEQXGTSS-LBPRGKRZSA-N 266.360 2.305 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)c1cn(C)cn1 710115703 HTPDKMYKNQTWDW-LLVKDONJSA-N 257.337 2.206 10 20 CECD OCC[C@H](NCc1ccc2c(c1)CCO2)C(F)(F)F 821206784 IPCPFFQLUDXZST-LBPRGKRZSA-N 275.270 2.024 10 20 CECD CC[C@@H](COC)NC(=O)NCc1ccc(N(C)C)cc1C 129334623 UKRFIDNOLXXXPH-AWEZNQCLSA-N 293.411 2.285 10 20 CECD C[C@H](N[C@H](C)CO[C@@H]1CCOC1)c1ccc(F)cc1O 185673310 GTIMKYCCURZICH-NTZNESFSSA-N 283.343 2.376 10 20 CECD CC[C@@H]1CCCCN1CCNC(=O)c1cccc(O)c1O 187091505 KEDIIYMBFGKJIV-GFCCVEGCSA-N 292.379 2.092 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)N2CCC[C@@H](O)C2)s1 1537962897 IFFYMYUGEKFJTL-MRVPVSSYSA-N 266.326 2.155 10 20 CECD CC(C)CNC(=O)CNCc1ccc(N2CCCC2)cc1 134637132 MOMLATGPTHOLTQ-UHFFFAOYSA-N 289.423 2.149 10 20 CECD Cc1nnnn1CC(=O)c1cc(C)n(-c2ccccc2)c1C 131855490 YGFAZNJVTWTPSH-UHFFFAOYSA-N 295.346 2.272 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CC[C@H](N)C1 236732878 KXJHTACQCRRAHQ-OCCSQVGLSA-N 276.380 2.258 10 20 CECD CC(C)(C)CN(CCCO)Cc1cc2c(cc1O)OCO2 93146348 FKKGXVAEPJRMRR-UHFFFAOYSA-N 295.379 2.351 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@@H]1[C@@H](O)C(F)(F)F 272214348 AZXDYLMBUQEZTF-ZYHUDNBSSA-N 293.260 2.419 10 20 CECD C[C@@H]1C[C@@H](CCNCc2cc3c(cc2O)OCO3)CCO1 273076498 PPSPDNFXPXACHD-NEPJUHHUSA-N 293.363 2.416 10 20 CECD COC(=O)[C@H](CC(F)(F)F)NCc1cc(F)ccc1O 276548584 YTTDSMNCUPRHEF-VIFPVBQESA-N 295.232 2.115 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1ccncc1 803400672 GUJDUGYQDWHQNO-RQOWECAXSA-N 271.272 2.249 10 20 CECD CCOc1cccc(CN(C)CC(C)(C)CO)c1O 294774213 KLTZAIXQOXMQAI-UHFFFAOYSA-N 267.369 2.241 10 20 CECD CCN(Cc1cc(OC)c(OC)cc1O)C[C@H](C)OC 291273020 ZORJRANJGDRWSI-NSHDSACASA-N 283.368 2.266 10 20 CECD COc1cccc(CN2CCC[C@@H]3CN(C)CC[C@@H]32)c1O 290641804 YMXYPIUKZUZQMM-HIFRSBDPSA-N 290.407 2.317 10 20 CECD Cc1cc(CN[C@H](C)c2ncn(C)n2)ccc1N(C)C 815099482 XEGDDLCUHNNNPA-GFCCVEGCSA-N 273.384 2.040 10 20 CECD CCn1nnc(C)c1CN(C)c1ccc(OC)cc1OC 828474948 VDYGBBNHOVYUEU-UHFFFAOYSA-N 290.367 2.260 10 20 CECD N[C@H]1Cc2ccccc2N(Cc2cccc3c2CCNC3)C1 662282173 SZFLGDLRTDXFGG-KRWDZBQOSA-N 293.414 2.222 10 20 CECD CC(C)C1(O)CN(Cc2cccc(Cl)c2O)C1 839133896 XLTOYHZYCDMFNA-UHFFFAOYSA-N 255.745 2.248 10 20 CECD O=C(O)c1cc(NCc2ccc(N3CCCC3)cc2)ncn1 906139378 KLHOOGZJAKSDCJ-UHFFFAOYSA-N 298.346 2.387 10 20 CECD COc1ccc(N(C)CCC2(O)CCC2)cc1OC 839472299 MZQNCRCRXARYOB-UHFFFAOYSA-N 265.353 2.445 10 20 CECD COC(=O)CN(CC(C)C)c1ccc(OC)cc1 741780605 JDHYGWBHOBBVRG-UHFFFAOYSA-N 251.326 2.331 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)C2CCC2)cc1 844852577 RDDJUCQPPZVIOX-UHFFFAOYSA-N 276.380 2.390 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1cccc(Cl)c1O 843065855 QTPJZDCUOLQPJX-AOOOYVTPSA-N 254.761 2.228 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)Cn2ccnc2)c1O 846138207 AAIFZGMXNGWGCO-NWDGAFQWSA-N 275.352 2.337 10 20 CECD N=C(NCc1ccc(N2CCCC2)cc1)N1CCC1 848993244 OMVPYDLNCTWNRX-UHFFFAOYSA-N 258.369 2.017 10 20 CECD CC[C@@H]1CN(C(=O)c2cc(O)cs2)[C@@H](C)CO1 846660013 SLJOZVCOFFGTLQ-WCBMZHEXSA-N 255.339 2.093 10 20 CECD COc1ccc(N2CCN(CC(C)C)CC2)c(OC)c1 846745189 DKQPEPXSXWYHPK-UHFFFAOYSA-N 278.396 2.482 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@H]1CN 841028523 AKLMIUAEZYZEEJ-XJKSGUPXSA-N 261.413 2.278 10 20 CECD CCc1cccc(CN2C[C@H](C)O[C@@]3(CCOC3)C2)c1O 848908082 MRKSVAVDTTWLQI-GUYCJALGSA-N 291.391 2.334 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C)[C@H](CN)C1 841099573 MEQGGSQAESGADI-XJKSGUPXSA-N 275.440 2.478 10 20 CECD C[C@@H]1C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CS1 840510204 MZUNFUITUKFVOB-FYGOAMBHSA-N 279.361 2.121 10 20 CECD CO[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)[C@@H](C)C1 841958634 HIYXOBNAYHWBGE-SWLSCSKDSA-N 291.395 2.020 10 20 CECD COc1cc(CN2C[C@@H]3[C@@H](C2)C3(F)F)c(O)cc1C 844758232 SXRKVHZPQYSMAF-GHMZBOCLSA-N 269.291 2.406 10 20 CECD C[C@H](NCC1(CO)CCC1)c1cc(F)cc(F)c1O 757655784 GRCGEFCCBXSBKL-VIFPVBQESA-N 271.307 2.484 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)[C@@H](CO)C2)cc1C 857061109 KANXBYMLXYHMRA-XHDPSFHLSA-N 263.381 2.459 10 20 CECD C[C@@H](NC(=O)NCCOCC(F)F)c1ccccc1O 868530874 QPSVXGDCWSWTJE-SECBINFHSA-N 288.294 2.034 10 20 CECD Cc1ccc([C@H](C)C(=O)NCCc2ccc(O)c(O)c2)o1 762275709 YEKBBDIZZLTFIT-NSHDSACASA-N 289.331 2.462 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1ccc(N2CCCC2)cc1 1116443764 GITRGLRYROXNPS-INIZCTEOSA-N 288.391 2.424 10 20 CECD CC(C)(C)c1cc(C(=O)NCc2cccc(O)c2O)[nH]n1 1123890134 UJOQFBCOGVPDKL-UHFFFAOYSA-N 289.335 2.048 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@H](C)c1c(O)cccc1F 886590433 VGJCTPUNYLUZKD-MPKXVKKWSA-N 283.343 2.376 10 20 CECD CC[C@H](O)CCCNCc1ccc(OC)c(OC)c1O 893019498 TWSMJODEXHLDAT-LBPRGKRZSA-N 283.368 2.050 10 20 CECD Cc1ccc(CN2CCO[C@@H](c3ccnn3C)C2)c(O)c1 897566961 BBDPSMXBVJNRHX-MRXNPFEDSA-N 287.363 2.008 10 20 CECD COc1cccc(CNC[C@@H]2CCCC[C@H]2O)c1O 77204634 VBCLNJXEGIFHHK-WCQYABFASA-N 265.353 2.042 10 20 CECD CN(C)c1cccc(CNC(=O)c2cccc(O)c2O)c1 790606243 YUJQHSJEFPXCOM-UHFFFAOYSA-N 286.331 2.094 10 20 CECD CON1CCC(N[C@@H](C)c2cc(C)ccc2O)CC1 692096910 FMTQCGJDLFIVRF-LBPRGKRZSA-N 264.369 2.377 10 20 CECD Cc1cc(NCc2ccc(N3CCCC3)cc2)nc(CO)n1 1322662616 SUGNVWMWKUXWMD-UHFFFAOYSA-N 298.390 2.490 10 20 CECD COc1cc(CN2CCCN3CCC[C@H]3C2)c(O)cc1C 1323286398 WUHMAAFGVQBWSY-HNNXBMFYSA-N 290.407 2.379 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCOC(C)(C)C2)c(O)c1 1337209887 JWGAUPCEQZQTMG-LLVKDONJSA-N 293.363 2.222 10 20 CECD O=C(O)[C@@H](C[C@H]1CCCO1)NCc1cccc(Cl)c1O 1601641573 MEVMBCIDZMRROM-ZYHUDNBSSA-N 299.754 2.158 10 20 CECD CCc1cccc(CN[C@@H]2CC[C@H](C(=O)O)C2)c1O 1593642235 MOWPGPUOTVMDBD-WCQYABFASA-N 263.337 2.298 10 20 CECD COc1ccc(CNCc2ccsc2C(=O)O)c(O)c1 1599572959 NNQPXWPOLPFZQY-UHFFFAOYSA-N 293.344 2.450 10 20 CECD COc1cc(O)c(CN2CCC[C@@H](OC)C2)cc1OC 160125639 PSVCUJUWSIJMGK-GFCCVEGCSA-N 281.352 2.020 10 20 CECD C[C@@H]1CC(NC(=O)N(C)Cc2ccccc2O)C[C@@H](C)O1 154989645 ZDAHVPYYOFDTNG-VXGBXAGGSA-N 292.379 2.490 10 20 CECD C[C@@H](Cn1ccnc1)NCc1ccc2c(c1)CCCO2 921527833 OWRPOAOQFASDLS-ZDUSSCGKSA-N 271.364 2.386 10 20 CECD COCCC1(C(=O)N[C@H](C)c2ccccc2O)CC1 827940381 CMDWZTRXYHUFOU-LLVKDONJSA-N 263.337 2.386 10 20 CECD CC[C@@H](NCC(=O)NCC(C)C)c1ccccc1O 135733838 BZEWRBDZSIGMTP-CYBMUJFWSA-N 264.369 2.205 10 20 CECD Nc1ccc(NC(=O)COc2ccc(F)cc2)cc1 22210869 DIEKBZUGSOUTKB-UHFFFAOYSA-N 260.268 2.425 10 20 CECD CC[C@H](N[C@@H]1CCN(C(C)C)C1=O)c1ccccc1O 183338837 IXMMHCNEGPJQQW-UONOGXRCSA-N 276.380 2.442 10 20 CECD CCON1CCC(NCc2ccc(N(C)C)cc2)CC1 323411185 WEVJMGDUBMXQMG-UHFFFAOYSA-N 277.412 2.258 10 20 CECD CC[C@](C)(O)CNCc1cc(Cl)cc([N+](=O)[O-])c1O 111384602 UZNDYJRELNBXSM-LBPRGKRZSA-N 288.731 2.204 10 20 CECD CCOC(=O)CN(C)Cc1cccc(Cl)c1O 179673027 SBTXCMYZLKMLTI-UHFFFAOYSA-N 257.717 2.041 10 20 CECD Cc1cnccc1CNC(=O)NCc1ccc(N(C)C)cc1 187164717 AJJZGTXKIQJXSJ-UHFFFAOYSA-N 298.390 2.455 10 20 CECD CCOc1ccc(O)c(CN2CCC(C)(CO)CC2)c1 184072442 YOCDDJPEAMBCIY-UHFFFAOYSA-N 279.380 2.385 10 20 CECD CC[C@@H](COC)NCc1ccc(N2CCOCC2)c(F)c1 120230096 GXDLLXNLMVTMCF-AWEZNQCLSA-N 296.386 2.177 10 20 CECD COC[C@H](O)CN(c1ccc(OC)cc1)[C@@H](C)C1CC1 127936019 PIXKMGFMWLETFI-SWLSCSKDSA-N 279.380 2.307 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@H](Cn2ccnn2)C1 180285617 ORLDJIXVRQODJR-LBPRGKRZSA-N 290.342 2.035 10 20 CECD CCS(=O)(=O)C1CCN(Cc2cc(C)ccc2O)CC1 195163408 ZESGOCLUNRHCNN-UHFFFAOYSA-N 297.420 2.100 10 20 CECD O=C1OCC[C@]12CCCN2Cc1cc(Cl)ccc1O 190041558 YQJAWSBKJNDSLQ-CQSZACIVSA-N 281.739 2.327 10 20 CECD Cn1nnc(CSc2ncc(C(C)(C)C)s2)n1 193092591 PLDCFXGHABWVME-UHFFFAOYSA-N 269.399 2.256 10 20 CECD COc1ccc(CNCc2cc(OC)ccc2O)nc1 1120033441 ONYZYOHMJPJQSF-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)NCc1ccccc1O 266027124 VMWKHNOTWBCKSK-BNOWGMLFSA-N 290.363 2.005 10 20 CECD Cc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)n(C)n1 284281517 JUWOBELYKLAJHC-JTQLQIEISA-N 290.323 2.193 10 20 CECD O=C(NCc1ccccc1O)Nc1cc2n(n1)CCCC2 287273128 HNOIYTFSUVYJJY-UHFFFAOYSA-N 286.335 2.247 10 20 CECD CC(=O)C(=O)COC(=O)c1ccccc1C(F)(F)F 808488313 SIIQVZQGVUJDIU-UHFFFAOYSA-N 274.194 2.020 10 20 CECD Cc1cccc(CN[C@@H](C2CC2)[C@]2(CO)CCCO2)c1O 816667175 FQOONMXMEVGLQZ-DLBZAZTESA-N 291.391 2.110 10 20 CECD CSCCNC(=O)N(C)Cc1ccc(N(C)C)cc1 726278882 LYVJCGWPLIXGPT-UHFFFAOYSA-N 281.425 2.257 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC2(CN)CC2)cc1 827340485 CDJJHBYRCQZHJN-UHFFFAOYSA-N 289.423 2.278 10 20 CECD CC[C@](C)(CC(=O)O)NCc1ccc2c(c1)CCO2 828665453 SHGSAKKUKGLGBG-OAHLLOKOSA-N 263.337 2.355 10 20 CECD CCN1CCC(N(C)C(=O)c2cc(O)cs2)CC1 825537375 XJNGZRSWJRBFNO-UHFFFAOYSA-N 268.382 2.010 10 20 CECD CNC(=O)C[C@@H](C)N[C@@H](C)c1cc(Cl)ccc1O 834900096 MDYKYEVSJSDNQG-BDAKNGLRSA-N 270.760 2.221 10 20 CECD O=C1Nc2ccccc2/C1=C\c1c[nH]c(C(=O)O)c1 833357951 LBVLYWJIPZDZCX-BJMVGYQFSA-N 254.245 2.206 10 20 CECD COc1cccc([C@H](C)NCCC[C@H](C)O)c1O 846169291 ZSTJJDRIDMZXIC-QWRGUYRKSA-N 253.342 2.212 10 20 CECD NC[C@H]1CC[C@H](CNCc2cc(F)ccc2O)CC1 841082370 IPTGVCSXUSPDLM-HAQNSBGRSA-N 266.360 2.386 10 20 CECD CCc1cccc(CN2CCC[C@@H](CNC(C)=O)C2)c1O 848877864 VDPZANRSLGPHPN-AWEZNQCLSA-N 290.407 2.303 10 20 CECD Cc1cc(CN2CC[C@H](C(=O)O)[C@@H]2C)ccc1N(C)C 846285071 NLCZCKOHWZSQSM-JSGCOSHPSA-N 276.380 2.356 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1NCCC1(C)C 852883544 YNYHMVRTCZQUQA-OAHLLOKOSA-N 289.423 2.099 10 20 CECD C[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)c2ncnn21 850352498 YMLXRVPJZRPWOT-RISCZKNCSA-N 271.368 2.140 10 20 CECD C[C@H](Cn1ccnc1)NCc1cc(F)c(N(C)C)cc1F 858093562 BHOXURUHGYHBQT-LLVKDONJSA-N 294.349 2.406 10 20 CECD COCCCN(CCOC)Cc1cc(C)cc(OC)c1O 754722812 KQBNMVXOAFDGJB-UHFFFAOYSA-N 297.395 2.194 10 20 CECD CCCCOCC(=O)N[C@H](C)c1ccccc1O 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899260260 ACLFUZSJKBZLTO-UITAMQMPSA-N 268.363 2.376 10 20 CECD COc1ccc(CNC(=O)c2ccc(O)cc2F)c(O)c1 794373149 HSOIYJLWSCKBGH-UHFFFAOYSA-N 291.278 2.176 10 20 CECD OCCCCCNCc1ccc(Br)cc1O 691452941 GNBBLAQQGFFUPO-UHFFFAOYSA-N 288.185 2.407 10 20 CECD Nc1ccc(CN2CCCN(c3nccs3)CC2)cc1 1336116983 JZYPJJCBFFTDHO-UHFFFAOYSA-N 288.420 2.438 10 20 CECD CCCN1CCCC[C@H]1C(=O)N(C)c1ccc(N)cc1 1336742377 KGKBZICRRMCKEK-HNNXBMFYSA-N 275.396 2.496 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1[C@@H](C)C1(F)F 1349834386 MHYFOKNKPCZPEQ-KCJUWKMLSA-N 290.306 2.395 10 20 CECD Oc1cnc(NCCCSc2nccs2)nc1 1354109675 RDYZYELNLQOCDF-UHFFFAOYSA-N 268.367 2.233 10 20 CECD C[C@H](N[C@H]1COC[C@@H]1C1CC1)c1cc(C(=O)O)ccc1O 1604331123 ZOAJIIKXOZCYPW-FZZIBODNSA-N 291.347 2.166 10 20 CECD Cn1cccc1C(=O)CSc1ncc(C(=O)O)s1 1600978844 SCPXSQCPCHRQSC-UHFFFAOYSA-N 282.346 2.155 10 20 CECD Cc1cc(Br)c(O)c(CN[C@H]2C[C@H](CN)C2)c1 1579551894 YVOBRMBKGZVCCU-HOMQSWHASA-N 299.212 2.290 10 20 CECD COc1cc(CN2CC[C@H](C(=O)O)[C@@H](C)C2)c(O)cc1C 1594056722 WDYRYNSONZDAFD-AAEUAGOBSA-N 293.363 2.252 10 20 CECD CC[C@H](CCNCc1ccc2c(c1)CCO2)C(=O)O 1776712189 UJYZXZOWNCZFGD-GFCCVEGCSA-N 263.337 2.212 10 20 CECD C[C@H](CNCc1ccc2c(c1)CCCO2)[C@@H](F)C(=O)O 1776425626 BHFHTSXJVJKLKN-QMTHXVAHSA-N 281.327 2.160 10 20 CECD Cc1ccc(O)c(CNc2cc(C(=O)N(C)C)ccn2)c1 158814523 MKBHTQHNHQTMQV-UHFFFAOYSA-N 285.347 2.410 10 20 CECD Cc1noc([C@@H](NC(=O)Cc2ccc(N)cc2)C(C)C)n1 157602462 XFDYVKIJTIBLIG-AWEZNQCLSA-N 288.351 2.016 10 20 CECD CCOC[C@H](NC(=O)Nc1ccc(N)cc1)C(C)C 233753277 YWGACETVXLSWMF-ZDUSSCGKSA-N 265.357 2.451 10 20 CECD C[C@H]1CCN(C(=O)c2cccc(O)c2O)CCS1 277697828 DZSIRHYNGCLXEI-VIFPVBQESA-N 267.350 2.065 10 20 CECD C[S@](=O)C1(CNCc2cccc(Cl)c2O)CCC1 281685055 BAHORAOOBDRKHX-SFHVURJKSA-N 287.812 2.436 10 20 CECD c1cc(CNCc2ccc(N3CCOCC3)cc2)co1 69832978 GHQBDEVRQBSLFU-UHFFFAOYSA-N 272.348 2.406 10 20 CECD Cc1noc([C@H]2CCCN(Cc3ccccc3O)C2)n1 179562724 CKZYPQDZSNANSD-ZDUSSCGKSA-N 273.336 2.463 10 20 CECD Oc1c(Br)cccc1CN1CCC[C@@H](O)C1 127988185 LRZXUHHRIQUTRA-SNVBAGLBSA-N 286.169 2.111 10 20 CECD Cc1ncc(C(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)n1 183503947 ISGNHOLJDCPPPN-UHFFFAOYSA-N 298.390 2.432 10 20 CECD CC(C)N(CC(=O)O)Cc1cc(Cl)ccc1O 86739774 VNUCPMXTOCPUAE-UHFFFAOYSA-N 257.717 2.341 10 20 CECD COc1cc(Cl)cc(CN(CCO)CC(F)F)c1O 193023620 HFPDHXYXGZPNRY-UHFFFAOYSA-N 295.713 2.114 10 20 CECD COCCCN(C)Cc1ccc(N2CCOCC2)c(F)c1 92537173 SFZANRRFKXWBLC-UHFFFAOYSA-N 296.386 2.131 10 20 CECD COc1cccc(CN(CCCO)CC(F)(F)F)c1O 93044404 ZMWLCODZZYCYDM-UHFFFAOYSA-N 293.285 2.148 10 20 CECD Cc1cccc(CNC[C@](C)(O)c2ccco2)c1O 271846875 RZAVVLPKPVTNCM-HNNXBMFYSA-N 261.321 2.291 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC[C@H](C)OC)c1 273575707 LTHSBAYEHIHWBO-WDEREUQCSA-N 281.352 2.254 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C)[C@@H]2CCOC2)c1 273554508 GQSONMICQHKBRR-GMXVVIOVSA-N 293.363 2.254 10 20 CECD CCCOc1ccc(CNC(C)(C)[C@@H](C)O)c(O)c1 270705278 JOWNVJZBOCSOQQ-LLVKDONJSA-N 267.369 2.430 10 20 CECD CC[C@H](N[C@H](C)C(=O)N(C)CC)c1ccc(F)cc1O 287532186 OYOZGIUTTAKNAY-MFKMUULPSA-N 282.359 2.439 10 20 CECD C[C@@H]1C[C@H](CCNC(=O)c2cccc(O)c2O)CCO1 280461373 MHNJWRMQMJXUIN-GHMZBOCLSA-N 279.336 2.033 10 20 CECD C[C@H](NCC1(CC(N)=O)CC1)c1cc(Cl)ccc1O 817584941 BEDVFCWQKDZXGW-VIFPVBQESA-N 282.771 2.352 10 20 CECD COCCOCCN(C)Cc1cc(Cl)c(C)cc1O 825944115 QIEAOYRCQPOHLW-UHFFFAOYSA-N 287.787 2.449 10 20 CECD O=C(NC[C@@H](C(=O)O)c1ccccc1)c1cc(O)cs1 833133358 IZPNFASPLZWVSA-LLVKDONJSA-N 291.328 2.052 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CC12CCNCC2 841081164 XDXDTXKSJNYKEI-ZDUSSCGKSA-N 266.772 2.277 10 20 CECD C[C@@H](N)C[C@@H](C)NCc1cccc(Br)c1O 843129936 UXUMSKDFABPWLG-RKDXNWHRSA-N 287.201 2.370 10 20 CECD CCOc1ccc(CNCc2ccn(C)c2)c(O)c1 748098750 MPJBLTDXGIRRMF-UHFFFAOYSA-N 260.337 2.419 10 20 CECD CC[C@H](O)CCN[C@H](C)c1cccc(OC)c1O 846151509 ZFYBBUYDDBJJDX-MNOVXSKESA-N 253.342 2.212 10 20 CECD COc1cccc([C@@H](C)NCC2=CCCOC2)c1O 846170119 IJDNNCIKVLPSIE-LLVKDONJSA-N 263.337 2.398 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H]2CNC[C@H]21 841027141 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Cc1cccc(O)c1CNCc1nc(C(F)F)no1 895726414 YQBYMCYNNZPBOB-UHFFFAOYSA-N 269.251 2.311 10 20 CECD COc1cc(C)cc(CN2CCSC[C@@H]2CCO)c1O 894089923 XZDJDRJOQKHKJF-ZDUSSCGKSA-N 297.420 2.009 10 20 CECD CCC[C@H](CCO)NCc1ccc(OC)c(OC)c1O 895697004 QNCVBJCSIPRKFU-GFCCVEGCSA-N 283.368 2.050 10 20 CECD CCN(CCCN(C)C)Cc1cc(C)cc(OC)c1O 894777072 LRLUMBRYPBDZLZ-UHFFFAOYSA-N 280.412 2.483 10 20 CECD CN(C)c1ccc(CNc2ncccc2CO)cc1 83422293 XULRHEZGNKXBGV-UHFFFAOYSA-N 257.337 2.252 10 20 CECD COc1cc(C)cc(CN2CCSC[C@H]2CCO)c1O 894089920 XZDJDRJOQKHKJF-CYBMUJFWSA-N 297.420 2.009 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1cc(C)ccc1O 185467105 RMQAWVNUUXPQNI-DOMZBBRYSA-N 267.369 2.139 10 20 CECD CCC[C@@H](CNC(=O)Cc1ccc(N)cc1)OCC 705341487 WAGYOAQRJMCJNY-AWEZNQCLSA-N 264.369 2.133 10 20 CECD COC(=O)C[C@H](C)Sc1ncc([N+](=O)[O-])s1 189679731 RCVIOOQCNLYHGV-YFKPBYRVSA-N 262.312 2.095 10 20 CECD CC[C@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@@H]1O 792173176 TXCRVBIOMXSEJI-UFBFGSQYSA-N 273.735 2.387 10 20 CECD 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C[C@H](NC[C@]1(O)CCO[C@H]1C)c1cc(Cl)ccc1O 278909020 VPAQOIHPWHZEPJ-PKFCDNJMSA-N 285.771 2.236 10 20 CECD COC(=O)c1ccc(CNCc2cc(OC)ccc2O)o1 271780178 DLJUNHSJVYFUFE-UHFFFAOYSA-N 291.303 2.070 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@]2(CCOC2)O1 373498537 ZLLCVKPGRLYJJS-NHYWBVRUSA-N 297.782 2.425 10 20 CECD C[C@@H]1CN(Cc2ccccc2O)C[C@]2(CCO[C@@H]2C)O1 280570363 VSUIHONQSOKDCM-IOASZLSFSA-N 277.364 2.161 10 20 CECD C[C@@H]1OCC[C@@]12CN(Cc1cc(F)ccc1O)C[C@@H](C)O2 280358002 CJWQGBYLMDNNLE-BFQNTYOBSA-N 295.354 2.300 10 20 CECD CC[C@H](C)N1CC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 285977950 PEVABBFRLKLUAL-LBPRGKRZSA-N 289.379 2.315 10 20 CECD C[C@@H](N[C@@H]1CC(=O)N(C)C1)c1ccc2ccccc2c1O 386973548 RDFTXUIWGBPXIL-DGCLKSJQSA-N 284.359 2.427 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(N)cc2)no1 297169193 KJTKZWJXUOVUIW-UHFFFAOYSA-N 259.309 2.310 10 20 CECD COc1cccc(CNC(=O)c2ncoc2C2CC2)c1O 293860919 ZPCUGCFNSVPRRU-UHFFFAOYSA-N 288.303 2.196 10 20 CECD C[C@H](O)c1ncc(CNCc2ccc3c(c2)CCO3)s1 809612548 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CCOc1ccc(CN2C[C@@H]3CCC[C@]3(CN)C2)c(O)c1 844903319 XHIBGGUKXWSESG-YOEHRIQHSA-N 290.407 2.352 10 20 CECD COC(=O)CCC1CCN(C(=O)c2cc(O)cs2)CC1 753337167 GTIWXJCMYFVZPA-UHFFFAOYSA-N 297.376 2.259 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC[C@@H]1CCOC1 751277589 HOAHHWQLBIWVMX-CQSZACIVSA-N 290.407 2.494 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@@H]1CO 856796009 MXALOZWQBPCNQL-DZGCQCFKSA-N 262.397 2.203 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H]3COC[C@H]3C)C2)cc1 926610772 FULUCYWROOQLSN-CKEIUWERSA-N 290.407 2.146 10 20 CECD CSC[C@H](C)NC(=O)NCc1cc(C)ccc1O 858233305 KLUMWRGGLKPTFE-JTQLQIEISA-N 268.382 2.251 10 20 CECD CCc1nnc(C)cc1C(=O)NCc1cc(C)ccc1O 862757366 RAZVIGMMUBOZHH-UHFFFAOYSA-N 285.347 2.291 10 20 CECD CN(Cc1ccc(N2CCOCC2)c(F)c1)C1CC1 768335266 KZSKZNIUXRQYAG-UHFFFAOYSA-N 264.344 2.257 10 20 CECD N[C@H](CNCc1ccc(N2CCCC2)cc1)C1CC1 1118018310 FXYMOUKMYMEBKF-MRXNPFEDSA-N 259.397 2.114 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCN(CC2CC2)C1 877025013 WQJRBQAJRMJBDP-CQSZACIVSA-N 260.381 2.275 10 20 CECD Cc1cccc(O)c1CN1CC[C@H](c2nccn2C)C1 877528573 DUSURNLQBXJJRQ-ZDUSSCGKSA-N 271.364 2.424 10 20 CECD CCN(Cc1c(C)cccc1O)[C@@H](C)CS(=O)(=O)CC 876734851 AQADETLJCRJPKM-ZDUSSCGKSA-N 299.436 2.346 10 20 CECD Cc1ccc(CNC[C@H](C(C)C)N2CCOCC2)c(O)c1 876908488 MQOSJAYSYNKOFF-MRXNPFEDSA-N 292.423 2.147 10 20 CECD CCCOc1ccc(CN[C@H](C)C(=O)NCC)cc1C 873007852 HTTWKRRCIMXOPG-CYBMUJFWSA-N 278.396 2.398 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1c(C)cccc1O 877550153 UJVBXESKBLKNAP-ZDUSSCGKSA-N 278.396 2.343 10 20 CECD CC[C@H](C)NC(=O)CCN[C@H](C)c1c(O)cccc1F 886512329 CDGJRMDLUQAPPR-WDEREUQCSA-N 282.359 2.487 10 20 CECD C[C@H](NCC(=O)N(C)C1CC1)c1ccc(N(C)C)cc1 775832342 ZGSCSSGRLWTPLJ-LBPRGKRZSA-N 275.396 2.024 10 20 CECD CC(C)N1CC[C@@H](N[C@@H](C)c2c(O)cccc2F)C1=O 886547824 RVYWHBMQRSVCFM-CMPLNLGQSA-N 280.343 2.191 10 20 CECD CO[C@@H](C)CS(=O)(=O)Nc1ccc(O)c(C(C)C)c1 882799197 SWLAKXTZNZIHLG-JTQLQIEISA-N 287.381 2.292 10 20 CECD Cc1ccc(C(=O)NCc2ccc(O)cc2)c(O)c1O 780984432 LMWBAFMMLXHUJT-UHFFFAOYSA-N 273.288 2.042 10 20 CECD C[C@@H]1CCCN1CCNCc1cc(F)cc(F)c1O 883022611 ZQGOYPWGCYFSLW-SNVBAGLBSA-N 270.323 2.244 10 20 CECD CC1(C)CN(C(=O)c2cc(O)cs2)CC(C)(C)O1 785425914 VUWCZNVQTVBTJD-UHFFFAOYSA-N 269.366 2.483 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1cc(Cl)cc(F)c1O 783603307 YEQAVMHVYKIVMC-HTQZYQBOSA-N 261.724 2.434 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CC(C)(C)CN 721156948 ZXKOBAPMIFGILC-UHFFFAOYSA-N 277.412 2.086 10 20 CECD COc1ccc(CN[C@@H]2C[C@H](C)N(C(C)=O)C2)cc1C 987645275 OIKKODDYMLCVAJ-SWLSCSKDSA-N 276.380 2.103 10 20 CECD Cc1cc(CNCc2cc(F)c(N(C)C)cc2F)n(C)n1 1328784685 VHRLCKNUWPYAGW-UHFFFAOYSA-N 294.349 2.363 10 20 CECD CCc1ncoc1C(=O)N[C@H](C)c1ccccc1O 1336064953 QVNYQGJSUQNRKU-SECBINFHSA-N 260.293 2.434 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H](C)OC[C@@H]2C)c1O 218348661 HGGGFZFMYJEXCI-UWVGGRQHSA-N 281.327 2.343 10 20 CECD CCOc1cccc(CN[C@]2(C)CCCOC2)c1O 221356884 AEDBUPNIRMDLCH-OAHLLOKOSA-N 265.353 2.450 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1[C@H]2CCCC[C@H]21 1528771134 LAFNUWCYSSCARX-PJXYFTJBSA-N 261.321 2.150 10 20 CECD Cc1oc(C(=O)O)cc1COc1cccc(-n2cncn2)c1 1600832070 LROQHWTZAOKTQB-UHFFFAOYSA-N 299.286 2.446 10 20 CECD O=C(O)CN(Cc1c(O)ccc(Cl)c1F)C1CC1 1602057834 WZDGNDIOTJUMGF-UHFFFAOYSA-N 273.691 2.234 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C(=O)O)C(C)C)c1O 229051432 HHCZCPYQGMNSMP-LLVKDONJSA-N 287.743 2.253 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1N 122381701 RCVWGVLGYSHSSQ-HOCLYGCPSA-N 261.413 2.312 10 20 CECD CC[C@@H](N[C@H]1CC12CC2)c1cccc(-c2nn[nH]n2)c1O 1590467768 TZPWMCIHWUBLFE-NEPJUHHUSA-N 285.351 2.166 10 20 CECD CCC[C@H](O)CCN[C@@H](C)c1cc(C(=O)O)ccc1O 1595607519 LPEYXKRXACFNTJ-JQWIXIFHSA-N 281.352 2.292 10 20 CECD C[C@H](NCc1cccnc1O)c1cc(C(=O)O)ccc1O 1593305432 ZNIGWRAWLXOYKU-VIFPVBQESA-N 288.303 2.042 10 20 CECD CCN(CC)c1ccc(CNc2ncnn2C)cc1F 162194794 JVGCEBDUQGMJOK-UHFFFAOYSA-N 277.347 2.413 10 20 CECD CN(C(=O)/C=C/c1cncc(F)c1)c1ccc(Cl)nn1 155757495 ABWHBQKWKVDTJM-GORDUTHDSA-N 292.701 2.340 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CC2(Cl)Cl)c1 155974182 BQANKPIYSGSDSS-SECBINFHSA-N 290.146 2.211 10 20 CECD COc1ccc(CNC(=O)c2cccc(O)c2O)cc1 126206734 WXFICUSZKOPSAC-UHFFFAOYSA-N 273.288 2.036 10 20 CECD Cc1ccncc1CNCc1cc2c(cc1O)OCO2 162641569 QHIDSSGNOFUDBX-UHFFFAOYSA-N 272.304 2.114 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CCN(C(C)C)C2=O)c(O)c1 186048491 OURVUZKTSGGDDQ-GXTWGEPZSA-N 276.380 2.361 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCCC[C@H]2O)c1 186798212 LDEBEVOUTOHZAM-PSOPSSQASA-N 265.353 2.355 10 20 CECD COc1ccc(O)c([C@H](C)NCCOCC(F)F)c1 189844188 XBMSJIIINAJENH-VIFPVBQESA-N 275.295 2.333 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)c1cncc(F)c1 80357904 NTIZGEFQUPNOQB-UHFFFAOYSA-N 282.296 2.036 10 20 CECD CC[C@H](C)NC(=O)CCNCc1c(O)cccc1Cl 83551982 DKPHZZXMCVVOBC-JTQLQIEISA-N 284.787 2.440 10 20 CECD CCc1cccc(CNC[C@@H]2CCCN(C)C2)c1O 691524099 RFKJXXXJADWKAJ-ZDUSSCGKSA-N 262.397 2.386 10 20 CECD COc1ccc(CN[C@H](C)c2ccccc2O)nn1 879649251 LZJYCTPCKAJWHK-SNVBAGLBSA-N 259.309 2.042 10 20 CECD CC(C)OCCC(=O)N1CCOc2cc(N(C)C)ccc21 173199023 SMSXFYHQEGIOQS-UHFFFAOYSA-N 292.379 2.293 10 20 CECD CCCCS(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 64942602 JVNTZMZWZDKHGL-UHFFFAOYSA-N 284.425 2.314 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccco1 173191372 DHYFFVNMFXSMCH-UHFFFAOYSA-N 272.304 2.385 10 20 CECD COCC[C@@](C)(O)CN[C@@H](C)c1cc(Cl)ccc1O 185466992 OLPUSRFJLRVBQW-IINYFYTJSA-N 287.787 2.484 10 20 CECD CCOC(=O)N1CC[C@H](NCc2cccc(Cl)c2O)C1 186475336 MQOHVUNJTIBPKT-NSHDSACASA-N 298.770 2.366 10 20 CECD CCOCCC(=O)N(C)Cc1ccc(N(C)C)cc1 76841536 QRKLONKLMVDEKV-UHFFFAOYSA-N 264.369 2.138 10 20 CECD CO[C@H](C)CCC(=O)N1CCOc2cc(N(C)C)ccc21 181581972 GDJPUDNOVNMLHU-GFCCVEGCSA-N 292.379 2.293 10 20 CECD CCC[C@H]1C[C@H](C(=O)NCc2ccc(O)c(O)c2)CCO1 182838276 KYRLZJOZSPLBSX-OLZOCXBDSA-N 293.363 2.309 10 20 CECD C[C@H](NC[C@]1(O)CCOC1)c1cc2c(cc1O)CCCC2 186178141 HLFHLRHZPOLXED-YVEFUNNKSA-N 291.391 2.073 10 20 CECD COC[C@H](C)CN[C@@H](C)c1cc(OC)ccc1O 45656220 UIWNBNQOJSPKRQ-MNOVXSKESA-N 253.342 2.334 10 20 CECD O=C(NCc1ccccc1O)c1cc2c(s1)CCOC2 264051708 TWGOSPXTSHTCLQ-UHFFFAOYSA-N 289.356 2.456 10 20 CECD O=C1COc2ccc(NCc3cc(F)ccc3O)cc2N1 226585610 HJDMABZEYRCDFG-UHFFFAOYSA-N 288.278 2.474 10 20 CECD COc1ccc(O)c(CN(C)[C@H]2CCN(C)C[C@@H]2C)c1 290626972 XOWGWACDBOMLPG-WFASDCNBSA-N 278.396 2.173 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2cccc(C)c2O)C1 193496167 NXHKKHHLLZPUSZ-WCQYABFASA-N 263.337 2.132 10 20 CECD O[C@H]1C[C@@H](NCc2ccc(N3CCCCC3)cc2)C1 294950697 VXTPEQWMTJEOHI-FZNQNYSPSA-N 260.381 2.290 10 20 CECD Cc1c(CNC(=O)c2ccncn2)n(C)c2ccccc12 348702613 UXCTUAJYXCODLH-UHFFFAOYSA-N 280.331 2.207 10 20 CECD COc1cc(O)c(CN2CCC3(CCO3)CC2)cc1OC 367245145 VRMNWWKVYPFISI-UHFFFAOYSA-N 293.363 2.164 10 20 CECD Cc1c(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)cnn1C 273477835 LGPLXNGDKRTGAF-SECBINFHSA-N 290.323 2.193 10 20 CECD Oc1ccccc1CN1CCC[C@@H]1[C@@H](O)C(F)(F)F 271261155 IPYIJNQLLIDNJM-ZYHUDNBSSA-N 275.270 2.280 10 20 CECD C[C@@H](NCC(C)(C)OCCO)c1cc(Cl)ccc1O 287308457 LDKKQUCGYQMQTQ-SNVBAGLBSA-N 287.787 2.484 10 20 CECD O=C(NC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)c1cc(O)cs1 807875486 DMBWRTBUUXWJAT-OAAXVMEWSA-N 293.388 2.267 10 20 CECD CN(C)c1ccc(CNC(=O)CSC(F)F)cc1F 294719214 MKAFXBPUOCKGDI-UHFFFAOYSA-N 292.326 2.464 10 20 CECD CC(C)[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H](C)N 399783433 WILAMQREZCWWJJ-CZUORRHYSA-N 291.439 2.330 10 20 CECD Cc1nccnc1[C@@H](C)NC[C@@H](N)c1ccc(N(C)C)cc1 817944172 XUUGNMMEBXEZOK-CZUORRHYSA-N 299.422 2.202 10 20 CECD CNCCN[C@H](C)c1cc(Br)cc(F)c1O 817952113 NKLHHLCPHCCGOV-SSDOTTSWSA-N 291.164 2.164 10 20 CECD C[C@H](NC(=O)C1(CN(C)C)CC1)c1ccc(N(C)C)cc1 822081375 DKJZNVIMIQMVEK-ZDUSSCGKSA-N 289.423 2.272 10 20 CECD COCCN(C)CCNCc1cc(Cl)c(C)cc1O 825185085 IOOHOLFUIDHEMI-UHFFFAOYSA-N 286.803 2.022 10 20 CECD Cc1nn(C)c2ncc(NC(=O)c3cc(O)cs3)cc12 731867329 GDHBOOUCKQYKIQ-UHFFFAOYSA-N 288.332 2.296 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](O)C(C)(C)C 735841710 VUJOLNOQJFQUMH-CQSZACIVSA-N 278.396 2.118 10 20 CECD Cc1n[nH]c(C)c1CC(=O)NCc1cc(Cl)ccc1O 846479473 LXVNLNKBGWNGHH-UHFFFAOYSA-N 293.754 2.244 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC12CCNCC2 841079329 MJFVWNFRAYEDFW-MRXNPFEDSA-N 273.424 2.293 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)c(O)c1 846048172 XKQXOXWQASNYIZ-NFAWXSAZSA-N 263.337 2.200 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CS[C@H](C)C2)c1O 840420567 RZXFAGBULHJWGM-KOLCDFICSA-N 296.392 2.094 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(OC)o2)c1 847590113 SEMUVZHSURQRQC-SECBINFHSA-N 291.303 2.493 10 20 CECD Nc1ccc(CCNC(=O)NC[C@@H]2CCCCS2)cc1 841876643 WAKVPDYGXGRXMI-AWEZNQCLSA-N 293.436 2.396 10 20 CECD Nc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1 848594372 JZRLPTXAOKWIOV-GJZGRUSLSA-N 288.395 2.407 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CC[C@H](O)CC2)c1O 846156307 DIZRAMLHOFOELZ-IJLUTSLNSA-N 265.353 2.355 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2=CCCC2)c1 853736855 QPCAANWYVGQQAC-UHFFFAOYSA-N 276.336 2.310 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H](O)COCC2CC2)c1 756511939 SLIALROZVLCBKW-TZMCWYRMSA-N 279.380 2.139 10 20 CECD C[C@H](NCCOCCF)c1cc(F)cc(F)c1O 853238246 DGSCBUMWPDWQOU-QMMMGPOBSA-N 263.259 2.307 10 20 CECD CCO[C@H](CN(C)c1ccc(OCC(=O)O)cc1)C1CC1 863467116 NTMYAIMAMOXZNU-OAHLLOKOSA-N 293.363 2.401 10 20 CECD COc1cccc(O)c1CN(C[C@H]1CCOC1)C1CC1 768257559 MPLTVJGNLOREAR-GFCCVEGCSA-N 277.364 2.402 10 20 CECD Cc1nocc1C(=O)NCc1ccc2c(c1)CCCN2C 865052355 CDSAUUOSJVCUQO-UHFFFAOYSA-N 285.347 2.295 10 20 CECD CC[C@@H](C)[C@](C)(O)CNCc1cc(F)ccc1O 779078596 SVECVRIDTXGOKN-QMTHXVAHSA-N 255.333 2.418 10 20 CECD CCOC(=O)C1=NN(c2cccc3cnccc23)C(=O)[C@H]1C 871959588 OCVDZFZRXFDVQA-JTQLQIEISA-N 297.314 2.137 10 20 CECD Cc1cccc(O)c1CN1CCOCC2(CCOCC2)C1 877316461 AWUGWKLYIDUOAM-UHFFFAOYSA-N 291.391 2.330 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCN(CC(F)F)C1 877593515 BUSOXQSESUZVJW-NSHDSACASA-N 270.323 2.130 10 20 CECD Cc1cccc(O)c1CN1CCC(Cn2ccnn2)CC1 876813983 HLVZATNKNFHKOY-UHFFFAOYSA-N 286.379 2.204 10 20 CECD CC[C@H](CSC)N(C)Cc1cc2c(cc1O)OC[C@H]2O 773255037 LPXTXZKEUJGROW-BXUZGUMPSA-N 297.420 2.391 10 20 CECD CC[C@@H](NCc1cc(F)cc(F)c1O)[C@H](O)C(F)(F)F 883079086 JRBRJZFYEYWYRB-KOLCDFICSA-N 299.239 2.462 10 20 CECD CC(C)[C@@H](CO)CN[C@H](C)c1c(O)cccc1F 886609628 YCRPSDWDQDLQEH-GHMZBOCLSA-N 255.333 2.446 10 20 CECD COC[C@H](N[C@H](C)c1ccc(F)cc1O)[C@H]1CCCO1 788619615 QKBVQESWRIQOOK-RIEGTJTDSA-N 283.343 2.376 10 20 CECD COc1cc(N(C)CCCCC(=O)O)cc(OC)c1OC 783729943 IPAAOKGXJCRBCP-UHFFFAOYSA-N 297.351 2.404 10 20 CECD COc1cc(C)cc(CNC[C@@]2(C)CCOC2)c1O 894260501 MMDSKVNODQTQFU-OAHLLOKOSA-N 265.353 2.225 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)cc(C)c2O)[C@H]1C 787247282 SOBTUBHZQVQKGT-GXTWGEPZSA-N 277.364 2.392 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1 86802689 MRGOAPGPYFKOCO-ZDUSSCGKSA-N 250.342 2.048 10 20 CECD C[C@H]1[C@@H](C)N(Cc2cc(F)cc(F)c2O)CC[S@@]1=O 894039687 LMFGNKMLKNNIBK-MGOSUKFUSA-N 289.347 2.012 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@@H]1c1ccc[nH]1 279659449 XRVNEWRJYNRFBT-GFCCVEGCSA-N 272.304 2.403 10 20 CECD CC[C@H](NCC1(C)OCCO1)c1ccccc1O 186306926 FTMBTTZBPKGSIL-LBPRGKRZSA-N 251.326 2.196 10 20 CECD O=C(N[C@H]1C[C@H]1Cc1ccccc1)c1cccc(O)c1O 790785844 YYEGTFPKXNHGOG-OCCSQVGLSA-N 283.327 2.459 10 20 CECD COc1cccc(O)c1CN1CCC[C@@](C)(O)CC1 793245916 DAWRMCQTXGWQQM-OAHLLOKOSA-N 265.353 2.138 10 20 CECD O=C(N[C@@H](CCO)c1cccs1)c1cccc(O)c1O 790907653 JUZUKSFVHPRZBW-JTQLQIEISA-N 293.344 2.013 10 20 CECD CCN(Cc1c(O)cccc1OC)C[C@@H]1CCOC1 768521737 UOCGOTUXHIBRPZ-LBPRGKRZSA-N 265.353 2.259 10 20 CECD Nc1ccc(CCNC2CCN(CC(F)F)CC2)cc1 1326040414 XEFNAWUJWWLYBD-UHFFFAOYSA-N 283.366 2.130 10 20 CECD COc1ccc(CNc2cc(CO)cc(C)n2)c(O)c1 1330045433 JOZKNLFYRNAAJW-UHFFFAOYSA-N 274.320 2.209 10 20 CECD COc1ccc(CNC[C@@H]2CCC[C@H](O)C2)c(O)c1OC 1342959653 HEMAAUJMLSPEIH-YPMHNXCESA-N 295.379 2.050 10 20 CECD O=C(/C=C/c1ccc(C(=O)O)o1)NCc1ccccc1O 1601236861 WYIYQDGEEVESQJ-SOFGYWHQSA-N 287.271 2.013 10 20 CECD Cc1ccc(O)c(CN[C@@H](C(=O)O)c2cccc(O)c2)c1 1607811309 HHDSCYVNHAZUDU-OAHLLOKOSA-N 287.315 2.322 10 20 CECD COc1cc(C)cc(CN[C@H]2CCNC23CCCC3)c1O 1579145313 PMWIDMVZKPMJEV-HNNXBMFYSA-N 290.407 2.474 10 20 CECD C[C@H](NCCN1CCSCC1)c1ccc(F)cc1O 230661636 CIWXVMFSSCFCTF-NSHDSACASA-N 284.400 2.231 10 20 CECD COc1cc(CN2C[C@@H](C)[C@H](CC(=O)O)C2)c(O)cc1C 1599408183 MKVMTWUCWBEUFB-VXGBXAGGSA-N 293.363 2.252 10 20 CECD CC(C)C[C@@H](CO)N[C@H](C)c1cc(C(=O)O)ccc1O 1591436118 FHCXYSNXUMXWJC-PWSUYJOCSA-N 281.352 2.148 10 20 CECD CCCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 5097654 AEHXIKBGFHZVJS-HNNXBMFYSA-N 277.412 2.272 10 20 CECD Cc1ccc(O)c(CNc2ccc(CNC(N)=O)cc2)c1 152885415 SQHZHSJZVBFODG-UHFFFAOYSA-N 285.347 2.481 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@]1(C)CCCCO1 837467566 IKEMLYOLPDPADC-OAHLLOKOSA-N 263.337 2.310 10 20 CECD Oc1ccccc1CN1CCC([C@H]2CCNC2)CC1 843127290 PNNVOKUQGOGKBG-AWEZNQCLSA-N 260.381 2.214 10 20 CECD Oc1ccc(F)cc1CN1CCC2(CCNCC2)C1 843120158 DZACGQKWRGSZTQ-UHFFFAOYSA-N 264.344 2.107 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](O)C(C)(C)C2)c1O 279695170 GKXKKKSHSIEXFD-ZDUSSCGKSA-N 297.782 2.451 10 20 CECD COc1cccc(CNCc2ncccc2C)c1O 71339382 WZOAZKSJOAIDHS-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1ccc(N2CCN(C[C@@H]3CCCCO3)CC2)cc1 58126813 LZHMDRDZNAZTJF-KRWDZBQOSA-N 290.407 2.386 10 20 CECD Oc1cc2c(cc1CNC1CCSCC1)OCO2 134413963 WXTHKCBVJBEGQB-UHFFFAOYSA-N 267.350 2.106 10 20 CECD CC[C@H]1COCCN1C(=O)NCc1ccc(N(C)C)cc1 115641349 MWXYCDAXUBTLAA-AWEZNQCLSA-N 291.395 2.073 10 20 CECD COCCN(Cc1ccccc1O)CC(F)(F)F 179564828 QOCZARLTTXGMRX-UHFFFAOYSA-N 263.259 2.403 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CC[C@@H]2CCOC2)c1 176138180 VAVBKRFMFGTWCP-NWDGAFQWSA-N 293.363 2.395 10 20 CECD COc1cccc(CNc2ccc3nccnc3n2)c1O 301273423 YDARIGTYIOMKPW-UHFFFAOYSA-N 282.303 2.351 10 20 CECD Cc1cc(C(=O)Nc2cn[nH]c2)c(C)n1-c1ccccn1 71969368 ZCIGLLDIIDBKDB-UHFFFAOYSA-N 281.319 2.465 10 20 CECD COc1ccc(N2CCN(C[C@H]3CCCO3)CC2)cc1F 84867036 DGNIQACLFMZUHJ-CQSZACIVSA-N 294.370 2.135 10 20 CECD CN1CC[C@@H]2[C@H](CCCN2Cc2cc(F)ccc2O)C1 290647606 YZNPDKXCKXZZIA-IUODEOHRSA-N 278.371 2.447 10 20 CECD CCn1nncc1CN[C@H](C)c1ccc(C)cc1O 527920310 NVYZSBNIMSNNCN-LLVKDONJSA-N 260.341 2.163 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(CN)o1 94567810 SXDAKPXMCBMICV-UHFFFAOYSA-N 287.363 2.077 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H]1c1ncc[nH]1 364997173 WMACOUXBJVULNG-FUEXJSSKSA-N 299.330 2.198 10 20 CECD CCN(CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 273579553 MHZYXSLGHSFRKE-NSHDSACASA-N 293.367 2.435 10 20 CECD COC[C@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCO1 278928499 USMWMBXFYMTMCR-GOEBONIOSA-N 296.386 2.175 10 20 CECD COCCN(C)Cc1ccc(N2CCC(OC)CC2)cc1 295432976 FVZLFSQCORZISH-UHFFFAOYSA-N 292.423 2.380 10 20 CECD Cc1ncc(C(=O)NCc2ccc(N(C)C)cc2)s1 299364210 QYLFYSDMHWJBOP-UHFFFAOYSA-N 275.377 2.448 10 20 CECD CCCN(CC(=O)Nc1ccon1)Cc1ccccc1O 727830888 TWETVHGONDUJAR-UHFFFAOYSA-N 289.335 2.231 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(N(C)C)cc1C 827845613 YCJAKWRXJRAGNS-CVEARBPZSA-N 290.407 2.492 10 20 CECD O=C(N[C@H]1CCC[C@@H]2C[C@H]12)c1c(F)ccc(O)c1O 839797912 RKQOHBRPKVWEEO-WEDXCCLWSA-N 265.284 2.155 10 20 CECD C[C@@H](NC(=O)C(=O)c1ccc[nH]1)c1ccc(N(C)C)cc1 836207330 HVASHGVRQNKBNE-LLVKDONJSA-N 285.347 2.141 10 20 CECD CC/C=C/CNC(=O)NCc1ccc(OC)cc1O 836573686 RJLCHIPHLBZNHE-SNAWJCMRSA-N 264.325 2.166 10 20 CECD COC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 918632662 AQQLZHNUOODOIQ-PHIMTYICSA-N 296.342 2.295 10 20 CECD C[S@@](=O)c1ccc(C(=O)NCc2ccccc2O)cc1 743327390 MNGVJWRMKLVJGP-HXUWFJFHSA-N 289.356 2.060 10 20 CECD CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)c1cc(O)cs1 743658689 BRXAWESJQPXNJG-JLLWLGSASA-N 281.377 2.387 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H](CN)C[C@H]1C 843057848 MMGDHFYZDQVZOU-ZIAGYGMSSA-N 261.413 2.230 10 20 CECD C[C@@]1(CN)CCN(Cc2c(O)ccc(Cl)c2F)C1 843116545 ZGQKYXRXSSMKFP-ZDUSSCGKSA-N 272.751 2.355 10 20 CECD CC(C)(C)CN1C(=O)C(C)(C)N[C@H]1c1cccc(O)c1O 840828853 WORVVENVFJZKGO-CYBMUJFWSA-N 292.379 2.353 10 20 CECD Cc1cccc(CN2CCC3(CCNC3)CC2)c1O 843126575 KPUFJBJZWRYYMO-UHFFFAOYSA-N 260.381 2.276 10 20 CECD CCN(C[C@H]1CCNC1)c1ccc(OC)c(OC)c1 843357495 NQPQCFSCIZBORF-LBPRGKRZSA-N 264.369 2.140 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](N)C[C@H]2C)c1 846698522 IHEOOZHPALTUAG-YPMHNXCESA-N 264.369 2.103 10 20 CECD CCN1C[C@H](CN[C@H](C)c2ccc(N(C)C)cc2)CC1=O 846209991 VFSILPSFIRXPDK-KGLIPLIRSA-N 289.423 2.272 10 20 CECD C[C@@H]1CC2(CCOCC2)CN1C(=O)c1cccc(O)c1O 844092661 CONIOCJAMHPAHH-LLVKDONJSA-N 291.347 2.129 10 20 CECD Cc1ccc(C(=O)OC[Si](C)(C)C)c(O)c1O 740957907 MNKVLNSMZAEBIO-UHFFFAOYSA-N 254.358 2.440 10 20 CECD CN(C)c1ccc([C@@H](N)CNCc2cccc(O)c2)cc1 841044626 XBDIDGMPJYJQPD-KRWDZBQOSA-N 285.391 2.248 10 20 CECD CN(CC[C@@H]1COC(C)(C)O1)Cc1ccccc1O 851841886 ZBPZSPBRXKOPSQ-CYBMUJFWSA-N 265.353 2.366 10 20 CECD CCOC[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CCO1 862502177 CQIURWSZJSLOMX-AWEZNQCLSA-N 296.386 2.129 10 20 CECD CCc1nocc1C(=O)NCc1cc(C)ccc1O 862754945 MBNYKDKJZQQTBJ-UHFFFAOYSA-N 260.293 2.181 10 20 CECD O=C(O)c1c[nH]ccc1=NCc1ccc(N2CCCC2)cc1 1118284615 NVOWQDAULIOKPS-UHFFFAOYSA-N 297.358 2.414 10 20 CECD CCOc1ccc(CNCCCCC(=O)O)c(O)c1 874043244 RVVFORLFNCRFGI-UHFFFAOYSA-N 267.325 2.135 10 20 CECD COCCC(C)(C)NC(=O)/C=C\c1ccc(O)c(O)c1 779533066 ZGNSOQNOFASQIN-ALCCZGGFSA-N 279.336 2.042 10 20 CECD CN(C(=O)CSC(F)(F)F)c1ccc(N)cc1 877078129 DWEHQUOQWWOFRE-UHFFFAOYSA-N 264.272 2.485 10 20 CECD CCOc1cccc(CN[C@]2(CCOC)CCOC2)c1O 775035468 ZZDDRMHZCMIVLD-MRXNPFEDSA-N 295.379 2.076 10 20 CECD CC(C)(C)c1cc(O)c(O)c(CN2C[C@H]3COC[C@H]3C2)c1 872784210 IWZFLGKPAXUYNP-BETUJISGSA-N 291.391 2.474 10 20 CECD Cc1ccc(O)c(CNc2cc(C)nc3nc(C)nn23)c1 882651546 HDWMBAORUUVWIA-UHFFFAOYSA-N 283.335 2.367 10 20 CECD O=C(Nc1cnn(C(F)F)c1)c1cc(O)cs1 783890283 HKMFMRIINVHSOL-UHFFFAOYSA-N 259.237 2.298 10 20 CECD CC1CCN(c2ccc(CNC[C@@H](C)O)cc2)CC1 76275452 XPPYYBCOOBMHRB-CQSZACIVSA-N 262.397 2.393 10 20 CECD COc1ccc(CNC[C@@H]2C[C@H]2C)c(O)c1OC 892569721 BBUJYDQRQPRKIO-KOLCDFICSA-N 251.326 2.155 10 20 CECD CCOC[C@@H]1CCN(Cc2ccc(OC)c(OC)c2O)C1 892180358 OSOHURVJWISUNW-GFCCVEGCSA-N 295.379 2.268 10 20 CECD CC[C@H](NCC1(O)CCC1)c1ccc(F)cc1O 796757909 BVOCHPAMKWVIOR-LBPRGKRZSA-N 253.317 2.487 10 20 CECD C[C@H]1[C@@H](CO)CCCN1Cc1cc(F)cc(F)c1O 895014934 QJNCKICSWFGQKT-VHSXEESVSA-N 271.307 2.263 10 20 CECD COc1ccc(CNc2nc(OC)ncc2Cl)c(O)c1 795285663 UCDQBTJBVFGPNQ-UHFFFAOYSA-N 295.726 2.465 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C[C@@H]1CCCOC1 774749067 COVUUWQJADDUKF-ZDUSSCGKSA-N 276.380 2.378 10 20 CECD COC[C@H]1CCCN(Cc2cccc(OC)c2O)C1 93337901 DDZNIQCMJVIWRL-LBPRGKRZSA-N 265.353 2.259 10 20 CECD Cc1n[nH]c(C)c1CCC(=O)Nc1ccc(N)cc1 212549942 JMEMWAXVNBDLBP-UHFFFAOYSA-N 258.325 2.180 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C(=O)O)[C@H]1C 1600236815 MXUJLJPTOWEZQQ-IUODEOHRSA-N 276.380 2.356 10 20 CECD O=C(O)c1cnc(NCc2ccc(N3CC=CC3)cc2)nc1 1602533360 GRQNFVGLRVVYGL-UHFFFAOYSA-N 296.330 2.163 10 20 CECD C[C@H](CC(=O)O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1609731518 JLWVJNLRHCLSMK-GHMZBOCLSA-N 278.352 2.041 10 20 CECD Cc1nn(C)c(CNCc2ccccc2O)c1Cl 228415558 FYLORVSONRRYEZ-UHFFFAOYSA-N 265.744 2.377 10 20 CECD C[C@H]1CC(NC(=O)N(C)Cc2ccccc2O)C[C@H](C)O1 154989533 ZDAHVPYYOFDTNG-RYUDHWBXSA-N 292.379 2.490 10 20 CECD C[C@H](CCc1ccco1)NC(=O)c1cccc(O)c1O 126321612 HGUTYGCQOHXKCA-SNVBAGLBSA-N 275.304 2.442 10 20 CECD CCCN(CC(F)F)C(=O)Cc1ccc(N)cc1 236899804 GEUSYPATNDVOCD-UHFFFAOYSA-N 256.296 2.315 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCN3CCC[C@H]3C2)c1 252672932 FFWANYUIQZTHRI-CABCVRRESA-N 260.381 2.417 10 20 CECD CSC[C@@H](C)C(=O)N(C)Cc1ccccc1O 66927730 FBWYEUWCJNYCON-SNVBAGLBSA-N 253.367 2.350 10 20 CECD CC[C@H]1CN(Cc2cccc(OC)c2O)[C@@H](C)CO1 403841963 STRMGJFQZCWEBI-AAEUAGOBSA-N 265.353 2.400 10 20 CECD C[S@](=O)C1(CNCc2cc(Cl)ccc2O)CC1 380172903 LTAUCRKGMOJZOU-KRWDZBQOSA-N 273.785 2.046 10 20 CECD CCCSCC(=O)NCc1cc(OC)ccc1O 114541512 IGMQGZUUVPFPII-UHFFFAOYSA-N 269.366 2.160 10 20 CECD COC1(CNC(=O)c2cccc(O)c2O)CCCCC1 280438318 KCAVQCZXUNZVBG-UHFFFAOYSA-N 279.336 2.177 10 20 CECD COc1ccnc(CN(C)c2ccc3c(c2)OCO3)c1 121422770 LVWYPDCSVINGRW-UHFFFAOYSA-N 272.304 2.455 10 20 CECD COCCC(C)(C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186425849 OAXPRJGHROKXEL-NSHDSACASA-N 295.379 2.208 10 20 CECD CN(Cc1noc(C2CC2)n1)c1ccc2c(c1)OCO2 121355518 YCKMEQGVVUHMOM-UHFFFAOYSA-N 273.292 2.312 10 20 CECD C[C@H](CC(=O)N(C)Cc1ccccc1O)[C@@H]1CCCNC1 127232173 WTDCWRIYZYWCHL-ZIAGYGMSSA-N 290.407 2.376 10 20 CECD COc1ccc(O)c(CNC(=O)C2(OC)CCCCC2)c1 184986418 KQZKUWWVKNCFIG-UHFFFAOYSA-N 293.363 2.366 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1cc(Cl)ccc1O 131512842 VEINKGLCXFLPLA-CABZTGNLSA-N 254.761 2.357 10 20 CECD COC[C@H](NCc1cccc(OC)c1O)C(C)C 86695400 DHGVJOCILVJUEG-LBPRGKRZSA-N 253.342 2.161 10 20 CECD CCC[C@](C)(NCc1ccc2c(c1)CCO2)C(=O)O 86732317 CLIGYMMWEDCGQL-HNNXBMFYSA-N 263.337 2.355 10 20 CECD C[C@@H](N[C@@H]1CCOC1)c1ccc(N2CCOCC2)c(F)c1 90774590 RLHRUGSUIDSOHS-TZMCWYRMSA-N 294.370 2.102 10 20 CECD O=C(c1cccc(O)c1O)N1CCOC[C@H]1c1ccccc1 366174645 ZQNCVPQBBYABJA-AWEZNQCLSA-N 299.326 2.312 10 20 CECD C[C@@]1(NCc2cc3c(cc2O)OCO3)CCO[C@H]1C1CC1 273133952 NCZGNVASYIBBNV-JKSUJKDBSA-N 291.347 2.168 10 20 CECD COC[C@H](N[C@H](C)c1cc(OC)ccc1O)[C@H]1CCCO1 278932148 XNPDJNHJWLQORD-DIOULYMOSA-N 295.379 2.245 10 20 CECD CCN1CCCN(Cc2c(O)cccc2Cl)CC1=O 276269842 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Cc1cc(CN2CC[C@@H]([C@@H](C)N)C2)ccc1N(C)C 923331449 MBXWYTNUCWKCGS-UKRRQHHQSA-N 261.413 2.230 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C/c1cn(C)cn1 929530989 FULMKZBOFLCHFG-JXMROGBWSA-N 298.390 2.158 10 20 CECD CCN(Cc1ccc(N(C)C)c(C)c1)[C@H](C)C(=O)O 923253483 KXPPCNWMXZRFLW-GFCCVEGCSA-N 264.369 2.356 10 20 CECD C[C@@H]1C[C@@H](NCCNC(=O)C2CC2)c2c(O)ccc(F)c21 756372195 PJHWJMILHSPFJP-BXKDBHETSA-N 292.354 2.195 10 20 CECD CC(=O)NCCCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756371787 MHDORTMMNUIRTA-SKDRFNHKSA-N 280.343 2.195 10 20 CECD COCCC1(CNC(=O)c2cc(O)cs2)CCC1 761591985 RPQXVSKXGRMHSC-UHFFFAOYSA-N 269.366 2.390 10 20 CECD CCN1CCCC[C@H]1C(=O)NCc1cc(C)ccc1O 862758974 RPZLKGNUUGORCR-AWEZNQCLSA-N 276.380 2.191 10 20 CECD CC[C@@H](C)N(CCO)Cc1cc(OC)c(OC)cc1O 862387161 ICERXPZMFYXSLN-LLVKDONJSA-N 283.368 2.002 10 20 CECD Cc1cc(C(=O)OCCN2CCC2)c(C)n1-c1ccccn1 861384166 GLKJUVWUNYFDCL-UHFFFAOYSA-N 299.374 2.352 10 20 CECD OC1CCN(c2ccc(CN3CC[C@H]4C[C@H]4C3)cc2)CC1 877636375 VJEXYABFMOHODQ-HOTGVXAUSA-N 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263.337 2.356 10 20 CECD COc1ccc(O)c(CNCc2cnc3n2CCCC3)c1 367435101 AQNRKWQNXMIFJC-UHFFFAOYSA-N 287.363 2.223 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)CN2CCOCC2)c(O)c1C 273379300 HVOUXOVEEPISAC-HIFRSBDPSA-N 292.423 2.380 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2CCCOCC2)c1O 360074670 JCGYWSMBXXXELC-UHFFFAOYSA-N 286.715 2.176 10 20 CECD CC1(C)[C@H](NC(=O)c2cccc(O)c2O)[C@H]2CCCO[C@H]21 370498573 HQOCBVIREAQORZ-LERXQTSPSA-N 291.347 2.031 10 20 CECD CC(C)[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)CCO1 271567482 SZLUIDKLAAXONB-HIFRSBDPSA-N 292.379 2.395 10 20 CECD CC[C@H](N[C@@H](C)C[S@@](C)=O)c1ccc(F)cc1O 286272475 VOYPFZPDVGEYFN-RPRQWQAVSA-N 273.373 2.339 10 20 CECD O=C1CN(Cc2ccc(N3CCCCC3)cc2)CN1C1CC1 280574196 WCSDASFFJDLUCM-UHFFFAOYSA-N 299.418 2.441 10 20 CECD CCOc1ccc(O)c(CNC[C@@H](C)CCCO)c1 294850044 RZTIQVWYVVSITP-LBPRGKRZSA-N 267.369 2.289 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H](CO)C(C)C)c1 806168904 DWQAJQSXXOUADN-YPMHNXCESA-N 295.379 2.094 10 20 CECD COc1ccc(CNC(=O)C(C)(C)CSC)c(O)c1 800560365 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C[C@@H]1C[C@@H](NCc2cccc(Br)c2O)CCN1 841061542 JYCXQJKCLMUKCL-KOLCDFICSA-N 299.212 2.385 10 20 CECD Oc1ccc(Cl)cc1CN[C@@H]1CCCNCC1 841058874 WSWCAFCNOICFFD-GFCCVEGCSA-N 254.761 2.277 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncc(C(=O)O)cn1 844209587 HNBFDZDJMWVSLU-UHFFFAOYSA-N 286.335 2.161 10 20 CECD COc1cccc([C@@H](C)NCC2CCN(C)CC2)c1O 846148339 ZRPHAEXEQMKJGH-GFCCVEGCSA-N 278.396 2.393 10 20 CECD CCc1cccc(CN2C[C@@H](C)[C@H](C(=O)OC)C2)c1O 848916939 BKIMCCFSXFBCIK-BXUZGUMPSA-N 277.364 2.196 10 20 CECD Cc1cccc(CN[C@H]2CCN(CC(F)F)C2)c1O 841893474 FXNIUNZFAFISBI-LBPRGKRZSA-N 270.323 2.130 10 20 CECD CN(C)c1ccc(CN[C@H]2CC23CCNCC3)cc1F 841078694 IQIRDSFQXOIZBG-HNNXBMFYSA-N 277.387 2.123 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)c2nccc(N)n2)c1 846844821 PXTYUHVOILHRTJ-VHSXEESVSA-N 288.351 2.185 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@H](OCCO)C1 840917103 FFTHZALNLPNPBG-QGZVFWFLSA-N 292.423 2.034 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCN(CC(F)F)C2)cc1 841894794 VIMZQLLDXAMAEV-CYBMUJFWSA-N 283.366 2.182 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)Nc2cnn(C)c2C)c1 756873067 GIJZMOXPYLNKOC-VIFPVBQESA-N 289.335 2.394 10 20 CECD C[C@@H]1CCN(Cc2c(O)cccc2Cl)C[C@@H]1CO 857061645 SVEUIABNSKDXOG-GHMZBOCLSA-N 269.772 2.496 10 20 CECD COc1ccc(-n2c(C)cc(C(=O)OCCO)c2C)cc1 925667428 YHNUUPPFZRBEEB-UHFFFAOYSA-N 289.331 2.252 10 20 CECD CC(C)N1CCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1 929402013 ADRVPQZLZLYFSI-INIZCTEOSA-N 289.423 2.242 10 20 CECD C[C@H](O)C[C@@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 757655794 KZOSECAAQBWSSE-VGMNWLOBSA-N 259.296 2.480 10 20 CECD COc1ccc(CNCCCNc2ncccn2)cc1C 751506315 OEKOPNQCUVXZGQ-UHFFFAOYSA-N 286.379 2.385 10 20 CECD COc1cccc(CN2CCCC3(CCNCC3)C2)c1O 1118242722 IGYDJFKPQQAIFW-UHFFFAOYSA-N 290.407 2.366 10 20 CECD CCCCN1CC(=O)N[C@H]1c1cc(Cl)cc(F)c1O 768273091 HQKPTFDWBXMGAQ-CYBMUJFWSA-N 286.734 2.415 10 20 CECD Cc1ccc(CNCCCN2CCCO[C@@H](C)C2)c(O)c1 877477404 CRURUEKZJURCSP-HNNXBMFYSA-N 292.423 2.291 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)NCC 876633827 YCQTZLDFDBKSLE-GFCCVEGCSA-N 264.369 2.129 10 20 CECD Cc1cc(COC(=O)/C=C\c2ccc(O)c(O)c2)on1 772777671 XBWPBMJEQQFLLK-HYXAFXHYSA-N 275.260 2.151 10 20 CECD C=C/C=C\CCNC(=O)NCc1ccc(OC)cc1O 883828411 RDQBFIADLHRUTR-PLNGDYQASA-N 276.336 2.332 10 20 CECD C[C@H](NCCC1(O)CCC1)c1c(O)cccc1F 886607292 ONZXEMJUDVYSSN-JTQLQIEISA-N 253.317 2.487 10 20 CECD CC(C)[C@@H](CNC(=O)c1cc(O)cs1)c1ccnn1C 788591353 IABZXRNCSWHTQP-LLVKDONJSA-N 293.392 2.357 10 20 CECD CCC[C@@H](NCc1ccc(N(C)C)cc1)C(=O)OC 83478820 RRGLWFFCGKYOFX-CQSZACIVSA-N 264.369 2.184 10 20 CECD COc1ccc(CN(C)C[C@H]2CCC[C@@H]2O)c(O)c1OC 892217602 ZEHPWSPRJDTERJ-YPMHNXCESA-N 295.379 2.002 10 20 CECD c1cc2c(cc1CNCc1cnc3n1CCC3)CCO2 719845663 KMKLUNGQEVRTLQ-UHFFFAOYSA-N 269.348 2.054 10 20 CECD COc1ccc(CN[C@@H](C)Cc2cnn(C)c2)cc1C 768400968 BWOBEOJNRGQKJT-ZDUSSCGKSA-N 273.380 2.458 10 20 CECD CC(=O)NCCC1=CCN(c2nc(C)nc(C)c2C)CC1 1089802464 PAYADLMLSIIOFJ-UHFFFAOYSA-N 288.395 2.065 10 20 CECD CS[C@@H]1CC[C@@H](NC(=O)NCc2ccc(N)cc2)C1 1336841914 ZDYRQXDVOSWCOD-CHWSQXEVSA-N 279.409 2.352 10 20 CECD O=C(O)[C@@H](F)CNCc1ccc(N2CCCCC2)cc1 1331996968 YKBMBGJVZDQWNM-AWEZNQCLSA-N 280.343 2.189 10 20 CECD CC[C@@H](C)CONC(=O)NCc1ccc(N)cc1 1262597127 FPPAIBTZPDEHGX-SNVBAGLBSA-N 251.330 2.046 10 20 CECD COc1ccc(O)c([C@@H](C)NCCN2CCSCC2)c1 223740302 WGSCDTLVVLWRDX-GFCCVEGCSA-N 296.436 2.100 10 20 CECD CCN(CCC(=O)O)Cc1cc(F)c(N(C)C)cc1F 1605443195 UPTUUJRRCDDHFS-UHFFFAOYSA-N 286.322 2.327 10 20 CECD O=C(O)[C@@H]1[C@H]2CN(Cc3cc4c(cc3O)CCCC4)C[C@H]21 1608817052 WDBKNAGCIVVTTK-FOLVSLTJSA-N 287.359 2.033 10 20 CECD CC(C)[C@H](C)NC(=O)CSc1ncc(C(=O)O)s1 1603720962 GPFKWKPUMHLZIJ-ZETCQYMHSA-N 288.394 2.094 10 20 CECD C[C@@H]1[C@H](C(=O)O)CCN1Cc1cc(Cl)cc(F)c1O 1609835435 UMPBEEQWGSVQOV-GMSGAONNSA-N 287.718 2.480 10 20 CECD O=C(O)c1cnc(SCc2cn(CC3CC3)nn2)s1 1610862971 NBGIHDMOGFPJLN-UHFFFAOYSA-N 296.377 2.135 10 20 CECD CCOc1cccc(CN2CC[C@@H](N)[C@@H](CC)C2)c1O 226010177 SUISXPROUVYUGS-GXTWGEPZSA-N 278.396 2.350 10 20 CECD N[C@@H](C(=O)NCc1cc(Cl)ccc1O)c1ccccc1 1574262421 NEZCEPHQLUTXKS-CQSZACIVSA-N 290.750 2.362 10 20 CECD C[C@@H](NCCN1CCSCC1)c1ccc(F)cc1O 230661632 CIWXVMFSSCFCTF-LLVKDONJSA-N 284.400 2.231 10 20 CECD CO[C@H](C)CCN[C@H](C)c1cc(C(=O)O)ccc1O 1599040571 TUBVAKCMDUZLNG-NXEZZACHSA-N 267.325 2.166 10 20 CECD CC[C@H](C)N(C)CCN[C@@H](C)c1cc(C(=O)O)ccc1O 1594967946 COXLGPXFJJQQBS-RYUDHWBXSA-N 294.395 2.471 10 20 CECD O=C(CCC(=O)c1ccccc1)NCc1ccc(O)c(O)c1 158969224 YDULVADWVDXLPB-UHFFFAOYSA-N 299.326 2.377 10 20 CECD COc1cc(C)sc1C(=O)NCc1ccc(O)c(O)c1 158995273 RVSMAFALTFEVCN-UHFFFAOYSA-N 293.344 2.406 10 20 CECD COc1cccc(O)c1CNCCc1scnc1C 824733375 QELTTXSNDUWTTP-UHFFFAOYSA-N 278.377 2.498 10 20 CECD CC[C@](C)(CNCc1c(O)cccc1OC)OC 824744078 ZARHMKNLVZJEAY-CQSZACIVSA-N 253.342 2.306 10 20 CECD C[C@@H](NS(=O)(=O)CCC(F)(F)F)c1ccccc1O 867835046 QTFQAYNAKNFGAW-MRVPVSSYSA-N 297.298 2.325 10 20 CECD CN(C)c1ccc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1 250362163 VDXRREQZDCAIEP-KKUMJFAQSA-N 274.364 2.190 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)OCO3)[C@@H](C)CO1 403787803 CVFIMELOHWOTKQ-JQWIXIFHSA-N 279.336 2.120 10 20 CECD CON1CCC(N[C@H](C)c2ccc(N(C)C)cc2)CC1 692122709 DQLVIOADGAMTKN-CYBMUJFWSA-N 277.412 2.429 10 20 CECD OC[C@H](C[C@@H]1CCCO1)NCc1cccc(Cl)c1O 895747915 JIYRVDLMPJOPAD-RYUDHWBXSA-N 285.771 2.065 10 20 CECD CN(C)c1ccc(CN2CCCC[C@@H]2C(=O)O)cc1 3755551 MADUPLUHJKWHTJ-CQSZACIVSA-N 262.353 2.192 10 20 CECD CCCN1CCC(N(C)C(=O)c2cccc(O)c2O)CC1 188253842 UBDYEDJIUZGNPW-UHFFFAOYSA-N 292.379 2.044 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2cc(C)ccc2O)C1 185787715 OUNCJKXXZXSYOU-QWHCGFSZSA-N 276.380 2.362 10 20 CECD Cc1cnc(C(=O)NCc2c(O)ccc3c2CCCC3)cn1 75159616 DWIBBAAMPCNCDQ-UHFFFAOYSA-N 297.358 2.299 10 20 CECD Oc1ccc(Br)cc1CNCc1ncc[nH]1 226212583 YJNMFFXUCBIMPY-UHFFFAOYSA-N 282.141 2.168 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCCNC 236731803 NCONBRCLRCMAOK-UHFFFAOYSA-N 264.369 2.130 10 20 CECD CC(C)OCCS(=O)(=O)Nc1ccc(O)c(Cl)c1 93666487 SGCRWLXDCLGNMU-UHFFFAOYSA-N 293.772 2.212 10 20 CECD O=C(O)[C@@H]1CCCCCN1Cc1cc(F)ccc1O 236444072 RPOQFGNDBQRNGK-LBPRGKRZSA-N 267.300 2.361 10 20 CECD CCO[C@@H]1C[C@H](NCc2cc(F)ccc2O)[C@]12CCCO2 368698220 JUSAUTXFDFNCHY-ARFHVFGLSA-N 295.354 2.348 10 20 CECD O=C1CN(Cc2cccc(Cl)c2O)CN1CC1CC1 279530160 ZIDTYVZVLNZPSM-UHFFFAOYSA-N 280.755 2.057 10 20 CECD CN(C)c1ccc(CNC[C@](C)(O)C(F)(F)F)cc1F 270452015 CMURTLLMWWUWRH-LBPRGKRZSA-N 294.292 2.295 10 20 CECD CC[C@H](NCCCNC(C)=O)c1ccc(C)cc1O 280079072 LPSFSRZLUVGSPB-AWEZNQCLSA-N 264.369 2.268 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H]1CCCCO1 808095006 NXCIXFXRLNZHFE-LBPRGKRZSA-N 298.379 2.453 10 20 CECD COc1cccc(CN2CC[C@@H](n3cc(C)cn3)C2)c1O 290978639 TWMFWNGOMQXXHS-CQSZACIVSA-N 287.363 2.353 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)Nc1ccnnc1 297356122 HAOSYPQJLVEVAX-UHFFFAOYSA-N 297.362 2.399 10 20 CECD CCO/C=C\C(=O)NCc1c(O)ccc2c1CCCC2 816938693 HIDKIZUAAQHUMA-KTKRTIGZSA-N 275.348 2.437 10 20 CECD C[C@H](NC[C@@H](C)N)c1cc(Br)ccc1O 817971529 DWEVCBNIONMMBF-SFYZADRCSA-N 273.174 2.153 10 20 CECD CCO[C@H](CCN(C)C)CN[C@@H]1CCc2cccc(O)c21 834620968 ZHVSPVVNXNTYNG-HUUCEWRRSA-N 292.423 2.326 10 20 CECD CC[C@H](CCO)N[C@H](C)c1cc(F)cc(F)c1O 756602973 HGZZFQYIVPEISX-PSASIEDQSA-N 259.296 2.482 10 20 CECD C[C@H](Cn1cncn1)NCc1ccc(N2CCCC2)cc1 731451394 YIMQTXFKOXRXHU-CQSZACIVSA-N 285.395 2.057 10 20 CECD C[C@@H](Cc1ccccn1)NCc1cc2c(cc1O)OCO2 848567460 WBRJLUYMNSGIPZ-NSHDSACASA-N 286.331 2.237 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C[C@@H](C)O 840936508 KKXZDKFMQNWTMY-QWHCGFSZSA-N 250.386 2.310 10 20 CECD COc1cccc(CNCc2ccc(CCN)cc2)c1O 841032777 XRTPNYTXXGAOJH-UHFFFAOYSA-N 286.375 2.192 10 20 CECD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)C1CCC1 911352795 BZSLAWSIUXXSKB-UHFFFAOYSA-N 297.738 2.259 10 20 CECD Cc1cc(N(C)C)ccc1CNCCN1CC[C@@H](C)C1 840935678 AADAPMAARJZXCL-CQSZACIVSA-N 275.440 2.492 10 20 CECD C[C@H]1C[C@@H](CN)CN1Cc1c(O)ccc(Cl)c1F 843058859 ZPQHOUWNHZZWPV-IUCAKERBSA-N 272.751 2.354 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCN[C@H](C)C2)c1 841061991 PPIUKNVBCSJFCQ-DGCLKSJQSA-N 264.369 2.021 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)NCC2CC2)cc1 844279304 FKXKTTGFPKBISG-UHFFFAOYSA-N 291.395 2.183 10 20 CECD CCOc1ccc(CN[C@H]2CC23CCNCC3)c(O)c1 841079803 OQKACBZQDNEPLT-HNNXBMFYSA-N 276.380 2.023 10 20 CECD CC(C)[C@@H](Sc1ncc(Cl)s1)C(N)=O 849998667 HUGQBWONUFATKN-ZCFIWIBFSA-N 250.776 2.399 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC[C@@H]1CCCO1 844281133 JXSDRQZDJZHHPM-NSHDSACASA-N 284.743 2.024 10 20 CECD Cc1cnc(COC(=O)c2cccc(O)c2O)s1 758559143 QJXJSBGEIBZQLH-UHFFFAOYSA-N 265.290 2.220 10 20 CECD C[C@H]1CCN(CCN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)C1 756629771 RZWPYRUNSCAHPN-RYUDHWBXSA-N 293.367 2.293 10 20 CECD CN1CCC(CNCc2cc(Cl)ccc2O)CC1 44515723 JOOKFFLQWLVMBG-UHFFFAOYSA-N 268.788 2.477 10 20 CECD C[C@@H](NCC1(C(N)=O)CCCC1)c1cc(F)cc(F)c1O 756587098 WYXLAZMQBRCLES-SECBINFHSA-N 298.333 2.367 10 20 CECD CSCCCOC(=O)/C=C/c1ccc(O)c(O)c1 759588751 OIJATDLETUHBBZ-GQCTYLIASA-N 268.334 2.407 10 20 CECD C[C@H]1CCN(Cc2cc(Cl)ccc2O)C[C@H]1CO 857061444 QWDRKKYJFSCVDX-JQWIXIFHSA-N 269.772 2.496 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H](O)C1CC1 854474776 NUQMIKJQYOGUEY-NSHDSACASA-N 290.146 2.086 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)[C@@H]2CN(C)CCO2)c(O)c1C 756757863 FWCCERPFHNHHBV-DZKIICNBSA-N 292.423 2.379 10 20 CECD C[C@@H](OC(=O)c1cccc(O)c1O)c1cccnc1 758559947 UESUUYLAYDHDRT-SECBINFHSA-N 259.261 2.411 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1ccc(C)cc1O 756733918 RSQNCZFZQCQEGT-OLZOCXBDSA-N 267.369 2.403 10 20 CECD CN(Cc1cc2c(cc1O)CCCC2)C[C@H]1COCCO1 853558336 RMACHXQUBGNVRZ-INIZCTEOSA-N 291.391 2.118 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCCSC2)c1 862755826 LLISFPYDZKCFKX-NSHDSACASA-N 265.378 2.460 10 20 CECD Oc1ccc(Cl)cc1CN[C@H]1CCCC[C@@H]1O 51991985 MKZZKCWSHOHZHN-AAEUAGOBSA-N 255.745 2.439 10 20 CECD C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)c1ccco1 762264332 SZDLUKQJGZZIRB-SNVBAGLBSA-N 275.304 2.153 10 20 CECD Cn1cc(CN(Cc2ccccc2O)C2CCCC2)nn1 761668873 IPDDMXUUTOTHBZ-UHFFFAOYSA-N 286.379 2.466 10 20 CECD Cc1ccc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c(O)c1 876755292 JECUGWJJHBRUOC-IUUKEHGRSA-N 267.394 2.042 10 20 CECD COc1cccc(CNCC[C@H](O)C2CCCC2)c1O 865874761 IGNJPTPXTFTDOR-AWEZNQCLSA-N 279.380 2.432 10 20 CECD C/C=C\C(=O)NCc1cccc(Br)c1O 765754283 UOYYBXPRQGTGQR-RQOWECAXSA-N 270.126 2.347 10 20 CECD CCCN(CC(=O)OC)Cc1ccc(OCC)cc1O 771935430 PRNUVACNJUSIDM-UHFFFAOYSA-N 281.352 2.176 10 20 CECD COc1ccc(CNC2(CO)CCCCC2)c(O)c1OC 893604029 XBBUWKOLTHAAJO-UHFFFAOYSA-N 295.379 2.194 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cccc(OC)c2O)C1 93770482 WLWWXOUENSWJEQ-CYBMUJFWSA-N 278.396 2.174 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@H](C2OCCO2)C1 896384310 JSDJHEDADRGINU-JTQLQIEISA-N 283.755 2.240 10 20 CECD COC[C@@H](CCO)NCc1cc(Cl)cc(Cl)c1O 219136450 XDYCXJYCAQEPCX-SNVBAGLBSA-N 294.178 2.186 10 20 CECD C[C@H](NCc1c(O)ccc(Cl)c1F)C(C)(C)O 790954915 CGKGDOWTGWSLQD-ZETCQYMHSA-N 261.724 2.434 10 20 CECD CON1CCC(NCc2cccc(Cl)c2O)CC1 692186653 CUMMBBZXSDEQPS-UHFFFAOYSA-N 270.760 2.161 10 20 CECD COC(=O)[C@@H]1CCC[C@H]1NCc1ccc(N(C)C)c(C)c1 1324268478 WJCJHBUYWAEMTK-HUUCEWRRSA-N 290.407 2.492 10 20 CECD CC[C@](C)(CNCc1cc(F)cc(F)c1O)C(=O)O 1339241567 RSPXCWMMHQKFJV-CYBMUJFWSA-N 273.279 2.261 10 20 CECD Oc1ccccc1CN1CCC(NC2CCOCC2)CC1 1255035601 JXFWDSZLIFIFJD-UHFFFAOYSA-N 290.407 2.125 10 20 CECD CCCc1n[nH]cc1C(=O)NCc1ccc(N(C)C)cc1 1337967119 LLQFRVIDYCHHLR-UHFFFAOYSA-N 286.379 2.358 10 20 CECD O=C(O)[C@@H]1CCCC[C@@H]1NCc1cc(F)cc(F)c1O 1350653069 MDRPWFJWGYDGGA-PWSUYJOCSA-N 285.290 2.403 10 20 CECD C[C@@H]1[C@H](C(=O)O)CCN1Cc1cc2c(cc1O)CCC2 1604635154 FPRSGKRQCNWSJZ-QMTHXVAHSA-N 275.348 2.176 10 20 CECD CC(C)c1ccc(O)c(CNC[C@@H]2[C@H]3CNC[C@H]32)c1 1575859023 YFNZQDZVMFPCDL-QKDCVEJESA-N 260.381 2.071 10 20 CECD COc1ccc(O)c(CN2CCC[C@](C)(OC)C2)c1 230299787 NFJBADFMTVTPCC-HNNXBMFYSA-N 265.353 2.402 10 20 CECD CO[C@@]1(C(=O)O)CCN(Cc2cc(Cl)c(C)cc2O)C1 1599078769 JSEFHTWPGDRBQM-AWEZNQCLSA-N 299.754 2.030 10 20 CECD O=C(O)CC[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 1595015245 PGHXZGSNQDJIRE-VIFPVBQESA-N 283.349 2.171 10 20 CECD CC[C@H](C)C[C@H](NCc1cccc(OC)c1O)C(=O)O 1594953670 RQAZRFCMKAXCOU-JQWIXIFHSA-N 281.352 2.380 10 20 CECD Cc1cccc(CN(CCC(=O)O)C2CCOCC2)c1O 1594403898 DYZXOEMRDPDSTN-UHFFFAOYSA-N 293.363 2.156 10 20 CECD C[C@H](CCO)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 151989929 ICOHEOSWTODZBO-CHWSQXEVSA-N 296.386 2.084 10 20 CECD N[C@@H]1CCCC[C@H]1NCc1ccc2c(c1)CCCO2 258877167 GKKCNNZYBMGGIB-HUUCEWRRSA-N 260.381 2.371 10 20 CECD Cc1cccc(O)c1CNCCCCn1ccnc1 876958537 GZONGNOHWDXYRF-UHFFFAOYSA-N 259.353 2.467 10 20 CECD CCN1CC[C@H](CNCc2ccc(N(C)C)cc2)C1 37643731 AVMDMJBEKQQHNR-OAHLLOKOSA-N 261.413 2.184 10 20 CECD C[C@H](Cn1cccn1)NCc1ccc2c(c1)CCCN2C 50286642 TZDUPSKFJOUGPS-CQSZACIVSA-N 284.407 2.444 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)OC 66096078 YQPWPMIJVHOKKD-NSHDSACASA-N 251.326 2.166 10 20 CECD COCCN1CCC(N[C@@H](C)c2cc(C)ccc2O)CC1 185144791 GLXROUHJKQIRHZ-AWEZNQCLSA-N 292.423 2.462 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(N(C)C)CCOCC2)c1 185449709 XNMHQZBCHUITAM-CQSZACIVSA-N 292.423 2.462 10 20 CECD COc1ccc(O)c(CNC(=O)NCCC2CCC2)c1 128509981 VWIHZWSWQDRNST-UHFFFAOYSA-N 278.352 2.390 10 20 CECD C[C@H](NCC(C)(C)C(N)=O)c1cc2c(cc1O)CCCC2 186220804 DWSSRHOOAYMWRH-NSHDSACASA-N 290.407 2.433 10 20 CECD COCCC[C@H](C)C(=O)N(C)Cc1ccccc1O 182201756 SLAQFTVRUMVJLQ-LBPRGKRZSA-N 265.353 2.413 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CC[C@@H](C)O2)cc1 191085875 AXKCNBTVTSHWEO-IUODEOHRSA-N 293.363 2.242 10 20 CECD Cc1ccc(C(=O)N2CCC3(CCOCC3)C2)c(O)c1O 272711670 FAQKHIMYEVLJSP-UHFFFAOYSA-N 291.347 2.049 10 20 CECD COc1cccc(CN2CC[C@@](CO)(C(C)C)C2)c1O 378127893 IHCCMTQKIAOOAX-MRXNPFEDSA-N 279.380 2.241 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1nnc(C)o1 292255422 SNSQCAPZKAKOJI-UHFFFAOYSA-N 289.335 2.065 10 20 CECD C[C@@H](N[C@@H]1CCNC1)c1cc2c(cc1O)CCCC2 817945222 XMXIMGCVTGDOJT-BXUZGUMPSA-N 260.381 2.284 10 20 CECD CC(=O)NCCCNCc1ccc2ccccc2c1O 816532168 UFRREKWYZKSCTI-UHFFFAOYSA-N 272.348 2.161 10 20 CECD CCOc1cccc(CN[C@@H](C)Cc2cnccn2)c1O 725849484 OKCRPUZSHXLHLB-LBPRGKRZSA-N 287.363 2.302 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H]2CC[C@@H]3C[C@@H]23)c1 825841132 ZZLMLDLKTNVENX-UHIISALHSA-N 275.348 2.453 10 20 CECD Cc1cc(C)c(O)c(CN2CCC(C(=O)O)CC2)c1 820968096 LQBANQWOSCLGKL-UHFFFAOYSA-N 263.337 2.306 10 20 CECD COc1cccc(O)c1CN1[C@H]2CC[C@H]1CC(=O)C2 839132029 VHEMIWSYHWTTGI-QWRGUYRKSA-N 261.321 2.097 10 20 CECD COCCOC[C@@H](C)N[C@@H]1CCc2cccc(O)c21 834667881 CPLIKRGHCCOIDC-DGCLKSJQSA-N 265.353 2.021 10 20 CECD CCN(C(=O)/C=C\c1cnn(C)c1)c1ccccc1 917107173 XOQIIIPJYAJQLP-KTKRTIGZSA-N 255.321 2.486 10 20 CECD COc1cccc(CN2C[C@H]3[C@H](C2)C3(F)F)c1O 846111301 LEIYLQMNHAAACJ-UWVGGRQHSA-N 255.264 2.098 10 20 CECD COc1ccc(O)c([C@H](C)NC(=S)NCC2CC2)c1 849256769 RPPHPIQUWXHRJL-VIFPVBQESA-N 280.393 2.336 10 20 CECD CC[C@H](N[C@H](C)c1cccc(OC)c1O)[C@@H](C)O 846170060 VTIKAPZFVICYST-FOGDFJRCSA-N 253.342 2.211 10 20 CECD CSC[C@@H](CCO)NCc1ccc(N(C)C)cc1C 840933058 FBGIONKBXNOAND-CQSZACIVSA-N 282.453 2.265 10 20 CECD CCc1cccc(CN2CCC[C@H]3CN(C)C[C@H]32)c1O 848918256 UIPUNBRAQXWRHF-GOEBONIOSA-N 274.408 2.481 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCCN2C)cc1 748561577 DSLGPIGYFNWGDQ-MRXNPFEDSA-N 289.423 2.243 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1 848594370 JZRLPTXAOKWIOV-CABCVRRESA-N 288.395 2.407 10 20 CECD COC1([C@@H](C)NC(=O)/C=C/c2ccc(O)c(O)c2)CCC1 840530637 AIIOOVOZWQMKOA-OKPNEXGHSA-N 291.347 2.185 10 20 CECD COc1cccc(CN[C@H](C)CCCCN)c1O 841080457 QFTMTMCIFQKLNH-LLVKDONJSA-N 252.358 2.008 10 20 CECD C[C@H](Nc1cnn(CCO)c1)c1cc(F)cc(F)c1O 756855640 LTSVIGTVWAGAPQ-QMMMGPOBSA-N 283.278 2.032 10 20 CECD CCOc1cccc(CN2CCc3n[nH]cc3C2)c1O 857877369 NBOQJHYFSNMGJK-UHFFFAOYSA-N 273.336 2.072 10 20 CECD CCn1cnnc1CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756418350 APNIOPMGFAPUGY-GXSJLCMTSA-N 290.342 2.481 10 20 CECD CCn1cc([C@H](C)NCc2cc([N+](=O)[O-])ccc2O)cn1 765617398 ASAGEAIFRIGJKO-JTQLQIEISA-N 290.323 2.368 10 20 CECD CCOC(=O)/C=C\CN[C@H](C)c1cc(OC)ccc1O 930215769 ZENHOVRMUYWWGF-ISALQUGTSA-N 279.336 2.171 10 20 CECD CC[C@H](C)N(CCO)Cc1cc(OC)c(OC)cc1O 862387162 ICERXPZMFYXSLN-NSHDSACASA-N 283.368 2.002 10 20 CECD C[C@H]1[C@@H](C)N(C)CCN1Cc1ccc(N(C)C)c(F)c1 775983988 DUPKMDNQPNSEJR-OLZOCXBDSA-N 279.403 2.416 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)C(C)(C)O)CC2)cc1 776899396 BSTHQSQLHLDNGH-ZDUSSCGKSA-N 292.423 2.413 10 20 CECD CC(C)Cn1ccc(C(=O)Nc2ccc(N)cc2)n1 884009321 SQVCEKSJFVEYJZ-UHFFFAOYSA-N 258.325 2.374 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCc1cccc(O)c1O 1123889276 OEOYPZJXHNVBCO-JBLDHEPKSA-N 261.321 2.150 10 20 CECD CCNC(=O)C1(CN[C@H](C)c2c(O)cccc2F)CCC1 886599144 SBQVDVQINPQKNH-LLVKDONJSA-N 294.370 2.488 10 20 CECD Cc1cc(C[C@@H](C)NCc2cc(F)cc(F)c2O)n[nH]1 883049580 QDTFIRHLWNRMLV-MRVPVSSYSA-N 281.306 2.423 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2(OC)CCC2)c1 782013137 GDYYDOZMLZQPPO-SNVBAGLBSA-N 279.336 2.147 10 20 CECD Cn1ncc(CNCc2ccccc2O)c1C1CC1 892790576 FVRVMVVFDOLWIT-UHFFFAOYSA-N 257.337 2.293 10 20 CECD CC(C)N1CCN(Cc2cc(Cl)ccc2O)CC1=O 780792082 FWXRBZGSVAOAMJ-UHFFFAOYSA-N 282.771 2.098 10 20 CECD Cc1cc(CN2CCCc3cc(CN)ccc32)on1 700923893 JJHAXEQJEMTYHM-UHFFFAOYSA-N 257.337 2.395 10 20 CECD CNc1c(Cl)ncnc1NCc1ccc(OC)cc1O 795288483 CJNBDIRJWNNUBU-UHFFFAOYSA-N 294.742 2.498 10 20 CECD OC[C@H]1C[C@@H](NCc2c(O)cccc2Br)C1 707639537 JUQOPXLZBQUTPO-DTORHVGOSA-N 286.169 2.015 10 20 CECD C[C@H](Cn1ccnc1)NCc1cc(F)cc(F)c1O 708494555 LSALTEOVMCOHMT-SECBINFHSA-N 267.279 2.045 10 20 CECD COc1cccc(C(=O)NCc2ccccc2O)c1 133784020 LJMQMJGJQSZLAO-UHFFFAOYSA-N 257.289 2.331 10 20 CECD COc1cccc(CN2CC[C@@H](N3CCCC3)C2)c1O 133953767 DAXBRWFXKWRGBQ-CQSZACIVSA-N 276.380 2.071 10 20 CECD COc1ccc2c(c1)CCCCN2C[C@@H]1CN(C)C(=O)O1 1324941529 SDXUOWVJIKIUHC-AWEZNQCLSA-N 290.363 2.289 10 20 CECD CN(C)CCOc1ccccc1CNCc1ccc(N)cc1 1334775489 ZNRJZRXCPNSYPR-UHFFFAOYSA-N 299.418 2.499 10 20 CECD CC(C)c1ccc(O)c(CNC[C@@]2(C(=O)O)CCOC2)c1 1591973918 JQWKPICPROOSIK-INIZCTEOSA-N 293.363 2.097 10 20 CECD COc1ccc(O)c(CNc2ccc(C(=O)O)cn2)c1 1599598735 RQRSUAWAZABFBG-UHFFFAOYSA-N 274.276 2.106 10 20 CECD CCCC[C@@H](NCc1ccc(OC)c(C)c1)[C@H](O)C(=O)O 1776774481 CKDWPTBAJGLSGO-HIFRSBDPSA-N 295.379 2.098 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)Cc1cccn1C 153303449 SUMPRZMORHJSAB-UHFFFAOYSA-N 299.418 2.494 10 20 CECD Cc1cccc(O)c1CN(C)CC1CCN(C)CC1 876689964 CROCKNIVWOEBMD-UHFFFAOYSA-N 262.397 2.474 10 20 CECD NC(=O)Nc1cccc(NCc2ccccc2O)c1 37135855 HHBLPAKNZRARIM-UHFFFAOYSA-N 257.293 2.495 10 20 CECD CCN(CC)c1ccc(CNC(COC)COC)cc1 388393682 FMEXRYZRFXWGMW-UHFFFAOYSA-N 280.412 2.284 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)c2n[nH]c(C)n2)c1 392461490 OZHSZDLZLHHZGM-DTWKUNHWSA-N 276.340 2.239 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCCOC2)c1 109543438 SHKJFJVIAQSZNN-WDEREUQCSA-N 251.326 2.230 10 20 CECD CCN1CC[C@H](N(C)C(=O)Cc2ccc(N)cc2)[C@H](C)C1 178813958 PRKORDDKENWPCD-CJNGLKHVSA-N 289.423 2.000 10 20 CECD CN(C)c1ccc(CNC[C@H]2CCCN2C)cc1F 113328521 BEBUFVWXBAWOJB-CYBMUJFWSA-N 265.376 2.076 10 20 CECD Cc1cc(O)c(/C=C2/SC(=S)NC2=O)cc1C 174052209 PBRCDFIZAOGZFS-BJMVGYQFSA-N 265.359 2.498 10 20 CECD CC(C)(CC(=O)O)NCc1cc(F)cc(F)c1O 1262163478 UUFUYILOKDCOLU-UHFFFAOYSA-N 259.252 2.013 10 20 CECD COc1cc(O)c(CN[C@H]2CCOC(C)(C)C2)cc1OC 127237234 NTQLBHQMGYGABB-LBPRGKRZSA-N 295.379 2.457 10 20 CECD Cc1ccc(C[C@@H](CO)NCc2ccccc2O)cc1 188981656 AFAFBAYZJZPMHJ-INIZCTEOSA-N 271.360 2.394 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCCCF 123913961 ZDNULQOWJRWTRY-UHFFFAOYSA-N 267.348 2.220 10 20 CECD CCN(CC)c1ccc(CNCCC(=O)O)cc1 36891890 SFQHHQRKJQFMJL-UHFFFAOYSA-N 250.342 2.097 10 20 CECD CSC[C@@H]1CCCN1C(=O)c1ccc(C)c(O)c1O 182830651 HQWOJVJGJHVDGK-JTQLQIEISA-N 281.377 2.374 10 20 CECD Nc1ccc(NC(=O)NC[C@H]2CCSC2)cc1 228580172 JMYMBVLLFQDZIK-SECBINFHSA-N 251.355 2.143 10 20 CECD CCOC[C@@H](O)COc1ccc(N2CCCC2)cc1 193829656 NKXSOFGJAQJAMH-CQSZACIVSA-N 265.353 2.063 10 20 CECD C[C@@H]1[C@@H](C(=O)O)CCN1Cc1ccc(N(C)C)cc1 92941444 VHEPSSFIRALJFF-RISCZKNCSA-N 262.353 2.048 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@H]2CN3CCC[C@H]3CO2)c1 252566746 ZVOGOFMNQMJISF-KKUMJFAQSA-N 290.407 2.214 10 20 CECD Cc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)on1 273563884 IYUQKDICBILXRA-VIFPVBQESA-N 277.280 2.448 10 20 CECD C[C@H](O)C[C@@H](C)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273613428 WTZUMCJHJASDRT-OUAUKWLOSA-N 282.340 2.358 10 20 CECD COc1cccc(CN2CCC3(CCO3)CC2)c1O 374335115 WZSRTPHPOPXKLP-UHFFFAOYSA-N 263.337 2.156 10 20 CECD CCN(CCOCCO)Cc1ccc(N(CC)CC)cc1 282695376 JHZIHEXDHGCNIY-UHFFFAOYSA-N 294.439 2.364 10 20 CECD Nc1ccc(NC(=O)[C@@H]2CCC[C@@H](C(=O)O)C2)cc1 388880099 HENODYRPCRXEFD-NXEZZACHSA-N 262.309 2.098 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](CO)CC2)c1O 293167098 OZKJILWVHKCJAA-LBPRGKRZSA-N 295.354 2.328 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](O)CC2)c1 294114405 SUSMCAPXALMXKS-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD CC(C)[C@H](C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 297744386 DGRFOMRHCGCJNE-AWEZNQCLSA-N 291.439 2.345 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](O)C[C@@H]2C)c1O 292777559 LBQGEGMSXITUHD-CABZTGNLSA-N 285.771 2.399 10 20 CECD CCOc1ccc(CNCc2snnc2C)c(O)c1 813790677 YFJPIPFFIPGEFV-UHFFFAOYSA-N 279.365 2.241 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](CCCO)C2)c1 825339081 ZXPRJESDIMRWEI-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1cccnc1 588406039 LSQAZDKJPCQSDS-JPVGGKMYSA-N 284.315 2.383 10 20 CECD CC[C@H](CN1CCOCC1)N[C@H](C)c1ccc(C)cc1O 903342995 LVQTXLRGEYTREO-HUUCEWRRSA-N 292.423 2.462 10 20 CECD CN(Cc1cscn1)C(=O)c1cc(O)cs1 732277758 OKXLGPLUOXTJHO-UHFFFAOYSA-N 254.336 2.182 10 20 CECD CCCC[C@H](CN)NCc1ccc(N(C)C)c(F)c1 841029806 SKZDWKZEOCDTGF-CYBMUJFWSA-N 267.392 2.499 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@]2(Cl)C[C@H]3CC[C@H]2O3)c1 913000139 DBIQTHXPWNANAY-UXIGCNINSA-N 295.766 2.246 10 20 CECD CC[C@@H](C)[C@H](C)C(=O)NCc1ccc(O)cc1O 910948817 AXFBHRDVILEVEM-ZJUUUORDSA-N 251.326 2.396 10 20 CECD CCOCCOCCN(C)c1ccc(OC)c(OC)c1 846753025 YTLJQHRWFBFRFD-UHFFFAOYSA-N 283.368 2.193 10 20 CECD COc1ccc(N2CCC(NCc3ccno3)CC2)cc1 843403297 WITQGRABBKAGOE-UHFFFAOYSA-N 287.363 2.442 10 20 CECD Cc1cc(O)c(CNCCC(C)(C)S(C)(=O)=O)cc1C 840960557 OMCBMQQSNQAXNN-UHFFFAOYSA-N 299.436 2.312 10 20 CECD COc1cccc(O)c1CNC[C@@]1(O)CCc2ccccc21 752124103 IUEMGQHQLZWQSS-SFHVURJKSA-N 299.370 2.324 10 20 CECD O=C(NCc1ccccc1O)[C@@H](O)CCc1ccccc1 765177581 OWQSSXUEBGHTMZ-INIZCTEOSA-N 285.343 2.002 10 20 CECD C[C@@H](O)CCN(C)Cc1c(O)cccc1Br 862247533 ZKIATDMXKNCBKB-SECBINFHSA-N 288.185 2.357 10 20 CECD C[C@@H]1CCN(Cc2cc(Cl)ccc2O)CC[S@]1=O 763488831 FHIHVIYVTUNPMY-MLCYQJTMSA-N 287.812 2.389 10 20 CECD COCC1(CNCc2ccc(C)cc2O)CCOCC1 877544532 YZBSJGNYXJNOOS-UHFFFAOYSA-N 279.380 2.233 10 20 CECD CC[C@@H]1C(=O)N(CC)CCN1Cc1ccc(C)cc1O 877440517 AWSUORYMUPQXCL-CQSZACIVSA-N 276.380 2.143 10 20 CECD CCCOc1ccc(CN[C@@H](C)C(=O)N(C)OC)cc1C 873145202 IYJUVCLLPZJBJI-ZDUSSCGKSA-N 294.395 2.282 10 20 CECD CCOC(=O)C1(CNCc2cc(Cl)ccc2O)CC1 770666242 WVENYDQZOKWVLM-UHFFFAOYSA-N 283.755 2.479 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1 887040579 GRHGMAHSSIQNOM-XIRDDKMYSA-N 274.408 2.488 10 20 CECD CCOC(=O)C1CCN(Cc2cc(F)cc(F)c2O)CC1 893872325 RAYFRHUHMOWLRP-UHFFFAOYSA-N 299.317 2.446 10 20 CECD O=C(NCCc1cccc(F)c1F)c1cccc(O)c1O 790708375 UVADHGTXKPIRTH-UHFFFAOYSA-N 293.269 2.349 10 20 CECD OC[C@H]1C[C@@H](NCc2cc(Br)ccc2O)C1 707546827 QNNULMWMTINRCW-DKTWLAJQSA-N 286.169 2.015 10 20 CECD C[C@H](NCc1ncnn1CCF)c1ccc(N(C)C)cc1 799323215 UMOBEDOWJBHGRU-LBPRGKRZSA-N 291.374 2.164 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)F)c1ccc(N(C)C)cc1 717809039 QCYWFMNMIRSBCD-ZYHUDNBSSA-N 272.339 2.419 10 20 CECD CO[C@@H](C)CC(=O)Nc1c(Cl)ccc2nonc12 1327168018 WVDYQHDJOLOJDO-LURJTMIESA-N 269.688 2.240 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1[C@H]2c3ccccc3C[C@H]21 1263896448 ZJWFZMDJNFPTMU-VNQPRFMTSA-N 295.338 2.300 10 20 CECD C[C@@H]1CC[C@](NCc2cc(F)cc(F)c2O)(C(=O)O)C1 1776628575 JIIGSWXUFHLPGY-XLKFXECMSA-N 285.290 2.403 10 20 CECD C[C@@H](NCCn1ccnc1)c1ccc(N(C)C)cc1 41119597 YEUVWZBEMJGYAL-CYBMUJFWSA-N 258.369 2.300 10 20 CECD C[C@H](NCC1=CCN(C)CC1)c1cc(F)ccc1O 273474361 KLXITYVCECVMRE-NSHDSACASA-N 264.344 2.444 10 20 CECD C[C@@H](NCCn1cccn1)c1ccc(N(C)C)cc1 49075337 SWVUWJOGAZUYBN-CYBMUJFWSA-N 258.369 2.300 10 20 CECD C[C@H](NCCCC(=O)N(C)C)c1cc(F)ccc1O 185194559 HKWUJPVJGVOZDQ-JTQLQIEISA-N 268.332 2.050 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCCn2cncn2)c1 381717721 TUNIKZCVUCGDFH-GFCCVEGCSA-N 260.341 2.033 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cncc(O)c1 115725865 VBPYPOAZBMSJLZ-UHFFFAOYSA-N 285.347 2.092 10 20 CECD COc1cc(Cl)cc(CNC2CCC(N)CC2)c1O 229051621 VBSYLYZZWCEODZ-UHFFFAOYSA-N 284.787 2.414 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1cnns1 294934971 KPHRKKFKISGQFK-UHFFFAOYSA-N 276.365 2.003 10 20 CECD Cc1ocnc1C(=O)NCc1c(O)ccc2c1CCCC2 266582991 VHDPSBMQFULATO-UHFFFAOYSA-N 286.331 2.497 10 20 CECD CCOc1ccc(N(CC)CC(=O)NCCCOC)cc1 269586165 GXCPQKDIVZBVAK-UHFFFAOYSA-N 294.395 2.064 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCOC 263902439 YENLUVUENRMBCQ-UHFFFAOYSA-N 264.369 2.138 10 20 CECD C[C@@H]1[C@@H](C)[S@](=O)CCN1Cc1ccc(N(C)C)c(F)c1 271200515 PSPXTASXTPLJFS-FKANQGBASA-N 298.427 2.233 10 20 CECD CO[C@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 271160759 DHTDBLOBURARIG-JTQLQIEISA-N 286.715 2.175 10 20 CECD Cc1ccc([C@@H](C)NCC(F)(F)CO)c(O)c1C 274455385 ZNUDKAJLHWVTDP-SNVBAGLBSA-N 259.296 2.287 10 20 CECD Cc1ccc(C(=O)N2CCC3(CC2)CC3)c(O)c1O 378554823 BVNKDUVTMVXDNQ-UHFFFAOYSA-N 261.321 2.422 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2ccccc2C)n1C 289708906 RJULWPRMHJRZOQ-UHFFFAOYSA-N 289.360 2.041 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](C(=O)N3CCCC3)C2)c1 290527306 QJKHOFIXOVQCOG-CQSZACIVSA-N 288.391 2.145 10 20 CECD CC[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1 295049629 GMTFHMVESHRTJA-QMMMGPOBSA-N 253.273 2.109 10 20 CECD Nc1ccc(CCNC(=O)CC[C@H](N)c2ccccc2)cc1 841847928 NDJVEIXWXPALQQ-KRWDZBQOSA-N 297.402 2.408 10 20 CECD CCOC(=O)C(C)(C)C(=O)NCc1cc(Cl)ccc1O 846473622 NMIWPQVAKNNLFJ-UHFFFAOYSA-N 299.754 2.251 10 20 CECD CC(C)(C)n1nnc(CNCc2cc(Cl)ccc2O)n1 848564047 AKWRZVNKTGKRAF-UHFFFAOYSA-N 295.774 2.077 10 20 CECD NC[C@@H](NCc1ccc2c(c1)CCO2)C1CCCC1 841087866 RBUVSECGWLFREE-OAHLLOKOSA-N 260.381 2.229 10 20 CECD CC[C@H](CO)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840554345 GGRMJLVLWDKRJG-ZIAGYGMSSA-N 292.423 2.127 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C)C[C@@H]1C(N)=O 840939071 KFBUKRQVGVKLLK-MLGOLLRUSA-N 289.423 2.147 10 20 CECD COc1ccc(N(C)CCN(C)CCOC(C)C)cc1 844398787 CLWFQJZQIXNCON-UHFFFAOYSA-N 280.412 2.488 10 20 CECD C[C@@H](CCN(C)C)NCc1cc(F)c(N(C)C)cc1F 858116633 UCORGJUQPBVUCO-NSHDSACASA-N 285.382 2.461 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)OCCF 858882220 NQFLEOVPBFFAIL-UHFFFAOYSA-N 254.305 2.291 10 20 CECD O=C(NCc1ccc(N2CCSCC2)cc1)OCCF 858908194 MPRCHIOASDLWNJ-UHFFFAOYSA-N 298.383 2.436 10 20 CECD CCN(CC)C[C@@H]1CCN(Cc2ccc(N)cc2)C1 1336285386 LXPBHEDAXIBFFA-HNNXBMFYSA-N 261.413 2.433 10 20 CECD CC(C)N1CC(=O)N(CCCSc2nccs2)C1=O 761296765 HKHQANCPYOOBLO-UHFFFAOYSA-N 299.421 2.298 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CC(c2ccccc2)=NO1 769366398 ZDRISKGVUPEFOE-MRXNPFEDSA-N 296.326 2.202 10 20 CECD C[C@@H](NS(=O)(=O)CCC(C)(F)F)c1ccccc1O 867834397 HPAOPSBBIQUJKA-SECBINFHSA-N 293.335 2.418 10 20 CECD CN(C)[C@@H]1CCCN(C(=O)c2cc(O)cs2)CC1 760921071 MFENKIURVKIAQY-SNVBAGLBSA-N 268.382 2.010 10 20 CECD COC(=O)C[C@@H](C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773007385 HZWQFSBRHLZXSS-VXGBXAGGSA-N 292.379 2.129 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)NCc1c(C)cccc1O 877147676 ZIBMZWJXLFCKPX-VXGBXAGGSA-N 264.369 2.093 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1c[nH]c2cnccc12 1117744623 QGBUUQUEVILUFG-UHFFFAOYSA-N 295.342 2.470 10 20 CECD CCc1nn(C)cc1NC(=O)/C=C/c1ccc(O)c(O)c1 779544946 PRVSKTCTXFWLKK-FNORWQNLSA-N 287.319 2.046 10 20 CECD CC1(C)[C@@H](NCc2cc(Cl)cc(F)c2O)C[C@H]1O 779190736 GVRYDSKRUQBOKO-WDEREUQCSA-N 273.735 2.434 10 20 CECD COc1ccc(O)c(CNc2ccc(N(C)C)cn2)c1 776251466 ZKGZMVVRFMXKAQ-UHFFFAOYSA-N 273.336 2.474 10 20 CECD CN(C)[C@@H](CNCc1cc(F)cc(F)c1O)C1CC1 882905162 VGJXIGYTRBENES-ZDUSSCGKSA-N 270.323 2.100 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC[C@H](n2ccnn2)C1 895053701 SGFOYIFBXGRSCW-LBPRGKRZSA-N 294.305 2.099 10 20 CECD CC1=NO[C@@H](CNCc2c(O)ccc(Cl)c2F)C1 895304679 PGGOLANSLNPBRS-MRVPVSSYSA-N 272.707 2.439 10 20 CECD COc1ccc(O)c(CN2CC[C@H](C)C[C@@H]2[C@@H](C)O)c1 785987209 GJJRDIGHVQWXPO-YWPYICTPSA-N 279.380 2.382 10 20 CECD CN(C)c1ccc(CNC(=O)NC/C=C/Cl)cc1F 892488601 QWGLGDQHAZCENR-ZZXKWVIFSA-N 285.750 2.443 10 20 CECD CC[C@@H](NC[C@@H](O)c1cnn(C)c1)c1ccc(F)cc1O 796790163 XPNRFFLKDCCONH-UKRRQHHQSA-N 293.342 2.039 10 20 CECD CCOC(=O)c1scc(Br)c1O 40545561 CHJIIBMFRFXUNR-UHFFFAOYSA-N 251.101 2.393 10 20 CECD CCc1ccnc(CNC(=O)c2ccc(C)c(O)c2O)c1 798064726 CBRVWMPCFCEJOQ-UHFFFAOYSA-N 286.331 2.294 10 20 CECD CCc1cccc(CNC[C@@H](C)C[C@H](C)O)c1O 709492902 VSGHLGCSONIPOC-RYUDHWBXSA-N 251.370 2.451 10 20 CECD CC[C@H](NCC(=O)N(CC)CC)c1ccc(F)cc1O 796704300 NKFXEQBQEXMTTL-ZDUSSCGKSA-N 282.359 2.440 10 20 CECD CCCNC(=O)CCN[C@H](C)c1cc(F)ccc1O 94618008 SWLBYTUYYUWMHW-SNVBAGLBSA-N 268.332 2.098 10 20 CECD COc1cccc(CN(C)C(C)(C)CC(=O)O)c1O 1599670848 NQWQFPLPUGYEFN-UHFFFAOYSA-N 267.325 2.086 10 20 CECD C[C@@H](NCC1(C)OCCO1)c1cc(F)cc(F)c1O 1342410045 YBMMXBVIADBTGH-MRVPVSSYSA-N 273.279 2.084 10 20 CECD O=C(C1=CCCNCC1)N1C[C@H]2CCCN2c2ccccc21 1340044023 FBQBPUTYPKHDEZ-OAHLLOKOSA-N 297.402 2.312 10 20 CECD Cc1cc(CN[C@@H](C)c2cc(C(=O)O)ccc2O)ncn1 1600203876 YCOPRJUXPDVEDJ-JTQLQIEISA-N 287.319 2.040 10 20 CECD COc1cc(C)c(CN2CC[C@](C)(C(=O)O)C2)c(O)c1 1604695421 WAGJUMJMHWJJQQ-HNNXBMFYSA-N 279.336 2.006 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)C(=O)NC(C)C)c(O)c1 228931837 XLHCPRRIQHBUKM-VXGBXAGGSA-N 264.369 2.264 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCNC23CCCC3)c1O 1579145314 PMWIDMVZKPMJEV-OAHLLOKOSA-N 290.407 2.474 10 20 CECD C[C@@H](NCC1(C(=O)O)CCC1)c1cc(F)ccc1O 1589123037 OEJMFWUAKGNUPM-SECBINFHSA-N 267.300 2.437 10 20 CECD Nc1ccc(CNCCN2CCc3ccccc32)cc1 1580445738 SIPGRCCRQYGILJ-UHFFFAOYSA-N 267.376 2.421 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CC[C@H]3CC[C@H]2OC3)cc1 1580445521 HWQNGWAOGLKOKU-NWANDNLSSA-N 289.379 2.026 10 20 CECD C[C@@H]1C[C@H]1[C@H](NCc1cc(F)c(N(C)C)cc1F)C(=O)O 1776602429 JBMDNBJJNJMPTD-PWZJLYFZSA-N 298.333 2.230 10 20 CECD CC[C@@H](NCCNC(=O)C(C)C)c1ccccc1O 20125318 SYSHTRFRKCDWCK-CYBMUJFWSA-N 264.369 2.205 10 20 CECD CS(=O)(=O)CC1(CSc2nccs2)CCC1 155425723 DQQPMMHROYWBRM-UHFFFAOYSA-N 277.436 2.450 10 20 CECD Oc1cc2c(cc1CNC[C@@H]1CCCCS1)OCO2 157997369 FILDRQRUEZVMNG-NSHDSACASA-N 281.377 2.496 10 20 CECD CCOC[C@H]1CCN(Cc2cc(F)ccc2O)C1 180241532 LOFHKFZWAMGOGL-NSHDSACASA-N 253.317 2.390 10 20 CECD Cc1cccc(OCC(=O)NCc2ccc(N)cc2)c1 700301403 NNDDHCUDBCFGHQ-UHFFFAOYSA-N 270.332 2.272 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CCN(C3CC3)C1)CC2 389088049 FYPYJFSWNCJGBK-GXTWGEPZSA-N 258.365 2.206 10 20 CECD Nc1ccc(CNC(=O)NCCC(F)(F)F)cc1 1346368564 YHTLMWAUQWQFJJ-UHFFFAOYSA-N 261.247 2.020 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)c1 172041010 CQRWBTGWSHZFTF-YYWQGFNFSA-N 291.347 2.146 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cc(C)cc(OC)c2O)C1 178900527 BIFSFNSSMXSICC-INIZCTEOSA-N 293.363 2.094 10 20 CECD COC(=O)C[C@@H]1CSCCN1Cc1cc(F)ccc1O 180191148 MCMCWNDOCSUJJZ-GFCCVEGCSA-N 299.367 2.012 10 20 CECD CCCn1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 180821777 LUCRMLXMAALVRP-GQCTYLIASA-N 287.319 2.356 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2cccc(C)c2O)C1 180783919 NMFYZLLIONZPPV-AWEZNQCLSA-N 276.380 2.001 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1cc(F)ccc1O 180195631 SBJIIRCDTUOPPZ-LBPRGKRZSA-N 267.300 2.059 10 20 CECD COc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)on1 184611303 TUPAZXRXCRVJPL-UHFFFAOYSA-N 289.335 2.021 10 20 CECD COc1ccc(N(C)Cc2csnn2)cc1F 180772782 VMFUHWWRROSABU-UHFFFAOYSA-N 253.302 2.322 10 20 CECD CC[C@H](N[C@H](C)C[S@](C)=O)c1ccccc1O 183862887 AKEGKOYMPMGIPQ-MOCULFSLSA-N 255.383 2.200 10 20 CECD COCCOCCN[C@@H](C)c1ccc(C)cc1O 44693903 KHAMMFMCMIBZDF-LBPRGKRZSA-N 253.342 2.014 10 20 CECD COc1ccc(O)c(CNCC2(SC)CC2)c1 193365316 GDHVRUCLGVKBPJ-UHFFFAOYSA-N 253.367 2.386 10 20 CECD COc1cccc(CN2CCC(n3ccnc3)CC2)c1O 92648786 BUDPNCMZRHPYKT-UHFFFAOYSA-N 287.363 2.434 10 20 CECD COC[C@@H](O)CCNCc1cc(Cl)cc(Cl)c1O 231606214 LWPUJPKPQOONPI-JTQLQIEISA-N 294.178 2.186 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](c3nccn3C)C2)c1 377887666 GODMANCTRTYKAO-ZDUSSCGKSA-N 271.364 2.424 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@H](C2CC2)O1 280502525 GGJYRRRXMVHYFK-QLJPJBMISA-N 291.347 2.120 10 20 CECD CC[C@@H](N[C@@H](CO)CCOC)c1ccc(N(C)C)cc1 281614515 NHVGZGCTHAPXMN-GDBMZVCRSA-N 280.412 2.191 10 20 CECD O=C(/C=C/c1c[nH]cn1)NCc1c(O)ccc2c1CCCC2 284245834 CKGPYVVRGVXVPI-SOFGYWHQSA-N 297.358 2.324 10 20 CECD CC(C)CO[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1 295141359 ORYWJKYZUCCLOH-JTQLQIEISA-N 297.326 2.124 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC(C)(F)F)c1 815644095 SENPXQPFOSXLOW-MRVPVSSYSA-N 273.279 2.485 10 20 CECD Nc1ccc(CCNC(=O)[C@@H](N)CC2CCCCC2)cc1 818545131 KIWUTUGGTRYBOQ-INIZCTEOSA-N 289.423 2.225 10 20 CECD CC(=O)N1CCC(NCc2cc(Cl)c(C)cc2O)CC1 825063826 HOVAOSVHHKUWMA-UHFFFAOYSA-N 296.798 2.455 10 20 CECD C[C@H]1C[C@@H](C(=O)N[C@H](C)c2ccccc2O)CCO1 827940945 LINNASZYZQSTHM-TUAOUCFPSA-N 263.337 2.385 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCN1C1CCCC1 820877931 FFMAVLJNVISXPY-OAHLLOKOSA-N 288.391 2.368 10 20 CECD OCCOCCN(Cc1ccccc1O)C1CCCC1 739916418 XQNCNTJYEPSAGK-UHFFFAOYSA-N 279.380 2.146 10 20 CECD Cc1cc(N(C)C)ccc1CNc1c([N+](=O)[O-])ncn1C 734482826 JEWYQTKOTHDWOU-UHFFFAOYSA-N 289.339 2.315 10 20 CECD O=C(Nc1noc2c1CCCC2)c1cccc(O)c1O 900780324 NKRFXJLZAYBOOP-UHFFFAOYSA-N 274.276 2.217 10 20 CECD O=C(NC[C@@H](O)c1ccc(F)cc1)c1cc(O)cs1 732271630 MKRQINGJTSRJBK-LLVKDONJSA-N 281.308 2.056 10 20 CECD COC(=O)[C@]1(F)CCN(Cc2ccc(N(C)C)cc2C)C1 840923346 SSISMDZDUIGWLC-INIZCTEOSA-N 294.370 2.148 10 20 CECD CCc1cccc(CN[C@@H]2CC(=O)N(C(C)(C)C)C2)c1O 848897842 NCRZJQXYCALTDX-CQSZACIVSA-N 290.407 2.444 10 20 CECD CC(C)OCCCN(C)C(=O)c1cc(O)cs1 740929295 ZDIDIVUMZXWUKH-UHFFFAOYSA-N 257.355 2.341 10 20 CECD COC(=O)[C@@H]1CN(Cc2ccccc2O)C[C@H]1C1CC1 846122362 HYYSXANSEKSSMS-UONOGXRCSA-N 275.348 2.023 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H](C)[C@@H]1C 841692506 RRWQGVNHONOLIZ-OZWUEAAUSA-N 277.364 2.294 10 20 CECD CC1CC(CNC(=O)/C=C/c2ccc(O)c(O)c2)C1 857736713 OQSQBZZYNPLINZ-HWKANZROSA-N 261.321 2.273 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H]3CCC[C@@]3(N)C2)c1O 857085801 HTKUGHLCKXYJLU-BLLLJJGKSA-N 292.354 2.047 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnc2nccnc2c1 759930029 BWNQQBJHSCHESK-UHFFFAOYSA-N 294.314 2.003 10 20 CECD C[C@H](NC(=O)N[C@H](C)c1ccccc1O)c1csnn1 868708868 MFIBMOYIRLEOKV-BDAKNGLRSA-N 292.364 2.365 10 20 CECD CC[C@@H]1C[C@H](C)CN1Cc1cc2c(cc1O)OC[C@@H]2O 768464967 CYFPAXZRQTYXBI-NVBFEUDRSA-N 277.364 2.438 10 20 CECD COc1cc(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)c(O)cc1C 768444860 CZZZSHDNBDVIEM-PVUDRZGPSA-N 297.420 2.051 10 20 CECD CN(C)c1ccc(CN(Cc2cn(C)nn2)C2CC2)cc1 761655360 BRKZGGITOAVPEH-UHFFFAOYSA-N 285.395 2.046 10 20 CECD N[C@@H](CNCc1ccc(N2CCCC2)cc1)C1CC1 1118018309 FXYMOUKMYMEBKF-INIZCTEOSA-N 259.397 2.114 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(C)C1)c1cc(Cl)ccc1O 775500935 MJLMXDUCKIMGIT-JQWIXIFHSA-N 282.771 2.317 10 20 CECD CO[C@H](C)c1noc(CN[C@H](C)c2ccccc2O)n1 879648374 LVPYBHBGAIXXME-NXEZZACHSA-N 277.324 2.333 10 20 CECD C[C@@H](N[C@H](C)c1nnnn1C1CC1)c1c(O)cccc1F 886598974 OFIVAVGFGAQFBP-RKDXNWHRSA-N 291.330 2.265 10 20 CECD CO[C@@H]1[C@H](C)[C@H](NC(=O)c2ccc(C)c(O)c2O)C1(C)C 781018187 TWZHDOSDPJFVRF-BIGNPOOSSA-N 293.363 2.196 10 20 CECD COC(=O)[C@H](CC(F)F)NCc1ccc(N(C)C)cc1 789583350 WRRDLPDSBDAFJF-LBPRGKRZSA-N 286.322 2.039 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)F)c1c(O)cccc1F 886600908 FFJIXTNWKGKSBH-HTQZYQBOSA-N 263.259 2.198 10 20 CECD CCCN1CCCN(Cc2cc(F)cc(F)c2O)CC1=O 894538860 NOFFYKJZNHQJCV-UHFFFAOYSA-N 298.333 2.115 10 20 CECD O=C1CC[C@@H](C(=O)NCc2ccccc2O)n2cccc21 789996442 RSWRARRJKHVRFU-ZDUSSCGKSA-N 284.315 2.028 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@]2(CCOC2)O1 894629665 MCJNWNWTFJDRBZ-BMIGLBTASA-N 299.317 2.050 10 20 CECD COc1ccc(CNCCNC(=O)CC2(C)CC2)cc1C 1131477219 MWNQLOKLWVJEMK-UHFFFAOYSA-N 290.407 2.400 10 20 CECD COCCN(C(=O)c1cccc(O)c1O)[C@@H]1CC[C@@H](C)C1 791772883 FDSPFGCCHJIJBF-VXGBXAGGSA-N 293.363 2.375 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H](O)COCC(C)C 797722267 JBGOUVYWEOJOCC-HNNXBMFYSA-N 293.407 2.481 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCOC[C@H]1C 796497696 ODAOFKPHYRACIQ-VXGBXAGGSA-N 265.353 2.163 10 20 CECD CCc1cccc(CN(C)CCN2CCCC2)c1O 692130387 VQQGPBRKWVXWLX-UHFFFAOYSA-N 262.397 2.482 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1cc(F)cc(F)c1O 1331552676 PIACMOGJTKTPSM-UHFFFAOYSA-N 287.306 2.444 10 20 CECD COC(=O)[C@H]1C[C@@H](C)CCN1Cc1ccc(N)cc1 1356083706 YIBHSABNMFMOBS-SMDDNHRTSA-N 262.353 2.042 10 20 CECD CC[C@H](NC(=O)NCc1ccc(N)cc1)C(F)(F)F 1578234162 MLNOHXZAFPIMED-JTQLQIEISA-N 275.274 2.409 10 20 CECD C[C@@H](NC1CCCC1)c1cccc(-c2nn[nH]n2)c1O 1589953053 CBQKHSKMAXRFCQ-SECBINFHSA-N 273.340 2.166 10 20 CECD CCN(C)c1ccc(CN2C[C@@H]3C[C@]3(C(=O)O)C2)cc1 1776855515 HSUPHXKFHGVCEW-BBRMVZONSA-N 274.364 2.049 10 20 CECD COCC[C@H](C)CNCc1c(O)cccc1OC 840955090 MPNMRBUGVUOEFN-NSHDSACASA-N 253.342 2.163 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCO2)[C@H](O)C(F)(F)F 922310712 ZPAVCBPBPSBJJA-ZANVPECISA-N 289.297 2.413 10 20 CECD COc1cccc(CNC(=O)c2cc(Cl)cn2C)c1O 105652425 IWIPHCHEERGPGV-UHFFFAOYSA-N 294.738 2.323 10 20 CECD C[C@H](NC[C@](C)(O)C1CC1)c1cc(F)ccc1O 310981738 RDOYJVOZTCVHEH-XPTSAGLGSA-N 253.317 2.343 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCSC1 75463562 VGXSFWVANPHSPH-CYBMUJFWSA-N 293.436 2.400 10 20 CECD CCOc1cccc(CN[C@@H](CC(C)C)C(=O)OC)c1O 36980915 NTJULCKFPVFIPI-ZDUSSCGKSA-N 295.379 2.468 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CCOCC1 181206218 UVQPCPXWPGAOKD-TZNOJPMFSA-N 291.347 2.042 10 20 CECD C[C@H](NCCCOCCO)c1cc(Cl)ccc1O 186513864 HDQUITMSZLWVKY-JTQLQIEISA-N 273.760 2.095 10 20 CECD CCn1nccc1/C=C/C(=O)N(C)Cc1ccccc1O 134203823 HNLPJKUCQLNLKJ-CMDGGOBGSA-N 285.347 2.280 10 20 CECD C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)C(C)(F)F 293680993 KURRVJGHQCKPPK-QMMMGPOBSA-N 273.279 2.048 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2CC2(Cl)Cl)cc1 238128686 CFQUZXSEYIYWDC-JTQLQIEISA-N 273.163 2.121 10 20 CECD C[C@@H](CCCO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273556392 HAQPFBWMSDMTEO-UWVGGRQHSA-N 268.313 2.112 10 20 CECD COC(=O)N1CCC(N[C@@H](C)c2cc(F)ccc2O)CC1 273376079 HHUBEUWUENHTAY-JTQLQIEISA-N 296.342 2.413 10 20 CECD COCCN1CC[C@@H](N[C@H](C)c2ccc(C)c(C)c2O)C1 273567926 JYPVYINEVGVRGN-HUUCEWRRSA-N 292.423 2.380 10 20 CECD Nc1ccc(CC(=O)NC[C@@H]2OCCc3ccccc32)cc1 366344140 DDKPZKGCGFOUBV-KRWDZBQOSA-N 296.370 2.242 10 20 CECD CCC(O)(CC)CCNCc1cccc(OC)c1O 276232109 NTMYFNRBHMIYPG-UHFFFAOYSA-N 267.369 2.432 10 20 CECD C[C@H](NC[C@H](CO)[C@@H]1CCOC1)c1cc(Cl)ccc1O 280921506 RCYZBFNLHJYTIC-QJPTWQEYSA-N 299.798 2.341 10 20 CECD CC[C@H](N[C@@H]1CC(=O)N(C)C1)c1cccc(Cl)c1O 287635083 KOIMUGFCAFXKSE-SKDRFNHKSA-N 282.771 2.317 10 20 CECD COc1cc(C)cc(CN2CCOCC(F)(F)C2)c1O 808235002 YOYVVJNYOSNVQW-UHFFFAOYSA-N 287.306 2.177 10 20 CECD O=C(NCc1ccccc1O)c1occ2c1CCC2 802778048 XMZNINWSPWAOLJ-UHFFFAOYSA-N 257.289 2.404 10 20 CECD CO[C@@](C)(CNC(=O)NCc1ccccc1O)C1CC1 291587670 XAAUMQHFPRPBCP-HNNXBMFYSA-N 278.352 2.007 10 20 CECD COCC(C)(C)CCCNC(=O)c1c(F)ccc(O)c1O 295543194 RMDGRAPUCMZMTR-UHFFFAOYSA-N 299.342 2.420 10 20 CECD CN(C)c1ccc(Cn2c(-c3cccnc3)noc2=O)cc1 814745065 GTOAAPHCCAFHAT-UHFFFAOYSA-N 296.330 2.013 10 20 CECD CCCN(CC)C[C@@H](C)NC(=O)c1cc(O)cs1 812387881 UHWOCPVEMUIMAL-SNVBAGLBSA-N 270.398 2.304 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1ccc(N(C)C)c(C)c1 815107552 BLMQSJQJMXTAJL-GFCCVEGCSA-N 264.369 2.054 10 20 CECD CN(C)C(=O)c1cccc(C(=O)NCc2ccccc2O)c1 728604489 DQRZIADKLGEABJ-UHFFFAOYSA-N 298.342 2.024 10 20 CECD CN(C)c1ccc(CNC(=O)c2cncnc2C2CC2)cc1 836240500 VTXGEBOBWJDXDM-UHFFFAOYSA-N 296.374 2.350 10 20 CECD C[C@@H]1[C@@H](CO)CCCN1Cc1ccc(N(C)C)cc1 839672811 HOXTWIPCUQONJA-UKRRQHHQSA-N 262.397 2.345 10 20 CECD CC[C@H](N[C@@H](C)C(=O)NC(C)C)c1ccc(F)cc1O 840888797 CRMWUTMKTYSXIX-GWCFXTLKSA-N 282.359 2.485 10 20 CECD CC(=O)c1cccc(OCC(=O)NCc2ccccc2O)c1 748354212 HDPLXZOSTXEYFR-UHFFFAOYSA-N 299.326 2.290 10 20 CECD CCN1C[C@@H](C)N(C(=O)Nc2ccc(N)cc2)C[C@@H]1C 841297848 IYEHVIURNQXSRK-NWDGAFQWSA-N 276.384 2.215 10 20 CECD COc1cccc([C@@H](C)NCCOCC2CC2)c1O 846146341 QDLDBTBCAYOXLG-LLVKDONJSA-N 265.353 2.478 10 20 CECD C[C@@H](N)[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843052448 UEPDNEDXDGHJQW-TZMCWYRMSA-N 279.403 2.451 10 20 CECD C[C@H]1CNCCN1Cc1ccc(N2CCCCC2)cc1 843048016 JDANHQBPPYGLPL-HNNXBMFYSA-N 273.424 2.471 10 20 CECD C[C@@H]1C[C@H](NCCCn2cncn2)c2c(O)ccc(F)c21 756830455 QIGFVYMNBYJWOM-PWSUYJOCSA-N 290.342 2.351 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNc2cnn(CCF)c2)c1 858245040 BCXMLKJIPCQTBV-UHFFFAOYSA-N 280.259 2.079 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@@]2(C)C(=O)O)cc1 756391806 YIIGDYBZHVOERM-GOEBONIOSA-N 276.380 2.486 10 20 CECD CCC[C@H](O)CC(=O)N(C)Cc1ccc(N(C)C)cc1 750097833 YOGSPNUGGNINQB-HNNXBMFYSA-N 278.396 2.262 10 20 CECD c1csc(Sc2c3c(nc4ncnn24)CCC3)n1 865460533 RYDCNZPTDINDEG-UHFFFAOYSA-N 275.362 2.221 10 20 CECD CN(CC(=O)NC(C1CC1)C1CC1)c1ccc(N)cc1 863557017 GUNJHLYPCVKTOR-UHFFFAOYSA-N 273.380 2.010 10 20 CECD Cc1cc(NC(=O)N[C@H](C)c2ccccc2O)n(C)n1 864424384 LNALFQRYOBCBLO-SNVBAGLBSA-N 274.324 2.317 10 20 CECD O=C(Cn1cnc2ccccc21)NCc1ccccc1O 769362871 LECHMPSZQIQYFM-UHFFFAOYSA-N 281.315 2.058 10 20 CECD COC1(CNC[C@H](N)c2ccc(N(C)C)cc2)CCCC1 863642371 ZUQVVGAIPXVHAT-INIZCTEOSA-N 291.439 2.301 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)CCC2CCC2)c1 1118878008 PIQCULWQYUCLGJ-UHFFFAOYSA-N 283.393 2.310 10 20 CECD CC[C@H]1CN(Cc2ccc(C)cc2O)C[C@H](C)S1(=O)=O 877521651 GFUDVHXVJNGHAM-JSGCOSHPSA-N 297.420 2.098 10 20 CECD Cc1ccc(CN2CCO[C@]3(CCO[C@@H]3C)C2)c(O)c1 877487285 SDCYYXWEIKIOIB-CZUORRHYSA-N 277.364 2.080 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccnn1CC1CC1 779535705 YFEDNERTPAHTLG-XQRVVYSFSA-N 299.330 2.356 10 20 CECD CC(C)[C@@H](CO)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773623598 LCIUUIJMCQLJKS-IUODEOHRSA-N 293.411 2.130 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1ccc(C)cc1O 876763447 GSBVULDISKLLIE-ZDUSSCGKSA-N 263.337 2.228 10 20 CECD C[C@@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 773615779 YGYOGHZFJNRULQ-CHWSQXEVSA-N 291.395 2.244 10 20 CECD CO[C@H]1CCC[C@@H]1CNC(=O)NCc1ccccc1O 774785316 FJHJDHYGUOJUNX-OCCSQVGLSA-N 278.352 2.007 10 20 CECD CCOc1cccc(CN2CCN(C)CC2(C)C)c1O 93457300 AHOAFFNAXBDXCF-UHFFFAOYSA-N 278.396 2.317 10 20 CECD Cc1c(N)cccc1NC(=O)Cc1ccc(N)cc1 746403796 HLQIOBDEIVPWQQ-UHFFFAOYSA-N 255.321 2.341 10 20 CECD CN(C)C1CCC(NC(=O)Nc2ccc(N)cc2)CC1 715534181 VPFZJLIORSYYDU-UHFFFAOYSA-N 276.384 2.263 10 20 CECD CC[C@H]1C[C@@H](CC(=O)NCc2cccc(O)c2O)CCO1 1263894553 LMUYGZNNPYIFQE-AAEUAGOBSA-N 293.363 2.309 10 20 CECD CC(=O)Nc1ccc(NC(=O)c2cc(O)cs2)nc1 1350947649 GVCZASGZMHDJRG-UHFFFAOYSA-N 277.305 2.059 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)CC(C)C)c1 223739201 ZRXQBSABUWECFH-RYUDHWBXSA-N 267.369 2.458 10 20 CECD C[C@@H](NC/C=C/C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589961139 ARMXLHSGBLONTP-HMDXOVGESA-N 285.351 2.189 10 20 CECD COc1ccc(CNC[C@@H](C)NC(=O)C(C)(C)F)cc1C 1754216100 BHJFPEVCDZISBH-GFCCVEGCSA-N 296.386 2.346 10 20 CECD CC[C@H](CCNCc1ccc(N(C)C)cc1)C(=O)O 1776711649 NKJFONACAIVFGF-CYBMUJFWSA-N 264.369 2.343 10 20 CECD O=C(/C=C/c1ccco1)NCc1ccc(O)c(O)c1 158863771 AFVLAPUKPFQILO-GQCTYLIASA-N 259.261 2.020 10 20 CECD Cc1cccc(CN[C@H]2CCN3CCCC[C@H]23)c1O 124709273 IYDYLPIRXCNAFK-LSDHHAIUSA-N 260.381 2.417 10 20 CECD CC[C@H](CCO)N[C@H](C)c1cc(OC)ccc1O 168794426 OWHDWTFQVZGVMS-GHMZBOCLSA-N 253.342 2.212 10 20 CECD Cc1cc(O)c(CN(CCS(C)(=O)=O)C2CC2)cc1C 157095697 YXCDUWCXVNFLCP-UHFFFAOYSA-N 297.420 2.018 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(Cl)c[nH]1 159121757 LIKDSRVYEUKNKZ-UHFFFAOYSA-N 266.684 2.009 10 20 CECD C[C@@H]1COCCN1Cc1cc2c(cc1O)CCCC2 159775143 KUYRVXPDPBKXJV-GFCCVEGCSA-N 261.365 2.492 10 20 CECD C[C@H]1C[C@H](NCc2cc(F)cc(F)c2O)CCO1 708436156 KFPLKVPLIOQETL-GZMMTYOYSA-N 257.280 2.328 10 20 CECD C[C@H](NCc1cc2c(cc1O)OCO2)[C@H]1CCCOC1 389002324 QWIASQQLNINFFD-QWRGUYRKSA-N 279.336 2.026 10 20 CECD CN[C@H](CC(C)(C)C)C(=O)N(C)Cc1ccccc1O 387564999 ZFWMCGPPDULKIS-CYBMUJFWSA-N 278.396 2.375 10 20 CECD CCO[C@H]1CCN(Cc2c(O)cccc2OC)C1 897067934 FEYMSAUNUVTJEQ-NSHDSACASA-N 251.326 2.012 10 20 CECD CCCOCC(=O)N[C@@H](C)c1cc(OC)ccc1O 103529241 GZKCYUHMPVFKPR-JTQLQIEISA-N 267.325 2.005 10 20 CECD COc1cc(Cl)cc(CN[C@H](CO)C(C)C)c1O 228675837 XORPAJGGBLCTNW-LLVKDONJSA-N 273.760 2.161 10 20 CECD CCOc1ccc(O)c(CN(C)[C@@H](C)COC)c1 179372462 AHZIKVBTJMJJEE-NSHDSACASA-N 253.342 2.258 10 20 CECD CCCOc1ccc(CN2CCOCC2)c(O)c1 154520981 XCGNNSLEFVFMPK-UHFFFAOYSA-N 251.326 2.013 10 20 CECD C[C@H](CNCc1cc2c(cc1O)OCO2)N1CCCCC1 42880284 DJGBTOIVJHLPMF-GFCCVEGCSA-N 292.379 2.085 10 20 CECD 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CCOCc1cc(CNC[C@H](N)C2CC2)ccc1OC 841050095 OQTBWLFWGXCCRC-HNNXBMFYSA-N 278.396 2.059 10 20 CECD CSCC1(CC(=O)NCCc2ccc(O)c(O)c2)CC1 845833606 MOGUKBOZSGTOLL-UHFFFAOYSA-N 295.404 2.290 10 20 CECD C[C@@H]1C[C@@H](CNC(=O)N(C)Cc2ccccc2O)[C@@H](C)O1 840431779 ASTVZQCFFFJRRB-BZPMIXESSA-N 292.379 2.347 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](CN)C[C@H]2C)c1O 843362452 HJAPJFSFDMGZKO-KOLCDFICSA-N 296.798 2.417 10 20 CECD COC[C@@](C)(CC(=O)OC)NCc1ccc(OC)c(C)c1 757926800 OTCRPUFEVXPALZ-MRXNPFEDSA-N 295.379 2.061 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](C2CCOCC2)C1 755326961 VDLXPMUVBZPLHE-NSHDSACASA-N 281.377 2.342 10 20 CECD CON(C)CCN[C@@H](C)c1cc(Cl)ccc1O 850479807 ZSLVYJLBQLQAQD-VIFPVBQESA-N 258.749 2.189 10 20 CECD CC[C@](C)(CNC(=O)NCc1cc(C)ccc1O)OC 858514090 OIEPETZYDDKDNO-OAHLLOKOSA-N 280.368 2.315 10 20 CECD COCc1nc(C(=O)N(C)Cc2ccccc2O)cs1 49175722 YOZLFANPQLXLQC-UHFFFAOYSA-N 292.360 2.267 10 20 CECD CC[C@H](N[C@H]1C[C@@H](CO)C1)c1ccc(F)cc1O 866416471 WRKZTPJIBPXPSB-NDMJEZRESA-N 253.317 2.343 10 20 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C[C@@H]1CC[C@H](C(=O)O)N(Cc2ccc(N(C)C)cc2)C1 1776619908 XKDGQERLZDICRZ-IUODEOHRSA-N 276.380 2.438 10 20 CECD CSC[C@H](CCO)NCc1ccc2c(c1)CCCO2 1332780717 CWEUJMGXFURSCV-AWEZNQCLSA-N 281.421 2.215 10 20 CECD Nc1ccc(CN2CCNC(=O)C[C@@H]2c2ccccc2)cc1 1352789221 UVUNQCKAHYCNPP-QGZVFWFLSA-N 295.386 2.332 10 20 CECD O=C(O)c1cnc(SCOC(=O)N2CCCC2)s1 1602536935 HUHMOSQUQBXBJF-UHFFFAOYSA-N 288.350 2.123 10 20 CECD O=C(O)c1cnc(SC[C@@H]2CC3(CC3)C(=O)O2)s1 1602536964 IULUBXBDIUFUPR-LURJTMIESA-N 285.346 2.029 10 20 CECD Cc1cc(N(C)C(=O)/C=C/[C@@H]2CCCNC2)ccc1O 1579617051 KKQAYECCFVASOF-LJLILKBBSA-N 274.364 2.219 10 20 CECD Cc1ccc(F)c2c1N(C(=O)C1=CC[C@@H](N)C1)CCC2 1579705500 ACFXMQMXJVEURE-GFCCVEGCSA-N 274.339 2.461 10 20 CECD O=C(O)[C@H]1CC=CC[C@H]1NCc1cc(F)cc(F)c1O 1777659911 KDAWUNXDAXDHFH-CMPLNLGQSA-N 283.274 2.179 10 20 CECD C[C@@H](NCCOCCO)c1ccc(N2CCCCC2)cc1 159172433 TVYGNZQSZPYGEO-OAHLLOKOSA-N 292.423 2.336 10 20 CECD Cc1cccc(O)c1CN[C@H](CO)Cc1ccccc1 877462411 PVJVCJOLFUOMEB-HNNXBMFYSA-N 271.360 2.394 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@@H]1CN 163436802 YVVYBSYCBBGLND-HIFRSBDPSA-N 261.413 2.169 10 20 CECD CCN(C[C@@H]1CCCO1)C(=O)Nc1ccc(N)cc1 48967058 GRCCWYONLKRTOY-ZDUSSCGKSA-N 263.341 2.302 10 20 CECD CCOc1cccc(CNC[C@@]2(O)CCC[C@@H]2C)c1O 293052757 RRHQFAPPKBDTGE-LRDDRELGSA-N 279.380 2.432 10 20 CECD CC1(C)CCN(Cc2cc(F)ccc2O)CC[S@]1=O 322051807 AJSUVDKAAPZISZ-LJQANCHMSA-N 285.384 2.264 10 20 CECD Cc1ccc(O)c(CN2CC[S@@](=O)C(C)(C)CC2)c1 322132672 POQNXHQLQNZQNL-LJQANCHMSA-N 281.421 2.434 10 20 CECD CC(C)(C)[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 756354043 UIGLSSWVOQQIBC-ZDUSSCGKSA-N 263.337 2.210 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CC[C@H]2CCOC2)c1 176138212 VAVBKRFMFGTWCP-RYUDHWBXSA-N 293.363 2.395 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)C[C@H](C)O)cc1 179591144 PGVCGHIJTPMAJB-ZDUSSCGKSA-N 293.411 2.055 10 20 CECD Cn1cncc1CCNCc1ccc(N2CCCC2)cc1 401774868 REPVHUCTEXWAHF-UHFFFAOYSA-N 284.407 2.353 10 20 CECD COc1ccc(CN[C@@H]2CCN(C3CC3)C2)cc1C 44686972 DJEOMFAWAYRWFM-CQSZACIVSA-N 260.381 2.330 10 20 CECD O=C(N[C@@H](C1CC1)C(F)(F)F)c1cccc(O)c1O 288629913 QZTATYYOZBMKFK-JTQLQIEISA-N 275.226 2.169 10 20 CECD CC(=O)Nc1ccc(CNC(=O)Cc2ccc(N)cc2)cc1 194122878 QYAWNBFLQBCTNM-UHFFFAOYSA-N 297.358 2.086 10 20 CECD CC(C)Oc1ccc(N(C)Cc2nncn2C)cc1 191585577 NVQROYJPMHKFLN-UHFFFAOYSA-N 260.341 2.239 10 20 CECD COc1cccc(CN(C)Cc2cccn2C)c1O 93584694 GFRWIGPWFWSMRP-UHFFFAOYSA-N 260.337 2.371 10 20 CECD CC[C@@H](C(=O)N(CC)Cc1ccc(N(C)C)cc1)N(C)C 271093302 VAFIVISGSUQGBH-INIZCTEOSA-N 291.439 2.441 10 20 CECD CC[C@@H](NCCNC(=O)C1CC1)c1ccc(F)cc1O 285811341 VUBDTSDIKIFGRC-CYBMUJFWSA-N 280.343 2.098 10 20 CECD CCCOc1ccc([C@H]2NC(=O)CN2CC(C)C)c(O)c1 298782326 MGOAIERKQYNOSZ-INIZCTEOSA-N 292.379 2.267 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)C[C@H](O)C1CC1 809752982 YPCNARFXRBFGFG-LBPRGKRZSA-N 273.735 2.387 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)C[S@@](=O)CC 296063239 PDOHBOHQGUDMHS-FQEVSTJZSA-N 297.420 2.290 10 20 CECD O=C(CCNC(=O)c1cc(O)cs1)OC1CCCCC1 802658815 IVZVPRJLTMMSQZ-UHFFFAOYSA-N 297.376 2.450 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C2CNC2)cc1 817890050 WHKIFQLLQCRDDY-ZDUSSCGKSA-N 261.413 2.230 10 20 CECD COC[C@@](C)(O)CNCc1ccc2ccccc2c1O 816549058 BQSRJWKVKWXLCZ-INIZCTEOSA-N 275.348 2.032 10 20 CECD C[C@H](N[C@@H]1CCCNC1)c1cc(Cl)ccc1O 817941437 QHJACSDRZYVOLU-GXSJLCMTSA-N 254.761 2.448 10 20 CECD C[C@@H]1[C@H](O)CCN1Cc1cccc(Br)c1O 825103486 GREXCOQZOUEEBA-LDYMZIIASA-N 286.169 2.110 10 20 CECD Cc1c(C)n(C)c2ccc(OC[C@H]3CNC(=O)O3)cc12 496813989 IPDXKRVFQHVVJE-GFCCVEGCSA-N 274.320 2.282 10 20 CECD CCOc1ccc(CN[C@@H](CC)[C@H](C)O)c(O)c1 824921744 PQVHBLCLROEXSJ-GWCFXTLKSA-N 253.342 2.040 10 20 CECD Cc1cc(CC(=O)N[C@H](C)c2ccccc2O)on1 827946918 VAOLXXQTLMNFII-SNVBAGLBSA-N 260.293 2.109 10 20 CECD CCOc1nnc(COC(=O)c2cc(O)cs2)s1 733497490 WHFMWXVDLLTETO-UHFFFAOYSA-N 286.334 2.061 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@H](C)c1ccc(C)cc1O 834880467 DGOAWIJTCQFXQU-DVOMOZLQSA-N 279.380 2.403 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@H](C)CC(=O)O)c1 911343662 SBXLFZGMFOFKRI-VHSXEESVSA-N 295.335 2.079 10 20 CECD C[C@H](N[C@H](CO)CCF)c1ccc(Cl)cc1O 846209987 VEPJRASIVAFROI-WPRPVWTQSA-N 261.724 2.417 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H](C3CCC3)C1)[C@@H](O)CO2 840188840 MXZHIUGLPBOUNY-WBMJQRKESA-N 289.375 2.440 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCNC1(C)C 841086633 OVNHBVCPSFYSDR-HNNXBMFYSA-N 261.413 2.291 10 20 CECD CCc1cccc(CN2CCOC3(CCOCC3)C2)c1O 848888887 CLPWWEVRKOILIG-UHFFFAOYSA-N 291.391 2.336 10 20 CECD COc1ccc(O)c(CN[C@H](C)C2(OC)CCC2)c1 840970019 OERURGMBUGDBCT-LLVKDONJSA-N 265.353 2.448 10 20 CECD Cc1ccc(CNC[C@@H](N)c2ccc(N(C)C)cc2)cn1 841041788 CDETVEOJHDYLAB-QGZVFWFLSA-N 284.407 2.246 10 20 CECD C[C@H](NCCN1CCCC1=O)c1cc(Cl)ccc1O 846206229 ODNVQCXCJSPCEQ-JTQLQIEISA-N 282.771 2.319 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H](C)CN)cc1F 843052469 UNFPYWXYXXDPED-GFCCVEGCSA-N 267.392 2.451 10 20 CECD CC(C)c1cc(C(=O)NCc2ccccc2O)n(C)n1 746689896 ZGMKHCUIBHDMLB-UHFFFAOYSA-N 273.336 2.179 10 20 CECD CCC[C@@H](O)CN[C@@H](C)c1cc(F)cc(F)c1O 756576133 JYDQYJQVOWMQDW-WCBMZHEXSA-N 259.296 2.482 10 20 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266.772 2.365 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1cc(C)cc(OC)c1O 894992400 AVRHUIBLYHZRTO-ZDUSSCGKSA-N 293.363 2.141 10 20 CECD OC[C@H]1Cc2ccccc2N1Cc1cc(F)ccc1O 895244067 YJUQJTBOUWUKMX-CQSZACIVSA-N 273.307 2.455 10 20 CECD CCc1nncn1CCNCc1c(O)ccc(Cl)c1F 790970467 JPNIBOKIIBPPPI-UHFFFAOYSA-N 298.749 2.128 10 20 CECD O=C(Nc1ccc2[nH]ncc2c1)c1cccc(O)c1O 186855414 ACLLEARKYOIZAS-UHFFFAOYSA-N 269.260 2.226 10 20 CECD O=S(=O)(Nc1ccc(O)cc1F)c1cccc(F)c1 85203906 VVANBOIMFKJHBS-UHFFFAOYSA-N 285.271 2.471 10 20 CECD CCC[C@@H]1CN(Cc2c(O)cccc2OC)CCO1 769451186 IZCCRUNMMGKHDS-GFCCVEGCSA-N 265.353 2.402 10 20 CECD CCOc1ccc(N2CCN(C[C@H](O)C(C)C)CC2)cc1 1253767310 BRVZGLBMFOAYCW-KRWDZBQOSA-N 292.423 2.224 10 20 CECD C[C@H](NC(=O)[C@H]1C[C@H]1F)c1ccc(N2CCOCC2)cc1 1262725677 FUSXOPGCYLOXPC-TUKIKUTGSA-N 292.354 2.058 10 20 CECD C[C@H](NCCN1CCC[C@H]1C)c1cc(C(=O)O)ccc1O 1609780458 SAAKFPRZSMQSSB-NEPJUHHUSA-N 292.379 2.225 10 20 CECD CCc1nnc(C)cc1C(=O)N(C)c1ccc(N)cc1 229149662 NHCPEGWMZOWLKJ-UHFFFAOYSA-N 270.336 2.206 10 20 CECD Oc1cc(Cl)ccc1CN[C@@]12CCC[C@@H]1NCC2 1580888563 QDPBSEDNOCMJBY-UONOGXRCSA-N 266.772 2.420 10 20 CECD Cc1cc(-c2nn[nH]n2)cc(N[C@@H](C)c2ccccc2O)n1 1580619718 HPPRKIDHFYEQTR-JTQLQIEISA-N 296.334 2.449 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCC[C@@H](N)C2)cc1F 166458837 ZENKZZNWBJGFJI-CHWSQXEVSA-N 293.386 2.025 10 20 CECD CCN(CC)CCCNCc1cccc(OC)c1O 19942953 RDXISGKMRCTDBG-UHFFFAOYSA-N 266.385 2.222 10 20 CECD CCCn1nccc1CNCc1cc(OC)ccc1O 850137517 PXDRJAMJKOQNQI-UHFFFAOYSA-N 275.352 2.297 10 20 CECD COc1cccc(O)c1CNCCC1CCOCC1 1319832745 TVJAXGIULPGCJR-UHFFFAOYSA-N 265.353 2.307 10 20 CECD CCOc1cccc(CNCc2cnn(CC)c2)c1O 265380962 CLUCIRPBJPTAFJ-UHFFFAOYSA-N 275.352 2.297 10 20 CECD Cc1ccnc(Sc2ncc(C(=O)O)s2)n1 309361610 DDHSQNAWGNIVGC-UHFFFAOYSA-N 253.308 2.091 10 20 CECD C[C@H](NCc1cc2c(cc1O)OCO2)[C@@H]1CCCOC1 389002325 QWIASQQLNINFFD-WDEREUQCSA-N 279.336 2.026 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2csnn2)c1 398279821 KUKLCQSTYALXMA-MRVPVSSYSA-N 265.338 2.103 10 20 CECD CCOc1cccc(CN[C@H](CCO)C(F)(F)F)c1O 886371898 XVBLBCOEBNMERT-LLVKDONJSA-N 293.285 2.194 10 20 CECD CNC(=O)c1cccc(NCc2cc(OC)ccc2O)c1 20124772 RUEJHPIERDUFGT-UHFFFAOYSA-N 286.331 2.373 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC[C@H](C)OC)c1 184026328 FNZLPBXHUMKRCI-WDEREUQCSA-N 281.352 2.393 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CC(=O)N(C3CC3)C2)c(O)c1 186089009 UEPULYAPHJGNFC-NWDGAFQWSA-N 274.364 2.115 10 20 CECD CNC(=O)CCCN(C)Cc1cccc(Cl)c1O 180506501 VZIUGPWFJJFCKF-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CC(C)C(=O)NCCNCc1ccc(N2CCCC2)cc1 37219955 AKQPWQLOUOPLQJ-UHFFFAOYSA-N 289.423 2.149 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)CC(C)(C)C 282215158 PXNSKMPVQUJWJA-UHFFFAOYSA-N 271.382 2.200 10 20 CECD CCCOc1ccc(CN2C[C@@H](C)[C@H](CO)C2)c(O)c1 191727919 PHBSTBNHGZSIKC-OCCSQVGLSA-N 279.380 2.241 10 20 CECD CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 48704904 UDYDBAYSQMVHGA-PHIMTYICSA-N 280.343 2.075 10 20 CECD Oc1cccc(Cl)c1CNC[C@@H]1CC[C@@H](O)C1 236533737 DYGGNQYNPIVWDG-NXEZZACHSA-N 255.745 2.296 10 20 CECD Cc1ncsc1CCNCc1cc2c(cc1O)OCO2 295047394 PDVGWSIGNBMZHI-UHFFFAOYSA-N 292.360 2.218 10 20 CECD COC(=O)[C@H](CC(F)(F)F)NCc1cccc(C)c1O 276448476 JNFWBRKFOLCNQU-JTQLQIEISA-N 291.269 2.284 10 20 CECD COc1ccc(O)c(CN2CCC[C@@](C)(O)CC2)c1 279736168 WRIXKMCQKOKRSV-OAHLLOKOSA-N 265.353 2.138 10 20 CECD C[C@H]1C[C@@H](C)CN(C(=O)c2c(F)ccc(O)c2O)C1 276659974 MMYFZLOJHJEHSO-DTORHVGOSA-N 267.300 2.355 10 20 CECD COc1cccc(CNc2nc(C)cnc2C)c1O 273921975 ZTMDYZRNVSRJLH-UHFFFAOYSA-N 259.309 2.420 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]2C[C@H](C)O)c1 271782141 HVFRBLXQJKIEGN-AAEUAGOBSA-N 265.353 2.136 10 20 CECD CC(C)N1C[C@H](NCc2c(O)cccc2Cl)CC1=O 271840756 QRGNKOVVMPWSDO-SNVBAGLBSA-N 282.771 2.145 10 20 CECD CC[C@H](NCc1cccc(C)c1O)[C@@H](O)C(F)(F)F 271767590 ATHKFBSDFUCPKD-CMPLNLGQSA-N 277.286 2.492 10 20 CECD CN(C)c1ccc(CNS(=O)(=O)CCC2CCC2)cc1 289262317 CCNXOYPFBHPQQD-UHFFFAOYSA-N 296.436 2.362 10 20 CECD CCC[C@]1(CO)CCN(Cc2cc(OC)ccc2O)C1 290235470 UAFWONBHTZRDPL-INIZCTEOSA-N 279.380 2.385 10 20 CECD C[C@H](CCO)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 297390327 RUBHULKMKKXUFX-WDEREUQCSA-N 282.340 2.360 10 20 CECD CSCC[C@H](N[C@@H](C)c1ccccc1O)C(=O)N(C)C 806661799 FANUZANKVRTOGF-AAEUAGOBSA-N 296.436 2.253 10 20 CECD C[C@H](NCC(F)(F)CN)c1cc(Cl)ccc1O 817965843 DBUNOEGVUXANRJ-ZETCQYMHSA-N 264.703 2.290 10 20 CECD CC[S@@](=O)CCNCc1ccc2ccccc2c1O 816551078 NYXKAWCGTISYKZ-LJQANCHMSA-N 277.389 2.404 10 20 CECD CCO[C@@H]1COC[C@H]1NCc1cc(Cl)cc(F)c1O 825197185 UMJPJHODVAIGIY-VXGBXAGGSA-N 289.734 2.078 10 20 CECD C/C(Cl)=C\C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 907274565 RLCNJSWHLYYFBG-WHXYTISESA-N 269.728 2.288 10 20 CECD COCCOC1CN(Cc2c(O)ccc(Cl)c2F)C1 838986506 ISOCJGCBBKFSMO-UHFFFAOYSA-N 289.734 2.032 10 20 CECD Cc1cc(C)c(O)c(CN2CCN(C(=O)C3CC3)CC2)c1 915840392 WTUIUSAGDOTZTA-UHFFFAOYSA-N 288.391 2.063 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3[C@@H](C2)C3(F)F)cc1 844461157 ITDWAWRZQMJVKV-CHWSQXEVSA-N 252.308 2.450 10 20 CECD COCC1(CC(=O)NCc2ccc(N(C)C)cc2)CC1 843519559 FYUTYTRPNGGVTR-UHFFFAOYSA-N 276.380 2.186 10 20 CECD N[C@@H]1CCC[C@H](NCc2cc(Cl)ccc2O)C1 841055255 MQRKPOJNAATIOP-NEPJUHHUSA-N 254.761 2.405 10 20 CECD CN(Cc1c(O)ccc2ccncc12)C[C@H]1CCOC1 749966097 JBKWPPGEXYGCMI-GFCCVEGCSA-N 272.348 2.409 10 20 CECD CCN(C(=O)/C=C/c1cncc(C)c1)c1cnn(C)c1 848343870 SYBYPMWKENIYIT-AATRIKPKSA-N 270.336 2.190 10 20 CECD C[C@H]1C[C@H](C(=O)NCc2cc(Cl)ccc2O)CO1 846473479 LPFUKDHZWUKLPE-WPRPVWTQSA-N 269.728 2.087 10 20 CECD COCC[C@@H](C)N[C@@H](C)c1cccc(OC)c1O 846144282 IPPPLULGTUWTKN-MNOVXSKESA-N 253.342 2.476 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CS[C@@H](C)C2)c1O 840420571 RZXFAGBULHJWGM-ONGXEEELSA-N 296.392 2.094 10 20 CECD CCOc1cccc(CN[C@@H](C)C[C@H](C)N)c1O 843129641 RBGYRMFNYGOBER-QWRGUYRKSA-N 252.358 2.006 10 20 CECD N[C@@H]1Cc2ccccc2N(Cc2cc(F)ccc2O)C1 841106261 IOLZOBBUBDLOCF-CQSZACIVSA-N 272.323 2.421 10 20 CECD CC(C)N1CC[C@@H](NCc2ccc3c(c2)CCCO3)C1=O 921742151 DARKCWIFNAKIHC-OAHLLOKOSA-N 288.391 2.111 10 20 CECD COCCCN(C)Cc1cc(C)cc(OC)c1O 754722117 CXTJFPQKGQHXSN-UHFFFAOYSA-N 253.342 2.178 10 20 CECD Cc1ccc(C(=O)Nc2ccc3c(c2)OCO3)c(O)c1O 751530457 MRFULTUKNIHTHH-UHFFFAOYSA-N 287.271 2.387 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1cc(F)c(N(C)C)cc1F 862216425 WJKIZJSDIVLNAB-ZDUSSCGKSA-N 298.333 2.168 10 20 CECD Cc1cccc(O)c1CN1CC(C(=O)OC(C)(C)C)C1 877580440 KZVYFIJBQKLBIC-UHFFFAOYSA-N 277.364 2.474 10 20 CECD C[C@@H](NC(=O)NOCC1CC1)c1ccccc1O 875619895 RNWWIURCXMJRCN-SECBINFHSA-N 250.298 2.094 10 20 CECD COc1ccc(CN(C)C(=O)c2cc(O)cs2)cc1O 771037292 LZUBPDSLNKGWBY-UHFFFAOYSA-N 293.344 2.440 10 20 CECD OC1CCN(c2ccc(CN3CCC(F)(F)C3)cc2)CC1 877141013 PGGOQWKPSWZBLT-UHFFFAOYSA-N 296.361 2.489 10 20 CECD CCCCN(C)CCNCc1cc(F)cc(F)c1O 882993759 HCQIPMYUTLJNQH-UHFFFAOYSA-N 272.339 2.492 10 20 CECD COC(=O)[C@@H](CC(F)F)NCc1ccc(N(C)C)cc1 789583348 WRRDLPDSBDAFJF-GFCCVEGCSA-N 286.322 2.039 10 20 CECD CC1=NO[C@H](CNCc2cccc(Br)c2O)C1 895310875 KXAIXEPMSNWDRW-JTQLQIEISA-N 299.168 2.409 10 20 CECD Cc1nc([C@H](C)NCc2cc(C)c(C)cc2O)n[nH]1 894772150 GJMSVAQHCRELGO-JTQLQIEISA-N 260.341 2.286 10 20 CECD CCOC(=O)c1cnc(S[C@@H](C)[C@H](C)O)s1 390476024 JDDJOKCVKSRRSX-BQBZGAKWSA-N 261.368 2.181 10 20 CECD COc1cc(C)cc(CN(CC(F)F)C[C@H](C)O)c1O 894918947 YZNZIOSRURNSSU-JTQLQIEISA-N 289.322 2.157 10 20 CECD COc1ccc(O)c(CN2CCn3cccc3C2)c1 896761817 VZUZXGCJMDOWKI-UHFFFAOYSA-N 258.321 2.218 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)/C=C\COC 791339851 MVLSPYHRAXMZSW-SREVYHEPSA-N 276.380 2.304 10 20 CECD C[C@@H](NS(=O)(=O)c1ccoc1)c1ccc(N(C)C)cc1 795934552 WOCUYOMPZXSTAJ-LLVKDONJSA-N 294.376 2.385 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@@H](C)[S@]1=O 792192005 IMXWYFSHDGEFBJ-LCKNKQDLSA-N 287.812 2.387 10 20 CECD CC1(C)CC[C@@H](CNC(=O)Cc2ccc(N)cc2)OC1 711341169 ZVASJQWAGFNNEB-AWEZNQCLSA-N 276.380 2.133 10 20 CECD COc1cccc(O)c1CN1CCCOC(C)(C)C1 769463867 RKLSPMHUYORBRB-UHFFFAOYSA-N 265.353 2.402 10 20 CECD CCC[C@H]1CN(Cc2cccc(OC)c2O)CCO1 93508816 RCOZKFFUMHOKCV-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD COc1ccc(CNCCCNC(=O)[C@@H]2C[C@H]2C)cc1C 1154309687 RONPOVYYBBHOAY-IUODEOHRSA-N 290.407 2.256 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCC[C@H](O)C2)c1O 1331992900 FXQPYQAPNQIJNQ-JSGCOSHPSA-N 279.380 2.350 10 20 CECD CC[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C(F)F 1330676643 JRTWTBGDHPJIDA-OTQAPUNGSA-N 271.263 2.271 10 20 CECD CC1(C)CC[C@H](CO)N(C(=O)c2cc(O)cs2)C1 1336076411 UVXDOEROTVPUKG-SECBINFHSA-N 269.366 2.077 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@@H]1CCCCCN1 1353511955 CCODRFRLOYVBBQ-AWEZNQCLSA-N 291.395 2.066 10 20 CECD CCC[C@H]1C[C@@H](C(=O)NCc2cccc(O)c2O)CCO1 1352658390 UGEAKNUVRPNXPH-AAEUAGOBSA-N 293.363 2.309 10 20 CECD O=C(O)[C@@]12C[C@@H](NCc3ccc(Cl)cc3O)C[C@@H]1C2 1608817931 NDNNYSHNUVIDFE-PUYPPJJSSA-N 281.739 2.389 10 20 CECD Nc1ccc(C(=O)Nc2c(Cl)ccc3nonc23)nc1 1580440088 OXDIHVXZTGBEKL-UHFFFAOYSA-N 289.682 2.106 10 20 CECD Nc1ccc(CCNC(=O)c2ccc(C=O)s2)cc1 1580443676 YDXQXYXZNWHZQE-UHFFFAOYSA-N 274.345 2.115 10 20 CECD CCN(C)c1ccc(CNCC2(C(=O)O)CC2)c(C)c1 1776856443 YKVKPBSATNBCOM-UHFFFAOYSA-N 276.380 2.406 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CC2(Cl)Cl)c1O 155576367 KDDSEANSBTYFIA-QMMMGPOBSA-N 290.146 2.211 10 20 CECD CC(C)N1CCCN(C(=O)Nc2ccc(N)cc2)CC1 841301518 SCHLGPDVGFJUPF-UHFFFAOYSA-N 276.384 2.217 10 20 CECD C[C@H](N[C@@H](C)c1ccc(F)cc1O)C(=O)NC(C)(C)C 181235072 MJBNQZWGYJUUEX-UWVGGRQHSA-N 282.359 2.485 10 20 CECD CS[C@H](CO)[C@H](C)N[C@@H]1CCc2cccc(O)c21 297794716 QBMMJPIAADOBRT-UFGOTCBOSA-N 267.394 2.082 10 20 CECD C[C@H]1CC[C@@H](C(=O)O)CN1Cc1ccc(N(C)C)cc1 397048450 QDCANELPCFDMRJ-GXTWGEPZSA-N 276.380 2.438 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@H]2C2CC2)c1O 176130907 JFEBKFZGBBCOOW-NWDGAFQWSA-N 261.321 2.063 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cnsn2)cc1 56214047 YVFYUJVNMWMJAP-UHFFFAOYSA-N 290.392 2.314 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1cccc(Cl)c1O 179774047 LEHBJWQPPCENGG-SECBINFHSA-N 271.744 2.287 10 20 CECD C[C@@H](NCCCN1CCCC1=O)c1ccccc1O 179879267 ALOIPBIJJSJGKK-GFCCVEGCSA-N 262.353 2.055 10 20 CECD CCSCC[C@H](C)NC(=O)c1cccc(O)c1O 126566252 MIGFOMYVNOFINC-VIFPVBQESA-N 269.366 2.359 10 20 CECD O=C(CC[C@H]1CCCCO1)NCc1ccc(O)c(O)c1 182531638 MBECYCISZLIKOC-GFCCVEGCSA-N 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C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1[C@@H](C)C1(F)F 1346735050 HKDTXYCXEGBTRI-RWYTXXIDSA-N 285.290 2.046 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C(=O)O)C2)cc1Cl 1600286636 TULGQWUCIOXQNI-VIFPVBQESA-N 269.728 2.261 10 20 CECD CCCCN(C(=O)C1=CC[C@H](N)C1)c1ccccn1 1577442165 YJVVXZBYLDXBSN-ZDUSSCGKSA-N 259.353 2.262 10 20 CECD CN(C)c1ccc(/C=C\c2cnc(C(=O)O)cn2)cc1 1777039139 KKGCFZKQGWFITQ-UTCJRWHESA-N 269.304 2.411 10 20 CECD CN(C)c1ccc(CN[C@@H](C(=O)O)c2ccns2)cc1 1777039595 VXIMGUZLVMNKMX-CYBMUJFWSA-N 291.376 2.125 10 20 CECD COc1cccc(CN[C@H]2CCOC(C)(C)C2)c1O 160630888 GUWGTDRJIICNKK-LBPRGKRZSA-N 265.353 2.448 10 20 CECD CCN(C)c1ccc([C@H](C)NCC(=O)NC(C)C)cc1 160925851 VYCFPYCSIHCVQG-ZDUSSCGKSA-N 277.412 2.318 10 20 CECD CN1CCCc2cc(CNC(=O)Nc3cccnn3)ccc21 152087401 AAMZPSABCMTPRO-UHFFFAOYSA-N 297.362 2.181 10 20 CECD Cc1ncc(CN(C)Cc2ccc(N(C)C)cc2)n1C 824474750 RZXBAHXNDWGHHJ-UHFFFAOYSA-N 272.396 2.427 10 20 CECD Nc1ccc(CC(=O)NCCc2cccs2)cc1 20185673 UXXQAIKELLYDMK-UHFFFAOYSA-N 260.362 2.232 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2c(C)cccc2O)C1 876783279 YOJXJJUDTJFKQM-AWEZNQCLSA-N 262.397 2.474 10 20 CECD Cc1ccc(CNCc2nn(C)cc2Cl)c(O)c1 877564991 RNJIJLXPLDXJDN-UHFFFAOYSA-N 265.744 2.377 10 20 CECD C[C@H]1CSC[C@@H]1NCc1ccc(N2CCOCC2)cc1 285470129 KMOWRLJADIOCAK-BBRMVZONSA-N 292.448 2.364 10 20 CECD COc1cccc(CN2C[C@H](CN)[C@H](C)C[C@H]2C)c1O 397356397 FQSAVTYNGXIMHO-BZPMIXESSA-N 278.396 2.206 10 20 CECD CNC(=O)COC(=O)c1sccc1-n1c(C)ccc1C 52179673 FXTJZPJZWKHVNR-UHFFFAOYSA-N 292.360 2.058 10 20 CECD CCOCCN(CC)C(=O)NCc1ccc(N(C)C)cc1 107720480 YPNHKDKMSYEKTQ-UHFFFAOYSA-N 293.411 2.321 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](C)O)cc1 127472434 GNWIONAIOXPYDR-ZDUSSCGKSA-N 272.348 2.205 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](C)C(N)=O)c1C 73019274 LVPDMCIFJUWCKI-GFCCVEGCSA-N 299.374 2.006 10 20 CECD CC(C)c1cc(C(=O)NCc2ccccc2O)on1 73110104 AIKHBSOFOJGWDO-UHFFFAOYSA-N 260.293 2.434 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccncc1F 155814830 QDVGLARZLUOWDG-UHFFFAOYSA-N 260.268 2.199 10 20 CECD 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COc1ccc(N2CC[C@H](CN[C@H]3CO[C@H](C)C3)C2)cc1 842713888 JYQPDLKOCCQTQD-RBSFLKMASA-N 290.407 2.289 10 20 CECD CN(CC[C@H]1CCCO1)c1ccc(OCC(=O)O)cc1 846280248 WDCHPFMNOSAFJQ-CYBMUJFWSA-N 279.336 2.155 10 20 CECD CC(C)(CC(=O)O)NCc1ccc2c(c1)CCCO2 1334407553 NCWJQEYMHKAZCJ-UHFFFAOYSA-N 263.337 2.355 10 20 CECD CC[C@H](C)[C@@H](C(=O)OC)N(C)Cc1ccccc1O 929975640 HUEHEBDYNXVNJH-FZMZJTMJSA-N 265.353 2.412 10 20 CECD COC(=O)C(C)(C)N(C)Cc1cc(F)cc(C(C)=O)c1O 750826731 XEGGPUKHHATEGY-UHFFFAOYSA-N 297.326 2.117 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)CCN(C2CCC2)C1 854602797 MFQMTWMJAOWRCW-LLVKDONJSA-N 294.420 2.400 10 20 CECD Cc1ccc(O)c([C@H](C)NCc2nc(C(N)=O)cs2)c1 850540713 NPKAYZTXPFNSIK-VIFPVBQESA-N 291.376 2.107 10 20 CECD CCOc1ccc(CNCC2(C(=O)O)CCC2)c(O)c1 854244615 MFGRZSHYNBCIHG-UHFFFAOYSA-N 279.336 2.135 10 20 CECD C[C@H](N[C@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 756770119 RTKOJPYYWDOGSD-ONGXEEELSA-N 280.324 2.112 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCSC2)c1 862758025 MJDSMDDKEZXYSS-JTQLQIEISA-N 251.351 2.070 10 20 CECD C[C@@H](NC(=O)NCCc1cccnc1)c1ccccc1O 868025693 USEXKXBWOZOLSE-GFCCVEGCSA-N 285.347 2.390 10 20 CECD CCOC(=O)[C@H](C)NCc1c(O)ccc(Cl)c1F 763271148 FBZXGKFQICXEFS-ZETCQYMHSA-N 275.707 2.226 10 20 CECD CCN(CC)C(=O)C[C@@H](C)NCc1ccc2c(c1)CCO2 765607945 FVVNTXYXUXSSJX-CYBMUJFWSA-N 290.407 2.358 10 20 CECD COc1ccc(O)c(CN2CCC(CN(C)C)CC2)c1 132797232 UANNWVXXHRNAOG-UHFFFAOYSA-N 278.396 2.174 10 20 CECD CCOc1ccc(CN2C[C@@H](C)N(C)C[C@H]2C)c(O)c1 775981479 QXZNMJNIKLRUMQ-CHWSQXEVSA-N 278.396 2.315 10 20 CECD Oc1ccc(Cl)c(F)c1CN1C[C@@H]2CC[C@H](C1)N2 873216739 SESMYZJKPYHTNF-DTORHVGOSA-N 270.735 2.121 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCCC(F)(F)F)c1O 775028961 HQBUKUWUXLYPTQ-UHFFFAOYSA-N 294.229 2.351 10 20 CECD CC(C)NC(=O)CN(C)Cc1cc(Cl)cc(F)c1O 775644345 IHBQQVFBHKBZNJ-UHFFFAOYSA-N 288.750 2.141 10 20 CECD COC1CCC(C(=O)NCc2ccccc2O)CC1 780931210 UORISZZTBZGJAP-UHFFFAOYSA-N 263.337 2.214 10 20 CECD COC(=O)N1CCC(N[C@@H](C)c2c(O)cccc2F)CC1 886510988 FKNNDLOYOGVPEF-JTQLQIEISA-N 296.342 2.413 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1Cc1ccc(OC)c(OC)c1O 891475489 GLXYSRKSSRENTE-WCQYABFASA-N 295.379 2.409 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCCCSc2nccs2)CO1 784410608 JRLCKXYRJFECLE-NXEZZACHSA-N 286.422 2.167 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCCC[C@H](C)O 789024279 HUBWIIQFRCSGEM-ZDUSSCGKSA-N 293.411 2.021 10 20 CECD CC[C@@H](C)N(CCO)Cc1ccc(OC)c(OC)c1O 894763925 QBRRPEAMHSRQFC-LLVKDONJSA-N 283.368 2.002 10 20 CECD COc1ccc(CNC(=O)[C@H](C)c2ccco2)c(O)c1 794380480 DTATXKDJZXSFHW-SNVBAGLBSA-N 275.304 2.414 10 20 CECD CCC[C@@H](NCc1cc(F)cc(F)c1O)C(=O)O 708214567 CFOSFKMRZSJFIC-SNVBAGLBSA-N 259.252 2.013 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)c1csnn1 708466948 VVECKSHURNUGEI-LURJTMIESA-N 271.292 2.373 10 20 CECD CN(Cc1cc(Cl)ccc1O)Cc1nnc2n1CCC2 768223661 NIJZUAAEBTXVDK-UHFFFAOYSA-N 292.770 2.215 10 20 CECD COc1cccc(O)c1CN1CC[C@@H]([C@@H]2CCOC2)C1 769517198 ZXLJKGMAUNJUFW-CHWSQXEVSA-N 277.364 2.259 10 20 CECD CCN(Cc1cc(F)ccc1O)C[C@H]1CCOC1 778996971 XYDFBYSBKCAIQN-LLVKDONJSA-N 253.317 2.390 10 20 CECD COc1cccc(CN2CCO[C@@H](C)[C@H]2C)c1O 93418393 VDUKULACYWXALT-MNOVXSKESA-N 251.326 2.010 10 20 CECD CCOc1cccc(CN(C)C[C@@H]2CCOC2)c1O 93839913 MHJBCKQLVMKIIF-LBPRGKRZSA-N 265.353 2.259 10 20 CECD CN(CC(=O)NCc1ccccc1O)Cc1ccccc1 1318082595 QIQIOLPDYQOAOK-UHFFFAOYSA-N 284.359 2.140 10 20 CECD C[C@]1(CNC(=O)NCc2ccc(N)cc2)CCCC[C@H]1O 1337017658 AUVRSMAITXOAQF-GDBMZVCRSA-N 291.395 2.009 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2ccnc(N)c2)cc1 1331692332 OIMAEAYRIDOAIE-UHFFFAOYSA-N 298.390 2.440 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCS[C@H]2C)c1 1261457090 XMNAYAGBIRXAKI-JOYOIKCWSA-N 296.392 2.094 10 20 CECD Oc1ccccc1CN(Cc1nc[nH]n1)C1CCCC1 1261637724 DKJSJSKZLJPUPH-UHFFFAOYSA-N 272.352 2.455 10 20 CECD O=C(NCc1cccc(O)c1O)C1[C@@H]2CCCC[C@@H]12 1528771133 LAFNUWCYSSCARX-GHMZBOCLSA-N 261.321 2.150 10 20 CECD C[C@@H](NCC(C)(C)CN(C)C)c1cc(C(=O)O)ccc1O 1593241205 XLLYTHXVSXDJKE-LLVKDONJSA-N 294.395 2.329 10 20 CECD COc1ccc(CNC[C@H](C)NC(=O)[C@H]2C[C@@H]2C)cc1C 1754278721 KMXUELGSROEFBP-WHOFXGATSA-N 290.407 2.254 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CC[C@@H]3[C@@H]2C(=O)O)cc1 1777039714 UECUFWSEGXVPMI-AEGPPILISA-N 274.364 2.048 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@H](N)[C@H]3C2)cc1 252861334 NLZNUUCMCVIGPL-XIRDDKMYSA-N 273.424 2.312 10 20 CECD Oc1ccc(F)cc1CN[C@H]1CCN2CCCC[C@H]12 272488695 UFWVRASPCQNIPZ-UONOGXRCSA-N 264.344 2.248 10 20 CECD COCCOc1ccc(NCc2ccccc2O)cn1 36978242 ONWDWLGSZMLOHD-UHFFFAOYSA-N 274.320 2.425 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](O)C(C)(C)C)c1 273552443 GDFJRVAODNKBNY-QMTHXVAHSA-N 267.369 2.458 10 20 CECD CN(Cc1ccccc1O)C(=O)C1CC(F)(F)C1 383944305 MHYGAXAGJOJEMZ-UHFFFAOYSA-N 255.264 2.396 10 20 CECD CCOC(=O)[C@H](C)[C@@H](C)NCc1cc(F)ccc1O 184568990 LMUCOYQKLYPMFG-NXEZZACHSA-N 269.316 2.209 10 20 CECD CC1(C)C(C(=O)NCc2ccc(O)c(O)c2)C1(C)C 182531466 PKSJCIVRXNLADC-UHFFFAOYSA-N 263.337 2.396 10 20 CECD NCc1cc(C(=O)NCCCSc2nccs2)co1 187778816 RKVGEZKRRYVJCW-UHFFFAOYSA-N 297.405 2.107 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H](C)CCSC)c1 77600119 KDQSWUJHJFUDAG-JTQLQIEISA-N 298.408 2.342 10 20 CECD C[C@H](CNCc1c(O)cccc1Cl)CN1CCOCC1 120293556 OMARJPGEFXYGLO-GFCCVEGCSA-N 298.814 2.104 10 20 CECD C[C@@H](NCCCO[C@H]1CCOC1)c1cc(F)ccc1O 185705629 QWDDTBJWKLMDEW-YPMHNXCESA-N 283.343 2.378 10 20 CECD COC[C@@H](C)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 131890669 LWRDNYNVFKEPTM-CHWSQXEVSA-N 296.386 2.348 10 20 CECD CN(C(=O)/C=C\c1cncc(F)c1)c1ccc(Cl)nn1 255764530 ABWHBQKWKVDTJM-DJWKRKHSSA-N 292.701 2.340 10 20 CECD CC[C@H](CO)N[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 268724203 PZZCORSIGQERLK-GXTWGEPZSA-N 296.386 2.084 10 20 CECD C[C@H](NC[C@H](C)N(C)C1CC1)c1cc([N+](=O)[O-])ccc1O 273462246 CYKOTRRTRNETIM-QWRGUYRKSA-N 293.367 2.434 10 20 CECD CC[C@H]1CO[C@@H](C)CN1C(=O)/C=C/c1ccc(O)c(O)c1 272685303 SSGOGYQMOFLNFV-FXOGGVSJSA-N 291.347 2.137 10 20 CECD CCN(CC)c1ccc(CNCC(C)(C)OCCO)cc1 288402404 IAVCJGFSOWVABJ-UHFFFAOYSA-N 294.439 2.410 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CCCC(N)=O 282580196 VXYGEGHRSTUZBX-UHFFFAOYSA-N 292.379 2.177 10 20 CECD Cc1ccc2c(c1)CN(C(=O)c1cccc(O)c1O)CCO2 376408399 PIBFONCCUXEVSN-UHFFFAOYSA-N 299.326 2.441 10 20 CECD CC[C@H](NC[C@H](O)CN(C)C)c1cccc(Cl)c1O 806137085 GQMGBIISYZJOOW-GWCFXTLKSA-N 286.803 2.009 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CCC2(C)C)c1 806811317 UOUREFCJZODMFJ-ZDUSSCGKSA-N 278.352 2.389 10 20 CECD CCCn1nc(C)c(C(=O)NCc2ccc(N)cc2)c1C 296840101 BWNUVNHDVZCLGV-UHFFFAOYSA-N 286.379 2.422 10 20 CECD CC(C)N(C)CC(=O)NCc1ccc(N2CCCC2)cc1 299305536 CYDQMEFCTKDTLC-UHFFFAOYSA-N 289.423 2.243 10 20 CECD CC(=O)C(=O)COC(=O)[C@@H](C)Oc1ccc(Cl)cc1C 808484112 JRCWQZTXEGLWIV-SNVBAGLBSA-N 298.722 2.117 10 20 CECD C[C@H](NCCc1ccc(N)cc1)C1CCN(C)CC1 817956123 RCORIPIZQDKBGK-ZDUSSCGKSA-N 261.413 2.131 10 20 CECD C[C@H](N[C@H](C)CCCN)c1cc(F)cc(F)c1O 817977252 FQCVEMUFUAJRFJ-BDAKNGLRSA-N 258.312 2.448 10 20 CECD CCC[C@H](OC)C(=O)NCc1ccc(N(C)C)cc1C 825873903 QETMBRXXFPKFCK-HNNXBMFYSA-N 278.396 2.492 10 20 CECD NCC[C@H]1CCN(Cc2cccc(Cl)c2O)C1 904405484 JXPROXVPLZSDSJ-JTQLQIEISA-N 254.761 2.216 10 20 CECD CC(C)C[C@@H](N)C(=O)NCc1c(O)ccc2c1CCCC2 830597975 XFJLRCIXYLBNSC-OAHLLOKOSA-N 290.407 2.261 10 20 CECD O=C(O)C[C@H]1CCCN1Cc1c(O)ccc2ccncc12 833210853 OHHNXEMUWMSFHR-GFCCVEGCSA-N 286.331 2.380 10 20 CECD O=C(c1cccc2c1CCN2)N1CCNCc2ccccc21 911761801 SAWRRBCFZZZBPM-UHFFFAOYSA-N 293.370 2.405 10 20 CECD C[C@H]1NCCC[C@@H]1NCc1ccc(N(C)C)c(F)c1 841065023 LGTATRYFPZOMNF-RISCZKNCSA-N 265.376 2.122 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCNCC1 846677095 MWOOVNUFDKCFGR-HNNXBMFYSA-N 289.423 2.101 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1ccc(Cl)cc1O 841753018 XCGWRGOPERIDMK-VIFPVBQESA-N 284.787 2.468 10 20 CECD CCC[C@@H]1C[C@H]1C(=O)NCCc1ccc(O)c(O)c1 812536330 XYXRJSZJLCDKAP-VXGBXAGGSA-N 263.337 2.193 10 20 CECD C[C@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CCS1 754872651 OBGCQBJWNZYXLB-IINYFYTJSA-N 295.404 2.145 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CS[C@H](C)C2)c1 858538583 ODYKCGFDJCFOQV-ZYHUDNBSSA-N 280.393 2.394 10 20 CECD OC1(CCNCc2ccc3c(c2)CCCO3)CCOCC1 922120401 FXMMUFMCOUWXPH-UHFFFAOYSA-N 291.391 2.033 10 20 CECD CCCN1CC(=O)N(CCCSc2nccs2)C1=O 761303317 YTNIQTIJBWEOMH-UHFFFAOYSA-N 299.421 2.300 10 20 CECD Cc1ccc(CCNC(=O)/C=C\c2ccc(O)c(O)c2)o1 779500833 ZFJPVBMOYPKRJP-DAXSKMNVSA-N 287.315 2.371 10 20 CECD Cn1cc(CCNCc2cc(Cl)cc(F)c2O)cn1 776033398 MTOXXUZJOXBFIT-UHFFFAOYSA-N 283.734 2.251 10 20 CECD CN(C)c1ccc(CN2Cc3cnn(C)c3C2)cc1F 877632650 IQSIBNIHLNUPBB-UHFFFAOYSA-N 274.343 2.141 10 20 CECD CSC[C@](C)(O)CNCc1cc(Cl)cc(F)c1O 776208939 FDDXGTTYQDBSHA-GFCCVEGCSA-N 293.791 2.388 10 20 CECD CCOC(=O)[C@@H](NCc1cc(C)ccc1O)C1CC1 1116755755 TYUSSSWQGDALKB-AWEZNQCLSA-N 263.337 2.132 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@H](C)c1c(O)cccc1F 886509846 GCILWBMPNWQDDD-WDEREUQCSA-N 280.343 2.193 10 20 CECD CCN(C)c1ccc(Cn2cc(CCCCN)nn2)cc1 881313833 UXAXYXXFKFRQCK-UHFFFAOYSA-N 287.411 2.064 10 20 CECD C[C@H](N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21)C(=O)N(C)C 790743704 YHBUYEVPZBZECC-YWVKMMECSA-N 280.343 2.146 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)NCc1cc(OC)ccc1O 793690687 XGBLXKSMHBSMHT-IINYFYTJSA-N 281.352 2.078 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC[C@H](C2OCCO2)C1 893995353 VJWHXIKYBZAKFA-JTQLQIEISA-N 299.317 2.255 10 20 CECD C[C@@H]1COC[C@H]1NCc1c(O)cccc1Br 706805243 TXSTZJIDCJATPI-LDYMZIIASA-N 286.169 2.279 10 20 CECD Cc1nnc(CN(C)Cc2ccc(N(C)C)cc2)o1 726981244 PGXBNXHBLAVGMC-UHFFFAOYSA-N 260.341 2.076 10 20 CECD CCc1cccc(CN[C@H](C)CCN(C)C)c1O 691484844 WSPBMHUERGCMJG-GFCCVEGCSA-N 250.386 2.384 10 20 CECD CCN(C)C[C@H]1CCN(Cc2c(O)cccc2OC)C1 769516325 SHVTWIQYFVHMOM-CYBMUJFWSA-N 278.396 2.174 10 20 CECD Nc1ccc(CNC(=O)c2ccc(N3CCCC3)nc2)cc1 1343566094 DYXAASWTQLMYSH-UHFFFAOYSA-N 296.374 2.194 10 20 CECD Nc1ccc(CNC(=O)c2ccnc(C3CC3)c2)cc1 1341922498 CWCFELWSSOLZSL-UHFFFAOYSA-N 267.332 2.471 10 20 CECD C[C@H](N[C@@H]1CCC[C@@H]1CCO)c1cc(C(=O)O)ccc1O 1609774973 DJFFUIXZRFVRAP-MISXGVKJSA-N 293.363 2.292 10 20 CECD CCOc1cccc(CNCc2cccnc2)c1O 20140830 YRCMYWCCYPZPTB-UHFFFAOYSA-N 258.321 2.476 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCCOCCO 230672073 KULKNFAKPAXBTP-CHWSQXEVSA-N 279.380 2.238 10 20 CECD CC(C)CN(CC(=O)O)Cc1cc2c(cc1O)CCC2 1591305027 ZXUKLTPAXNUABO-UHFFFAOYSA-N 277.364 2.424 10 20 CECD C[C@@H]1CCC[C@]1(NCc1ccc(N(C)C)cc1)C(=O)O 1776639607 MOGZYFGAQIYOQR-MLGOLLRUSA-N 276.380 2.486 10 20 CECD CC[C@@H](C)OCC(=O)N[C@H](C)c1cc(OC)ccc1O 162187710 LNXQCRKFKBGGHF-GHMZBOCLSA-N 281.352 2.393 10 20 CECD Cc1cccc(CNc2cccc(-n3cnnn3)c2)c1O 158015443 ZMMANLBMDOGAFR-UHFFFAOYSA-N 281.319 2.288 10 20 CECD O=C(CCc1ccc(F)cc1)NCc1ccc(O)c(O)c1 159031547 ARVUEJGNTLFJCX-UHFFFAOYSA-N 289.306 2.486 10 20 CECD COc1ccc(CNCc2cncn2C(C)C)c(O)c1 822475839 DQUPGALKTXELNF-UHFFFAOYSA-N 275.352 2.468 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1ccc2c(c1)CCO2 37363253 DYIXGQCOHBMSTC-AWEZNQCLSA-N 277.364 2.299 10 20 CECD CC[C@H](C)[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 37801159 XVDKCXHGPZFDRU-WFASDCNBSA-N 277.412 2.084 10 20 CECD C[C@@H](NCC1([S@](C)=O)CCC1)c1cc(F)ccc1O 281024380 MNUVIQSEAHVYII-DGIBIBHMSA-N 285.384 2.483 10 20 CECD Nc1ccc(CC(=O)N2CCC(F)(F)CC2)cc1 405164067 JLZYLADRQGBJNM-UHFFFAOYSA-N 254.280 2.069 10 20 CECD CCc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)[nH]n1 32271692 YNCHJJBNRBCYFE-UHFFFAOYSA-N 286.379 2.310 10 20 CECD COc1cccc2c1OC[C@@H](NCc1ccccc1O)C2 77412394 MAUBMUCCGMATLG-AWEZNQCLSA-N 285.343 2.494 10 20 CECD COc1cccc(CNC(=O)NCc2ccccc2)c1O 75640162 TZXCJQMMINDNMM-UHFFFAOYSA-N 286.331 2.400 10 20 CECD COc1ccc(O)c(CNC(=O)CC(C)(C)CC(C)=O)c1 191923404 SYXKTYMDBJMWSE-UHFFFAOYSA-N 293.363 2.412 10 20 CECD CC[C@]1(CO)CCCN1Cc1cc(F)ccc1O 191010040 KMLRZAUGXSIUTL-CQSZACIVSA-N 253.317 2.268 10 20 CECD Cc1cc(O)c(CN(C)[C@@H](C)C[S@](C)=O)cc1C 131074172 KBHPJRDWIARFGC-KPZWWZAWSA-N 269.410 2.208 10 20 CECD CO[C@H]1CCN(Cc2cc(Br)ccc2O)C1 234885197 UIMQLFUPAVSHCN-NSHDSACASA-N 286.169 2.375 10 20 CECD C[C@H]1[C@H](C2CC2)[C@@H]1C(=O)NCCc1ccc(O)c(O)c1 528856508 AXSFQUUGGHQLLD-TZTCFGBESA-N 275.348 2.049 10 20 CECD Cc1c(CNC(=O)Cc2cc[nH]n2)n(C)c2ccccc12 352135668 QPIRRUSJQZPKCG-UHFFFAOYSA-N 282.347 2.069 10 20 CECD COCCC1(CNC(=O)NCc2ccccc2O)CC1 269059003 TYDOQWUITWYTTR-UHFFFAOYSA-N 278.352 2.008 10 20 CECD CC[C@@H]1CO[C@H](C)CN1C(=O)c1ccc(C)c(O)c1O 272751950 OKXXILFZTPUCTP-GHMZBOCLSA-N 279.336 2.046 10 20 CECD CCOc1ccc(O)c(CNCCc2nnc(C)s2)c1 289985862 XCVABIZNKKATPX-UHFFFAOYSA-N 293.392 2.283 10 20 CECD COC(=O)C(C)(C)CCNCc1cccc(C)c1O 289630394 WUHBNXGSYKISRR-UHFFFAOYSA-N 265.353 2.380 10 20 CECD COc1cccc(O)c1CN1CC[C@H](n2cc(C)cn2)C1 811518134 HNPHALSOLYVZGV-ZDUSSCGKSA-N 287.363 2.353 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@@H]2CCNC2)c1O 817945229 XOXIXDMJNCOJSJ-GXSJLCMTSA-N 254.761 2.367 10 20 CECD CC[C@](C)(O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 822834514 XXZYXRGBMDOPER-DYVFJYSZSA-N 292.423 2.269 10 20 CECD CCOc1ccc(O)c(CN(C)Cc2noc(C)n2)c1 827891392 JGDXXNCLLYKDFQ-UHFFFAOYSA-N 277.324 2.114 10 20 CECD CCOc1ccc(CN2CCCC[C@@H]2C(=O)O)c(O)c1 820387658 WGJQDJBNWXHBEL-CYBMUJFWSA-N 279.336 2.230 10 20 CECD Cc1ccncc1/C=C/C(=O)N1CCc2ccncc21 492549075 KNIWBLZNASQOEH-NSCUHMNNSA-N 265.316 2.388 10 20 CECD CC1(C)C[C@H](CNC(=O)NCc2ccccc2O)CCO1 836674730 SBSAMHDZXUJDEC-GFCCVEGCSA-N 292.379 2.397 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)CCCC3)C[C@H]1C(=O)O 833630866 XUKSYJQVBSRZHI-XHDPSFHLSA-N 289.375 2.424 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1cc(Cl)cc(OC)c1O 840837589 JROCEZCUSDUQPR-LBPRGKRZSA-N 298.770 2.283 10 20 CECD CO[C@@H]1CCCN(C(=O)NCCc2ccc(N)cc2)CC1 841956418 BAHQBWDZUGLXAD-OAHLLOKOSA-N 291.395 2.022 10 20 CECD COc1cccc(O)c1CNC[C@@](C)(O)c1cccs1 740014578 NUFZAMQVRYNHNV-OAHLLOKOSA-N 293.388 2.460 10 20 CECD C[C@H](NC[C@@H](O)c1cnn(C)c1)c1ccc(Cl)cc1O 841748533 AMMCJSMZCQNGEE-LKFCYVNXSA-N 295.770 2.163 10 20 CECD CCOc1cccc(CN[C@@H]2CC23CCNCC3)c1O 841079798 OLQTVMNAFSPRNV-CQSZACIVSA-N 276.380 2.023 10 20 CECD CC(C)[C@H](O)C1(CNC(=O)Nc2ccc(N)cc2)CC1 841295716 DGRYXGNJNIEUMK-ZDUSSCGKSA-N 277.368 2.187 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](N)[C@@H](CC)C2)c1 843053623 OXNQUOXCSBFAHT-SWLSCSKDSA-N 278.396 2.350 10 20 CECD CC1(C(=O)NCc2cc(Cl)ccc2O)CCOCC1 846472365 ISYXTSVYZPYIJG-UHFFFAOYSA-N 283.755 2.479 10 20 CECD C[C@@H](NCC1CC2(C1)OCCO2)c1cc(F)cc(F)c1O 927004725 VRWOOVPCDGIIPD-SECBINFHSA-N 299.317 2.474 10 20 CECD CC(=O)CCCC(=O)NCc1cc(Cl)ccc1O 846478320 BNZMFBIILPYXME-UHFFFAOYSA-N 269.728 2.421 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 840951592 ZAMQEHMOVPFLGM-WNRNVDISSA-N 284.403 2.446 10 20 CECD CCN1CCC[C@H](NCc2ccc3c(c2)CCCO3)C1=O 922638028 CQHKMQLTMDLQMZ-HNNXBMFYSA-N 288.391 2.112 10 20 CECD C[C@@H](Cn1cccn1)NCc1cc(F)c(N(C)C)cc1F 858095616 RIKSAGGOGMGQFI-NSHDSACASA-N 294.349 2.406 10 20 CECD CN(C)c1ccc(CN(C)c2cc(F)ncn2)cc1 853093753 QTDCMNMWWVKRQV-UHFFFAOYSA-N 260.316 2.318 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)CCCF)cc1 855020086 FYOQNADMSMJFFP-UHFFFAOYSA-N 282.359 2.340 10 20 CECD C[C@H](N[C@@H]1CCOC[C@H]1O)c1cc2c(cc1O)CCCC2 858552343 GKIYXJUTCRJXOM-UXEPBGEESA-N 291.391 2.071 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnn(C(F)F)c2)cc1 864573450 MBBIDPPSRNLTGF-UHFFFAOYSA-N 294.305 2.274 10 20 CECD COC(=O)CCC(C)(C)NCc1cc(F)ccc1O 762788115 UPCGYVRJHVPARH-UHFFFAOYSA-N 269.316 2.353 10 20 CECD CCN(Cc1cc(F)c(N(C)C)cc1F)[C@H](C)CO 862375438 PGZZRBQOLZGGAS-SNVBAGLBSA-N 272.339 2.234 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CC[C@H]1N 1118241673 KBEZQXQIVTVVFD-RHSMWYFYSA-N 273.424 2.456 10 20 CECD C[C@H](C[C@H]1CCCC(=O)N1)NCc1ccc(N(C)C)cc1 876905545 IODFHPFGNXFZBF-UKRRQHHQSA-N 289.423 2.290 10 20 CECD CCCN(CCO)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 776246765 UKGZJHKEQACGAX-CYBMUJFWSA-N 293.411 2.228 10 20 CECD CCN(C)c1ccc(CN2CCC(C(=O)NC)CC2)cc1 773735206 YRWFKQBUWVHGPS-UHFFFAOYSA-N 289.423 2.101 10 20 CECD O=C1NC(=S)S/C1=C/c1ccc([N+](=O)[O-])cc1F 777869044 DXMCXIFOQHQFPM-FPYGCLRLSA-N 284.293 2.223 10 20 CECD C[C@H](NC(=O)NC[C@H](C)CCO)c1ccc(N(C)C)cc1 776248397 ZMACGGOBHFAQPF-OLZOCXBDSA-N 293.411 2.131 10 20 CECD CN(C(=O)c1cc2c(nc1O)CCC2)c1ccc(N)cc1 877078654 YFZPQCJCGIDMCK-UHFFFAOYSA-N 283.331 2.135 10 20 CECD CCOc1ccc(O)c(CN[C@@]2(C)CCCOC2)c1 771893906 SFPZHKXUVATZMF-HNNXBMFYSA-N 265.353 2.450 10 20 CECD Cc1cccn2cc(COC(=O)c3cccc(O)c3O)nc12 776282954 ZIHFBEAOPMBBGL-UHFFFAOYSA-N 298.298 2.411 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](N)CC2CC2)cc1 884193679 MNLUJSCBIZIMPC-MRXNPFEDSA-N 289.423 2.276 10 20 CECD COc1cc(O)c(CN2CCC[C@H]([C@@H](C)O)C2)cc1OC 780891853 AOAOKUABIYAURT-NEPJUHHUSA-N 295.379 2.002 10 20 CECD CCCC[C@@H](NCc1ccccc1O)C(=O)OC 83385013 SQVRWILOESUVHA-GFCCVEGCSA-N 251.326 2.214 10 20 CECD COc1ccc(CNC(=O)c2cccnc2S)c(O)c1 794389532 PSYVLPBWROJPSB-UHFFFAOYSA-N 290.344 2.015 10 20 CECD C[C@@H](CCS(C)(=O)=O)N[C@H](C)c1ccc(F)cc1O 185790660 DBHUPHHFCCJRHJ-VHSXEESVSA-N 289.372 2.005 10 20 CECD CC(C)[C@H]1CN(Cc2cc(F)ccc2O)CCO1 709019969 LIZZCMRNZXXHSZ-CQSZACIVSA-N 253.317 2.388 10 20 CECD CCOc1cccc(CNCC[C@H](C)N(C)C)c1O 829320801 UYIOMWGIFYJRJG-LBPRGKRZSA-N 266.385 2.221 10 20 CECD COc1ccc(N2CCC(Nc3cc(N)ncn3)CC2)cc1 1318306890 ZUFBVZZABRIPKH-UHFFFAOYSA-N 299.378 2.148 10 20 CECD COc1cccc(O)c1CN1CC[C@](CO)(C(C)C)C1 1324207339 HMMYNLMVUSNHMY-INIZCTEOSA-N 279.380 2.241 10 20 CECD COC[C@@H]1CCCCN(C(=O)NCc2ccc(N)cc2)C1 1335726678 VLURWMRHFSOVOE-CQSZACIVSA-N 291.395 2.227 10 20 CECD Cc1cc(Br)c(O)c(CNCCCCN)c1 1345106376 YNKHCBRGANBHGN-UHFFFAOYSA-N 287.201 2.292 10 20 CECD C[C@H]1[C@@H](C(=O)O)CCN1Cc1cc(Cl)cc(F)c1O 1609835449 UMPBEEQWGSVQOV-XVKPBYJWSA-N 287.718 2.480 10 20 CECD Cc1cc(O)c(CN2CCC[C@H]2C(=O)O)cc1Cl 1574343121 DNFMQHUKZRSYSY-NSHDSACASA-N 269.728 2.403 10 20 CECD C[C@@H](C(=O)O)N(Cc1cc(F)c(F)cc1O)C1CCC1 1589486938 PSWXURYYFMCMAI-QMMMGPOBSA-N 285.290 2.498 10 20 CECD CCCC[C@@H](NCc1cc(F)ccc1O)C(=O)O 1595638552 WZNQIRKVAWHDEO-LLVKDONJSA-N 255.289 2.264 10 20 CECD Cc1cc(N[C@@H](C)c2ccccc2O)ncc1-c1nn[nH]n1 1592054557 HTSAPVGWJCLEKT-JTQLQIEISA-N 296.334 2.449 10 20 CECD C[C@@H](CNCc1c(O)ccc(Cl)c1F)[C@@H](F)C(=O)O 1776423156 BAWNAMWNZYSLBO-QUBYGPBYSA-N 293.697 2.333 10 20 CECD CCCOc1ccc(CN(CCC)CCO)c(O)c1 161223132 KRHIEYREANMFIO-UHFFFAOYSA-N 267.369 2.385 10 20 CECD COc1ccc(N2CCN(CC3CC3)CC2)cc1F 156686823 ZKSDOFRNAVFSJL-UHFFFAOYSA-N 264.344 2.366 10 20 CECD COc1ccc(CNC[C@@H](CO)C(C)C)cc1C 258956636 JYQXXJBECFUFKA-AWEZNQCLSA-N 251.370 2.358 10 20 CECD C[C@@H](N[C@@H]1CCc2cccc(O)c21)c1ccn(C)n1 840816412 VZKJFOCCJIQVRG-ZWNOBZJWSA-N 257.337 2.464 10 20 CECD C[C@@H](N[C@H]1CCN(C2CC2)C1)c1ccc(F)cc1O 62748346 JNJXXXNIAKGKPL-PWSUYJOCSA-N 264.344 2.419 10 20 CECD COc1cc(Cl)cc(CN2CCN[C@H](C)[C@H]2C)c1O 379436601 NIWQTQJGRBGFBX-NXEZZACHSA-N 284.787 2.236 10 20 CECD C[C@@H](C(=O)NC1CCCC1)N(C)Cc1ccccc1O 109773407 BFYANOCTDQCURM-LBPRGKRZSA-N 276.380 2.271 10 20 CECD CC[C@@H](C)NC(=O)CN1CCCc2cc(OC)ccc21 27959649 IWGNBXQUTNXJJD-GFCCVEGCSA-N 276.380 2.363 10 20 CECD Cc1ccc(C(=O)N(C)CC(F)(F)F)c(O)c1O 177672041 MBFRRLDCENHUEL-UHFFFAOYSA-N 263.215 2.041 10 20 CECD COc1ccc(O)c(CNC(=O)CC[C@@H]2CC[C@@H](C)O2)c1 173579407 PCESSTIRBWTKBV-YPMHNXCESA-N 293.363 2.365 10 20 CECD CCc1occc1C(=O)NCCc1ccc(O)c(O)c1 280817066 NTGFKEYNBIXFJI-UHFFFAOYSA-N 275.304 2.226 10 20 CECD CCN1CCN(Cc2cccc(Cl)c2O)CC1 124502426 NSDKRWOJUWYVIX-UHFFFAOYSA-N 254.761 2.183 10 20 CECD CC(C)[C@]1(C)C[C@H]1C(=O)NCc1ccc(O)c(O)c1 186462346 QDMQKKZOUBTZCQ-NHYWBVRUSA-N 263.337 2.396 10 20 CECD O=S(=O)(CCC1CCC1)NCc1ccccc1O 290830141 UNOGEALNECQHSY-UHFFFAOYSA-N 269.366 2.002 10 20 CECD CCCNC(=O)CN(CCC)Cc1cc(C)ccc1O 92192549 KKCGOALESUQJMY-UHFFFAOYSA-N 278.396 2.439 10 20 CECD CCCn1ncnc1CN(C)c1ccc(OC)c(F)c1 279084124 MJZFLFZAABFXEA-UHFFFAOYSA-N 278.331 2.472 10 20 CECD COC[C@@H](CCO)N[C@H](C)c1cc(Cl)ccc1O 273561425 IHHXLFPNGYJTGG-MWLCHTKSSA-N 273.760 2.094 10 20 CECD CC[C@@H](NCCOCCOC)c1ccc(F)cc1O 286098122 NCSXFGONEIZUNM-CYBMUJFWSA-N 271.332 2.235 10 20 CECD Cc1nnc(CCNCc2ccc(N(C)C)c(F)c2)s1 289896202 QSMALZZJOFBSIA-UHFFFAOYSA-N 294.399 2.384 10 20 CECD CCCN(CCCN(C)C)Cc1cc2c(cc1O)OCO2 290311749 CDZMXRWHNIIRHL-UHFFFAOYSA-N 294.395 2.285 10 20 CECD CC(=O)C(=O)COc1cc(Cl)cnc1Br 808030958 HBCANSVARMHFAI-UHFFFAOYSA-N 292.516 2.034 10 20 CECD CN(C)c1ccc(CNC(=O)CSC2CC2)cc1 294228207 BOJORWXUEHVGHF-UHFFFAOYSA-N 264.394 2.264 10 20 CECD C[C@H](NC[C@@H]1CCCN1)c1cc(F)cc(F)c1O 817951455 FWHSMABJBPFFFD-WPRPVWTQSA-N 256.296 2.073 10 20 CECD Cc1nc([C@@H](C)OC(=O)c2ccc(C)c(O)c2O)no1 811113033 YQOQQVXNOHITBN-SSDOTTSWSA-N 278.264 2.016 10 20 CECD C[C@H](N[C@H]1CCN(C(C)(C)C)C1=O)c1ccccc1O 822812846 OHEPJQQDASXVIW-AAEUAGOBSA-N 276.380 2.442 10 20 CECD Cc1cccc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1O 824838046 KUYHBKPILYBXAG-KBUPBQIOSA-N 257.333 2.086 10 20 CECD Cc1cc(O)c(CN(C)CC(=O)NC(C)C)cc1Cl 824535703 USVYFHWPMBOPKG-UHFFFAOYSA-N 284.787 2.310 10 20 CECD CN1CC[C@@H]2CN(Cc3cc(Cl)cc(F)c3O)C[C@@H]21 824893402 RESNFXTZYQDJEU-RNCFNFMXSA-N 284.762 2.321 10 20 CECD Cc1cc(N(C)C)ccc1CNCC(C)(C)C(=O)O 901506745 POFBXUGUYQJJLF-UHFFFAOYSA-N 264.369 2.261 10 20 CECD Cc1ccn(C[C@@H](C)C(=O)N[C@H](C)c2ccccc2O)n1 827917407 NJQZQEYDVUUOCZ-DGCLKSJQSA-N 287.363 2.411 10 20 CECD COC(=O)C1CCC(NCc2c(O)cccc2OC)CC1 730107493 MEHJCXSQVLKOOC-UHFFFAOYSA-N 293.363 2.222 10 20 CECD Cc1cn(C)nc1C(=O)N(C)Cc1ccc(N(C)C)cc1 839468358 XYZFZLUXWPVKGZ-UHFFFAOYSA-N 286.379 2.067 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(O)cs1 731872013 UHSKVATZISEJSB-UHFFFAOYSA-N 263.318 2.432 10 20 CECD COc1cccc([C@@H](C)NCCSCCCO)c1O 846143357 DZTWWFLHGCGDTH-LLVKDONJSA-N 285.409 2.167 10 20 CECD C[C@H]1C[C@H](C)CN(C(=O)NCCc2ccc(N)cc2)C1 841961727 GUFRMLBDFYTWAX-STQMWFEESA-N 275.396 2.499 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1([S@@](C)=O)CCC1 840942595 JFTOGJQFFCPUIE-HXUWFJFHSA-N 294.464 2.452 10 20 CECD O=C(CCC1CCOCC1)NCc1ccccc1O 743326648 FQFXHYKXWAAHTC-UHFFFAOYSA-N 263.337 2.215 10 20 CECD Cc1ccncc1/C=C\C(=O)NCCc1ccc(O)c(O)c1 752597626 YJZDYNBGLQYDSR-HYXAFXHYSA-N 298.342 2.173 10 20 CECD COC[C@@H](OC)C(=O)Oc1ccc2c(c1)c(C)c(C)n2C 851091989 GKULYCWFYJWUQB-OAHLLOKOSA-N 291.347 2.362 10 20 CECD C[C@H](NC(=O)Nc1cnns1)c1ccc(N(C)C)cc1 755342149 BJJWEEKHFDUQJT-VIFPVBQESA-N 291.380 2.487 10 20 CECD O=C(NCCCSc1nccs1)NCc1ccon1 759585177 PNOUMUCDOMRRKF-UHFFFAOYSA-N 298.393 2.113 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2[C@H]3Cc4ccccc4[C@H]32)cc1 859593089 AKOOQKVSVDHKBJ-GVDBMIGSSA-N 278.355 2.471 10 20 CECD C[C@@H](NCCCNc1ncccn1)c1ccc(F)cc1O 756643596 WDKKRNZZPDNTAA-LLVKDONJSA-N 290.342 2.474 10 20 CECD CCON(C)C(=O)NCc1ccc(N2CC=CC2)cc1 753536506 YQFGZAMPJPILQM-UHFFFAOYSA-N 275.352 2.156 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](N2CCCC2)C1 768900800 JLEVWSDMLQSGSQ-AWEZNQCLSA-N 290.407 2.461 10 20 CECD CSC[C@@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O 768464010 YTWMQEVAEFLGPZ-SMDDNHRTSA-N 295.404 2.145 10 20 CECD Cc1ccc(O)c(CNC(=O)NOCC2CCC2)c1 875754182 FIHJWUQHQSNZNG-UHFFFAOYSA-N 264.325 2.232 10 20 CECD Cc1ccc(CN2C[C@@H](C)O[C@@]3(CCOC3)C2)c(O)c1 877491995 DSZUPFDFAZHKHB-CJNGLKHVSA-N 277.364 2.080 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2[nH]cnc2C)cc1 874085257 GJBOXDZVJPNGMF-UHFFFAOYSA-N 286.379 2.494 10 20 CECD Cc1cc(NS(=O)(=O)N(C)CC2CC2)c(C)c(C)c1O 775291460 HMOBJLPUYKAKTI-UHFFFAOYSA-N 298.408 2.316 10 20 CECD C[C@H](O)C[C@@H](C)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776248418 IXUNAJODOYTRFO-FRRDWIJNSA-N 293.411 2.272 10 20 CECD COc1ccc(CNCCNC(=O)[C@@H](C)C2CC2)cc1C 1125343609 WTNPOEWRVVKLCC-ZDUSSCGKSA-N 290.407 2.256 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCc2n[nH]cc2C1 883016329 WHPWUNZKGDNOIN-LLVKDONJSA-N 279.290 2.041 10 20 CECD COc1ccc(CNCc2cccnc2C)c(O)c1OC 895618682 NAVPIAXLWGVKIH-UHFFFAOYSA-N 288.347 2.403 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2ccc(C)cc2O)C1 896956564 UGQSOWNGMTXIMU-ZDUSSCGKSA-N 263.337 2.086 10 20 CECD CN(C)c1ccc([C@H](CNC2CCOCC2)N(C)C)cc1 898449399 DOCZKEKJBUTNBK-KRWDZBQOSA-N 291.439 2.124 10 20 CECD Cc1cc(O)c(CNCCO[C@H]2CCOC2)cc1Cl 897201730 MDUJWJFMUGDWQR-LBPRGKRZSA-N 285.771 2.249 10 20 CECD COc1ccc(CN2CCO[C@@H](C(C)C)C2)c(O)c1OC 893403533 TXMYMULHGGJZSF-CQSZACIVSA-N 295.379 2.266 10 20 CECD COc1ccc(CNCC2(SC)CC2)c(O)c1OC 894105735 DXHVNLCBINOOGM-UHFFFAOYSA-N 283.393 2.395 10 20 CECD C[C@@H](CNC(=O)Nc1ccc(N)cc1)CN1CCCC1 62070012 QWMSLDJKAHFHCS-LBPRGKRZSA-N 276.384 2.122 10 20 CECD CC(C)CN1CC(=O)N[C@@H]1c1ccc(N2CCCC2)cc1 1337564303 QCCKSNOFYFFILY-KRWDZBQOSA-N 287.407 2.373 10 20 CECD CC1(NCc2ccc(N3CCC(O)CC3)cc2)CC1 1336742359 JZRRVMCAKOYLCL-UHFFFAOYSA-N 260.381 2.290 10 20 CECD C[C@H](C(=O)O)C1(NCc2ccc3c(c2)CCCO3)CC1 1343428518 ZMFFIGVQSPCDFC-LLVKDONJSA-N 275.348 2.355 10 20 CECD COC(=O)CCN(Cc1ccc(N)cc1)CC(C)C 1356082920 HSFANVVNRTTWEQ-UHFFFAOYSA-N 264.369 2.290 10 20 CECD Cc1c(C(=O)O)cc(CNCc2c(O)cccc2F)n1C 1599997108 QRCIVZDYTAAEJQ-UHFFFAOYSA-N 292.310 2.166 10 20 CECD Nc1ccc(CCNC(=O)C2[C@@H]3[C@@H]4CC[C@H](C4)[C@@H]23)cc1 152547901 TVEQSYVZAXUBSE-QHSBEEBCSA-N 270.376 2.220 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCO[C@@H](C3CC3)C2)c(O)c1O 157083691 ZBDCVCQVWUDBSW-WCQYABFASA-N 291.347 2.094 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(=O)OC(C)(C)C)c1 151758301 KXCRHPSLOVOJII-SNVBAGLBSA-N 281.352 2.393 10 20 CECD Cc1cccc(CN[C@H](C)c2nnc3n2CCC3)c1O 165016695 FJYAKHDIOABFEU-LLVKDONJSA-N 272.352 2.089 10 20 CECD CCCN(Cc1cnn(C)c1)c1ccc(CN)cc1 50539213 PXHAJHWJEHVYTF-UHFFFAOYSA-N 258.369 2.295 10 20 CECD CCCN(CC(=O)N(C)C1CC1)Cc1ccccc1O 112979390 KRMHAVUAJJPHMV-UHFFFAOYSA-N 276.380 2.225 10 20 CECD O=C(CN1CCCc2cc(OC(F)F)ccc21)NC1CC1 65597013 SQFURQCBRKLKAM-UHFFFAOYSA-N 296.317 2.319 10 20 CECD COc1ccc(N2CCCN(Cc3ncc[nH]3)CC2)cc1 111204441 GBMCZCXIPOOENM-UHFFFAOYSA-N 286.379 2.131 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1CC[C@@H](O)C1 128085482 SDHOORRBDVREIC-SECBINFHSA-N 262.136 2.266 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)C[C@H]1CCCCO1 189426241 AGJYMHWOABFYLD-CYBMUJFWSA-N 299.392 2.265 10 20 CECD CN(C(=O)CN1CCCCCCC1=O)c1ccc(N)cc1 37273983 REFIVKKLSOZONW-UHFFFAOYSA-N 289.379 2.024 10 20 CECD COc1ccc(N2CCN(C[C@@H]3CCCO3)CC2)cc1F 84867034 DGNIQACLFMZUHJ-AWEZNQCLSA-N 294.370 2.135 10 20 CECD Cc1cc(NS(=O)(=O)c2cnn(C(C)C)c2)ccc1O 136492883 IPCNSWFJPSVBDB-UHFFFAOYSA-N 295.364 2.279 10 20 CECD CCOC(=O)C[C@H]1CCCN1Cc1cccc(OC)c1O 130530702 RVOCVSGAUQISAZ-CYBMUJFWSA-N 293.363 2.318 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CCN1 88058650 KYANWGKAFGISSF-MRVPVSSYSA-N 275.179 2.493 10 20 CECD COc1cccc(CN2CCOC3(CCC3)C2)c1O 93640416 SGRQMPBIWDNOJE-UHFFFAOYSA-N 263.337 2.156 10 20 CECD Cc1cc(C(=O)NC[C@@H](C)O)c(C)n1-c1ccccc1 97178960 KRACGDIYXHVJEP-GFCCVEGCSA-N 272.348 2.205 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NCC12CC(CO1)C2 528234690 LXZFYZBAVWRHGA-UHFFFAOYSA-N 296.754 2.024 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)OC[C@H]2C)c1O 247053735 VHLLDWGBZOCDJC-VXGBXAGGSA-N 265.353 2.318 10 20 CECD Cc1nc(C(=O)NCc2ccc3c(c2)CCCN3C)c[nH]1 264886015 UNBCVYAMUJJQNU-UHFFFAOYSA-N 284.363 2.031 10 20 CECD Cc1noc(CCCNCc2c(O)cccc2Cl)n1 264996317 YGRCVMNVNVDHQR-UHFFFAOYSA-N 281.743 2.459 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNC[C@H]2CCSC2)c1 278520298 QAISQTKRNNMAML-SECBINFHSA-N 268.338 2.143 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](C)[S@@](=O)CC2)c1 277395165 GPEBYGUWFZVGNC-SGTLLEGYSA-N 267.394 2.044 10 20 CECD CN(C)c1ccc(CN2CCOC[C@H]2[C@H]2CCCO2)cc1 367604466 UCEMKHZJARSYAQ-DLBZAZTESA-N 290.407 2.132 10 20 CECD C[C@@H](O)CCCN[C@H](C)c1ccc(N2CCOCC2)cc1 278876900 SFRBBHOMJYDPDM-HUUCEWRRSA-N 292.423 2.335 10 20 CECD CCOc1ccc(O)c(CNCC2([S@](C)=O)CCC2)c1 280599185 JEFCUFNVABEGFT-FQEVSTJZSA-N 297.420 2.182 10 20 CECD C[C@@H](NC(=O)c1cn(C(C)(C)C)nn1)c1ccccc1O 827946322 DIUXHOASUUJDKT-SNVBAGLBSA-N 288.351 2.230 10 20 CECD CC1(C)CCN(C(=O)c2c(F)ccc(O)c2O)CC1 825693859 KZGQGYYMGQGJQQ-UHFFFAOYSA-N 267.300 2.499 10 20 CECD COc1ncc(/C=C/C(=O)N2CCc3ccc(F)cc32)cn1 493255243 NJEOTOXUIZJJMQ-GORDUTHDSA-N 299.305 2.227 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](CCCO)C2)c1 825339080 ZXPRJESDIMRWEI-CYBMUJFWSA-N 279.380 2.385 10 20 CECD CCN(C)c1ccc([C@H](C)NCCCON)cc1 902417166 GNSOHOYUKFGPGG-LBPRGKRZSA-N 251.374 2.074 10 20 CECD C[C@H]1C[C@H](CCNC(=O)c2c(F)ccc(O)c2O)CCO1 828292758 GZZHDQNEEPUFOF-VHSXEESVSA-N 297.326 2.172 10 20 CECD CCn1ccnc1[C@@H](C)NC(=O)NCc1ccccc1O 836628643 UECSIOYZAWDGIE-LLVKDONJSA-N 288.351 2.169 10 20 CECD O=C(C[C@H]1CCOC1)NCCCSc1nccs1 739730348 FDLIEHVBLROCMI-SNVBAGLBSA-N 286.422 2.168 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C)[C@@H](C(=O)O)C2)cc1C 832899481 OIIPGVAGBLLPGV-YPMHNXCESA-N 263.337 2.162 10 20 CECD CC[C@H](C)C[C@H](NCc1ccccc1O)C(=O)O 901679356 CXQDNRJPUIKJGB-JQWIXIFHSA-N 251.326 2.371 10 20 CECD O=C1CC[C@@H]2[C@H]1[C@@H]2C(=O)NCc1ccc(N2CCCC2)cc1 906110762 HCPCCXGKIPCXRI-DJIMGWMZSA-N 298.386 2.128 10 20 CECD Nc1ccc(CC(=O)Nc2cc([C@H]3CCCO3)[nH]n2)cc1 832135319 PSCAXBPTAVZBDV-CYBMUJFWSA-N 286.335 2.025 10 20 CECD CN(Cc1cc(O)nc(C2CC2)n1)Cc1ccccc1O 838896418 TVNZFJHALIEALU-UHFFFAOYSA-N 285.347 2.397 10 20 CECD CC[C@@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841011926 XATXSBBURXODFY-RISCZKNCSA-N 289.379 2.292 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@@H](C)CCN1 844186648 MGOXMMIYTQOJIP-LRDDRELGSA-N 289.423 2.065 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](C(=O)O)C2)cc1 840995594 WZVBTRBJWXDQQS-CQSZACIVSA-N 276.380 2.439 10 20 CECD CC(C)SCCNC(=O)NCCc1ccc(N)cc1 841906187 MJAWWCJYTBLBQC-UHFFFAOYSA-N 281.425 2.252 10 20 CECD Oc1ccc(Cl)cc1CN[C@@H]1CC12CCNCC2 841078741 JPMROXMIXAZOQP-CYBMUJFWSA-N 266.772 2.277 10 20 CECD CNC[C@@H]1CCCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 843054999 CFMCDWQKXWLAIH-NSHDSACASA-N 299.758 2.138 10 20 CECD COc1ccc(CN[C@H]2CC=C(C(=O)O)C2)cc1C 853040433 XKRUNNTYPJNEBC-ZDUSSCGKSA-N 261.321 2.267 10 20 CECD Cc1ccc(N[C@H](C)Cc2ccc(O)c(O)c2)nn1 853474127 WISIZDMMWQPPCO-SNVBAGLBSA-N 259.309 2.239 10 20 CECD CN(C)c1ccc(CN(C)c2ncnc3c2ncn3C)cc1 750530522 MDSJNKAEELVERS-UHFFFAOYSA-N 296.378 2.066 10 20 CECD CCCN1CC[C@@H](NC(=O)N[C@H](C)c2ccccc2O)C1 868784584 QDHOPNGUMIRSFP-CHWSQXEVSA-N 291.395 2.237 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)[C@@H](O)C(F)(F)F)c1 865712132 XEBUDRZUSRFIDP-QPUJVOFHSA-N 293.285 2.192 10 20 CECD CCO[C@@H](C(=O)N(C)Cc1ccccc1O)C1CC1 860047995 OERDNBPJDYSVHZ-CQSZACIVSA-N 263.337 2.166 10 20 CECD CC1CCN(c2ccc(CNCc3ncnn3C)cc2)CC1 877024549 HJIHGZJGRSHMNO-UHFFFAOYSA-N 299.422 2.341 10 20 CECD CCOC(=O)N[C@@H](C(=O)N(C)c1ccc(N)cc1)C(C)C 877080437 IVZSSASFGHXAED-CYBMUJFWSA-N 293.367 2.002 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C12CCCN1CCC2 1118335409 XRHORZYBCQEKBB-UHFFFAOYSA-N 294.782 2.290 10 20 CECD CCN(C)c1ccc(CN2CC[C@H]([C@@H](C)O)C2)cc1 773834895 VJPHDZQXKIQPIY-HIFRSBDPSA-N 262.397 2.345 10 20 CECD CCN(C)c1ccc(CN2CCC(NC(C)=O)CC2)cc1 773756048 QAZHKGRLBNZJIQ-UHFFFAOYSA-N 289.423 2.243 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(C(F)(F)F)n[nH]1 774042359 AZPKLHQCOOHHNY-UHFFFAOYSA-N 299.252 2.406 10 20 CECD Cc1ccc(CN2CCNC(=O)[C@H]2CC(C)C)c(O)c1 877461360 DWWVKNMYAALYPL-CQSZACIVSA-N 276.380 2.047 10 20 CECD Cc1cc(N(C)C)ccc1CN1C(=O)N[C@@H](C(C)C)C1=O 777655542 KTWPJMRAODVKJC-AWEZNQCLSA-N 289.379 2.137 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCCN1C)c1ccc(N(C)C)cc1 775402507 DUDLSUAQDJCDGF-CZUORRHYSA-N 289.423 2.414 10 20 CECD C[C@H](NC(=O)N(C)CC[C@@H](C)O)c1ccc(N(C)C)cc1 776250283 UBDUUFYPHTWCOJ-OLZOCXBDSA-N 293.411 2.226 10 20 CECD COC(=O)N1CCC(N[C@H](C)c2c(O)cccc2F)CC1 886510989 FKNNDLOYOGVPEF-SNVBAGLBSA-N 296.342 2.413 10 20 CECD Cc1nccn1CCNCc1c(O)cccc1Cl 385279894 RSEIRWAFYNEFEA-UHFFFAOYSA-N 265.744 2.340 10 20 CECD O=C(NCCc1ccccc1F)c1c(F)ccc(O)c1O 789944201 NHCCMUNAZDEGNW-UHFFFAOYSA-N 293.269 2.349 10 20 CECD Cc1nc([C@@H]2CCN(Cc3c(O)cccc3Cl)C2)n[nH]1 895008364 WCWBIKWMJMDNAL-SNVBAGLBSA-N 292.770 2.462 10 20 CECD COc1cc(C)cc(CNc2cnn(CCF)c2)c1O 895392027 JOSQXGUIHJXSKQ-UHFFFAOYSA-N 279.315 2.487 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCCN(C)C2)c1O 894254025 LBKKIWMTYVEZME-ZDUSSCGKSA-N 278.396 2.141 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1ccc(C)cc1O 186030268 JRNQKXLOSYITFV-RYUDHWBXSA-N 285.409 2.174 10 20 CECD C[C@@H]1N(Cc2cc3c(cc2O)OCO3)CCOC1(C)C 687954738 SMOGYNFKMAYUSU-JTQLQIEISA-N 279.336 2.120 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCCC12OCCO2 708393842 KFVYHISKMMYICF-GFCCVEGCSA-N 285.290 2.056 10 20 CECD COc1ccc(CNCc2c(C)nn(C)c2Cl)c(O)c1 793388080 KZYBIXMQUGJADI-UHFFFAOYSA-N 295.770 2.386 10 20 CECD Oc1cc(Br)ccc1CNCCc1cn[nH]c1 691489559 RUCGTIUISHFVOR-UHFFFAOYSA-N 296.168 2.210 10 20 CECD Oc1cc(Br)ccc1CNC[C@H]1CCCO1 691430885 UMNNKHHMFLZRSV-LLVKDONJSA-N 286.169 2.423 10 20 CECD C[C@@H]1CN(Cc2ccc(Br)cc2O)CCO1 691738315 VUHZUPQMSIXHJN-SECBINFHSA-N 286.169 2.375 10 20 CECD CC(C)(C)NCC(=O)NCCCSc1nccs1 1318553382 WJDSAAPYAYWRAR-UHFFFAOYSA-N 287.454 2.130 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@H]1CO[C@H](C)C1 1326784049 PYGDCPFLRSJVNF-TZMCWYRMSA-N 291.395 2.038 10 20 CECD C/C=C/C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1333100174 KJCDBCNFUMJVNN-HWKANZROSA-N 274.364 2.310 10 20 CECD CC(C)CN1CCC[C@@H]1C(=O)NCCc1ccc(N)cc1 1339851865 BQRKLUKHBBHLLX-MRXNPFEDSA-N 289.423 2.048 10 20 CECD C[C@H](N)C1CCN(Cc2ccc(N(C)C)cc2)CC1 104134096 DWHIAUGYAWWIDS-ZDUSSCGKSA-N 261.413 2.312 10 20 CECD c1cc2c(cc1CN[C@@H]1CCN3CCC[C@@H]3C1)CCO2 108098110 RUIHHLKIMKYEFW-HZPDHXFCSA-N 272.392 2.338 10 20 CECD Cn1ccnc1[C@@H]1N(C(=O)c2cc(O)cs2)CC1(C)C 1350424652 XKHALUKJYBKYLC-NSHDSACASA-N 291.376 2.411 10 20 CECD CCOc1cccc(CNCCOCC2CC2)c1O 224529930 QUHXQBGOYDUEIQ-UHFFFAOYSA-N 265.353 2.307 10 20 CECD C[C@](CC(=O)O)(NCc1ccc(N)cc1)c1ccncc1 1604090432 MUTRTBGSZUMDGL-MRXNPFEDSA-N 285.347 2.144 10 20 CECD Cc1conc1CSc1ncc(C(=O)O)s1 1600645421 LXYVKTYNGYGRBG-UHFFFAOYSA-N 256.308 2.430 10 20 CECD CC[C@H](N[C@@H](C)c1cc(C(=O)O)ccc1O)C(C)(C)O 1605089921 NXOOIFYFIVUMLE-ZANVPECISA-N 281.352 2.291 10 20 CECD CCC(CC)CS(=O)(=O)NCc1ccc(N)cc1 1577069619 LOAZEFSNGNIPCM-UHFFFAOYSA-N 270.398 2.124 10 20 CECD CC[C@@H](C)OCC(=O)NCc1ccc(N(C)C)cc1 151956203 LPPHUIDCJLZFKO-GFCCVEGCSA-N 264.369 2.184 10 20 CECD COC[C@H](C)CNC(=O)N[C@H](C)c1ccccc1O 868213670 MKYGCZZWVOQUAA-GHMZBOCLSA-N 266.341 2.035 10 20 CECD C[C@@H](Cn1cccn1)N[C@@H](C)c1ccc(F)cc1O 62747592 FGFBPZVJKQFFFI-QWRGUYRKSA-N 263.316 2.467 10 20 CECD CCn1cc(CN[C@H](C)c2ccc(N(C)C)cc2)nn1 404466142 MIDDDHKDBQYIGJ-GFCCVEGCSA-N 273.384 2.215 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H](F)C1)OCO2 689902335 DFEULUUJJQIZTO-SNVBAGLBSA-N 253.273 2.055 10 20 CECD CN(C)c1ccc(CNCc2nn(C)cc2Cl)cc1 393463891 XXMHFWATQROUMJ-UHFFFAOYSA-N 278.787 2.429 10 20 CECD Cc1cccc(CN2CCNC(=O)[C@H]2c2ccccc2)c1O 179921235 PKNIDQMVAVPXAZ-MRXNPFEDSA-N 296.370 2.374 10 20 CECD COc1ccc(N(C)C[C@H](O)Cn2cccn2)cc1Cl 177074051 JKFRGHAQNCELDG-LBPRGKRZSA-N 295.770 2.042 10 20 CECD CCCOc1ccc(CNC[C@](C)(O)CC)c(O)c1 111384886 CNZQYCWUYQMFCK-OAHLLOKOSA-N 267.369 2.432 10 20 CECD Nc1ccc(CN2CCN(C(=O)c3ccccc3)CC2)cc1 20398354 VMIOCHOIQAZXIC-UHFFFAOYSA-N 295.386 2.227 10 20 CECD COc1cc(C(=O)NCc2ccc(O)c(O)c2)ccc1F 182526401 ALXPZIONLQGHAE-UHFFFAOYSA-N 291.278 2.176 10 20 CECD CC(C)C[C@@H](CNCc1cc2c(cc1O)OCO2)N(C)C 42879585 FQGFQURJMMAAGU-ZDUSSCGKSA-N 294.395 2.187 10 20 CECD Cc1c(CN[C@@H](C)C2CNC2)n(C)c2ccccc12 423086767 NZSLPZGLBNTMTE-LBPRGKRZSA-N 257.381 2.184 10 20 CECD CNC(=O)CCCN(C)Cc1cc(Cl)ccc1O 93717695 BFPXRHQWJQKHPQ-UHFFFAOYSA-N 270.760 2.004 10 20 CECD Nc1ccc(CCNC(=O)[C@H]2OCCc3ccccc32)cc1 237947382 VBPFOCBLNFUTPJ-KRWDZBQOSA-N 296.370 2.242 10 20 CECD CN(C)c1ccc(CNC(=O)[C@](C)(N)c2ccccc2)cc1 237085549 ZXNBQMZMKGONFE-GOSISDBHSA-N 297.402 2.243 10 20 CECD CCC[C@@H](CNCc1cc2c(cc1O)OCO2)OC 293801330 YGSOKXJAXRDJBL-NSHDSACASA-N 267.325 2.026 10 20 CECD FC(F)Oc1ccc2c(c1)CCCN2CCn1cncn1 368925009 FJBQMAMFTRJWSY-UHFFFAOYSA-N 294.305 2.332 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CC(C)(O)C1 277769238 PPNZCTBSZSCVPN-UHFFFAOYSA-N 290.388 2.362 10 20 CECD Cc1ccc(O)c(CN2CCN(c3nccnc3C)CC2)c1 374210046 JRNUFGMMASJDML-UHFFFAOYSA-N 298.390 2.121 10 20 CECD OC[C@H]1CN(Cc2ccccc2O)CC[C@@H]1C(F)(F)F 289685240 OCCXOPSSMVIIRD-NEPJUHHUSA-N 289.297 2.385 10 20 CECD CO[C@]1(C)CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 280199830 WHPHCLZYXQWBGJ-BIENSFFJSA-N 291.347 2.139 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C)no1 808094375 MIAZIQTZCMFQMC-UHFFFAOYSA-N 281.308 2.104 10 20 CECD COc1cc(Cl)cc(CN(C2CC2)C2COC2)c1O 296171507 XHMSUYKISRVPGU-UHFFFAOYSA-N 283.755 2.417 10 20 CECD CC(C)(C)C(=O)N1CCC[C@H]1C(=O)Nc1ccc(N)cc1 818556521 YKVUJJOPNPZUFM-ZDUSSCGKSA-N 289.379 2.244 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1CC(=O)O 722648955 OFWOOVFTWLVHBD-TZMCWYRMSA-N 276.380 2.295 10 20 CECD Cc1cc(O)c(CNC[C@@H](O)C2CC2)cc1Cl 825916601 QNNRWSBPMMLOQT-CYBMUJFWSA-N 255.745 2.215 10 20 CECD CCCn1cc(C(=O)N[C@H](C)c2ccccc2O)cn1 827941871 ZEFGFDSQXGOZPF-LLVKDONJSA-N 273.336 2.490 10 20 CECD C[C@@H](NCc1ccccc1O)C(=O)NCCc1ccccc1 835072565 HDJRCHRGTPZUFW-CQSZACIVSA-N 298.386 2.229 10 20 CECD COCC1(C)CN(Cc2ccc(N(C)C)c(F)c2)C1 839145753 SYGMTXNHXFBLQR-UHFFFAOYSA-N 266.360 2.360 10 20 CECD O=C(NCCCN[C@@H]1CCc2cccc(O)c21)C1CCC1 834675652 KNQHITIKHIUZRB-CQSZACIVSA-N 288.391 2.276 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1cc2n(n1)CCC2 846217668 KVOAFDYMGLCEJO-UHFFFAOYSA-N 282.391 2.241 10 20 CECD CC1(O)CCC(NCc2cc([N+](=O)[O-])ccc2O)CC1 749297267 VZVPXPAZOILULS-UHFFFAOYSA-N 280.324 2.084 10 20 CECD O=C(CSCc1ccncc1)NCc1ccccc1O 748345435 LEINDDLGHVUEMO-UHFFFAOYSA-N 288.372 2.337 10 20 CECD CCN1C[C@@H](CN[C@@H](C)c2cc(F)cc(F)c2O)CC1=O 846207813 GCOHLAXSCJDYMA-VHSXEESVSA-N 298.333 2.189 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 840951594 ZAMQEHMOVPFLGM-XMTFNYHQSA-N 284.403 2.446 10 20 CECD CCc1cccc(CNCCCN(C)CCOC)c1O 848892618 CDXLBQPNEQBERA-UHFFFAOYSA-N 280.412 2.013 10 20 CECD CC1(C)CCCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841048443 IUTDTRNETYHWBF-UHFFFAOYSA-N 289.379 2.246 10 20 CECD C[C@@H](CCCN)NC(=O)N(C)Cc1ccc(N(C)C)cc1 842000103 UKJKVMFXPVGKLX-ZDUSSCGKSA-N 292.427 2.021 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@@H]1CCCNC1 841043020 MOOGNCAZIMAXHZ-MRVPVSSYSA-N 258.724 2.026 10 20 CECD CC[C@@H](NCc1cc2c(cc1O)OCO2)[C@@H](O)C(C)C 840966530 HLDDNUGZFCLPPX-ABAIWWIYSA-N 281.352 2.006 10 20 CECD CCc1nncn1CCN[C@@H](C)c1ccc(F)cc1O 756619966 JAVRVDXVOZBQGV-JTQLQIEISA-N 278.331 2.036 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCS[C@H]2C)c1 858579711 XTKHBJMCSXOLOJ-CMPLNLGQSA-N 280.393 2.394 10 20 CECD Cc1ccc(C(=O)NCCC(C)(C)F)c(O)c1O 855745954 NIWYWDCKXWATGZ-UHFFFAOYSA-N 255.289 2.274 10 20 CECD C[C@@H]1COCC[C@@H]1CNC(=O)N[C@H](C)c1ccccc1O 868604777 RVFATVVBTJMZOP-JHJVBQTASA-N 292.379 2.425 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N(C1CC1)C1CC1 862852681 PHFMNULATQNKDH-KRXBUXKQSA-N 259.305 2.264 10 20 CECD Cc1ccc(O)c(CNC(=O)CCn2cccc2)c1 862760061 KOZASJZILCDWTM-UHFFFAOYSA-N 258.321 2.209 10 20 CECD CCO[C@@H]1C[C@](CO)(NCc2ccc(C)cc2O)C1(C)C 877459824 LURRYBVYEYLBPF-NVXWUHKLSA-N 293.407 2.356 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@H]1C(=O)NCc1ccccc1O 878559675 NVTVKEGJGNJCJV-BMIGLBTASA-N 285.347 2.098 10 20 CECD CN(C(=O)c1ccc2c(c1)CCNCC2)c1ccc(N)cc1 877077573 NJBOECMKWTZYBO-UHFFFAOYSA-N 295.386 2.234 10 20 CECD CCN(C)c1ccc(CN(C)Cc2nnc3n2CCC3)cc1 773766744 VDWWPLSFOQACRO-UHFFFAOYSA-N 299.422 2.312 10 20 CECD COc1cc(Cl)cc(CN[C@H]2C[C@H](C(=O)O)C2)c1O 874053478 CWEGMFMUKNWJML-GVJMRKKJSA-N 285.727 2.007 10 20 CECD COC(=O)[C@H]1CC12CCN(Cc1cccc(C)c1O)CC2 775701417 UWPSMDVKQNCBFX-CQSZACIVSA-N 289.375 2.476 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](n3cncn3)C2)c1 776774629 MGNOGWFODNLRLI-CQSZACIVSA-N 272.352 2.048 10 20 CECD COC[C@H](C)NCc1cc(F)c(N(C)C)cc1F 883374946 XHNNZMCFLZKYPV-VIFPVBQESA-N 258.312 2.155 10 20 CECD CN(C)c1ccc(CNC(=O)N2C[C@@H]3C[C@H]3C2)cc1F 888004986 DVIVYFYZMQVOFT-RYUDHWBXSA-N 277.343 2.053 10 20 CECD CO[C@]1(C)CCCN(C(=O)c2cc(O)cs2)CC1 795866314 AUZWKVHMTLDMQW-CYBMUJFWSA-N 269.366 2.485 10 20 CECD COc1ccc(CNC(=O)c2ccc(Cl)cn2)c(O)c1 794383966 UQQHKBBIVUZYKG-UHFFFAOYSA-N 292.722 2.379 10 20 CECD C[C@H](NC(=O)NOCC(F)F)c1ccc(N(C)C)cc1 793061641 LQOSUQSMFLKTEW-VIFPVBQESA-N 287.310 2.310 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCCCO 92170789 YZZQJVPBMHMPGY-UHFFFAOYSA-N 278.396 2.264 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCCC[C@H]2C(=O)O)c1 1600465003 MQHGRHJAPYWCMN-QWHCGFSZSA-N 291.347 2.208 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@H]1C(=O)O 1610392391 KZIZBPONGRJAEB-CZUORRHYSA-N 288.391 2.439 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)N(C)c2ccc(N)cc2)[C@@H]1C 226709332 BAPKSDHTGHROAH-DEKYYXRVSA-N 262.353 2.291 10 20 CECD CNC(=O)[C@]1(C)CCN(Cc2cc(Cl)ccc2O)C1 228099092 HFNWUOCMTOHOLG-CQSZACIVSA-N 282.771 2.004 10 20 CECD N[C@H](CC1CCCCC1)C(=O)NCc1c(O)cccc1O 1580124707 XFRWYOJJODMZHC-CYBMUJFWSA-N 292.379 2.012 10 20 CECD COc1cccc(CN2C[C@@H]3CCC[C@]3(C(=O)O)C2)c1O 1599674905 ZCRRRACRISVVCT-LRDDRELGSA-N 291.347 2.088 10 20 CECD CCN1CCc2cc(CN[C@H]3C=C[C@H](C(=O)O)C3)ccc21 1776877506 OZYXJAYEODGHOI-GJZGRUSLSA-N 286.375 2.188 10 20 CECD CC[C@@H](O)CCN[C@@H](C)c1cc(OC)ccc1O 168825869 CGESFSRWTWESEG-WDEREUQCSA-N 253.342 2.212 10 20 CECD C[C@H]1SCCN(C(=O)Cc2ccc(N)cc2)[C@@H]1C 157076705 OWGHZLDLSDXSLB-GHMZBOCLSA-N 264.394 2.164 10 20 CECD Cc1ccc([C@H](C)NCCO[C@H]2CCOC2)c(O)c1 927079116 DMCMBUJNOGEORA-STQMWFEESA-N 265.353 2.157 10 20 CECD C[C@H]1OCC[C@H]1CN1CCOc2cc(N(C)C)ccc21 878319655 YKUVZFFFDBSWPT-OLZOCXBDSA-N 276.380 2.376 10 20 CECD CCCNC(=O)CN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 36780976 YPFZORUNNFCUJL-RYUDHWBXSA-N 276.380 2.365 10 20 CECD COc1cccc(CNCc2ccc(C)cn2)c1O 400948507 STYPNSOKAHNVGP-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Oc1ccc(Br)cc1CNCC12CC(CO1)C2 527790710 SYWSMBIKBXRFOZ-UHFFFAOYSA-N 298.180 2.423 10 20 CECD CCCN(CC)CCNCc1cc(F)cc(F)c1O 708518023 YHIKKBFHDFSTHV-UHFFFAOYSA-N 272.339 2.492 10 20 CECD CN[C@@H](CC(C)(C)C)C(=O)N(C)Cc1ccccc1O 387565001 ZFWMCGPPDULKIS-ZDUSSCGKSA-N 278.396 2.375 10 20 CECD C[C@H]1C[C@H](C(=O)O)CN(Cc2ccc(N(C)C)cc2)C1 399026585 WQOCUBOUZKYWFU-JSGCOSHPSA-N 276.380 2.295 10 20 CECD CN(C)c1ccc(CNc2cc(C(=O)O)ccn2)cc1 820547721 CBWLUVWIVOCIDT-UHFFFAOYSA-N 271.320 2.458 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccc(Cl)n2)c1 114541959 UYHBCDMIDKULEO-UHFFFAOYSA-N 292.722 2.379 10 20 CECD COc1cc(N(C)CC2CCNCC2)cc(OC)c1OC 178974994 RZRZVQCPKINFKN-UHFFFAOYSA-N 294.395 2.148 10 20 CECD CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H](C)O1 181067563 YVIDJNXMBVOHNO-VAFIWLDWSA-N 291.347 2.137 10 20 CECD COc1ccc(O)c(CN(C)CCOCC2CC2)c1 180581617 SRUFSLUUBKZJNK-UHFFFAOYSA-N 265.353 2.259 10 20 CECD O=C(O)c1cccc(CNCc2ccccc2O)c1 236486368 VJPUVQSVJNGPPC-UHFFFAOYSA-N 257.289 2.380 10 20 CECD CNC(=O)c1ccc(NC(=O)Cc2ccc(N)cc2)c(C)c1 315369914 BVGUPUHMTGTBIL-UHFFFAOYSA-N 297.358 2.118 10 20 CECD CCN(CC)c1ccc(CNC(=O)N2CCC2)cc1 193412698 DGGRGWYJLPVSTH-UHFFFAOYSA-N 261.369 2.448 10 20 CECD C[C@H]1OCC[C@@]1(C)NCc1ccc(N2CCOCC2)cc1 230153957 REGPEJJZMRWTHP-RHSMWYFYSA-N 290.407 2.180 10 20 CECD CCCOc1ccc(CN2C[C@@H](O)[C@H](CC)C2)c(O)c1 271279563 LTBPWZQOCBBGRX-MLGOLLRUSA-N 279.380 2.384 10 20 CECD COc1cc(O)c(CN(C)CCCCCO)cc1OC 279325111 CKDXVYINCRCYRX-UHFFFAOYSA-N 283.368 2.004 10 20 CECD C[C@H](N[C@H](C)c1ncn(C)n1)c1ccc(F)c(F)c1O 277003722 ZRMPFPTYKFMOIF-JGVFFNPUSA-N 282.294 2.211 10 20 CECD CN(C)c1ccc(CN2C(=O)N3CCC[C@@]3(C)C2=O)cc1 272045806 GSYAMZHTVGLNJM-INIZCTEOSA-N 287.363 2.069 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cncn2C)cc1 289173961 FMRYSSBZNSTPOK-UHFFFAOYSA-N 286.379 2.196 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2coc(C)n2)c1 801616757 WOVYNQDXPIWXIV-QMMMGPOBSA-N 276.292 2.188 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1cccc(C)c1O 816626148 WYODGWBKTDZKCJ-CYBMUJFWSA-N 278.396 2.343 10 20 CECD CC[C@H](NCc1cc(Cl)c(F)cc1O)[C@@H](C)O 824921315 ITXDHTDWTPMCMQ-HQJQHLMTSA-N 261.724 2.434 10 20 CECD C[C@H](N[C@H](C)CC(=O)O)c1ccc(N2CCOCC2)cc1 820072804 YISAXDVJGKJFRW-OLZOCXBDSA-N 292.379 2.037 10 20 CECD Cc1cc(Cl)cc(CNCCCC(=O)O)c1O 820976310 AJFRJJIVSPWWEI-UHFFFAOYSA-N 257.717 2.308 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1ccc(N(C)C)cc1 828664980 MXQDMBDCVZPQAD-HNNXBMFYSA-N 264.369 2.486 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc(O)cs2)cc1 732258302 RHOCAXUUVVXVOX-UHFFFAOYSA-N 276.361 2.450 10 20 CECD CC1(C)C[C@@H](CNCc2cc3c(cc2O)OCO3)CCO1 835061444 ZYKVRPPEEDIAIV-NSHDSACASA-N 293.363 2.416 10 20 CECD COC(=O)N1CC(N[C@H](C)c2ccc(Cl)cc2O)C1 841751700 OJAPTMLKWPCYHD-MRVPVSSYSA-N 284.743 2.147 10 20 CECD CCOc1ccc(CN[C@@H](C)C[C@@H](C)N)c(O)c1 843129870 SHIIGFHECYENIL-MNOVXSKESA-N 252.358 2.006 10 20 CECD Cc1nn(C)c(Cl)c1CNCCc1ccc(N)cc1 841036336 LKWLDHJNUYAVHE-UHFFFAOYSA-N 278.787 2.296 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H](C)C(=O)O)cc1 846224228 HZRLNLWLCRSWDB-NSHDSACASA-N 250.342 2.048 10 20 CECD C[C@H]1C[C@H](NCCCSc2nccs2)CO1 842684033 VYMLXZNKMXUJOG-UWVGGRQHSA-N 258.412 2.392 10 20 CECD COc1cc(Cl)cc(CN2CCN[C@@H](C(C)C)C2)c1O 843105909 ZFEUCAOGVWFPSA-CYBMUJFWSA-N 298.814 2.484 10 20 CECD CC(C)n1ccc(CC(=O)NCc2ccccc2O)n1 743327814 QIQDVSXRDIZLGW-UHFFFAOYSA-N 273.336 2.029 10 20 CECD CCOc1ccc(CN[C@H]2CCOC[C@@H]2OCC)c(O)c1 759172290 HLMKIUAHHDRULP-HOCLYGCPSA-N 295.379 2.075 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H](N2CCCC2)C1 768900801 JLEVWSDMLQSGSQ-CQSZACIVSA-N 290.407 2.461 10 20 CECD Cc1ccc(O)c(CNC(=O)c2occ3c2CCOC3)c1 862755084 BZNXPDILKQHWAD-UHFFFAOYSA-N 287.315 2.296 10 20 CECD Cc1ccc(O)c(CNC2CCN(CC(C)(C)O)CC2)c1 877652159 CVFBROJABRPELD-UHFFFAOYSA-N 292.423 2.026 10 20 CECD Cc1cccc(O)c1CN(CC(F)F)C[C@H](C)O 877572198 NMZHBMMQGNAJCP-JTQLQIEISA-N 259.296 2.149 10 20 CECD COc1cccc2c1O[C@H](c1cccc(F)c1O)NC2=O 877841813 ANIYVGBAFVCVNL-OAHLLOKOSA-N 289.262 2.361 10 20 CECD CC[C@@H]1C(=O)N(CC)CCN1Cc1ccc(N(C)C)cc1 779218841 UZPNTSLFFLTUKT-MRXNPFEDSA-N 289.423 2.195 10 20 CECD CC[C@H](NCCOC[C@@H]1CCOC1)c1ccccc1O 775503360 GHPDAMJJNXIOBG-HIFRSBDPSA-N 279.380 2.486 10 20 CECD C[C@H](NCC1(N2CCOCC2)CC1)c1c(O)cccc1F 886601357 QLFBVKWWFAZSRL-LBPRGKRZSA-N 294.370 2.047 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cccc(C)c2O)C1 896961261 WHZRYITUCYIPRJ-ZDUSSCGKSA-N 263.337 2.086 10 20 CECD C[C@H](C[S@](C)=O)NCc1ccc(N2CCCC2)cc1 168149702 DJMOGJSPFKJJJI-BFUOFWGJSA-N 280.437 2.143 10 20 CECD CC1=NO[C@H](CNCc2cccc(Cl)c2O)C1 895306199 AVGIYVIQRPPAHY-JTQLQIEISA-N 254.717 2.300 10 20 CECD COc1ccc(CNC(=O)c2cc(C)sn2)c(O)c1 794373918 OQDQVWKCHMXHMX-UHFFFAOYSA-N 278.333 2.096 10 20 CECD CN(Cc1c(O)cccc1Br)C1(CN)CCC1 706861335 LCZFVQQHDMMOKL-UHFFFAOYSA-N 299.212 2.468 10 20 CECD CC[C@@]1(C)COCCN1Cc1cc(OC)ccc1O 708281831 MOAAUQVSCBJQLL-HNNXBMFYSA-N 265.353 2.402 10 20 CECD COc1cccc(O)c1CNCCCn1ccnc1C 725846453 FKPYFESAUWOEGU-UHFFFAOYSA-N 275.352 2.086 10 20 CECD COc1cccc(O)c1CNCC(C)(C)CCCO 771897251 HCBNCBNCBUHCIS-UHFFFAOYSA-N 267.369 2.289 10 20 CECD O=C(c1cc(O)cs1)N1CC(F)(F)C(F)(F)C1 1261741297 JONLQSZFIVADIB-UHFFFAOYSA-N 269.219 2.180 10 20 CECD C[C@@]1(NC(=O)NCc2ccc(N)cc2)CCO[C@H]1C1CC1 1262603757 ULSJGTRTPPBHPW-GOEBONIOSA-N 289.379 2.026 10 20 CECD CN[C@H](C)CCNCc1c(O)ccc(Cl)c1F 1348515591 NVAVNMTVSYISQR-MRVPVSSYSA-N 260.740 2.272 10 20 CECD NC[C@@H](C(=O)NCc1ccc(N)cc1)C1CCCCCC1 1524019440 SCMZZOXVIAEJCR-MRXNPFEDSA-N 289.423 2.430 10 20 CECD CNC[C@H]1CCCN1Cc1cc(Cl)cc(OC)c1O 229104808 PRRKVWWNHXXOPJ-GFCCVEGCSA-N 284.787 2.238 10 20 CECD C[C@@H](Cc1cccc(O)c1)NC(=O)NCc1ccc(N)cc1 1576052138 HNCRXDRVEJZXDI-LBPRGKRZSA-N 299.374 2.405 10 20 CECD C[C@@H](NCCCCC(=O)O)c1cc([N+](=O)[O-])ccc1O 1589128285 NBYKYYGXKMDEMU-SECBINFHSA-N 282.296 2.206 10 20 CECD O=C(O)c1ccnc(N2Cc3cccc(O)c3C2)c1 1595262530 JHWOEGQJVLGUCA-UHFFFAOYSA-N 256.261 2.006 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C)[C@H]2C(=O)O)c1O 1776210720 PFRBHJOEQDCOCH-OQPBUACISA-N 295.310 2.029 10 20 CECD Cc1cc(CN(C)Cc2ccccc2O)nc(C)n1 851840886 KVTIYJRDNXUBDX-UHFFFAOYSA-N 257.337 2.431 10 20 CECD CCOc1cccc(CNCc2cc(C)on2)c1O 44692280 GCNWHWVXPYQENE-UHFFFAOYSA-N 262.309 2.377 10 20 CECD O=C1c2ccccc2C(=O)N1CSc1nccs1 48874755 UQCAIRFGLQNFBA-UHFFFAOYSA-N 276.342 2.489 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@]2(O)CCSC2)c1 185638542 WDXJKCBEJXTYDL-FZMZJTMJSA-N 267.394 2.219 10 20 CECD CCn1cc(CN2CCCc3cc(CN)ccc32)cn1 700899195 NLTCQCQSWQYEDN-UHFFFAOYSA-N 270.380 2.315 10 20 CECD O=C(c1cccc2c1CCN2)N1CCc2ccncc21 1343643705 MVMNLEDFMCHPIB-UHFFFAOYSA-N 265.316 2.253 10 20 CECD Oc1cc2c(cc1CN1CC[C@H]3OCCC[C@@H]3C1)OCO2 129050413 UIPHSDPSGPAAGP-BXUZGUMPSA-N 291.347 2.122 10 20 CECD C[C@H](N[C@H](C)CN1CCCC1=O)c1ccc(N(C)C)cc1 37782524 ZMYGQYWRJQJOJR-KGLIPLIRSA-N 289.423 2.414 10 20 CECD CCOc1cccc(CN[C@@H]2CCSC2)c1O 230705107 OUGAWLJRMNXZSQ-LLVKDONJSA-N 253.367 2.386 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2cc(Cl)ccc2O)C1 93813698 UEGBENAQPXNLES-CQSZACIVSA-N 283.755 2.431 10 20 CECD COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1cc(C)ccc1O 274896523 GAQCAXXALIPWGW-JSGCOSHPSA-N 277.364 2.474 10 20 CECD COc1cccc(CN2C[C@H](C)O[C@@H](C3CC3)C2)c1O 280671169 UFRRUVLAUYDFAW-XHDPSFHLSA-N 277.364 2.400 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)OC 296170964 SJWDRQXXCCZODV-VUPNYRSLSA-N 293.363 2.288 10 20 CECD CC(C)(C)c1ncc(/C=C2/SC(=S)NC2=O)cn1 806565593 PLRKSEWOEGYAOJ-XBXARRHUSA-N 279.390 2.263 10 20 CECD C[C@@H](NC(=O)C(C)(F)F)c1ccc(N2CCOCC2)cc1 808457176 HASQTNKHWVYMGR-LLVKDONJSA-N 298.333 2.356 10 20 CECD C[C@H](O)CNc1ccccc1OC[C@H]1CCCCO1 819426990 QKYCAPBQMDAOOQ-QWHCGFSZSA-N 265.353 2.427 10 20 CECD C[C@@H](NCCC1=CCNCC1)c1ccc(F)cc1O 817984806 AIJPLLNWXSAIOI-LLVKDONJSA-N 264.344 2.492 10 20 CECD CC[C@@H](N[C@@H]1CCNC1)c1cc(Cl)ccc1O 817944641 ITGPZNDRANZWLK-ZYHUDNBSSA-N 254.761 2.448 10 20 CECD OC[C@@H](CC(F)F)NCc1cc(Cl)c(F)cc1O 816591823 OVCVFKKCXTYVTK-SSDOTTSWSA-N 283.677 2.290 10 20 CECD CC[C@@H](NC[C@@H]1CNCCO1)c1cc(Cl)ccc1O 817982992 JHFSTQMAOKGLLS-WCQYABFASA-N 284.787 2.075 10 20 CECD CCCCC[C@H](NC(=O)c1cc(O)cs1)C(=O)O 829326055 BVSRFDCQKNQXCI-VIFPVBQESA-N 271.338 2.217 10 20 CECD Cc1cc(N(C)C)ccc1CN(CC(=O)O)C1CC1 901970616 BJJPLEAEEARPAO-UHFFFAOYSA-N 262.353 2.110 10 20 CECD COc1ccc(O)c(CNCc2cnn3ccccc23)c1 734003532 NGADUWPPNJPGHF-UHFFFAOYSA-N 283.331 2.338 10 20 CECD CN(Cc1ccc(O)cc1)C(=O)c1cc(O)cs1 732271486 YZKCXPYXLMXQED-UHFFFAOYSA-N 263.318 2.432 10 20 CECD CCN(C)c1ccc(CN[C@H](CO)[C@@H]2CCCOC2)cc1 839651775 RDNNLYYSBAYTLI-NVXWUHKLSA-N 292.423 2.020 10 20 CECD CCOc1ccc(CN2CC[C@@]3(CCCN3)C2)c(O)c1 841105666 WTGWWLOZLIJGFX-INIZCTEOSA-N 276.380 2.119 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCS[C@H]2C)c1O 843434868 NWBNYLYYDWKEFW-WCBMZHEXSA-N 298.364 2.293 10 20 CECD CCCn1ncnc1CN1CCCc2cc(CN)ccc21 843350726 UAZXZQOUWQJVTB-UHFFFAOYSA-N 285.395 2.100 10 20 CECD CCc1cccc(CNCCCO[C@H]2CCOC2)c1O 848897150 FLUUGKQBHAHQKA-HNNXBMFYSA-N 279.380 2.240 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1cccc(Cl)c1O 840957210 JQQBVNCDZLTNIL-GFCCVEGCSA-N 283.755 2.477 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](NC)C2)cc1F 843045560 VDFUEQLOZNJKGN-AWEZNQCLSA-N 279.403 2.466 10 20 CECD CCc1cccc(CNCc2nn(CC)nc2C)c1O 848918034 NLUYJEWRECVDRO-UHFFFAOYSA-N 274.368 2.164 10 20 CECD CCc1cccc(CNCCC(=O)Nc2ccccn2)c1O 848896081 ZSQUBMPVJLRTPE-UHFFFAOYSA-N 299.374 2.468 10 20 CECD C[C@H](CCN(C)C)NCc1cc(F)c(N(C)C)cc1F 858116630 UCORGJUQPBVUCO-LLVKDONJSA-N 285.382 2.461 10 20 CECD CN(C)c1ccc(OCC(=O)NCc2ccccc2)cc1 757702701 GCUHULMRDPMWRK-UHFFFAOYSA-N 284.359 2.448 10 20 CECD CCO[C@@H]1CCCC[C@H]1NC(=O)c1cccc(O)c1O 837144597 PBHQNRAHMVCCLS-DGCLKSJQSA-N 279.336 2.175 10 20 CECD COc1cc(Cl)cc(CN(C)CC2(O)CCC2)c1O 761218311 AEWMOMHFMZARAY-UHFFFAOYSA-N 285.771 2.401 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H]2COC[C@@H]2C)c1O 932495595 DEZPXGNVJCWWKD-SDBXPKJASA-N 283.755 2.373 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@@H]1C(=O)N(C)Cc1ccccc1O 878277299 QXSUUOIVUJSTLY-BDJLRTHQSA-N 299.374 2.440 10 20 CECD Cc1nnc(O)c(CNCc2c(O)cccc2Cl)c1C 1116055664 RKYAZBXJCWYGFK-UHFFFAOYSA-N 293.754 2.448 10 20 CECD COC(=O)C1=C(C)O[C@H](CN[C@H](C)c2ccccc2O)C1 879649014 HLROBAHRULPZJD-PWSUYJOCSA-N 291.347 2.279 10 20 CECD COC[C@@H](C)NC(=S)N[C@@H](C)c1ccc(N(C)C)cc1 774248731 HNRIXPDLRGELLP-NEPJUHHUSA-N 295.452 2.313 10 20 CECD COC(=O)[C@H]1C[C@H](C)CCN1Cc1ccc(C)cc1O 877415980 FNZYRKQRPCDCCQ-TZMCWYRMSA-N 277.364 2.474 10 20 CECD COc1ccc2c(c1)CCN2C(=O)/C=C\[C@@H]1CCCNC1 876630789 KUTYWPAGVHMOLO-IRBQFCFKSA-N 286.375 2.140 10 20 CECD CC1(CS(=O)(=O)NCc2ccccc2O)CCC1 881912571 GHULRPSNTJMFGD-UHFFFAOYSA-N 269.366 2.002 10 20 CECD COc1ccc(CN[C@H](C)CC(C)(C)O)c(O)c1OC 894700558 RUHOWLCAYIDZFI-SNVBAGLBSA-N 283.368 2.049 10 20 CECD COc1cc(C)cc(CN[C@H](CCO)C(C)C)c1O 894300106 SRJNCNFIEPWLPP-CYBMUJFWSA-N 267.369 2.206 10 20 CECD CCOc1ccc(CNCCO[C@@H]2CCCCO2)c(O)c1 894798571 GFFSTRGNGPFUTD-MRXNPFEDSA-N 295.379 2.424 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H]1CCCOC1 793512304 BTUCGAXKIBYNHA-AWEZNQCLSA-N 290.407 2.494 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCC[C@@H](C3)C1)[C@H](O)CO2 795679927 ZWHFVHJFZUMMFC-MQIPJXDCSA-N 289.375 2.440 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@H](C)c1cc(F)ccc1O 94617707 JWQITPJMKIVZKH-WDEREUQCSA-N 280.343 2.193 10 20 CECD O=C(O)c1cnc(SCCn2cc(Cl)cn2)s1 1602536988 JLVUPHLOUKIMIN-UHFFFAOYSA-N 289.769 2.484 10 20 CECD O=C(O)[C@@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 1608634240 CPNJYFZBVCSIHE-SSDOTTSWSA-N 273.691 2.091 10 20 CECD CCN(CC)c1ccc(CNCCCOCCO)cc1 227332271 QSZIFIZSNCSLFU-UHFFFAOYSA-N 280.412 2.021 10 20 CECD CCCCNC(=O)CN(C)c1ccc(OCC)cc1 150734310 CYQAFHVDMLWWLH-UHFFFAOYSA-N 264.369 2.438 10 20 CECD Cc1ccc(O)c(CNc2nnc3ccccn23)c1 157153684 MMMULOYUEUCDEL-UHFFFAOYSA-N 254.293 2.355 10 20 CECD CCN(C)C(=O)NCc1ccc(N2CC=CC2)cc1 155696032 XKQRRUIPTKMMBH-UHFFFAOYSA-N 259.353 2.224 10 20 CECD COCCOc1ccc(/C=C2\SC(=S)NC2=O)cc1 575449222 FQWFTSBOBHEYHQ-FLIBITNWSA-N 295.385 2.201 10 20 CECD in-vitro Cc1cccc(CN2CCCC[C@@H]2CS(C)(=O)=O)c1O 824914315 PEJWYBNYCOQCAD-CQSZACIVSA-N 297.420 2.100 10 20 CECD Cc1ccc(C(=O)NCc2ccccc2)c(O)c1O 177658684 IHMQZXMYANGJCW-UHFFFAOYSA-N 257.289 2.336 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](C)S(C)(=O)=O)cc1 697589994 RFCAAFJMUOOOSU-CYBMUJFWSA-N 298.452 2.056 10 20 CECD C[C@@H](NCCN1CC=CCC1)c1cc(F)ccc1O 392256322 YOROFFZPRRLWNB-GFCCVEGCSA-N 264.344 2.444 10 20 CECD C[C@@H](NCC1CC2(C1)OCCO2)c1ccccc1O 927003986 PTOVSWFMZJFEMJ-LLVKDONJSA-N 263.337 2.196 10 20 CECD CCN(CC)c1ccc(CNC[C@@](C)(O)CCOC)cc1 172069068 RJOJJTTWWBUMIX-KRWDZBQOSA-N 294.439 2.410 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2ccncc2)c1 114541052 DAOCZRDOQZYYTL-UHFFFAOYSA-N 286.331 2.045 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CC=CCC2)c1O 175093602 HJSNVYNUPDVNTM-GFCCVEGCSA-N 276.336 2.309 10 20 CECD COCCOC[C@@H]1CCN(Cc2cc(C)c(C)cc2O)C1 173398839 PKDXOELKEWHBKD-OAHLLOKOSA-N 293.407 2.494 10 20 CECD COc1ccc(N(C)Cc2nnnn2C2CC2)cc1Cl 121872723 BZMNUHDKAVAJIB-UHFFFAOYSA-N 293.758 2.306 10 20 CECD CCOc1cccc(CN2C[C@H](C)O[C@H](COC)C2)c1O 188373875 XTTMGMYVGJLJFQ-JSGCOSHPSA-N 295.379 2.027 10 20 CECD CC(C)[C@H](C)NC(=O)CN(C)c1ccc2c(c1)OCO2 121366181 JXJICQPPLBMURY-NSHDSACASA-N 278.352 2.012 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1C(=O)O 235345527 BUESLUCQKLJYOI-LDYMZIIASA-N 269.728 2.198 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCOC2)cc1 194423250 LIEXWHZLUBRKJX-CQSZACIVSA-N 276.380 2.186 10 20 CECD Cc1nscc1C(=O)N(C)Cc1ccccc1O 181149116 MTGRVPALJJVSQR-UHFFFAOYSA-N 262.334 2.429 10 20 CECD C[C@H](NC1CCOCC1)c1cc([N+](=O)[O-])ccc1O 273390361 KOOPBSZQFNBHOY-VIFPVBQESA-N 266.297 2.130 10 20 CECD CC[C@H](N[C@@H](CO)c1cnn(C)c1)c1ccc(C)cc1O 280245551 WGHBTXGVDRNHLL-GJZGRUSLSA-N 289.379 2.208 10 20 CECD Cc1ccc(O)c(CN[C@H]2COc3ccccc3[C@@H]2O)c1 288507097 ILPRUTUVFDXGPK-YOEHRIQHSA-N 285.343 2.285 10 20 CECD CCOC1(C(=O)NCCc2ccc(O)c(O)c2)CCCC1 286645233 BTBPGLKTPUSNGI-UHFFFAOYSA-N 293.363 2.106 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H](O)CC2)c1O 294132918 UPNHAGDTXXOAHJ-LBPRGKRZSA-N 285.771 2.401 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccccc2O)[C@H]1SC 298229939 BFEQGBFOIFCXHF-IACUBPJLSA-N 267.394 2.391 10 20 CECD COCC[C@H]1COCCN1Cc1ccc(N(C)C)c(F)c1 291363686 YQWHPHBFWDIXAG-AWEZNQCLSA-N 296.386 2.129 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cnc(S)[nH]1 800691494 XLGMSCZPJAOAST-UHFFFAOYSA-N 290.392 2.003 10 20 CECD C[C@H]1C[C@H](N[C@H]2CCCNC2)c2c(O)ccc(F)c21 817965957 XMPJMWMKSLIYNG-NHCYSSNCSA-N 264.344 2.421 10 20 CECD CCN(CC)C(=O)C[C@@H](C)NCCc1ccc(N)cc1 817955628 DDAPIGWWGRLCPG-CYBMUJFWSA-N 277.412 2.048 10 20 CECD c1cc(N2CCOCC2)ccc1CN1CCCc2n[nH]cc21 811497934 ZJRLCYHBTQSSMD-UHFFFAOYSA-N 298.390 2.199 10 20 CECD CC[C@@H](NCc1cccc(Br)c1O)C(=O)O 818316652 CLSLNWGDJSZVQZ-SECBINFHSA-N 288.141 2.108 10 20 CECD CCOc1ccc(CNCCCn2ccnc2C)c(O)c1 725846684 KYVBXDSNARBFCS-UHFFFAOYSA-N 289.379 2.476 10 20 CECD CCOC1CN(Cc2ccc(Br)cc2O)C1 826114057 SVXGCPPSFXKHMS-UHFFFAOYSA-N 286.169 2.375 10 20 CECD C/C(=C(\F)C(=O)NCc1ccc(O)c(O)c1)C1CC1 901131394 KIVACHRDYHGBBX-MDWZMJQESA-N 265.284 2.368 10 20 CECD CCOC1(C)CCN(C(=O)c2cc(O)cs2)CC1 832410862 WXZVDCPDBCPFEX-UHFFFAOYSA-N 269.366 2.485 10 20 CECD O=C(NCc1ccc(O)c(F)c1)NCc1ccccc1O 738992490 VRNJGZFNCXVIBW-UHFFFAOYSA-N 290.294 2.236 10 20 CECD C[C@H](OC(=O)c1cc(O)cs1)C(=O)NC1CCCC1 731912286 UATRQCWIPCMXEB-QMMMGPOBSA-N 283.349 2.058 10 20 CECD CC(C)(C(=O)O)[C@H]1CCCN(C(=O)c2cc(O)cs2)C1 833417773 FOFAOAQOYSEJFV-VIFPVBQESA-N 297.376 2.417 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cn[nH]c1 839915719 JMTZBYTXQQCBTN-GFCCVEGCSA-N 286.379 2.145 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)N(C)Cc1ccccc1O 838726408 GIRUYSKEILUPCP-UKRRQHHQSA-N 292.379 2.491 10 20 CECD C/C=C(/C)C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 911360024 LKNNSOHHPQWTJX-OQFOIZHKSA-N 297.738 2.425 10 20 CECD Nc1ccc(NC(=O)N2CC[C@@H](Oc3ccncc3)C2)cc1 841297015 KPMCSWYUONYGKF-OAHLLOKOSA-N 298.346 2.349 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](O)[C@H](C)C1 840938205 LTLUDTHOGDUNBF-CJNGLKHVSA-N 262.397 2.264 10 20 CECD COc1ccc(O)c(CNS(=O)(=O)C2CCCCC2)c1 742301691 VSRADDFKSXMJIF-UHFFFAOYSA-N 299.392 2.153 10 20 CECD Cc1nn(Cc2cn(-c3ccc(N)cc3)nn2)c(C)c1C 849134773 OPIOELYHUVMNHW-UHFFFAOYSA-N 282.351 2.020 10 20 CECD CCN(CC)c1ccc(CN2CCNCC2)cc1F 843043937 DEGVIOULJQZBIG-UHFFFAOYSA-N 265.376 2.077 10 20 CECD C[C@@H]1C[C@H](NCc2cc(Cl)cc(F)c2O)CO1 843432998 TUZPDRZHDCLMPA-XCBNKYQSSA-N 259.708 2.452 10 20 CECD Cc1c(C(=O)NCc2ccc(O)cc2O)cnn1C(C)C 910948982 CSHFEDJIFLVNMH-UHFFFAOYSA-N 289.335 2.114 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cc(OC)no2)c1 851902406 QIKDAATZXHCRKP-VIFPVBQESA-N 278.308 2.248 10 20 CECD C[C@@H](NC[C@@H]1CCCN(C)C1)c1cc([N+](=O)[O-])ccc1O 756555115 RGWZWFNTZXZMAK-NEPJUHHUSA-N 293.367 2.293 10 20 CECD COCC1(NC(=O)c2cc(O)cs2)CCCC1 855217967 NHXZANHKDVTYQT-UHFFFAOYSA-N 255.339 2.143 10 20 CECD Cc1ccnn1CC(=O)NCc1ccc(N2CCCC2)cc1 858452003 GSDKLANDSCYJOJ-UHFFFAOYSA-N 298.390 2.108 10 20 CECD Cc1cnc(CN2CCOc3cc(N(C)C)ccc32)[nH]1 862327007 PHOQOFRNHJLPDC-UHFFFAOYSA-N 272.352 2.183 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccc(N(C)C)nc2)c1 862760408 RVPVXYBAHGNJAH-UHFFFAOYSA-N 285.347 2.092 10 20 CECD CCOc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C)c(O)c1 769482143 XDACQTCOJDBNLI-CABCVRRESA-N 290.407 2.459 10 20 CECD COc1cc(CN2CCCOC[C@@H]2C)c(O)cc1C 768463637 VFYNOOTVVLYMGK-LBPRGKRZSA-N 265.353 2.320 10 20 CECD CC(C)(C(=O)NCc1ccccc1O)c1cccnc1 778390230 YTFVCZXDTKSKLL-UHFFFAOYSA-N 270.332 2.381 10 20 CECD CCn1nncc1CNCc1ccc(N2CCCC2)cc1 1118883946 OGMCJGDGBLVBRZ-UHFFFAOYSA-N 285.395 2.188 10 20 CECD Cc1ccc(CN2C[C@@H](C)O[C@]3(CCOC3)C2)c(O)c1 877491997 DSZUPFDFAZHKHB-CZUORRHYSA-N 277.364 2.080 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@H]1C(=O)NCCc1ccc(N)cc1 884028519 JDGRRFWDBGQXOG-ZBEGNZNMSA-N 298.390 2.017 10 20 CECD CC(C)(NCc1cc(F)cc(F)c1O)C(=O)N1CCCC1 883109174 HODXDCUJWWVYSU-UHFFFAOYSA-N 298.333 2.161 10 20 CECD C[C@H](N[C@H](C)CO[C@H]1CCOC1)c1c(O)cccc1F 886538917 PUJCNDSIRQVFAT-WOPDTQHZSA-N 283.343 2.376 10 20 CECD Cc1ccc(C(=O)O[C@@H](C)c2cnccn2)c(O)c1O 783343647 IJKSYKXCXXPTQY-VIFPVBQESA-N 274.276 2.114 10 20 CECD CC[C@H](O)CNCc1c(O)cccc1Br 706852270 ZHCDLTZQORKZBM-QMMMGPOBSA-N 274.158 2.015 10 20 CECD Cn1cncc1CNCc1c(O)cccc1Br 706842081 KAFIUGPZJIJVCM-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CO[C@H](C)CNCc1cccc(Br)c1O 191202265 UOUKESUWWMSXGA-MRVPVSSYSA-N 274.158 2.279 10 20 CECD C[C@@H]1OCCN(Cc2cc(F)cc(F)c2O)[C@H]1C 708399236 KIZUTVOZORYKIP-IUCAKERBSA-N 257.280 2.280 10 20 CECD CCc1cccc(CN2CCCC[C@@H]2C(=O)NC)c1O 692092222 JKWVGTMJJUFBCX-CQSZACIVSA-N 276.380 2.055 10 20 CECD CN(C)c1ccc(CN2CC[C@@H]3CC[C@@]32C(=O)O)cc1 1777039699 UTIIHSGQXHHYFV-BBRMVZONSA-N 274.364 2.192 10 20 CECD O=C(/C=C/c1ccccc1)NCc1ccc(O)c(O)c1 158863930 ROTXSPHVBSMVQP-VQHVLOKHSA-N 269.300 2.427 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccncc2F)c1 156229697 LDKUSVYTWPVERA-SECBINFHSA-N 290.294 2.426 10 20 CECD COc1cccc(CNc2ccc(N(C)C)nc2)c1O 36989037 XGGJTKJCCOUESA-UHFFFAOYSA-N 273.336 2.474 10 20 CECD OC[C@H](NCc1c(O)cccc1Br)C1CC1 858137934 ISUXHXAYAAQYTQ-NSHDSACASA-N 286.169 2.015 10 20 CECD C[C@]1(C(=O)O)CCCN1Cc1ccc(Cl)cc1O 1589187574 VYDJEHTZIWQGAD-CYBMUJFWSA-N 269.728 2.485 10 20 CECD CCOc1ccc(O)c(CN2CCCO[C@H](C)C2)c1 179400743 QNCSQZFILJMLMQ-GFCCVEGCSA-N 265.353 2.402 10 20 CECD CN(C)c1ccc(CNC(=O)C(F)(F)C(F)F)cc1F 176268156 POSFOQOCLNXCQF-UHFFFAOYSA-N 296.239 2.408 10 20 CECD CC(C)NC(=O)[C@H](C)NCc1cc(Cl)ccc1O 228931460 LCFQJINNMZVEJG-VIFPVBQESA-N 270.760 2.048 10 20 CECD CON(C)C(=O)c1cc(C)n(-c2ccccn2)c1C 73744573 ZZKDVBUXFPKCOA-UHFFFAOYSA-N 259.309 2.123 10 20 CECD Oc1ccccc1CNC[C@@H](O)COc1ccc(F)cc1 134227664 FJQLWOMGRIGMQI-CQSZACIVSA-N 291.322 2.061 10 20 CECD C[C@H](NCCN(C)C)c1ccc(Br)cc1O 287081444 ORIKQMZJKZPBJC-VIFPVBQESA-N 287.201 2.367 10 20 CECD CCN(CC)CC(=O)NCc1ccc(N(CC)CC)cc1 194636890 RSXYHQPMHHSONI-UHFFFAOYSA-N 291.439 2.491 10 20 CECD Cc1noc(C)c1C[C@H](C)NC(=O)Cc1ccc(N)cc1 237517757 REGRCRBWJLMVDE-JTQLQIEISA-N 287.363 2.164 10 20 CECD CN[C@@H](C)CNC(=O)c1cc(C)n(-c2ccccc2)c1C 261872097 ZUCJLHKEPHNXQQ-LBPRGKRZSA-N 285.391 2.432 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1cncnc1 274306187 CUZKBQZGFRXZKL-UHFFFAOYSA-N 298.346 2.383 10 20 CECD CC(=O)C(=O)COc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 288290345 BIPFOKGNFROPRC-UHFFFAOYSA-N 291.181 2.151 10 20 CECD COC[C@@H]1CCCCN(C(=O)c2ccc(C)c(O)c2O)C1 375099845 LLTDNMBSXKFUEE-GFCCVEGCSA-N 293.363 2.295 10 20 CECD C[C@H](CF)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 288875824 DABNAUDOVJBEAG-WXJAXGNASA-N 292.354 2.011 10 20 CECD COC[C@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@H](C)O1 294699754 UJUMXWKMWZJUPD-GOEBONIOSA-N 292.423 2.297 10 20 CECD C[C@H](NCCCNC1CC1)c1cc([N+](=O)[O-])ccc1O 817984264 PJOUPVNBJDCPSF-JTQLQIEISA-N 279.340 2.093 10 20 CECD CCCON1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 819179641 FXTNTMXQRMDLSO-UHFFFAOYSA-N 298.726 2.151 10 20 CECD C[C@H]1C[C@@H](NC[C@@H]2C[C@H](F)CN2)c2c(O)ccc(F)c21 817977067 ZXVCZBRIISPTSD-QFOLPQNPSA-N 282.334 2.369 10 20 CECD Cc1ccc(O)c(CNC(=O)Cn2ccnc2C(C)C)c1 824904637 UNVFJGZZJBZDEG-UHFFFAOYSA-N 287.363 2.337 10 20 CECD COC[C@@H]1CN(Cc2cc(Cl)c(C)cc2O)CCO1 824835926 CSDVTPLSVNNDRU-LBPRGKRZSA-N 285.771 2.201 10 20 CECD C[C@@H](NC(=O)c1cc2n(n1)CCC2)c1ccccc1O 827952323 NUCHLAMVFVGBIP-SNVBAGLBSA-N 271.320 2.026 10 20 CECD O=C(NCc1ccccc1O)c1ccc2c(c1)CCNCC2 828015283 DBQKOBARCQTNQP-UHFFFAOYSA-N 296.370 2.010 10 20 CECD COCC(COC)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 834894083 YYJMFGCWXPDMHJ-CABZTGNLSA-N 283.343 2.331 10 20 CECD CC[C@H](OC)C(=O)NCc1ccc(N(C)C)cc1C 734405046 RQGCVVWJBIVJPI-AWEZNQCLSA-N 264.369 2.102 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ncoc1C 734406303 QSLKOFOSOOUEDB-UHFFFAOYSA-N 273.336 2.287 10 20 CECD O=C(c1cc(O)cs1)N1C[C@@]2(CCCO2)[C@H]1C1CC1 832926972 JQYSRXKAXDCMBC-OCCSQVGLSA-N 279.361 2.237 10 20 CECD O=C(O)C[C@H](NC(=O)c1cc(O)cs1)c1ccccc1 738564563 ANFVRHQZMGWCAH-NSHDSACASA-N 291.328 2.400 10 20 CECD COc1cccc([C@@H](C)N[C@H](CO)CC(F)(F)F)c1O 846157896 PFOWYRPGLCWBLQ-BDAKNGLRSA-N 293.285 2.365 10 20 CECD CC[C@@H](C(=O)OC)N(C)CCN(C)c1ccc(OC)cc1 844399457 KDPCRJLBUAINLQ-HNNXBMFYSA-N 294.395 2.015 10 20 CECD CO[C@](C)(C1CC1)[C@H](C)NC(=O)c1ccc(C)c(O)c1O 840510727 QBRHEOCWILUZMS-QFYYESIMSA-N 293.363 2.340 10 20 CECD CCCN(C)CC(=O)NCc1cc(Cl)ccc1O 846475769 IVPREAQIIXLHNZ-UHFFFAOYSA-N 270.760 2.004 10 20 CECD Cc1ncccc1CNC[C@@H](N)c1ccc(N(C)C)cc1 841043347 OASZZPLVPHMHOL-QGZVFWFLSA-N 284.407 2.246 10 20 CECD Cc1cc(N(C)C)ccc1CN(CCCO)C1CC1 840915343 PMSTYZUBBUWPDX-UHFFFAOYSA-N 262.397 2.408 10 20 CECD CC[C@H](C)C[C@@H](CO)NCc1cc2c(cc1O)OCO2 842754601 QSWDLJPRPYGNJB-JQWIXIFHSA-N 281.352 2.008 10 20 CECD Cc1ccc2c(c1)/C(=C\c1cnc(N(C)C)n1C)C(=O)N2C 840721212 UHNLIZPLIATEGG-NTEUORMPSA-N 296.374 2.312 10 20 CECD COC(=O)c1cnc(SCCC2(O)CCC2)s1 840209883 GJGMVMRONQMJLH-UHFFFAOYSA-N 273.379 2.327 10 20 CECD C[C@@H]1CCCN1S(=O)(=O)Nc1ccc(O)cc1Cl 849308829 VXRHGJPYHKHEBE-MRVPVSSYSA-N 290.772 2.187 10 20 CECD CC[C@@](C)(CC(=O)OC)NCc1cc(OC)ccc1O 757918799 GDGCSRFXRHNORV-HNNXBMFYSA-N 281.352 2.222 10 20 CECD COCC(C)(C)CNC(=O)NCc1cc(C)ccc1O 858483256 DVCMMMUNVZIMEL-UHFFFAOYSA-N 280.368 2.172 10 20 CECD CCOCc1cc(CN[C@H]2C[C@H](CO)C2)ccc1OC 923007742 NMNOYEWSSYAMTR-CTYIDZIISA-N 279.380 2.092 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H](C)C2CCOCC2)c1 858299784 AJINKZKPIIJZCP-GFCCVEGCSA-N 292.379 2.315 10 20 CECD COC[C@H](CCO)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756595689 YCRGDGJLMNGJND-JBLDHEPKSA-N 283.343 2.067 10 20 CECD C[C@H](NCc1cnn(C)c1)c1cc(F)cc(F)c1O 756450911 VTKJQKWKEYAMSK-QMMMGPOBSA-N 267.279 2.255 10 20 CECD COc1ccc(N(C)Cc2csnn2)cc1OC 761222258 RYRJSTONBZUNEH-UHFFFAOYSA-N 265.338 2.192 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2cc(C)nn2C)c1 860287994 ALKKDRIZFNMAKO-UHFFFAOYSA-N 274.324 2.064 10 20 CECD Cc1cc(CN2CCCNC(=O)C2)c(O)c(C(C)(C)C)c1 872825620 MHDQYNYMMCMWQR-UHFFFAOYSA-N 290.407 2.320 10 20 CECD Oc1ccc(F)cc1CN1CCC(O)(C(F)F)CC1 779209732 ZTFDYFPDSYXYOE-UHFFFAOYSA-N 275.270 2.123 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCc2c[nH]nc2C1 877084398 MOAFOVRQRHZDSC-GFCCVEGCSA-N 257.337 2.071 10 20 CECD Cc1cccc(O)c1CNC[C@H]1COC2(CCCC2)O1 877132449 DTTHGRSOIUTWER-ZDUSSCGKSA-N 277.364 2.476 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)cc1 877978602 NGIJHENFRNJDCG-CWRNSKLLSA-N 288.391 2.184 10 20 CECD C[C@@H](C[C@H]1CCCC(=O)N1)N[C@H](C)c1ccccc1O 877755645 JNEJWZZLYUNATF-YNEHKIRRSA-N 276.380 2.490 10 20 CECD CCN1CCN(Cc2cc(C)c(C)cc2O)C(C)(C)C1=O 779198694 KIOBLDYZVBGIQL-UHFFFAOYSA-N 290.407 2.452 10 20 CECD CCO[C@@H](C)c1noc(CN(C)Cc2ccc(N)cc2)n1 1120269580 URMSFHDHYKUODK-NSHDSACASA-N 290.367 2.381 10 20 CECD COc1ccc(/C=C2/SC(=S)N(C3CC3)C2=O)cn1 780143570 PLGSLFSPRQHYMK-UXBLZVDNSA-N 292.385 2.454 10 20 CECD COc1cccc(O)c1CN1CCC(CCCO)CC1 783599485 PLPIHPKRMSXICX-UHFFFAOYSA-N 279.380 2.385 10 20 CECD Cc1nc([C@@H](C)NCc2cc(C)c(C)cc2O)n[nH]1 894772156 GJMSVAQHCRELGO-SNVBAGLBSA-N 260.341 2.286 10 20 CECD COc1cc(C)cc(CNC[C@H](C)CCCO)c1O 894876127 FJDOSACOSKZSAJ-LLVKDONJSA-N 267.369 2.207 10 20 CECD COc1ccc(CNC(=O)c2cccnc2Cl)c(O)c1 794381888 RDLKOQWZOPPNJZ-UHFFFAOYSA-N 292.722 2.379 10 20 CECD COc1ccc(CNC(=O)CC[C@H]2CC[C@@H](C)O2)c(O)c1 794383329 LFSRZQYFNZRGRX-DGCLKSJQSA-N 293.363 2.365 10 20 CECD CN1CCN(c2ccc(CN[C@H]3CC3(C)C)cc2F)CC1 1327391878 BBXVKZMZWFKWIB-INIZCTEOSA-N 291.414 2.466 10 20 CECD O=C(O)[C@@H](CC1CC1)NCc1cc(F)cc(F)c1O 1331983314 RPTOYWGMOXBACM-LLVKDONJSA-N 271.263 2.013 10 20 CECD CN(C)c1cc(F)c(CN2CC[C@](O)(C3CC3)C2)cc1F 1261829490 RGXMXWBKNNNULA-MRXNPFEDSA-N 296.361 2.378 10 20 CECD CCCN(Cc1ccn(C)n1)c1ccc(CN)cc1 211614250 RFMXLSZCYMRKMU-UHFFFAOYSA-N 258.369 2.295 10 20 CECD CC[C@@]1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCCN1 1577195977 OOPWVIVEDKICKV-DYVFJYSZSA-N 289.423 2.462 10 20 CECD COCc1ccc(C(=O)NCc2ccc(O)c(O)c2)cc1 158934343 LYMJMCKILCPDKS-UHFFFAOYSA-N 287.315 2.174 10 20 CECD CC(C)[C@@H](C)CC(=O)NCCc1ccc(O)c(O)c1 156645014 BXLSNFAJGQGGPY-NSHDSACASA-N 265.353 2.439 10 20 CECD O=C(NCCCSc1nccs1)NCC(F)F 154674720 HMACBULPULWYAT-UHFFFAOYSA-N 281.353 2.190 10 20 CECD Oc1ccccc1CNC[C@H]1CCN(CC(F)(F)F)C1 37648365 BEEVKVXFMWCBET-LLVKDONJSA-N 288.313 2.366 10 20 CECD CC[C@H](NCC1(S(C)(=O)=O)CC1)c1ccccc1O 281203108 SEMTYNCSGDGFAQ-LBPRGKRZSA-N 283.393 2.010 10 20 CECD Cc1nnc(CCNCc2cccc(C)c2O)s1 291614013 RDYIIEPIVWPZGT-UHFFFAOYSA-N 263.366 2.193 10 20 CECD C[C@@H](CN[C@H](C)c1cc(F)ccc1O)CN(C)C 310777879 DZGUYMCKWAZKBY-WDEREUQCSA-N 254.349 2.380 10 20 CECD Oc1cccc(Cl)c1CNCC12CC(CO1)C2 527790735 UPIRHNNAHKGTEW-UHFFFAOYSA-N 253.729 2.314 10 20 CECD COCC(COC)NCc1cc(Cl)cc(Cl)c1O 388389042 ATPZBCCFCDNGSS-UHFFFAOYSA-N 294.178 2.450 10 20 CECD COc1ccc(O)c(CN[C@H]2CSC[C@H]2C)c1 397880780 KGZYWSXCCOTDQN-SKDRFNHKSA-N 253.367 2.242 10 20 CECD CC[C@H](N[C@@H](CO)C[C@@H]1CCCO1)c1ccccc1O 886669776 DOGICYOSKOLKMR-IPYPFGDCSA-N 279.380 2.363 10 20 CECD COc1ccc(O)c(CNC(=O)Cc2cccc(F)c2)c1 114540836 BGJDQSZGJLAONA-UHFFFAOYSA-N 289.306 2.399 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](CN(C)C)C2)c1 178892823 LGQDJMKGMSOHIC-AWEZNQCLSA-N 262.397 2.393 10 20 CECD Cc1nccc(C(=O)NCc2c(O)ccc3c2CCCC3)n1 174514820 HVZUMJMMZUQTOI-UHFFFAOYSA-N 297.358 2.299 10 20 CECD Cc1ccc(O)c([C@H](C)NCc2nnc3n2CCCC3)c1 183847653 IFGINLCENNUGIM-LBPRGKRZSA-N 286.379 2.479 10 20 CECD Cc1cccc(NC(=O)c2cccc(O)c2O)c1O 187166736 UCOBETKREMNOSF-UHFFFAOYSA-N 259.261 2.364 10 20 CECD CNC(=O)C(C)(C)CN[C@H](C)c1ccc(F)c(F)c1O 187827878 GQZDNTHCVVZMME-MRVPVSSYSA-N 286.322 2.093 10 20 CECD Cc1cc([C@@H]2CCCN2C(=O)Cc2ccc(N)cc2)on1 37820282 YNBCXAMVYMEMJC-AWEZNQCLSA-N 285.347 2.471 10 20 CECD C[C@H](N[C@@H](C)c1nnnn1C1CC1)c1ccc(F)cc1O 189128220 XUNHJEJZPRNJGV-IUCAKERBSA-N 291.330 2.265 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCCC1 183481397 LNQCCVQTQDTDLW-JTQLQIEISA-N 263.337 2.335 10 20 CECD CC(=O)c1cc(F)cc(CN2CCO[C@H]3CCC[C@H]32)c1O 227156256 HEHKYMDNPCEWQI-CABCVRRESA-N 293.338 2.487 10 20 CECD C[C@H]1CSCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 191577352 HYRJXLKIZGOWDK-JOAKQRRISA-N 293.388 2.323 10 20 CECD CC[C@H]1CO[C@H](C)CN1C(=O)/C=C/c1ccc(O)c(O)c1 272685304 SSGOGYQMOFLNFV-HASJVIIQSA-N 291.347 2.137 10 20 CECD Cc1cc(C)c([C@H](C)NCCNC(=O)C2CC2)c(O)c1 285197959 NZURBGWXEHWLNB-LBPRGKRZSA-N 276.380 2.186 10 20 CECD CN(C)c1ccc(CNC(=O)OC[C@@H]2CCCO2)cc1 286802764 YYJJAGGOLLTHIU-AWEZNQCLSA-N 278.352 2.158 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H]1C(=O)O 299948969 CJJPRQYSPZVHOL-SMDDNHRTSA-N 262.353 2.048 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)CN(C)C)CC2)cc1 806169891 SDTAXHPZKRNYTQ-AWEZNQCLSA-N 291.439 2.204 10 20 CECD CN1CC[C@]2(CCN(Cc3ccc(N(C)C)cc3)C2)C1 292183460 QSURATSTPZPEII-KRWDZBQOSA-N 273.424 2.280 10 20 CECD CC(=O)C(=O)COc1cc(Br)cc(F)c1F 808034339 DZUNMAMUPPTRKN-UHFFFAOYSA-N 293.063 2.264 10 20 CECD Cc1nc([C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)no1 811156221 JANFJLLJGFWWLV-HORMHSFOSA-N 290.275 2.107 10 20 CECD COc1cccc(CNc2cccnc2[N+](=O)[O-])c1O 727432197 FYHOGJICRJLHCS-UHFFFAOYSA-N 275.264 2.316 10 20 CECD Cc1cccc(CN2CCC[C@H](CC(=O)O)C2)c1O 821112199 JCHPQBXFPBKWLQ-GFCCVEGCSA-N 263.337 2.387 10 20 CECD CCN(CC(=O)O)Cc1c(O)ccc2ccc(OC)cc12 737074709 KKBASRPDNJUFIJ-UHFFFAOYSA-N 289.331 2.461 10 20 CECD O=C(OC[C@H]1C[C@H]2CC[C@H]1O2)c1cc(O)cs1 837515859 WQMNMNMGIJEAKA-SZEHBUNVSA-N 254.307 2.178 10 20 CECD O=C(NCCOc1ccccc1)c1cc(O)cs1 731861818 PFIMIQPXGAFOHX-UHFFFAOYSA-N 263.318 2.263 10 20 CECD O=C(O)N1CCC(NCc2c(O)cccc2Cl)CC1 738637524 CJYVNZDQPLPSRU-UHFFFAOYSA-N 284.743 2.278 10 20 CECD CCc1cccc(CN[C@@H]2CCCN(C(=O)OC)C2)c1O 848894611 LKPMPFHJGORRSU-CQSZACIVSA-N 292.379 2.275 10 20 CECD CC1(C)CN(C(=O)Cc2ccc(N)cc2)C(C)(C)CO1 843441368 AEEZBGBGESGLKX-UHFFFAOYSA-N 276.380 2.227 10 20 CECD CCS[C@@H](C(=O)NCc1ccc(O)cc1O)C(C)C 910954170 IZSLPPXIWVKADQ-CYBMUJFWSA-N 283.393 2.492 10 20 CECD COc1cccc([C@H](C)NCc2snnc2C)c1O 846170428 NPZXBQPCJLWQMN-QMMMGPOBSA-N 279.365 2.412 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)CCN1 841061419 IRQSLNRGSIBEKO-YPMHNXCESA-N 265.376 2.122 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CCC[C@H]2CNC[C@H]21 841026815 QPNSVSAHGAVCJU-JOYOIKCWSA-N 284.762 2.369 10 20 CECD COc1ccc(CNC(=N)N2CCC[C@@H](C)C2)c(O)c1 849025151 QBXRPYUKGBDTTC-LLVKDONJSA-N 277.368 2.157 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)N1 843049839 WQRGFJHDQXPQPB-TXEJJXNPSA-N 265.376 2.074 10 20 CECD CC[C@@H](NCc1cc([N+](=O)[O-])ccc1O)[C@@H](O)C(C)C 840966168 CXGMHLPUHUDFOV-OCCSQVGLSA-N 282.340 2.186 10 20 CECD CCN(C)c1ccc(CN(C)Cc2nc(C)no2)cc1 847086072 LECVBZVWPLDPSK-UHFFFAOYSA-N 274.368 2.466 10 20 CECD CCOc1cccc(CNCCC[C@H]2CCCN2)c1O 841072133 HUNMEFWUESJNJW-AWEZNQCLSA-N 278.396 2.413 10 20 CECD CCc1cccc(CN(C)[C@H](C)CN2CCOCC2)c1O 848908032 WRBRXFOKEFWSSD-CQSZACIVSA-N 292.423 2.107 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@]3(CCCN3)C2)c1O 842477031 CAYGJQLRJNAPDH-INIZCTEOSA-N 292.354 2.062 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](C)CN 841983206 PUZNMRBCZUCBRR-ZDUSSCGKSA-N 292.427 2.020 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)NCc1ccc2c(c1)CCCO2 921618579 JHLPKBXBAWOVQL-STQMWFEESA-N 290.407 2.404 10 20 CECD C[C@H](NC[C@H]1CCCN1C)c1cc(F)cc(F)c1O 756459814 XNNIFJYWJQSJJG-GXSJLCMTSA-N 270.323 2.415 10 20 CECD CC[C@H](N[C@@H]1CCOC[C@H]1O)c1cc(Cl)ccc1O 858553244 MPBZTLMDGSDELD-OUCADQQQSA-N 285.771 2.236 10 20 CECD CCNC(=O)[C@@H](NCc1ccc2c(c1)CCCO2)C(C)C 922145845 CSYOFSJGTRGLNL-INIZCTEOSA-N 290.407 2.262 10 20 CECD C[C@H](NC[C@H]1C[C@@H](O)C1)c1cc(Cl)ccc1O 858545906 WWMGQRLHTWZEBJ-ATZCPNFKSA-N 255.745 2.467 10 20 CECD CCOc1ccc(CN[C@H]2CCO[C@@H](C)C2)c(O)c1 769709729 JKALBZAACSABLZ-AAEUAGOBSA-N 265.353 2.448 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(OC)c(C)c1 765797182 QEBOBIMSHCLSKI-ZIAGYGMSSA-N 276.380 2.008 10 20 CECD CN(C)c1cc(F)c(CN2C[C@@H]3CCN(C)[C@@H]3C2)cc1F 862385109 FBFKEFLQHQCBGF-MEDUHNTESA-N 295.377 2.167 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(O)nc(C3CC3)n2)c1 862755085 CBWAWQMBLSECBN-UHFFFAOYSA-N 299.330 2.004 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)CCN1 1118237448 YJOWFOTWSWVELG-AWEZNQCLSA-N 259.397 2.081 10 20 CECD CN(C(=O)c1ncc2n1CCCC2)c1ccc(N)cc1 877076573 NVCRQHGGHFYETR-UHFFFAOYSA-N 270.336 2.078 10 20 CECD CCOc1ccc(O)c(CN2CCN(C)[C@H](C)[C@@H]2C)c1 775985715 NEYIFYGBNAPILA-OLZOCXBDSA-N 278.396 2.315 10 20 CECD CCOc1ccc(O)c(CN[C@]2(CCOC)CCOC2)c1 775033206 NJJLAARGMDDVRG-MRXNPFEDSA-N 295.379 2.076 10 20 CECD CCOC(=O)[C@@H](C)[C@H](C)NCc1c(C)cccc1O 877322715 CCHBKYJHWDKALZ-RYUDHWBXSA-N 265.353 2.378 10 20 CECD CC[C@H](NCCCOCCO)c1cc(Cl)ccc1O 775548436 ROZJBPJJMJTZPK-ZDUSSCGKSA-N 287.787 2.485 10 20 CECD C[C@@H](NC[C@H](O)C1CCC1)c1c(O)cccc1F 886621985 HNHWJOUUVWFANO-RNCFNFMXSA-N 253.317 2.343 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@H](C)c1c(O)cccc1F 886619078 RSHLMESLSKJBFU-JTNHKYCSSA-N 283.343 2.233 10 20 CECD Cc1ccc(C(=O)N2CC(C)(C)OCC2(C)C)c(O)c1O 780944014 QQPBEZISVYNPFQ-UHFFFAOYSA-N 293.363 2.436 10 20 CECD COc1cc(C)cc(CNCCC2(O)CCC2)c1O 894699222 ZJQXUIWFMROFPQ-UHFFFAOYSA-N 265.353 2.104 10 20 CECD COc1cc(C)cc(CN[C@H](C)c2nc(C)no2)c1O 894543869 XMWVHUJKEWRJJS-SECBINFHSA-N 277.324 2.251 10 20 CECD CCN(Cc1cc(F)cc(F)c1O)C[C@H](O)C(F)(F)F 894494038 LOMLRBGWCFTJSM-JTQLQIEISA-N 299.239 2.416 10 20 CECD CCCN(Cc1ccccc1O)[C@H](COC)C(=O)OCC 792185974 NIDSWSSXNMKHLO-CQSZACIVSA-N 295.379 2.182 10 20 CECD Oc1c(F)cc(Br)cc1CNC1CSC1 715724199 ZJXWSDBRPIVJQE-UHFFFAOYSA-N 292.173 2.499 10 20 CECD Cc1ccc(O)c(CNCc2n[nH]cc2Br)c1 718138979 HYQFDULIKKGVAN-UHFFFAOYSA-N 296.168 2.476 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@@H](C)c1ccccc1O 760884209 FIXNYMICFTWSDV-CORIIIEPSA-N 265.353 2.237 10 20 CECD COc1ccc(CNCc2ccnn2C(C)C)c(O)c1 793391355 VXUZEEGJNJEDEK-UHFFFAOYSA-N 275.352 2.468 10 20 CECD Cc1nnc(CN[C@@H]2C[C@H](C)c3c(F)ccc(O)c32)n1C 1321022046 AXHXVTIKRVQFPP-GZMMTYOYSA-N 290.342 2.306 10 20 CECD CCC1(O)CCC(NC(=O)NCc2ccc(N)cc2)CC1 1336075351 JZYHNGSVTOGFIW-UHFFFAOYSA-N 291.395 2.152 10 20 CECD Nc1ccc(CNC(=O)CCCc2cccnc2)cc1 1356226949 DJYBLZISIQMPGK-UHFFFAOYSA-N 269.348 2.303 10 20 CECD CC[C@@H](N[C@@H]1CC12CC2)c1cccc(-c2nn[nH]n2)c1O 1590467771 TZPWMCIHWUBLFE-VXGBXAGGSA-N 285.351 2.166 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H](C)CO)cc1 151726567 ODLNYJAEZWABNF-CHWSQXEVSA-N 250.386 2.422 10 20 CECD CSC[C@@](C)(O)CNCc1ccc2c(c1)CCCO2 921767772 SIHIJQAFKDRIJJ-HNNXBMFYSA-N 281.421 2.215 10 20 CECD CN1CCCc2cc(CNC3CCS(=O)CC3)ccc21 157973993 DEHDQGQYGJRWFC-UHFFFAOYSA-N 292.448 2.070 10 20 CECD C[C@H](NCc1nccn1C)c1ccc(N(C)C)cc1 71273283 LLSHBUXTGGQDIS-LBPRGKRZSA-N 258.369 2.337 10 20 CECD CC[C@H]1CN(C(=O)c2cccc(O)c2O)[C@H](CC)CO1 403780307 ADPAIQHCSRKLNT-MNOVXSKESA-N 279.336 2.127 10 20 CECD COCCN(Cc1cc(F)ccc1O)CC(F)F 180057928 ALNHZJPHJGHHLI-UHFFFAOYSA-N 263.259 2.245 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C(C)(C)F 132340085 VZGLGQJXMXMHMZ-UHFFFAOYSA-N 294.370 2.230 10 20 CECD CCCN(Cc1cccc(C)c1O)[C@@H]1CCS(=O)(=O)C1 179574021 ZTXHSCATOAMXOO-CQSZACIVSA-N 297.420 2.100 10 20 CECD CCCCN(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 248146098 VXZYOFUKHUZFFG-UHFFFAOYSA-N 291.439 2.443 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCS2)cc1 266510748 BKDUGYXFEBUHSW-ZDUSSCGKSA-N 264.394 2.264 10 20 CECD CC(C)NC(=O)NCc1cccc(Br)c1O 278371666 MJULGPZDLGTQRM-UHFFFAOYSA-N 287.157 2.362 10 20 CECD N[C@@H]1Cc2ccccc2N(C(=O)c2cccc3c2CCN3)C1 1341975811 ZGCIADRRIRSECA-CYBMUJFWSA-N 293.370 2.185 10 20 CECD CCOc1ccc(O)c(CN2CCOC[C@@H](C)C2)c1 370054488 WIMCPDAECSJCEE-LBPRGKRZSA-N 265.353 2.259 10 20 CECD Cc1ccc(O)c(CNC2CCN(c3cccnn3)CC2)c1 277422976 GROSGGDEMHXRGV-UHFFFAOYSA-N 298.390 2.249 10 20 CECD COCCn1cc(CN[C@H](C)c2cc(C)ccc2O)cn1 282433433 DJUWIRRRZNOLBA-CYBMUJFWSA-N 289.379 2.394 10 20 CECD CN(Cc1cccc(Cl)c1O)C[C@H](O)C(F)(F)F 809751629 UTBCUFMNAMDDEO-VIFPVBQESA-N 283.677 2.401 10 20 CECD COCCNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 298885855 TYFKOXLBPDTKML-UHFFFAOYSA-N 291.395 2.073 10 20 CECD CC(C)N1CCC(NC(=O)NCc2ccccc2O)CC1 299471175 DBEITJVDGVVROF-UHFFFAOYSA-N 291.395 2.064 10 20 CECD CCOCC(C)(C)CNC(=O)/C=C/c1ccc(O)c(O)c1 293763535 SHGWXFGRGQKXKT-SOFGYWHQSA-N 293.363 2.290 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@H]2CNCCCO2)cc1 817983239 ZXXDMVRYXLITLC-WMLDXEAASA-N 291.439 2.172 10 20 CECD Cc1nccn1CCNCc1cc(Cl)c(F)cc1O 816544639 NYSQOHVKQOXFKV-UHFFFAOYSA-N 283.734 2.479 10 20 CECD CO[C@H]1COCC[C@@H]1CNCc1ccc(N(C)C)c(F)c1 824709728 SHVIXFFWFMRXIU-CJNGLKHVSA-N 296.386 2.033 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CSC2CC2)c1 825737149 TYXRXRQDFPNITK-VIFPVBQESA-N 281.377 2.474 10 20 CECD CC(=O)c1cc(F)cc(CN2CCc3nc[nH]c3C2)c1O 821270597 MKBCIYWXTFXOGB-UHFFFAOYSA-N 289.310 2.015 10 20 CECD NCC[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 904406393 SBKMIGWYMOXCKX-VIFPVBQESA-N 272.751 2.355 10 20 CECD CCOCc1cc(CNC[C@](C)(O)C2CC2)ccc1OC 732669686 REQJWFAIPGAEKZ-KRWDZBQOSA-N 293.407 2.482 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(C)cc(C)c2O)C1 902420492 XLKXSMCGFSDJGX-ZDUSSCGKSA-N 277.364 2.394 10 20 CECD O=C(O)COc1ccc(NC(=O)c2cc(O)cs2)cc1 739823855 MLGONWMIXLMFEA-UHFFFAOYSA-N 293.300 2.169 10 20 CECD C[C@H](C1CC1)N(C)CC(=O)NCc1ccc(N(C)C)cc1 839460623 QGUSZMMEIOKXPU-CYBMUJFWSA-N 289.423 2.099 10 20 CECD COc1cccc(CNC(=O)c2cc(O)cs2)c1OC 731868500 GXNXHPUOCLZZNT-UHFFFAOYSA-N 293.344 2.401 10 20 CECD CCOc1cccc(CN2CC(c3nc(C)no3)C2)c1O 839130817 HZHSOXUCSGUHEA-UHFFFAOYSA-N 289.335 2.082 10 20 CECD CN(C[C@@H]1CC1(C)C)C(=O)NCCc1ccc(N)cc1 831104318 ZHJWIQFGXFZJOK-ZDUSSCGKSA-N 275.396 2.499 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CC[C@@H](C2CCC2)C1 839948558 MRFJYFGZQYQLCN-SNVBAGLBSA-N 279.311 2.499 10 20 CECD CC[C@@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(C)cc1O 834907813 CVBYVDLLCXIJSM-CZUORRHYSA-N 276.380 2.410 10 20 CECD CN(C)CC(C)(C)NCc1ccc(N(C)C)c(F)c1 835068249 DFKKQLVPXOHVHQ-UHFFFAOYSA-N 267.392 2.322 10 20 CECD Cc1noc(NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 836494067 PPPDCZYSFXWAEQ-SECBINFHSA-N 289.339 2.327 10 20 CECD C[C@@H]1C[C@H](N)CCN1Cc1ccc(N(C)C)c(F)c1 846698207 CHBNLGIMFDWPGY-DGCLKSJQSA-N 265.376 2.203 10 20 CECD COCCCOC1CCN(C(=O)c2cc(O)cs2)CC1 743522552 YEJDBAXPSJURQO-UHFFFAOYSA-N 299.392 2.111 10 20 CECD CC[C@H](C)C[C@@H](CO)NC(=O)/C=C\c1ccc(O)c(O)c1 844038260 VUCJKLOQTPCCHH-YQCLLZEUSA-N 293.363 2.024 10 20 CECD COc1cccc2c1N(C(=O)/C=C\c1cnn(C)c1)CCC2 914611122 BLTJHRJUUQOISA-HJWRWDBZSA-N 297.358 2.421 10 20 CECD Cc1nc(NCc2ccc(N(C)C)cc2)ncc1C(=O)O 910276740 KHARRSZNBAUEAE-UHFFFAOYSA-N 286.335 2.161 10 20 CECD CCC[C@@H]1CNCCN1Cc1cccc(OCC)c1O 843057761 HYCFLAVCBDTIHV-CQSZACIVSA-N 278.396 2.365 10 20 CECD CC(=O)Nc1ccc(C(=O)NCc2ccccc2O)cc1 748353031 JBYNSFNDOMTOQQ-UHFFFAOYSA-N 284.315 2.281 10 20 CECD Oc1ccc(Cl)cc1CN1CCc2n[nH]cc2C1 857877000 KUUQJRFHYJCHTF-UHFFFAOYSA-N 263.728 2.327 10 20 CECD CSC1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 869646120 NIRUBMSJJLKTNH-HWKANZROSA-N 293.388 2.465 10 20 CECD C[C@@H](NC(=S)NC1(C)CC1)c1ccccc1O 865269354 JRYTUBQZKQLJHG-SECBINFHSA-N 250.367 2.470 10 20 CECD CCOc1ccc(CNC[C@@](C)(O)C(F)(F)F)c(O)c1 760452380 XUCNQQUWTUIBDK-GFCCVEGCSA-N 293.285 2.194 10 20 CECD Cc1nnc(N(C)Cc2ccc(N(C)C)cc2)nc1C 775415804 BEWVOVJPFKNQAT-UHFFFAOYSA-N 271.368 2.191 10 20 CECD Cc1ccc(CN(C)CCc2cnccn2)c(O)c1 877172017 NILIBELOZBKFRN-UHFFFAOYSA-N 257.337 2.165 10 20 CECD CCCN(Cc1ccc(N)cc1)[C@@H](COC)C(=O)OCC 1120269354 QOZYBUROXPLOPD-HNNXBMFYSA-N 294.395 2.059 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2(OC)CCC2)c1 782013135 GDYYDOZMLZQPPO-JTQLQIEISA-N 279.336 2.147 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2cccnc2C)c1 898922362 ZECBORJUDXMNFW-UHFFFAOYSA-N 299.374 2.446 10 20 CECD COc1ccc(N2CCC(NC3CSC3)CC2)cc1 780878938 OIHOUNORQSOYHJ-UHFFFAOYSA-N 278.421 2.369 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@H](C)c1cc(F)cc(F)c1O 788986095 ZOBMPRPBXZSUSL-RKDXNWHRSA-N 286.322 2.188 10 20 CECD COc1cccc(CNCCN2CCC(C)(C)C2)c1O 898035113 LLSHEXPXPHZYHK-UHFFFAOYSA-N 278.396 2.222 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@H]1COC(C)(C)O1 891397108 LMOXFAHSBWTAIG-HNNXBMFYSA-N 278.396 2.336 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)ccc2O)[C@@H]1C 787420919 NEKGHHDINHGEJG-DGCLKSJQSA-N 263.337 2.084 10 20 CECD CCCN1CC[C@@H](NCc2cc(C)cc(OC)c2O)C1 895326820 HGKIPAUYLYPQBE-CQSZACIVSA-N 278.396 2.283 10 20 CECD COc1ccc(CNC(=O)c2ccc3nc[nH]c3c2)c(O)c1 796349971 IXJRUARVGOFFSQ-UHFFFAOYSA-N 297.314 2.207 10 20 CECD Cc1ccc(O)c(NC(=O)c2ccc(C)c(O)c2O)n1 790073786 UZZMRDTUIGKMGB-UHFFFAOYSA-N 274.276 2.068 10 20 CECD OCC1(CNCc2ccc(Br)cc2O)CC1 691427843 HTLLNBDQBWEXOO-UHFFFAOYSA-N 286.169 2.017 10 20 CECD C[C@@H]1SCCN(C(=O)NCc2ccc(N)cc2)[C@H]1C 1262603191 AGIXUUBCYTZYMM-QWRGUYRKSA-N 279.409 2.304 10 20 CECD CN(C)c1ccc(/C=C\c2ccncc2-c2nn[nH]n2)cc1 1604700711 QAMPHWMMTVNIAL-UTCJRWHESA-N 292.346 2.498 10 20 CECD Cc1nnc([C@@H](C)Sc2ncc(C(=O)O)s2)o1 1608012897 DPCBKRNFBMIAKR-SCSAIBSYSA-N 271.323 2.386 10 20 CECD C[C@@H]1CC[C@@H](N[C@H](C)c2cccc(-c3nn[nH]n3)c2O)C1 1603879098 BGPSWMFOVUVTSH-GMTAPVOTSA-N 287.367 2.412 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCN(C3CC3)C2)c1O 228673576 PQFOIKVLPRPVEL-LBPRGKRZSA-N 296.798 2.381 10 20 CECD Cc1c(F)ccc(N)c1C(=O)NCCc1ccc(N)cc1 1579537319 NIKCFMRXHZGMEG-UHFFFAOYSA-N 287.338 2.271 10 20 CECD C[C@@H](NCc1cccnc1F)c1cc(C(=O)O)ccc1O 1593304391 MIFIAYFQZBVXRO-SECBINFHSA-N 290.294 2.475 10 20 CECD CN(C)c1ccc(CN2CCC(F)(F)C[C@H]2C(=O)O)cc1 1777039450 ULOINDXKLRHSCE-ZDUSSCGKSA-N 298.333 2.437 10 20 CECD O=C1NC(=S)S/C1=C/c1ccc(C(=O)O)c(F)c1 1777698942 PKQFBUWYIISCHN-XBXARRHUSA-N 283.305 2.013 10 20 CECD O=C(Cc1c[nH]c2ccccc12)NCc1ccc(O)c(O)c1 158932781 CMVHNLQVQOKMRQ-UHFFFAOYSA-N 296.326 2.438 10 20 CECD CCC[C@H](O)CN[C@@H](C)c1cc(OC)ccc1O 168771158 DGXDICSGKLLZNU-QWRGUYRKSA-N 253.342 2.212 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccnc1 152978235 JHGJTPCVNXLWTN-SNVBAGLBSA-N 287.319 2.246 10 20 CECD COc1ccc(C)cc1/C=C1/SC(=S)NC1=O 209098057 NLYKTTZSNWMXGP-UXBLZVDNSA-N 265.359 2.492 10 20 CECD C[C@H]1OCC[C@@H]1CN1CCCc2cc(CN)ccc21 866659935 YGJPNOWMWWNNAY-IUODEOHRSA-N 260.381 2.323 10 20 CECD CC(C)(CN1CCOCC1)NCc1cccc(Cl)c1O 308639747 KRXWESYSKQHXKH-UHFFFAOYSA-N 298.814 2.246 10 20 CECD C[C@@H](CCO)CCNCc1cc(F)cc(F)c1O 708485752 NFWSGWPPNLBWQB-SECBINFHSA-N 259.296 2.169 10 20 CECD Cc1ccc(O)c([C@H](C)NCCCn2cncn2)c1 381717723 TUNIKZCVUCGDFH-LBPRGKRZSA-N 260.341 2.033 10 20 CECD CN(CC(F)F)C(=O)NCc1ccc2c(c1)CCCN2C 103612627 DIUQXKKFXCVOQM-UHFFFAOYSA-N 297.349 2.476 10 20 CECD CCOC(=O)[C@H]1CCCCN1Cc1cc(F)ccc1O 179885345 WMKAAZUWIJEKTB-CYBMUJFWSA-N 281.327 2.449 10 20 CECD CC1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 180589562 DRYRYZMRPJWBAF-HWKANZROSA-N 261.321 2.370 10 20 CECD C[C@H](N[C@H](C)c1cc2c(cc1O)CCCC2)C(=O)N(C)C 189000999 DQISIRQHNGWMGA-NEPJUHHUSA-N 290.407 2.398 10 20 CECD CSC[C@@H](CCO)N[C@@H](C)c1ccc(F)cc1O 185530273 BXJPESPSYRFVHC-GXSJLCMTSA-N 273.373 2.296 10 20 CECD CN(C)c1ccc(CNc2cncc(-n3cccn3)n2)cc1 48300108 LMBGLFALFIZSHR-UHFFFAOYSA-N 294.362 2.340 10 20 CECD COC(=O)Cc1cccc(NCc2ccc(N(C)C)cc2)n1 191600907 MXFDVYGFKCLKBM-UHFFFAOYSA-N 299.374 2.475 10 20 CECD CN(C(=O)/C=C/c1cccnc1)c1ncccc1F 131355872 CFAJDRAPICLPPT-VOTSOKGWSA-N 257.268 2.292 10 20 CECD CCCOc1ccc(CN(C)C[C@@H](C)C(=O)OC)c(O)c1 91986722 CZDYBERQQSYJKG-GFCCVEGCSA-N 295.379 2.422 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](Cc3cnn(C)c3)C2)c1 93870481 QOTHDXCLCIDDPQ-AWEZNQCLSA-N 285.391 2.499 10 20 CECD CSCC(=O)NCc1c(C)c2ccccc2n1C 348665249 JHYVCCABCWXYCM-UHFFFAOYSA-N 262.378 2.466 10 20 CECD Cc1ccc([C@@H](C)NCC2(N3CCOCC3)CC2)c(O)c1 278511781 RMOWYERFHSWBNB-CQSZACIVSA-N 290.407 2.216 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C)[C@H]2CCOC2)c1 273554509 GQSONMICQHKBRR-GVXVVHGQSA-N 293.363 2.254 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(OC)c(C)c2)[C@@H]1OC 274846217 AGZSXSAASOBENG-BMFZPTHFSA-N 279.380 2.286 10 20 CECD C[C@H](NC[C@H](O)C(F)(F)F)c1ccc(F)c(F)c1O 276947813 QJPSZPUQWBWUON-XNCJUZBTSA-N 285.212 2.244 10 20 CECD Cc1nc(C)c(CNC(=O)c2ccc(C)c(O)c2O)s1 271265961 KSLKQGKTSUKBPT-UHFFFAOYSA-N 292.360 2.410 10 20 CECD CC[C@@H](NCc1ncn(C)n1)c1cccc(Cl)c1O 287625123 KAKPCVIJQBHSGX-LLVKDONJSA-N 280.759 2.415 10 20 CECD COc1cc(N(C)[C@@H]2CCCOC2)c([N+](=O)[O-])cc1OC 804785039 XRDUHWTXNFDYCS-SNVBAGLBSA-N 296.323 2.227 10 20 CECD CCOc1ccc(O)c(CN(C2CC2)C2COC2)c1 296007636 LHSAKGZVWZBUOZ-UHFFFAOYSA-N 263.337 2.154 10 20 CECD CCOCC(C)(C)NC(=O)NCc1ccc(N(C)C)cc1 296678965 WYUSIEFEOVOVCJ-UHFFFAOYSA-N 293.411 2.367 10 20 CECD Cc1ccc(C(=O)OCc2ccncc2)c(O)c1O 803328664 SRYBMNZNOFXYBO-UHFFFAOYSA-N 259.261 2.158 10 20 CECD COC(=O)[C@@H]1[C@H]2CN(Cc3cc(Cl)c(F)cc3O)C[C@H]21 816616670 CESMVWIWYVBBFM-WOFXILAISA-N 299.729 2.036 10 20 CECD CCO/C=C\C(=O)NCc1ccc2c(c1)CCCN2C 816910942 XGSGZFXAJWUSCJ-NTMALXAHSA-N 274.364 2.235 10 20 CECD Cc1cc(O)c(CN(C)CCN2CCCC2=O)cc1Cl 824778318 RYSMCLPTPKDWGE-UHFFFAOYSA-N 296.798 2.408 10 20 CECD Cc1cccnc1CNC(=O)NCc1ccccc1O 729607381 ZBQAAGGDHONPOE-UHFFFAOYSA-N 271.320 2.095 10 20 CECD CCN1CC[C@H](N(C)C(=O)c2cc(O)cs2)C[C@H]1C 828491263 XWYWDELAZHTDRN-MNOVXSKESA-N 282.409 2.399 10 20 CECD COCCN(C(=O)/C=C/c1cn(C)cn1)c1ccccc1 821797351 SLSITKIEVDTPMU-CMDGGOBGSA-N 285.347 2.113 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCOc1ccccc1 588403229 BFLIPPPAJGHPRY-CLFYSBASSA-N 299.326 2.306 10 20 CECD O[C@@H]1Cc2ccccc2N(Cc2cccc3c2CCNC3)C1 903909225 RYINATKHOSZMDD-QGZVFWFLSA-N 294.398 2.256 10 20 CECD Oc1ccccc1CNCc1ccc(-c2nn[nH]n2)cc1F 738400171 FCIUEUUPKNNUPN-UHFFFAOYSA-N 299.309 2.001 10 20 CECD Nc1ccc(NC(=O)c2ccnc(N3CCCCC3)n2)cc1 832244767 USHIMEWFKMAFCC-UHFFFAOYSA-N 297.362 2.301 10 20 CECD CC[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)[C@@H](C)O 834889453 XYWGMWMYUIBPHW-LNLATYFQSA-N 268.313 2.110 10 20 CECD CCc1cccc(CNCc2nc(C(C)C)n[nH]2)c1O 848915617 KQFXVZAOCYNGLN-UHFFFAOYSA-N 274.368 2.486 10 20 CECD CCN(CC)c1ccc(CN2CCNC[C@@H]2C)cc1F 843046914 DRCWDJXWPLBCMD-ZDUSSCGKSA-N 279.403 2.466 10 20 CECD CNC(=O)C1CCN(Cc2ccc(N(C)C)cc2C)CC1 840909560 ITAFWFYEXGACIS-UHFFFAOYSA-N 289.423 2.019 10 20 CECD CCNCCNCc1cc(Br)cc(C)c1O 841037698 SMLUBGQCFRPHRY-UHFFFAOYSA-N 287.201 2.162 10 20 CECD CN1CCCC[C@H]1CCOC(=O)c1cc(O)cs1 840228776 SQXUFQQOYPXTRJ-JTQLQIEISA-N 269.366 2.485 10 20 CECD O=C(Nc1cc(C2CCOCC2)[nH]n1)c1cc(O)cs1 743730814 FUVMWGGYAWBPSE-UHFFFAOYSA-N 293.348 2.323 10 20 CECD Cc1cc(N(C)C)ccc1[C@@H]1NC(=O)[C@@H]2C[C@H](C)CCN21 840819048 KWKKAJGPVQNUEO-XFBWCDHKSA-N 287.407 2.290 10 20 CECD COc1cccc(CNC(=O)[C@@H](CC(C)C)OC)c1O 841404945 IHOULVLDNCAGNN-CYBMUJFWSA-N 281.352 2.078 10 20 CECD CCc1cnc(COC(=O)c2cccc(O)c2O)o1 758545751 BPOQPSKSTRMBLU-UHFFFAOYSA-N 263.249 2.005 10 20 CECD CC(C)N1CC[C@@H](N[C@@H](C)c2cc(F)cc(F)c2O)C1=O 756708262 BFPVFCMPDCKRGZ-TVQRCGJNSA-N 298.333 2.330 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)NC/C=C\CO 855404246 RZSASNGSTYOTFG-ARJAWSKDSA-N 290.388 2.434 10 20 CECD C[C@@H](CCCO)N[C@H](C)c1cc(F)cc(F)c1O 756648726 YZVBRNKYNGMEKS-DTWKUNHWSA-N 259.296 2.482 10 20 CECD COCc1nc(Sc2ncc(Cl)s2)n[nH]1 765048803 DNJBOISFFDREIR-UHFFFAOYSA-N 262.747 2.212 10 20 CECD CN(Cc1cn[nH]c1)Cc1cc(Cl)cc([N+](=O)[O-])c1O 769426813 WWKQFANNVUNJRX-UHFFFAOYSA-N 296.714 2.309 10 20 CECD O=C(NCc1ccn2ccnc2c1)c1cc(O)cs1 762579825 VTEPVFXNZIJBPP-UHFFFAOYSA-N 273.317 2.031 10 20 CECD Nc1ccc(Cc2nc(C(=O)N3C[C@@H]4C[C@H]4C3)cs2)cc1 876994398 HWBCBIAAKAMOAX-RYUDHWBXSA-N 299.399 2.408 10 20 CECD COc1ccc(CN[C@H](C[C@H]2CCCO2)C(=O)O)cc1C 1119611986 PNKGNSDUFCNFPB-ZIAGYGMSSA-N 293.363 2.116 10 20 CECD COC(=O)[C@@H](NCc1ccc(C)cc1O)C(C)(C)C 877170982 YXNDIWJDZOWZQD-CYBMUJFWSA-N 265.353 2.378 10 20 CECD Cc1nc[nH]c1C(=O)NCCCSc1nccs1 874464480 CYGCYHPEUPLFMX-UHFFFAOYSA-N 282.394 2.087 10 20 CECD C[C@H](Cc1cnccn1)NCc1cc(F)ccc1O 779059402 FIBAABUUQZFHSA-SNVBAGLBSA-N 261.300 2.042 10 20 CECD CCN(CC)c1ccc(CNCCN(C)OC)cc1F 883172030 RFCYPBBRSGPOGY-UHFFFAOYSA-N 283.391 2.255 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@H]2CCCC[C@H]2C1 789991139 ARGYZJWOLHEPHF-AOOOYVTPSA-N 279.311 2.499 10 20 CECD CS[C@@H]1CC[C@H](NC(=O)c2ccc(C)c(O)c2O)C1 780955028 PZOLSOIYEHOQKF-VHSXEESVSA-N 281.377 2.420 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H](O)COCC2CC2)c(O)c1 788584284 NIFVZRJSEJXWJR-HIFRSBDPSA-N 293.407 2.447 10 20 CECD COc1ccc(CN2CCO[C@@H](C)[C@H]2C)c(O)c1OC 892048079 HNGPDPCXPGONBG-MNOVXSKESA-N 281.352 2.019 10 20 CECD COc1cccc(CN2CCc3ncsc3C2)c1O 783746029 USZHNAKOGBRUGF-UHFFFAOYSA-N 276.361 2.416 10 20 CECD C[C@H](O)C[C@H](C)NCc1ccc(Br)cc1O 701015870 SCZRKDKGCQIXEU-IUCAKERBSA-N 288.185 2.404 10 20 CECD CCc1ccnc(CNC(=O)/C=C/c2ccc(O)c(O)c2)c1 798064959 JSZRJZBLFBELEM-GQCTYLIASA-N 298.342 2.385 10 20 CECD COC1CCC(N(C)C(=O)c2cccc(O)c2O)CC1 279271726 KLSXWEAXFADWJO-UHFFFAOYSA-N 279.336 2.127 10 20 CECD CNc1nnc(Sc2ncc([N+](=O)[O-])s2)s1 195507186 NLRCZPDKTXXEKN-UHFFFAOYSA-N 275.340 2.096 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)n2cccc2)c(O)c1 1325005280 ZNFDPENSJHOOOY-LLVKDONJSA-N 274.320 2.080 10 20 CECD COc1cc(C)cc(CN[C@H](CO)C2CCCC2)c1O 1338272923 AQXNROUJLCOIGJ-CQSZACIVSA-N 279.380 2.350 10 20 CECD C[C@]1(NC(=O)NCc2ccc(N)cc2)CCO[C@@H]1C1CC1 1262603759 ULSJGTRTPPBHPW-ZBFHGGJFSA-N 289.379 2.026 10 20 CECD C=C=CCNC(=O)NCc1ccc(N(C)C)c(F)c1 1350882515 WCOPXEDOXXPTMU-UHFFFAOYSA-N 263.316 2.032 10 20 CECD C[C@H](CNCc1cc(F)ccc1O)N1CCCCC1 226585838 KZOPMUKJVVVDFP-GFCCVEGCSA-N 266.360 2.495 10 20 CECD Cc1cc(N(C)C)ccc1CN(C1CC1)[C@H](C)C(=O)O 1594311621 MZEJEIGQMDPXQR-GFCCVEGCSA-N 276.380 2.499 10 20 CECD Cc1cccc(CNc2ccc(OCC(N)=O)cc2)c1O 158044040 FNHMQGMTTMCLBQ-UHFFFAOYSA-N 286.331 2.177 10 20 CECD Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)CC2 160382733 RUUITOTZUWMONO-IUODEOHRSA-N 299.422 2.318 10 20 CECD CO[C@@H](CN(C)Cc1ccccc1O)C1CCOCC1 876616556 ZKDOOOYCINLPET-INIZCTEOSA-N 279.380 2.266 10 20 CECD Cc1ccc(CN[C@@H](C)[C@H](O)C(F)(F)F)c(O)c1 877693717 ORERKHVRBOMMLE-KWQFWETISA-N 263.259 2.102 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CCN(C(C)C)C2=O)c(O)c1 186048524 OURVUZKTSGGDDQ-JSGCOSHPSA-N 276.380 2.361 10 20 CECD COc1nccc(CN[C@H](C)c2ccccc2O)n1 877755868 PMTOYCZZLBRARN-SNVBAGLBSA-N 259.309 2.042 10 20 CECD COc1c(O)ccc2c1C(=O)c1ccc(C)c(O)c1C2=O 6523023 QJRHLPRUPYDZHC-UHFFFAOYSA-N 284.267 2.190 10 20 CECD biogenic,in-vitro CCN(CC)c1ccc(CN2C(=O)[C@H](C)NC2=S)cc1 55179722 ZNIHOSHSEVUNIS-NSHDSACASA-N 291.420 2.138 10 20 CECD CC(C)=CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 55523900 ZHOGTZUYTLQIJQ-UHFFFAOYSA-N 292.354 2.245 10 20 CECD CO[C@H](CNCc1cc([N+](=O)[O-])ccc1O)C(C)C 72924701 IYZRRSPXBDSLCD-CYBMUJFWSA-N 268.313 2.061 10 20 CECD Nc1ccc(CC(=O)Nc2ccc3nccnc3c2)cc1 37765704 SINNYYCTJHWVFA-UHFFFAOYSA-N 278.315 2.393 10 20 CECD Cc1ccc([C@@H](C)NCCCN2CCC(O)CC2)c(O)c1 185116336 JCBNWAPXIVIXRZ-CQSZACIVSA-N 292.423 2.198 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCOC(C)(C)C2)c1 185361170 JPRDOMFKOVMFRJ-CQSZACIVSA-N 292.423 2.462 10 20 CECD CCS(=O)(=O)NCc1ccc(N2CCCCC2)cc1 49393988 PMUCJXNMNYLRPL-UHFFFAOYSA-N 282.409 2.116 10 20 CECD Cc1cc(NC(=O)N(C)Cc2ccccc2O)no1 48769387 NVUXELQZNXCVSS-UHFFFAOYSA-N 261.281 2.353 10 20 CECD CCOC(=O)CN(Cc1cc(C)ccc1O)C1CC1 91773151 BVMPRXFQPNHWFA-UHFFFAOYSA-N 263.337 2.228 10 20 CECD Cc1cccc(CN2CCO[C@@H]([C@@H]3CCCO3)C2)c1O 180707058 UDUFRDGOFBHYJV-LSDHHAIUSA-N 277.364 2.080 10 20 CECD CCOc1ccc(O)c(CNCc2cnn(CC)c2)c1 265486611 MXVDXVYHMWHJEF-UHFFFAOYSA-N 275.352 2.297 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)Cc1nccn1C 272820919 OOYGMNOOLOAPLK-UHFFFAOYSA-N 276.359 2.257 10 20 CECD Cc1cccc(CN2C[C@H](C)OC3(CCOCC3)C2)c1O 280482275 ODGXSGJWSYTYRF-AWEZNQCLSA-N 291.391 2.471 10 20 CECD CC(=O)NCCCN[C@@H](C)c1c(C)cc(C)cc1O 284160611 PVIDIRKHYSSQQX-LBPRGKRZSA-N 264.369 2.186 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)c1c(F)ccc(O)c1O 295098422 XAKGYHRBXYSROU-QMMMGPOBSA-N 285.315 2.170 10 20 CECD COc1ccc(CNCCc2nccnc2C)cc1C 292962499 JOAGRXLKXPASKM-UHFFFAOYSA-N 271.364 2.434 10 20 CECD CSCC(C)(C)C(=O)OCC(=O)c1ccc(O)c(O)c1 800313641 DJBXLXYRVOOQHV-UHFFFAOYSA-N 298.360 2.213 10 20 CECD CCO[C@H]1C[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 298665725 QMJCIQQOHDOAQD-CABCVRRESA-N 276.380 2.136 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H]2COC(=O)C2)cc1 816678314 BHWLPNLPDNLQNC-AWEZNQCLSA-N 298.342 2.139 10 20 CECD CC[C@H](CNC(=O)NCc1ccc(N(C)C)cc1C)OC 811968367 GXJDPRLRNAEOIP-OAHLLOKOSA-N 293.411 2.285 10 20 CECD NC(=O)c1cccc(Sc2ncc([N+](=O)[O-])s2)c1 811866685 JIVZSQLJWZOGIL-UHFFFAOYSA-N 281.318 2.301 10 20 CECD COCC(C)(C)N(C)Cc1ccc(N2CCOCC2)cc1 814178550 VAFSIBINHOFMGF-UHFFFAOYSA-N 292.423 2.380 10 20 CECD COCC[C@@H](C)Sc1ncc(C(=O)OC)s1 829680889 HRLYTVZSCUCCLA-SSDOTTSWSA-N 261.368 2.447 10 20 CECD Cc1ccc(CCNC(=O)c2cc(O)cs2)o1 732271498 ZJUBEXDHNHGYDT-UHFFFAOYSA-N 251.307 2.328 10 20 CECD CCc1cc(CN[C@@H]2CCc3cccc(O)c32)n[nH]1 834585168 HYLRPIVKJAFQNF-CYBMUJFWSA-N 257.337 2.455 10 20 CECD Oc1cccc2c1[C@@H](NCCOc1cccnc1)CC2 834585155 HLOYGSFZFNMPDX-AWEZNQCLSA-N 270.332 2.443 10 20 CECD C[C@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)c1cnccn1 905449366 TVOWDQAGGVNGCC-ZDUSSCGKSA-N 298.390 2.305 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2C)n(C)n1 734405606 UVZUCFRTWZCKFA-UHFFFAOYSA-N 286.379 2.033 10 20 CECD COc1ccc(O)c(CNc2nn3cc(C)nc3s2)c1 733994501 LQTDWRIPBSVWBA-UHFFFAOYSA-N 290.348 2.426 10 20 CECD CCc1cccc(CN2CCN(C)[C@H](C)[C@@H]2C)c1O 848904439 UBYXPMVYOVFWEM-OLZOCXBDSA-N 262.397 2.479 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C[C@@H](O)C1CC1 840949011 NWOKUHRIBFVDJP-MRXNPFEDSA-N 262.397 2.264 10 20 CECD CCc1cccc(CN2CCSC[C@H]2CCO)c1O 848889360 IURUDIKEENQJAQ-CQSZACIVSA-N 281.421 2.254 10 20 CECD Nc1ccc(CCNC(=O)NC[C@@H]2Cc3ccccc32)cc1 841726472 KHXWEYCYOJBLNQ-HNNXBMFYSA-N 295.386 2.450 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1cnc(N)s1 843058642 YNEUCUPKWNEAHS-UHFFFAOYSA-N 274.393 2.137 10 20 CECD O=C(O)CN(Cc1cc(Cl)cc(F)c1O)CC1CC1 844937343 UDTQFGFCLRZBGU-UHFFFAOYSA-N 287.718 2.481 10 20 CECD COc1cccc([C@@H](C)NCCCN(C)C)c1O 846136493 IZKCWCGPCKMVCM-LLVKDONJSA-N 252.358 2.003 10 20 CECD C[C@H]1CN(CCN[C@@H](C)c2ccc(Cl)cc2O)CCO1 841748368 XBISIOMNDISBJQ-RYUDHWBXSA-N 298.814 2.417 10 20 CECD CCC[C@@H](O)[C@@H](CO)NCc1ccc(N(CC)CC)cc1 842224702 FBXVXNGDBXAWHY-IAGOWNOFSA-N 294.439 2.144 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](CN(C)C)C1 840915580 RETFAQDWXMBZCV-HNNXBMFYSA-N 275.440 2.445 10 20 CECD CC(C)(C)C(=O)C(=O)NCc1cc(Cl)ccc1O 846477468 UKWFYISASNFJEK-UHFFFAOYSA-N 269.728 2.277 10 20 CECD C[C@H](N[C@@H](C)[C@H]1CN(C)CCO1)c1ccc(Cl)cc1O 841747808 DPLLQRQHFYGNDX-ZIBATOQPSA-N 298.814 2.415 10 20 CECD Cc1noc(CN(C)Cc2cc(Cl)ccc2O)n1 848927662 JWDSAZFAGZXIDD-UHFFFAOYSA-N 267.716 2.369 10 20 CECD CN(C)c1ccc(CNC[C@H](CO)CC2CC2)cc1F 850389404 WNWAPGNHSBHJOR-CQSZACIVSA-N 280.387 2.390 10 20 CECD O=C(O)[C@H](NCc1ccc2c(c1)CCO2)c1ccc(O)cc1 756362308 KWWQTOUVUBURRS-MRXNPFEDSA-N 299.326 2.243 10 20 CECD CC(=O)NCC1CCN(Cc2cc(C)cc(C)c2O)CC1 754722451 IKQHHSNIQZKJHU-UHFFFAOYSA-N 290.407 2.357 10 20 CECD C[C@H]1COC[C@@H]1NCc1cc(F)c(N(C)C)cc1F 922641303 ZZWFCFBONVZIKH-ZANVPECISA-N 270.323 2.155 10 20 CECD Cc1cc(CN2C(=O)CN(C)C2=O)c(C)n1-c1ccccc1 863533616 UKSJGDJTIUBFEQ-UHFFFAOYSA-N 297.358 2.488 10 20 CECD O=C(c1cccc(O)c1O)N1CCC(c2ncco2)CC1 862106983 AWHIXYWGYABHFE-UHFFFAOYSA-N 288.303 2.106 10 20 CECD COC[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862244233 KNPRLVUWEXECAM-LLVKDONJSA-N 284.350 2.499 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](C)OCC2CC2)c1 862758578 DIVURLBRAISMEW-LLVKDONJSA-N 263.337 2.132 10 20 CECD CC(C)N1CCC[C@H](N[C@H](C)c2ccccc2O)C1=O 879648182 BZFTVGORSKVCRC-OCCSQVGLSA-N 276.380 2.442 10 20 CECD Cc1cc(Br)c(O)c(CNCc2ncc[nH]2)c1 877672324 BVLSHMXDDOKTML-UHFFFAOYSA-N 296.168 2.476 10 20 CECD Nc1ccc(Cc2noc(C3(F)CCOCC3)n2)cc1 872172009 ZCKATPBXADRJDT-UHFFFAOYSA-N 277.299 2.218 10 20 CECD COc1ccc(N2CCC(NC[C@H]3C[C@H](O)C3)CC2)cc1 872126955 UJEMBQPVICMDFI-SAZUREKKSA-N 290.407 2.025 10 20 CECD C[C@H]1COCCCN1C(=O)NCc1ccc(N(C)C)cc1 772928634 NPRWJPKFMAQVSA-ZDUSSCGKSA-N 291.395 2.073 10 20 CECD Nc1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)cn1 876886599 ZZVHUZOZSWWZKN-UHFFFAOYSA-N 297.358 2.178 10 20 CECD CO[C@@H]1CCC[C@H]1CNC(=O)/C=C\c1ccc(O)c(O)c1 779545113 QEJIRQHJLIUDDM-PGGQVOCTSA-N 291.347 2.042 10 20 CECD C[C@H](NCc1ccno1)c1ccc(N2CCOCC2)cc1 775258112 QNDZQHWLDHMLJY-ZDUSSCGKSA-N 287.363 2.362 10 20 CECD COC(=O)[C@@H]1CCN(Cc2c(O)cccc2Cl)[C@H]1C 787420630 JRIPXIHIUUBXCV-VHSXEESVSA-N 283.755 2.429 10 20 CECD C[C@H](NC[C@@H]1CC[C@@H](O)C1)c1cc(F)cc(F)c1O 788984316 KNXPSXHCAJWXTA-IQJOONFLSA-N 271.307 2.482 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CCCCS2)c1 783590688 XRCVUNJWZJTPQV-CYBMUJFWSA-N 281.377 2.303 10 20 CECD C[C@H](Nc1ncc(C(=O)O)cn1)c1ccccc1O 1599902453 GCPMFXSERMCEOL-QMMMGPOBSA-N 259.265 2.054 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc3c(c2)CCCO3)[C@@H]1OC 893593819 PEZUENGGCMLEKV-UAGQMJEPSA-N 291.391 2.294 10 20 CECD Cc1nc([C@@H]2CCN(Cc3cc(F)cc(F)c3O)C2)n[nH]1 895013231 YUUNRFZGDVGGCU-SECBINFHSA-N 294.305 2.086 10 20 CECD CC(F)(F)CCC(=O)OCC(=O)c1ccc(O)c(O)c1 783007624 WWQLTEWPOZFUJR-UHFFFAOYSA-N 288.246 2.259 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1cc(C)cc(OC)c1O 895591591 BSTSTVGEDXMMDD-ZDUSSCGKSA-N 295.379 2.387 10 20 CECD C[C@H]1COC[C@H]1NCc1cc(Br)ccc1O 829431590 ISZSPOWFXDWUDC-GZMMTYOYSA-N 286.169 2.279 10 20 CECD CC(C)[C@H](CO)CNCc1cc(F)cc(F)c1O 708554099 GSAHZLKATIJKDO-JTQLQIEISA-N 259.296 2.025 10 20 CECD CCCn1ncnc1CN[C@@H](C)c1cc(OC)ccc1O 790325170 PCBYRNRJXHGBDF-NSHDSACASA-N 290.367 2.253 10 20 CECD C[C@]1(NC(=O)NCc2ccc(N)cc2)CCO[C@H]1C1CC1 1262603758 ULSJGTRTPPBHPW-HOCLYGCPSA-N 289.379 2.026 10 20 CECD CC[C@@H](F)C(=O)N(C)Cc1ccc(N(C)C)cc1 1346418383 SIFNJDURAVNOPO-CYBMUJFWSA-N 252.333 2.459 10 20 CECD CCCNCCN[C@H](C)c1cc(F)cc(F)c1O 1345482498 NCCKYGGEJJZVKU-SECBINFHSA-N 258.312 2.321 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@@H](c3ncc[nH]3)C2)cc1 1353538858 DZGABXCBJSMODP-CYBMUJFWSA-N 299.378 2.081 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](C(=O)O)C(C)C)c1 1604821253 USLAUGOMPSACDE-GXFFZTMASA-N 281.352 2.408 10 20 CECD O=C(O)[C@H](NCc1ccccc1O)c1cccs1 1601675923 GVRFXNDMQVSXJM-GFCCVEGCSA-N 263.318 2.369 10 20 CECD C[C@H](N[C@@H](C)c1ccc(F)cc1O)C(=O)N1CCCC1 228093783 YITPEAXFEDBNAT-QWRGUYRKSA-N 280.343 2.193 10 20 CECD Cc1ccc(C(=O)NCc2ccc(N(C)C)cc2)nc1 162932590 CMAGRQSHBQSLLX-UHFFFAOYSA-N 269.348 2.386 10 20 CECD C[C@H](N[C@@H]1CCCCNC1=O)c1ccc(N(C)C)cc1 37282684 VPZRJARNOYWIMO-SWLSCSKDSA-N 275.396 2.072 10 20 CECD COC1(CNCc2cc3c(cc2O)OCO3)CCCC1 296082381 QQUWEVXJHPCMAH-UHFFFAOYSA-N 279.336 2.170 10 20 CECD C[C@H](O)C[C@H](C)CNCc1cc(F)cc(F)c1O 708481392 RTSMLRBBGODRIH-IUCAKERBSA-N 259.296 2.167 10 20 CECD Cc1cc(/C=C2/SC(=S)N(CC(=O)O)C2=O)c(C)o1 6456323 LXLBHCWOJPLARI-RUDMXATFSA-N 297.357 2.182 10 20 CECD Cc1cccnc1NC(=O)NCCc1ccc(O)c(O)c1 172043705 QHIZUGUZCAEDLF-UHFFFAOYSA-N 287.319 2.165 10 20 CECD CN1CCCc2cc(CNC(=O)Nc3ccon3)ccc21 183606369 XCNUKBGZSKSDJF-UHFFFAOYSA-N 286.335 2.379 10 20 CECD COCCOC1CCN(Cc2cc(OC)ccc2O)CC1 180201216 MLIAQCCWKLLUCR-UHFFFAOYSA-N 295.379 2.028 10 20 CECD CCNC(=O)C(C)(C)NCc1ccc(N2CCCC2)cc1 312826028 HRDXYOZGXMGXOE-UHFFFAOYSA-N 289.423 2.291 10 20 CECD CC[C@H](CSC)NC(=O)c1ccc(C)c(O)c1O 182989083 QOEDSFFYGPJGMA-SECBINFHSA-N 269.366 2.278 10 20 CECD COCCCN(C)CCN[C@H](C)c1cc(OC)ccc1O 185553828 GQOJFIGGGHJSGP-CYBMUJFWSA-N 296.411 2.020 10 20 CECD CCNC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 46906147 YZCNDQCILZKTBL-ZDUSSCGKSA-N 278.352 2.103 10 20 CECD CCCN(CC(=O)NC)Cc1c(O)cccc1Cl 133294215 PGQYKCIFLJHKAF-UHFFFAOYSA-N 270.760 2.004 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C)S(=O)(=O)CC2)cc1C 191320836 WAPOWOCZYPGRLS-CYBMUJFWSA-N 297.420 2.018 10 20 CECD C[C@@H](CN)N(C)Cc1cc(Cl)cc(Cl)c1O 382981361 YSJYDXUQIRRINH-ZETCQYMHSA-N 263.168 2.478 10 20 CECD CCCN(Cc1ccccc1O)[C@@H](C)c1nncn1C 287821698 PRDYKWADMWVEEX-LBPRGKRZSA-N 274.368 2.494 10 20 CECD CC[C@H](N[C@H](CO)CCOC)c1ccc(C)cc1O 281764878 WOSIHVKHGAQDNI-JSGCOSHPSA-N 267.369 2.139 10 20 CECD CCOC1CN(Cc2ccc(N(C)C)c(F)c2)C1 297355617 GIKAZXFJZLJLGJ-UHFFFAOYSA-N 252.333 2.112 10 20 CECD Oc1ccc(F)cc1CN1CC[C@H](O)C12CCCC2 293957588 PQCYSGFDQBVRLI-AWEZNQCLSA-N 265.328 2.411 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C(C)C)[C@@H](C)N)c1 817996428 FFTIYWKOCAIGRS-ZETOZRRWSA-N 294.395 2.197 10 20 CECD COC(=O)[C@@H](NCc1cc(Cl)c(F)cc1O)C1CC1 816590186 SSXXFUZHAKOXLU-LBPRGKRZSA-N 287.718 2.226 10 20 CECD CN(C)c1ccc(CN(C[C@@H]2COCCO2)C2CC2)cc1 827443201 ZGYLIIJRJAXRDR-QGZVFWFLSA-N 290.407 2.132 10 20 CECD CCOc1ccc(N(C)CCNC(=O)NC(C)C)cc1 827936289 INQZRZYCPKPDFE-UHFFFAOYSA-N 279.384 2.229 10 20 CECD CC(C)(N)CCNCc1cc(Cl)cc(F)c1O 903938900 PKBJSLQFTGXMKD-UHFFFAOYSA-N 260.740 2.402 10 20 CECD CCC[C@H](C)NC(=O)NCc1cc(OC)ccc1O 734064593 JHPSFXULGSUOKD-JTQLQIEISA-N 266.341 2.389 10 20 CECD CCN(C)c1ccc(Cn2nc3ccccn3c2=O)cc1 747809677 RFKNWFUDAVBFLO-UHFFFAOYSA-N 282.347 2.000 10 20 CECD CC[C@H](C)[C@H](CNC(=O)NCCc1ccc(N)cc1)OC 841907606 DFBRGAWTRXSXPS-WFASDCNBSA-N 293.411 2.172 10 20 CECD Cc1noc(C)c1[C@H](C)C(=O)NCc1ccccc1O 749941422 LCJOXUMBGUYOLT-VIFPVBQESA-N 274.320 2.417 10 20 CECD COc1cccc(CN[C@H](CN)C2CCCCC2)c1O 841039244 GSTDJXQMIIVVNF-CQSZACIVSA-N 278.396 2.398 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2ccc(N(C)C)cc2C)C1 840916050 DTRDNSWXVXEYRW-QGZVFWFLSA-N 290.407 2.446 10 20 CECD CN(C)c1ccc(CN(C)c2ncccc2C(=O)O)cc1 920964944 ROGKMIKPAKBCLU-UHFFFAOYSA-N 285.347 2.482 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[S@](=O)[C@H](C)[C@@H]1C 840917411 JXYRZYAGYHGHSZ-MNVSYLFESA-N 294.464 2.402 10 20 CECD CC[C@](C)(CO)NCc1cc(F)c(N(C)C)cc1F 858122906 UCAQIGIUJPJBRS-CQSZACIVSA-N 272.339 2.281 10 20 CECD Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1cc(O)cs1 759464205 FBELZAPPWJPMNH-LBPRGKRZSA-N 291.376 2.473 10 20 CECD CCOc1ccc(CN2CCC[C@@H](CCO)C2)c(O)c1 769333280 JDCORKALGWMJGA-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD CC[C@@H](NC[C@H](O)COCC1CC1)c1ccccc1O 775416247 XMMGVVCFTUFQFX-DZGCQCFKSA-N 279.380 2.220 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCC[C@@H](C(=O)N(C)C)C1 877044976 MXTJDRUKESKTIK-ZIAGYGMSSA-N 290.407 2.437 10 20 CECD CCN(C)c1ccc(CN2CCC(C)(O)CC2)cc1 773766712 UPEIROJSTWJHMW-UHFFFAOYSA-N 262.397 2.490 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)C[C@@H](C)O1 245560682 MZLCGXNSFACEQF-DGCLKSJQSA-N 265.353 2.400 10 20 CECD CN(C)c1ccnc(CNCc2cc(F)ccc2O)c1 896299264 YGFYKFHURIRYJX-UHFFFAOYSA-N 275.327 2.282 10 20 CECD CN(C)C(=O)c1cc(N(C)Cc2ccccc2O)ccn1 786794232 YOSAYLBIWSMJIY-UHFFFAOYSA-N 285.347 2.125 10 20 CECD OC[C@@H]1CCCCCN1Cc1cc(F)cc(F)c1O 895151615 VBSUSSXRAVILKX-LBPRGKRZSA-N 271.307 2.407 10 20 CECD O=C(c1cc(O)cs1)N1CCC(CCCO)CC1 782876196 AFGCPDTZKYGKPO-UHFFFAOYSA-N 269.366 2.078 10 20 CECD COc1cc(C)cc(CNCCCCn2ccnc2)c1O 894199243 KRIVUCVVNOLNSH-UHFFFAOYSA-N 289.379 2.476 10 20 CECD CN(C)c1ccc([C@@H](CNc2cnccn2)N(C)C)cc1 897523218 RXKZTMKIRHCINX-OAHLLOKOSA-N 285.395 2.257 10 20 CECD COc1cc(C)cc(CNC[C@]2(O)CCC[C@@H]2C)c1O 894865128 MRJNXHJMXKNKFD-BLLLJJGKSA-N 279.380 2.350 10 20 CECD CCO[C@H]1C[C@@H](NCc2ccc(OC)c(OC)c2O)C1 894846626 SMTCJUANUBYZRY-TXEJJXNPSA-N 281.352 2.067 10 20 CECD COc1cccc(CNCCOC2CCC2)c1O 690702862 UCEGVFPQUBZBKD-UHFFFAOYSA-N 251.326 2.060 10 20 CECD OCCCNCc1cc(Cl)cc(Br)c1O 708157144 LLYLGZXQYBUGFU-UHFFFAOYSA-N 294.576 2.280 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@H](C(F)(F)F)C1 708382786 HWPDMBQHVHQTSU-JTQLQIEISA-N 297.223 2.434 10 20 CECD COC(=O)[C@@H]1CCC[C@H]1NCc1ccc(N(C)C)c(F)c1 1326280126 LSXLUVWWAZOWIA-TZMCWYRMSA-N 294.370 2.323 10 20 CECD Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)cc(C)n1 1335821579 ZBYRVHWHLQQWCM-UHFFFAOYSA-N 286.331 2.082 10 20 CECD CCOC(=O)[C@@H](NCc1cc(C)cc(OC)c1O)C1CC1 1338266061 YMOIPYKCXOKWKT-AWEZNQCLSA-N 293.363 2.141 10 20 CECD CC1(C)OC[C@H](CSc2ncc(C(=O)O)s2)O1 1604560327 RIVKCUUAUXYYEC-ZCFIWIBFSA-N 275.351 2.085 10 20 CECD Oc1cc(Cl)ccc1CN[C@H]1CC12CCNCC2 1580888768 YSGDUNATSGTXJW-ZDUSSCGKSA-N 266.772 2.277 10 20 CECD C[C@](CCF)(NCc1cc(Cl)ccc1O)C(=O)O 1592506276 JTWFTHVDEMPDNQ-GFCCVEGCSA-N 275.707 2.338 10 20 CECD COc1cccc(O)c1CN1C[C@H]2CC[C@H]1[C@@H](C(=O)O)C2 1599680479 SUKLUJTYNZUBTI-GVXVVHGQSA-N 291.347 2.086 10 20 CECD CCCCN(CCO)Cc1cccc(OCC)c1O 159093200 NOKRCXTYLFPSFH-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CCO[C@H]1C[C@@H](NCc2c(O)cccc2OC)C1 839147470 JVHSHNBDGNPPPS-PHIMTYICSA-N 251.326 2.058 10 20 CECD COCCOC[C@@H]1CCN(Cc2ccc(C)cc2O)C1 876774831 IGCYBVRUMAFGBH-CQSZACIVSA-N 279.380 2.186 10 20 CECD C[C@H](NCCOCCO)c1ccc2ccccc2c1O 20198674 XCTMEPANSSDTEG-LBPRGKRZSA-N 275.348 2.205 10 20 CECD Cc1cccc(CN[C@@H](C)c2nnc3n2CCC3)c1O 165016610 FJYAKHDIOABFEU-NSHDSACASA-N 272.352 2.089 10 20 CECD CCn1cc(CN[C@@H](C)c2ccc(C)cc2O)nn1 404470049 YEKHDDYTVXBLNU-NSHDSACASA-N 260.341 2.163 10 20 CECD CN(C)CCCCNCc1cc(F)cc(F)c1O 708440988 GQAIKYOWVKAGDQ-UHFFFAOYSA-N 258.312 2.102 10 20 CECD CCc1nnc(CNCc2cc(F)cc(F)c2O)s1 708535113 IEZUCISVXQGPEN-UHFFFAOYSA-N 285.319 2.374 10 20 CECD Cc1cc(CNCc2cc(F)cc(F)c2O)on1 708536003 SNJAEGLXBJZPBW-UHFFFAOYSA-N 254.236 2.257 10 20 CECD C[C@H](NCC1=CCN(C)CC1)c1ccc(F)cc1O 392222453 LLYHTAXZJJMTIV-NSHDSACASA-N 264.344 2.444 10 20 CECD Oc1c(Cl)cccc1CNCC[C@@H](O)C1CC1 898203106 RIXNKPCZJHXQBT-GFCCVEGCSA-N 255.745 2.296 10 20 CECD COc1cccc(CN2CCC[C@H]2CN2CCCC2)c1O 179645991 MHJWKUVRGBRBQO-HNNXBMFYSA-N 290.407 2.461 10 20 CECD COc1cccc(CNC(=O)C2[C@H]3CCC[C@H]23)c1O 178190127 QOMVGIVKNDDMSQ-QWRGUYRKSA-N 261.321 2.063 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CCC[C@H]1CCO 188423626 WMQZGLCQQXMVBI-JSGCOSHPSA-N 292.379 2.085 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)Nc3nnn[nH]3)c2C)c1 76963638 FMGGQWHIGJYYKB-UHFFFAOYSA-N 296.334 2.168 10 20 CECD COC(=O)COc1ccc(N(C)Cc2nccs2)cc1 183804930 KRMJKOHDVSDXOM-UHFFFAOYSA-N 292.360 2.331 10 20 CECD COc1cc(N(C)C[C@H](C)OC)cc(OC)c1OC 182189791 ZEQWJFUXEQAQGD-JTQLQIEISA-N 269.341 2.184 10 20 CECD Oc1c(Cl)cccc1CNC[C@@H]1CC[C@H](O)C1 187985872 VLIWGFPBZJPGGH-KOLCDFICSA-N 255.745 2.296 10 20 CECD CN(C)c1ccc(CNC(=O)CN2[C@H]3C=CC[C@H]2CC3)cc1 361910193 XNGMBFHVGIUPNG-IRXDYDNUSA-N 299.418 2.162 10 20 CECD CC[C@H](NCC1(N2CCOCC2)CC1)c1ccccc1O 278468813 NLYMIOXBFDCYIW-HNNXBMFYSA-N 290.407 2.298 10 20 CECD COC[C@H](CO)N[C@H](C)c1ccc(Cl)c(Cl)c1O 280840393 AMUACHAAKABINP-SFYZADRCSA-N 294.178 2.357 10 20 CECD Oc1cccc2c1[C@H](NCCCO[C@H]1CCOC1)CC2 297540143 DYWBIMHDKVUDBG-UONOGXRCSA-N 277.364 2.165 10 20 CECD CCc1cc(NC(=O)NCc2ccccc2O)nn1C 817341840 DABFKHPNJGDHPG-UHFFFAOYSA-N 274.324 2.010 10 20 CECD CC[C@@H](OC)C(=O)N[C@@H](C)c1cc(OC)ccc1O 728983060 SWRIVRQDROBIEU-TVQRCGJNSA-N 267.325 2.003 10 20 CECD C[C@@H](NC(=O)c1cccnc1N(C)C)c1ccccc1O 827930968 XGLWSMKDNXWXQA-LLVKDONJSA-N 285.347 2.344 10 20 CECD CNc1nc(C)ccc1C(=O)N(C)Cc1ccccc1O 901055365 NCGZMUVQWLSLDJ-UHFFFAOYSA-N 285.347 2.410 10 20 CECD Cc1ccc(CCNCc2cc3c(cc2O)OCO3)nc1 835064015 ADQNDOPFNRGDEN-UHFFFAOYSA-N 286.331 2.157 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@@H]3CCCCN3C2=O)cc1C 835073097 KYJJEDBYRVMRGV-GJZGRUSLSA-N 288.391 2.252 10 20 CECD CC(C)(CNC(=O)c1cc(O)cs1)N1CCCCC1 731864123 PSEGNPQNTMUIIX-UHFFFAOYSA-N 282.409 2.448 10 20 CECD Cc1cc(N(C)C)ccc1CNCCc1nccnc1C 840948235 CXJDQENPHGMMRQ-UHFFFAOYSA-N 284.407 2.492 10 20 CECD O=C(O)C12CCC(C(=O)NCc3ccccc3O)(CC1)C2 911327891 GEFBUCGHMSBWCH-UHFFFAOYSA-N 289.331 2.044 10 20 CECD CCN1CC[C@@H](N(C)C(=O)Cc2ccc(N)cc2)C[C@H]1C 844184972 BAFKKNMDHLRLBX-CZUORRHYSA-N 289.423 2.143 10 20 CECD Oc1ccc(Br)cc1CNC[C@H]1CCCCN1 841032337 CPXZDJQUHUWGEE-GFCCVEGCSA-N 299.212 2.386 10 20 CECD CCOCc1cc(CN[C@H](CN)C2CC2)ccc1OC 841027501 CKJWPYAOIXKFOT-OAHLLOKOSA-N 278.396 2.059 10 20 CECD COc1cccc(CN[C@@H](C)CCCCN)c1O 841080461 QFTMTMCIFQKLNH-NSHDSACASA-N 252.358 2.008 10 20 CECD CC[C@@H](NC/C=C/c1ccc(N(C)C)cc1)C(=O)O 840996400 MSTYRHGSVOXXTI-VBROQKIQSA-N 262.353 2.219 10 20 CECD CCN1C[C@@H](CN[C@H](C)c2cc(F)cc(F)c2O)CC1=O 846207811 GCOHLAXSCJDYMA-NXEZZACHSA-N 298.333 2.189 10 20 CECD CCc1nn(C)cc1C(=O)NCc1cc(Cl)ccc1O 846473960 OYTRGDQXDKOJMI-UHFFFAOYSA-N 293.754 2.272 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)CO1 842674398 ZYNOVGDNSLDXIS-ZYHUDNBSSA-N 252.333 2.159 10 20 CECD CC[C@@H]1CO[C@H](C)CN1Cc1cccc(OC)c1O 131504441 CNMVDKRPJPKOBB-DGCLKSJQSA-N 265.353 2.400 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1NC[C@@H]3C2 925499183 WRYYKOMXFRFZAN-XWJBARJFSA-N 285.435 2.147 10 20 CECD Cc1cccc(OC[C@@H](O)CN(C)c2ccc(N)cc2)c1 923399797 GDNISFYUKCLGPW-INIZCTEOSA-N 286.375 2.453 10 20 CECD CCn1cc(CNCc2c(O)ccc(Cl)c2F)nn1 850366904 NKIUPVCIPNHYSH-UHFFFAOYSA-N 284.722 2.086 10 20 CECD CCCCOCCNC(=O)NCc1cc(C)ccc1O 858162229 TUEIJWCVSMRKES-UHFFFAOYSA-N 280.368 2.317 10 20 CECD COc1ccc(N(C)CCN(C)[C@@H]2CCCC[C@H]2O)cc1 852210776 AOEMVXIYNSPAOJ-IAGOWNOFSA-N 292.423 2.367 10 20 CECD CN(C)c1cc(F)c(CNCC2(O)CCC2)cc1F 858133712 VPXIWCRINAMGOQ-UHFFFAOYSA-N 270.323 2.035 10 20 CECD CN(Cc1cc(F)c(N(C)C)cc1F)CC1(O)CCC1 862327157 ZQRDRFOISYROTC-UHFFFAOYSA-N 284.350 2.378 10 20 CECD COc1cc(CN2CC[S@](=O)[C@H](C)[C@H]2C)c(O)cc1C 768444567 CZZZSHDNBDVIEM-HTGLOVNISA-N 297.420 2.051 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](CN2CCCC2)C1 769473529 OWWKYHMTGOXERM-AWEZNQCLSA-N 290.407 2.319 10 20 CECD Cc1ncc(C)c(NC(=O)N(C)Cc2ccccc2O)n1 1117739038 YAFVYTXGMYOQHT-UHFFFAOYSA-N 286.335 2.463 10 20 CECD COC(=O)[C@H]1C[C@@H](C)CCN1Cc1ccccc1O 776000793 NPSCOCLQEKDHNZ-WCQYABFASA-N 263.337 2.166 10 20 CECD Cc1cc(COC(=O)/C=C/c2ccc(O)c(O)c2)on1 772777669 XBWPBMJEQQFLLK-HWKANZROSA-N 275.260 2.151 10 20 CECD C[C@@H](C(=O)N(C)c1ccc(N)cc1)N1CCCCCC1 877077621 OXPPPHSWDHJBKF-ZDUSSCGKSA-N 275.396 2.496 10 20 CECD COC(=O)C(C)(C)N(C)Cc1ccc(C)cc1O 876678374 LZJKVVPENHOGAX-UHFFFAOYSA-N 251.326 2.084 10 20 CECD CC[C@H](CSC)N(C)Cc1cc2c(cc1O)OC[C@@H]2O 773255041 LPXTXZKEUJGROW-RISCZKNCSA-N 297.420 2.391 10 20 CECD COc1cccnc1NCc1cccc(OC)c1O 776253153 JOSNNERDLPCCCJ-UHFFFAOYSA-N 260.293 2.417 10 20 CECD CC[C@](C)(CC(=O)OC)NCc1cc(F)cc(F)c1O 883027597 GZWYRMVGNRWYPO-CQSZACIVSA-N 287.306 2.492 10 20 CECD C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)c1ccco1 783838678 MGETYCPFVWQMHW-VIFPVBQESA-N 290.271 2.220 10 20 CECD CN(CC1=CCCOC1)Cc1cc(F)cc(F)c1O 1334375945 SQLWUGZHKQATBS-UHFFFAOYSA-N 269.291 2.449 10 20 CECD NCC1(CC(=O)NCc2c(O)cccc2F)CCCCC1 1341011738 MGTCAJJDSDRSGU-UHFFFAOYSA-N 294.370 2.447 10 20 CECD O=C(O)C[C@@H](NC(=O)c1cc(O)cs1)C1CCCC1 1601903782 FWBAPGIVWPSCST-SNVBAGLBSA-N 283.349 2.217 10 20 CECD Cc1ncc(COc2ccc(N(C)C)c(C(=O)O)c2)o1 1600738275 WOAKGFUIKWOKJZ-UHFFFAOYSA-N 276.292 2.326 10 20 CECD Cc1cccc([C@H](O)CNC(=O)NCc2ccc(N)cc2)c1 1579755590 WDWNTOVZNSYSNG-MRXNPFEDSA-N 299.374 2.110 10 20 CECD Oc1c(CNCC2[C@H]3CNC[C@H]23)ccc2ccccc12 1580885888 QWBCJVQWTRBBJD-HZPDHXFCSA-N 268.360 2.100 10 20 CECD CC1(C)CC(NCc2cc([N+](=O)[O-])ccc2O)(C(=O)O)C1 1776538305 BYWVWZSAMUNODO-UHFFFAOYSA-N 294.307 2.033 10 20 CECD CC[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)N(C)C 156319269 NBKRAXSNDQMRMY-HNNXBMFYSA-N 290.407 2.227 10 20 CECD Cc1cnc([C@H](C)NC(=O)c2cccc(O)c2O)s1 126525762 OOEZCRXMZQEKML-QMMMGPOBSA-N 278.333 2.354 10 20 CECD Cc1ccc([C@@H](C)NCCO[C@H]2CCOC2)c(O)c1 927079114 DMCMBUJNOGEORA-OLZOCXBDSA-N 265.353 2.157 10 20 CECD Oc1cccc2c1[C@H](NCCN1CCCCC1)CC2 296113956 UZKDFYPBIZBMAP-CQSZACIVSA-N 260.381 2.455 10 20 CECD CN(Cc1cc(F)ccc1O)CC1(N(C)C)CCC1 189008384 NUWJEKWWNGREOD-UHFFFAOYSA-N 266.360 2.447 10 20 CECD COc1cccc(CN2CCC[C@H](C)[C@H]2CCN)c1O 404429489 NTDWOENJCGIRKU-GXTWGEPZSA-N 278.396 2.350 10 20 CECD C[C@H](N[C@H](CO)CC(F)F)c1ccc(F)cc1O 717768263 MTOPEPDLVDHPJW-CBAPKCEASA-N 263.259 2.198 10 20 CECD C[C@@H](NC(=O)CC1CCN(C)CC1)c1ccccc1O 827940852 JKRSLNWGZOKMEP-GFCCVEGCSA-N 276.380 2.301 10 20 CECD CN1CCCc2cc(CNC(=O)NCC3CC3)ccc21 58557560 BVCDBWMDMONFPU-UHFFFAOYSA-N 273.380 2.278 10 20 CECD Cc1ccc(C(=O)Nn2cnc3ccccc32)c(O)c1O 177663603 KUSTXLYWDDVZSG-UHFFFAOYSA-N 283.287 2.140 10 20 CECD COc1cccc(CNc2ncc(Cl)cn2)c1O 301475900 AUYBZDQEBLBGIS-UHFFFAOYSA-N 265.700 2.456 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1cc(C)ccc1O 179895062 FSNIBCPGMJWVGS-ZDUSSCGKSA-N 263.337 2.228 10 20 CECD C[C@@H](CNCc1c(O)cccc1Cl)CN1CCOCC1 120293422 OMARJPGEFXYGLO-LBPRGKRZSA-N 298.814 2.104 10 20 CECD CN(C)c1ccc(CNc2nnc3ccccn23)cc1 120989752 IXASIUCKZPETNH-UHFFFAOYSA-N 267.336 2.407 10 20 CECD COCc1ccc(CNC(=O)c2cccc(O)c2O)cc1 186907871 RUXMSRKJCHONDK-UHFFFAOYSA-N 287.315 2.174 10 20 CECD Cc1cnc(C(=O)NCCCSc2nccs2)cn1 78713476 BXHUUOHYTPOYOK-UHFFFAOYSA-N 294.405 2.154 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2cccc(C)c2O)C1 186475876 CUSWTPBQYZDYDY-CYBMUJFWSA-N 278.352 2.021 10 20 CECD CN(CCO[C@H]1CCCCO1)c1ccc2c(c1)OCO2 181773849 IEBDQLNENDMMAT-HNNXBMFYSA-N 279.336 2.395 10 20 CECD COCCCOCCN(C)Cc1cc(C)c(C)cc1O 91026216 UWMQYDQLWVLZAT-UHFFFAOYSA-N 281.396 2.494 10 20 CECD COc1cccc(CN[C@@H](CO)c2ccc(F)cc2)c1O 265256291 PUUGYMVVIXAXKA-AWEZNQCLSA-N 291.322 2.363 10 20 CECD Cc1ccc(O)c(CN2C[C@@H](C)O[C@]3(CCCOC3)C2)c1 366449956 FZAVJLWYZCDTCS-RHSMWYFYSA-N 291.391 2.471 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H]1c1ncc[nH]1 364997174 WMACOUXBJVULNG-FVOPLDGLSA-N 299.330 2.198 10 20 CECD CCNC(=O)[C@@H](C)N[C@H](C)c1cc(Cl)ccc1O 273407106 ORFPYTFZRLAYES-RKDXNWHRSA-N 270.760 2.221 10 20 CECD C[C@@]1(CNC(=O)c2cccc(O)c2O)CCO[C@H]1C1CC1 370497086 AGYDRXSWERKPNB-HOCLYGCPSA-N 291.347 2.033 10 20 CECD COC(=O)[C@]12CCC[C@H]1CN(Cc1cccc(C)c1O)C2 374675390 DBAQEYNJQKLPHJ-YOEHRIQHSA-N 289.375 2.476 10 20 CECD COc1cc(O)c(CN(C)[C@H]2CCCOC2)cc1OC 809692705 FCUXEPPGVOSWMI-LBPRGKRZSA-N 281.352 2.020 10 20 CECD Cc1c(CNC(=O)CN2CC[C@@H](C)C2)n(C)c2ccccc12 565201497 MGFWPXLSEVHZTJ-CYBMUJFWSA-N 299.418 2.445 10 20 CECD CN(C)c1ccc(CNC(=S)NC2CCC2)cc1 814190805 CNBXBBJQLUUSEP-UHFFFAOYSA-N 263.410 2.269 10 20 CECD Cc1cc(CN(C)C[C@H](O)C2CC2)ccc1N(C)C 815060822 UNFHQWNDMFWCMO-INIZCTEOSA-N 262.397 2.264 10 20 CECD O=C(COc1cc(F)cc(F)c1)NCc1ccccc1O 810276018 ZMITVQVHCBOVDF-UHFFFAOYSA-N 293.269 2.366 10 20 CECD C[C@H](NC[C@H]1CNCCO1)c1ccc2ccccc2c1O 817983946 SFDIYOHILYMPNX-GXTWGEPZSA-N 286.375 2.184 10 20 CECD Cc1cc(O)c(CN[C@@H](C)CN2CCOCC2)cc1Cl 825114719 VTDIRDHYFNKYMO-LBPRGKRZSA-N 298.814 2.164 10 20 CECD O=C(NC[C@@H]1C[C@H]1C1CCC1)c1c(F)ccc(O)c1O 822376372 RZWNJLXTUVOZGR-UWVGGRQHSA-N 279.311 2.403 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H](C(N)=O)C2)cc1Cl 824474769 SFNMZSLUWNRBHF-SNVBAGLBSA-N 282.771 2.051 10 20 CECD CC[C@@]1(C)CCN(C(=O)c2c(F)ccc(O)c2O)C1 826882389 JTPXIYIMWTXMRK-AWEZNQCLSA-N 267.300 2.499 10 20 CECD C[C@@H](Oc1ccccn1)C(=O)NCc1ccc(N(C)C)cc1 823730073 QJZJOPJKHSWSSY-CYBMUJFWSA-N 299.374 2.231 10 20 CECD Cc1nc(/C=C2\SC(N3CCCCC3)=NC2=O)[nH]c1C 901436733 ZHIJWACZFLZVOF-FLIBITNWSA-N 290.392 2.483 10 20 CECD CC[C@H](CN1CCOCC1)N[C@H](C)c1ccccc1O 903343204 NMUCIGPNYHIDTD-ZIAGYGMSSA-N 278.396 2.154 10 20 CECD CCOc1ccc(CNCCc2cnc(C)cn2)c(O)c1 835061504 MEZBLELHUBFRGF-UHFFFAOYSA-N 287.363 2.222 10 20 CECD COc1ccc(O)c(CNc2cccnc2[N+](=O)[O-])c1 733994153 BDFVCYRCMHNEDG-UHFFFAOYSA-N 275.264 2.316 10 20 CECD O=C(c1cc(O)cs1)N1CCc2ccccc2[C@H]1CO 831278710 KYDFDJZEWNNLTN-CYBMUJFWSA-N 289.356 2.186 10 20 CECD C[C@@H](CC(=O)NC[C@H](N)c1ccc(N(C)C)cc1)C1CC1 832281587 UNXOVSDFYAYCNB-LRDDRELGSA-N 289.423 2.305 10 20 CECD Cc1cc(Br)c(O)c(CNCC(C)(C)N)c1 841030398 HKMKIBBUKSQKLB-UHFFFAOYSA-N 287.201 2.290 10 20 CECD CC(C)(C)CN1C(=O)C(C)(C)N[C@@H]1c1ccc(O)c(O)c1 840828540 UDJMYAANHBWART-ZDUSSCGKSA-N 292.379 2.353 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)c1ccco1 840928742 HTBKFHBLMGZPAN-OAHLLOKOSA-N 274.364 2.477 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2cc(Cl)ccc2O)CO1 846473476 LPFUKDHZWUKLPE-PSASIEDQSA-N 269.728 2.087 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCc2cc(Cl)ccc2O)C1 843039002 LXUXGUBHCFIGRX-KCJUWKMLSA-N 269.728 2.389 10 20 CECD C[C@H](CCO)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 846109537 FDGZNQAKSSILIT-MRVPVSSYSA-N 288.731 2.157 10 20 CECD CCc1noc([C@@H](C)OC(=O)c2ccc(C)c(O)c2O)n1 744909595 JOZCZNFBLREIKV-MRVPVSSYSA-N 292.291 2.270 10 20 CECD CCC(F)(F)C(=O)NCc1ccc(N(C)C)cc1 854271550 LDGPKQSTLLDSAX-UHFFFAOYSA-N 256.296 2.414 10 20 CECD CC(C)C(=O)NCCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756371655 MIGASMHWYMTHJX-JQWIXIFHSA-N 294.370 2.441 10 20 CECD C[C@@H]1C[C@H](N[C@H]2C[C@H](O)C2)c2c(O)ccc(F)c21 850577577 ANMUZPOEPFPZJQ-CDLYGTGVSA-N 251.301 2.193 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@H](C)c1ccc(F)cc1O 760883552 CEIWMARKRCRJHI-WDBKCZKBSA-N 283.343 2.376 10 20 CECD Cc1ccc(CN2CCC[C@H](Cn3ccnn3)C2)c(O)c1 876815276 WGUUSDJZCOCJGD-AWEZNQCLSA-N 286.379 2.204 10 20 CECD CC(C)[C@H](CN)CN1CCCc2cc(CN)ccc21 873202340 XMTMFJDMNVPDDU-OAHLLOKOSA-N 261.413 2.129 10 20 CECD Cc1nccc(N2CCN(Cc3c(C)cccc3O)CC2)n1 877347364 VGCIEVCDBNVELD-UHFFFAOYSA-N 298.390 2.121 10 20 CECD Cc1cc(CN[C@@H]2C[C@H](O)C2(C)C)ccc1N(C)C 779414351 XTCDKBXTMKXRIO-CABCVRRESA-N 262.397 2.310 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@H](C)c1ccc(N(C)C)cc1 773130268 HUAXDAGWXJSHSI-WQVCFCJDSA-N 289.423 2.318 10 20 CECD CC[C@H](CNCc1ccc(N2CCC(O)CC2)cc1)OC 877542103 VKOUILOEVSEJSC-QGZVFWFLSA-N 292.423 2.162 10 20 CECD CC(C)N1CCCN(Cc2cc(F)ccc2O)CC1 272227759 DFVKDELJXFDIJH-UHFFFAOYSA-N 266.360 2.447 10 20 CECD CN1CC[C@H]1CNCc1ccc2ccccc2c1O 896595427 RMSUNXHXVQXVOE-AWEZNQCLSA-N 256.349 2.339 10 20 CECD O=C(NC[C@@H](CO)CC1CCCC1)c1cc(O)cs1 799182432 FXLUTCXEJUJVRR-NSHDSACASA-N 283.393 2.372 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)Cc1ncc[nH]1 894586908 LURLURZDQBGYFL-UHFFFAOYSA-N 258.369 2.416 10 20 CECD CN1CCN(c2ccc(CNC/C=C/Cl)cc2)CC1 898434000 REFIRKJOBKXZLL-FARCUNLSSA-N 279.815 2.281 10 20 CECD O[C@@H](CNCc1ccc(N2CCCC2)cc1)C1CC1 71301771 VWRUYSGNNFFBPZ-INIZCTEOSA-N 260.381 2.147 10 20 CECD CC(C)(O)CNCc1c(O)cccc1Br 706828461 DRZYDMKZYIXXGI-UHFFFAOYSA-N 274.158 2.015 10 20 CECD COc1cc(C)cc(CN2CCC[C@](C)(O)CC2)c1O 794672452 MMLWLFQPYKIZTA-INIZCTEOSA-N 279.380 2.446 10 20 CECD C[C@@H](NC(=O)NOCC(F)F)c1ccc(N(C)C)cc1 793061640 LQOSUQSMFLKTEW-SECBINFHSA-N 287.310 2.310 10 20 CECD CCC(C)(C)N[C@@H](C)C(=O)NCc1ccc(OC)cc1O 794388243 SDWWQOLKSJORDL-NSHDSACASA-N 294.395 2.184 10 20 CECD CC(C)OCCCN(C)C(=O)NCc1ccc(N)cc1 1335723870 CDUIJAFBQMKNBR-UHFFFAOYSA-N 279.384 2.225 10 20 CECD CC(C)CN1CC(=O)N[C@H]1c1ccc(N2CCCC2)cc1 1337564304 QCCKSNOFYFFILY-QGZVFWFLSA-N 287.407 2.373 10 20 CECD O=C(O)[C@@H]1CCC[C@@H]1NCc1cc(F)cc(F)c1O 1262163298 NZJBSUSHPYKZLY-KOLCDFICSA-N 271.263 2.013 10 20 CECD C[C@@H](NCc1ccnc(F)c1)c1cc(C(=O)O)ccc1O 1593302876 AUKCYMBDVARSBU-SECBINFHSA-N 290.294 2.475 10 20 CECD CCOc1ccc(N(C)CCCCS(C)(=O)=O)cc1 163589129 IEUNIKXZIHSPQJ-UHFFFAOYSA-N 285.409 2.346 10 20 CECD CCOc1cccc(CNCC2CC3(C2)OCCO3)c1O 922798309 KKMDFNLJMZJWSF-UHFFFAOYSA-N 293.363 2.034 10 20 CECD C[C@@H](NC(=O)[C@H]1CC[C@@H](N)CC1)c1ccccc1O 870988316 MGZSGATXOHLYQL-UTUOFQBUSA-N 262.353 2.087 10 20 CECD CO[C@H](CNC(=O)Cc1ccc(N)cc1)C1CCCC1 703036806 JQVPOGQKOADARN-OAHLLOKOSA-N 276.380 2.133 10 20 CECD COc1ccc(CN[C@H]2CSC[C@@H]2C)c(O)c1 397913091 ZEJUJFLNBOYMCW-CABZTGNLSA-N 253.367 2.242 10 20 CECD CC[C@@H](O)CCNC(=O)NCc1ccc(N(C)C)cc1C 305085416 TZYXNDUYCWTFHT-OAHLLOKOSA-N 293.411 2.021 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@@]1(C)CCOC1 124834106 KXRGNMABGJFQKY-INIZCTEOSA-N 291.395 2.039 10 20 CECD Cc1ccoc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183474115 PJDWMSHWOZVSKO-JTQLQIEISA-N 275.304 2.360 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](C)N(C)C)c1 38088604 DAXLOCSNWZXRGZ-GHMZBOCLSA-N 252.358 2.002 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)cc(O)n1 183503974 SSQAGSWDAYKENJ-UHFFFAOYSA-N 299.374 2.434 10 20 CECD CCCOc1ccc(CNc2nc(C)no2)c(O)c1 181521851 ZHSMBFZSJBQGON-UHFFFAOYSA-N 263.297 2.485 10 20 CECD C[C@@H]1CC[C@H](CCC(=O)NCCc2ccc(O)c(O)c2)O1 122189919 JWIIVBXOXQORSD-DGCLKSJQSA-N 293.363 2.104 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)C(=O)NC(C)C)c(O)c1 228931854 XLHCPRRIQHBUKM-NEPJUHHUSA-N 264.369 2.264 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C1(N)CC1 88130905 GCHVNEMDSLOISK-UHFFFAOYSA-N 287.407 2.127 10 20 CECD CN1CCC(NCc2c(O)cccc2Cl)CC1 89647962 PWYAWZBYYVNFBI-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CCOC1CC(CC(=O)NCc2cc(OC)ccc2O)C1 190724728 FLHZEHKQJQTFBV-UHFFFAOYSA-N 293.363 2.222 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(C(C)C)C1)c1ccccc1O 274896956 KKEIOEODQYCGTR-GXTWGEPZSA-N 276.380 2.442 10 20 CECD CCCc1nc(C(=O)NCc2cccc(OC)c2O)co1 273666717 IQFKMTHRAGJXAF-UHFFFAOYSA-N 290.319 2.271 10 20 CECD COCCn1cc(CN[C@@H](C)c2ccccc2O)cn1 281913001 ACYQZNGRUKBCOG-LBPRGKRZSA-N 275.352 2.086 10 20 CECD CCc1nn(C)c(Cl)c1C(=O)NCc1ccc(N)cc1 297249724 QNKAHURQWKNIAI-UHFFFAOYSA-N 292.770 2.148 10 20 CECD C[C@H](N[C@H]1CCC[C@H](N)C1)c1ccc(F)cc1O 817970507 XTVNDIYGVURCKF-DLOVCJGASA-N 252.333 2.452 10 20 CECD Cc1cccc(CN[C@@H]2CCC[C@H]([S@](C)=O)C2)c1O 826911112 RZYHCWRDEMVMMP-TYILLQQXSA-N 281.421 2.480 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)C[C@H]1COCCO1 827141559 UKNXCXWXBKELKG-NSHDSACASA-N 289.734 2.032 10 20 CECD CO[C@]1(C)C[C@@H](NC(=O)c2cc(O)cs2)C1(C)C 829414584 CYVLMEWVJCZMCF-ZWNOBZJWSA-N 269.366 2.387 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCOC1 822834271 WKAWIOKFCSEJGP-DZGCQCFKSA-N 290.407 2.145 10 20 CECD CC(C)(C)[C@H](CC(=O)O)NCc1ccccc1O 905790429 SQGLWIDVZVGLFF-LBPRGKRZSA-N 251.326 2.371 10 20 CECD C[C@@H]1CCCN1CCN[C@@H]1CCc2cccc(O)c21 834607294 SOAICJUTTUJCBC-TZMCWYRMSA-N 260.381 2.453 10 20 CECD O=C(NCCC[C@H]1CCOC1)NCc1ccccc1O 836646132 DDGYPZMEEALSDZ-LBPRGKRZSA-N 278.352 2.008 10 20 CECD COC(=O)c1cnc(SCc2cc(C(C)=O)no2)s1 848438380 DZOCTNWWXNQZLN-UHFFFAOYSA-N 298.345 2.413 10 20 CECD Cc1cc(Br)c(O)c(CN2CCC[C@H](N)C2)c1 843043858 MCEFREVWBIHRMB-NSHDSACASA-N 299.212 2.386 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCS[C@H]2C)c(O)c1O 844109094 VDAMNRLIHYFEGE-WPRPVWTQSA-N 267.350 2.030 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H]1CCCNC1 843069982 UNEZKDPQCNNHQX-ZDUSSCGKSA-N 260.381 2.447 10 20 CECD COc1cc(O)c(CN[C@@H](CN)C2CCCC2)cc1OC 841087502 OUPMIHZZCHLJPB-ZDUSSCGKSA-N 294.395 2.017 10 20 CECD CN1CCN=C1NCc1cc(Cl)cc(Cl)c1O 849028133 BXFAOXDXNDRDCY-UHFFFAOYSA-N 274.151 2.090 10 20 CECD Cc1cnc(CCNC(=O)c2cc(O)cs2)c(C)c1 848390944 LSDHRJIDUWFEQM-UHFFFAOYSA-N 276.361 2.438 10 20 CECD COc1ccc(CN[C@@H]2CCN(CC(F)F)C2)cc1C 841893229 BXDLIMTZVOKVDA-CYBMUJFWSA-N 284.350 2.433 10 20 CECD CN(CC1=CCSC1)C(=O)NCCc1ccc(N)cc1 851664924 LTPMUSMKYJGGOF-UHFFFAOYSA-N 291.420 2.126 10 20 CECD Cc1ccc(O)c(CNCC(C)(C)[C@]2(O)CCCOC2)c1 850400439 HZBIFNFJRICKIZ-KRWDZBQOSA-N 293.407 2.358 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)CC(F)(F)F)cc1C 756993453 AZIUGLAZXXIFBW-LLVKDONJSA-N 277.286 2.412 10 20 CECD COc1cc(CNCC[S@](C)=O)c(O)c(C(C)(C)C)c1 850138209 AMKUMMYGMBBPMA-FQEVSTJZSA-N 299.436 2.166 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 756732552 JCGCIAWPGMKELQ-ZJUUUORDSA-N 289.322 2.373 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)[C@](C)(CO)C2)c1O 852701910 VTONRMMJIFCCOI-HWPZZCPQSA-N 295.354 2.184 10 20 CECD C[C@H]1C[C@@H](N[C@H](C)C(=O)N(C)C)c2c(O)ccc(F)c21 756737709 YHBUYEVPZBZECC-IQJOONFLSA-N 280.343 2.146 10 20 CECD CC(C)[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O 768441714 GPDILEMOADUJQJ-HIFRSBDPSA-N 277.364 2.438 10 20 CECD CC[C@H](N[C@@H]1CCCN(C)C1=O)c1ccc(N(C)C)cc1 766435876 BJVONMVJVRJFTI-JKSUJKDBSA-N 289.423 2.414 10 20 CECD COc1cccc(O)c1CN(C)CC(=O)OC(C)(C)C 769233355 SJZJXJAIXXHLOW-UHFFFAOYSA-N 281.352 2.174 10 20 CECD C[C@H](Cc1cnn(C)c1)NCc1ccc(N(C)C)c(F)c1 768404065 UQEMQDZRUFLRAG-GFCCVEGCSA-N 290.386 2.346 10 20 CECD C[C@@H](N[C@H](CCO)C1CCOCC1)c1ccc(F)cc1O 763557095 BFQOVOHGNTVIRT-IAQYHMDHSA-N 297.370 2.360 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H](O)COCC2CC2)c(O)c1 788584283 NIFVZRJSEJXWJR-DZGCQCFKSA-N 293.407 2.447 10 20 CECD C[C@H](N[C@H](C)CC[S@@](C)=O)c1c(O)cccc1F 886551199 DJSQZKRYLPAPMP-AUSHCKSDSA-N 273.373 2.339 10 20 CECD Cc1ncc(CCNC(=O)c2ccc(C)c(O)c2O)s1 780985839 IGBDMBUEDPOITB-UHFFFAOYSA-N 292.360 2.144 10 20 CECD COCc1nccc(NCc2ccc(N(C)C)cc2)n1 891579035 TXUCYRMWMJZOKC-UHFFFAOYSA-N 272.352 2.301 10 20 CECD Cc1ccc(CN[C@H](C)c2ccc(F)cc2O)c(=O)n1C 786928205 BNVKLVYCCZZRGE-LLVKDONJSA-N 290.338 2.389 10 20 CECD CCN1CCC[C@@H]1CNCc1cc(C)cc(OC)c1O 894139076 AQDGAEKKVJQJQZ-CQSZACIVSA-N 278.396 2.283 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCC2(O)CCC2)c1 793562710 AOKYUSUEPMZYEA-NSHDSACASA-N 293.363 2.135 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOC[C@H]1C1CC1 1334350395 SSZVRWCVJADWKC-ZDUSSCGKSA-N 269.291 2.281 10 20 CECD CC1=NO[C@](C)(C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1335561304 ZFSZYADFTARTTN-INIZCTEOSA-N 289.379 2.266 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(C(=O)O)cc1 1601239304 WQRUNPBXKXOSEQ-WAPJZHGLSA-N 299.282 2.448 10 20 CECD Cc1ccc(O)c([C@H](C)NCCc2ccn(C)n2)c1 230897835 ODHAWFSWYMPXAJ-LBPRGKRZSA-N 259.353 2.327 10 20 CECD CN(C)c1ccc(OCC(=O)OC(C)(C)C)cc1C(=O)O 1598328013 BALJSRXHYGXMQO-UHFFFAOYSA-N 295.335 2.171 10 20 CECD CCOc1cccc(CN(C[C@H](C)C(=O)O)C2CC2)c1O 1597153146 AEDYIMMTIIYSPB-NSHDSACASA-N 293.363 2.476 10 20 CECD CCOc1ccc(CN2CCC[C@@H]2CC(=O)O)c(O)c1 1597102164 PWBBTBYKFNDAAZ-GFCCVEGCSA-N 279.336 2.230 10 20 CECD Cc1cc(N(C)C)ccc1CN(CC(=O)O)CC1CC1 1594311011 ASTORMWIFMMKLE-UHFFFAOYSA-N 276.380 2.358 10 20 CECD CC[C@@H](N[C@@H](C)c1cc(F)cc(F)c1O)C(=O)O 1593607200 OJEUFWFHNCDICL-QUBYGPBYSA-N 259.252 2.184 10 20 CECD C[C@H](NCc1nccs1)c1cc(C(=O)O)ccc1O 1593316472 IAQBLYRJUDEANK-QMMMGPOBSA-N 278.333 2.398 10 20 CECD C[S@@](=O)C1(CNCc2ccc3c(c2)CCCO3)CC1 922099693 MMRNVVBOLSIJMQ-LJQANCHMSA-N 279.405 2.012 10 20 CECD Oc1cc2c(cc1CNC[C@H]1CCCCS1)OCO2 157997520 FILDRQRUEZVMNG-LLVKDONJSA-N 281.377 2.496 10 20 CECD C[C@H]1OCC[C@@]1(C)NCc1cc(F)cc(F)c1O 708438235 WITQWWDZZMHQGV-AMIZOPFISA-N 257.280 2.328 10 20 CECD C[C@@H]1CCCN(C(=O)CN(C)Cc2ccccc2O)C1 111236477 RPFFRVNXDPJMMV-CYBMUJFWSA-N 276.380 2.083 10 20 CECD Oc1ccccc1CN1CCC[C@H](c2nnc3n2CCC3)C1 179570897 PWFIUDSCKGHHHW-AWEZNQCLSA-N 298.390 2.310 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCO[C@H]2CCOC2)c1 182392020 PUCSOOFZWJBXFE-OCCSQVGLSA-N 295.379 2.247 10 20 CECD Cc1ccc(O)c([C@H](C)NCCSCCCO)c1 185378650 ONALHQRZFWREPX-LBPRGKRZSA-N 269.410 2.467 10 20 CECD CN(C)CCN(C(=O)Cc1ccc(N)cc1)C1CCCC1 37825032 GFEVFIGEUNLQIY-UHFFFAOYSA-N 289.423 2.144 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H]([C@H](C)O)C2)c1O 184744327 CKMBZUWKEFSKKA-VHSXEESVSA-N 285.771 2.257 10 20 CECD COc1cc(O)c(CN2CCOC[C@@H]2C2CC2)cc1OC 180426108 GLEREGQWIDJGBU-CYBMUJFWSA-N 293.363 2.020 10 20 CECD COc1cc(O)c(CNC[C@@]2(C)CCCO2)cc1OC 182641046 UCXAAGUSZOGGQG-OAHLLOKOSA-N 281.352 2.068 10 20 CECD C[C@H](CO)CNCc1cc(Cl)cc(Cl)c1O 82367475 MEIZGFBQVHLLOC-ZETCQYMHSA-N 264.152 2.417 10 20 CECD CC(=O)CC(C)(C)CC(=O)NCCc1ccc(O)c(O)c1 191922382 WQSKURZWPAUGDK-UHFFFAOYSA-N 293.363 2.152 10 20 CECD CO[C@@H](C)CS(=O)(=O)Nc1cc(C)c(O)c(C)c1C 193343484 IUSGZKUTRVWVKC-VIFPVBQESA-N 287.381 2.094 10 20 CECD COC[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 271158841 DZNYRJVYXQAKJB-CYBMUJFWSA-N 266.360 2.360 10 20 CECD CC[C@H](NC[C@H](CO)[C@@H]1CCOC1)c1ccc(C)cc1O 280888533 OVYRROWTAUOJKB-FMKPAKJESA-N 293.407 2.386 10 20 CECD COc1cc(C(C)=O)ccc1SCC(=O)C(C)=O 289583555 IVYCMZLNIKCLFS-UHFFFAOYSA-N 266.318 2.148 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](c3nccn3C)C2)c1 377887665 GODMANCTRTYKAO-CYBMUJFWSA-N 271.364 2.424 10 20 CECD CC[C@H](NC[C@@H](CO)[C@@H]1CCOC1)c1ccc(F)cc1O 286937154 BAKKRVMJXDGVLM-XUJVJEKNSA-N 297.370 2.217 10 20 CECD C[C@@H](O)C[C@H]1CCCCN1Cc1cc2c(cc1O)OCO2 280471514 NBTIDOCMEVDNAZ-DGCLKSJQSA-N 293.363 2.246 10 20 CECD COCCO[C@@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1 294633342 PJXFEJQXUTWLPT-MRXNPFEDSA-N 292.423 2.298 10 20 CECD C[C@H](NCc1nc(C2CC2)n[nH]1)c1ccc(F)cc1O 296365748 IYNXREODYXLYKX-QMMMGPOBSA-N 276.315 2.378 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2cc(F)ccc21 801545188 JJNKGHCFRSAASK-UHFFFAOYSA-N 273.263 2.440 10 20 CECD CCC[C@H](OC)C(=O)N1CCOc2cc(N(C)C)ccc21 295481480 ZUCFCJRTNGFUQL-AWEZNQCLSA-N 292.379 2.293 10 20 CECD C[C@@H](NC[C@@H]1CCCNC1)c1ccc(N(C)C)cc1 817946164 SRKYJKAKMOZYEQ-ZIAGYGMSSA-N 261.413 2.403 10 20 CECD C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc2ccccc2c1O 817977645 MTBQIXYPIZABKG-MZORAGNBSA-N 268.360 2.414 10 20 CECD Cc1cc(O)c(CN2CC(=O)N(C)C[C@H]2C)cc1Cl 825628587 AYZXHOZZUQQLIL-SNVBAGLBSA-N 282.771 2.017 10 20 CECD C[C@@H](NC(=O)c1cn2c(n1)CCCC2)c1ccccc1O 827946686 ONDXBDFVVWZUPM-LLVKDONJSA-N 285.347 2.416 10 20 CECD CC[C@H](NCc1ccc(N2CCCCC2)cc1)C(=O)NC 825315866 HCIGJVJAICSZJD-INIZCTEOSA-N 289.423 2.291 10 20 CECD CCCn1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 588405707 LUCRMLXMAALVRP-XQRVVYSFSA-N 287.319 2.356 10 20 CECD CCn1ccnc1[C@H](C)NCc1cc([N+](=O)[O-])ccc1O 825004974 AMGYSVYNIMUHAB-JTQLQIEISA-N 290.323 2.368 10 20 CECD CC(C)(C(=O)NCc1ccccc1O)N1CCCCC1 907055711 HMTJKCIMCWIMPL-UHFFFAOYSA-N 276.380 2.273 10 20 CECD CCc1noc(NC(=O)N(C)Cc2ccccc2O)n1 821498575 KUDPFJJHIHYFPF-UHFFFAOYSA-N 276.296 2.002 10 20 CECD Cc1nccn1C[C@@H](C)CNC(=O)c1cc(O)cs1 732274138 CVPUVEQJAPAYMC-VIFPVBQESA-N 279.365 2.025 10 20 CECD Cc1coc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 907273075 KOEIGJKDRIROJG-SNVBAGLBSA-N 275.304 2.360 10 20 CECD Cc1ccc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)cc1 832283706 AIWGMFMYFAGMDO-QGZVFWFLSA-N 297.402 2.491 10 20 CECD C[C@H](NCc1ccc(N2CCCC2)cc1)c1cn(C)nn1 902742468 QPNMMGISJGPJKO-ZDUSSCGKSA-N 285.395 2.266 10 20 CECD CN(CCn1cc(Cl)cn1)c1ccc2c(c1)OCO2 838901072 NOXIUQOPYYNPHS-UHFFFAOYSA-N 279.727 2.402 10 20 CECD C[C@H](C(=O)NCc1cc(Cl)ccc1O)c1cnn(C)c1 846475419 GYTVFIYEZSRJET-VIFPVBQESA-N 293.754 2.199 10 20 CECD COC(=O)[C@]1(C)CCCN(Cc2ccccc2O)C1 840976929 ZGBDEMFHRTUSBW-OAHLLOKOSA-N 263.337 2.167 10 20 CECD CCc1cccc(CN[C@@H]2CCN(CC(F)F)C2)c1O 848918364 XEWPDWFHZNBRJE-CYBMUJFWSA-N 284.350 2.384 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H]([C@@H](C)O)C1 840936157 FPXAOTRLTVIQAR-UKRRQHHQSA-N 262.397 2.264 10 20 CECD CCc1cccc(CN2CCN(CC)C(=O)[C@@H]2CC)c1O 848903775 DBOPYRMWDSHWSM-HNNXBMFYSA-N 290.407 2.397 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2cc(Cl)ccc2O)CO1 846473477 LPFUKDHZWUKLPE-SCZZXKLOSA-N 269.728 2.087 10 20 CECD CN(C)c1ccc(CN[C@@H](CN)C(C)(C)C)cc1F 841086961 FZIJJQPSYFMCDN-AWEZNQCLSA-N 267.392 2.355 10 20 CECD CN1CCC[C@@]2(CCN(C(=O)Nc3ccc(N)cc3)C2)C1 841298773 FXYBJZIAYAEUKL-MRXNPFEDSA-N 288.395 2.218 10 20 CECD CCC[C@@](C)(O)C(=O)NCc1cc(Cl)ccc1O 846474854 CMSDDGAWHCVNNO-CYBMUJFWSA-N 271.744 2.213 10 20 CECD C[C@@H](C(=O)NCc1cc(Cl)ccc1O)c1cnn(C)c1 846475416 GYTVFIYEZSRJET-SECBINFHSA-N 293.754 2.199 10 20 CECD CCn1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)n1 843767017 WNNPTHFYDPIXGD-UHFFFAOYSA-N 298.390 2.433 10 20 CECD CCOCc1cc(CNCC2(N)CCC2)ccc1OC 841050441 FOYIQUUTELHPFL-UHFFFAOYSA-N 278.396 2.203 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@H](C)CN1 843119707 DISFORNCDCKPQM-DTWKUNHWSA-N 299.758 2.136 10 20 CECD C[C@@H](NC(=O)NCc1cc(Cl)ccc1O)[C@@H]1CCOC1 845009269 CYFNZKVTXSJMPV-NXEZZACHSA-N 298.770 2.270 10 20 CECD CN1CCC([C@@H]2CCN(C(=O)c3cc(O)cs3)C2)CC1 756809264 NLNXFMHBEJCBEH-GFCCVEGCSA-N 294.420 2.258 10 20 CECD C[C@H](N[C@H]1C[C@H](O)C1)c1ccc(Br)cc1O 850578270 IVBQDXXDKDEVHR-HGNGGELXSA-N 286.169 2.329 10 20 CECD COc1cccc(O)c1CN(CCCO)CC(F)(F)F 769318394 YSOCCVYBNKENNJ-UHFFFAOYSA-N 293.285 2.148 10 20 CECD CCOC(=O)[C@@H](C)NCc1cc(F)c(N(C)C)cc1F 862339288 OJOBVDLDIKTNIU-SECBINFHSA-N 286.322 2.072 10 20 CECD O=S(=O)(CCC1CCCC1)NCc1ccc(O)cc1O 867417184 NIUDCXLMSUSAND-UHFFFAOYSA-N 299.392 2.098 10 20 CECD Cc1ccc(CNC[C@H](O)Cc2ccccc2)c(O)c1 877014487 CODMMGLBZPUCPO-MRXNPFEDSA-N 271.360 2.394 10 20 CECD Cc1cccc(O)c1CN1CCSC[C@H]1CCO 876806999 XBLNUNLFLDKGLO-GFCCVEGCSA-N 267.394 2.000 10 20 CECD CCC[C@@](C)(O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775411143 PFTJVUOMFYGXIP-BLLLJJGKSA-N 278.396 2.481 10 20 CECD C[C@H](N[C@H](C)Cn1cccn1)c1c(O)cccc1F 886543187 LMZNOCFXWFOUHW-MNOVXSKESA-N 263.316 2.467 10 20 CECD CCc1ccc(CC(=O)NCc2ccc(N)cc2)nc1 1122536241 WHYDCGQDJUTTFX-UHFFFAOYSA-N 269.348 2.085 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)CC2(C)CCC2)c1 882441120 KMARONOFRBVYBD-UHFFFAOYSA-N 283.393 2.310 10 20 CECD O=C(COC(=O)C1(F)CCCC1)c1ccc(O)c(O)c1 784800397 FASVJEMOQWEQNC-UHFFFAOYSA-N 282.267 2.106 10 20 CECD CC[C@@H](N)c1cn(Cc2ccc(N(C)CC)cc2)nn1 881313553 NUSQSLVEQXXQBQ-CQSZACIVSA-N 273.384 2.192 10 20 CECD CCc1cc(CNCc2ccc(OC)c(OC)c2O)on1 892396668 GDJZWSGLVBPYGX-UHFFFAOYSA-N 292.335 2.250 10 20 CECD CCOC(=O)/C(=C/c1cnc(F)c(C)c1)c1nccn1C 899350124 VAKQPJVSQMHYDH-XYOKQWHBSA-N 289.310 2.366 10 20 CECD COc1cccc(CN[C@H](C)[C@@H]2CCCOC2)c1O 388841977 UPUKCDMGUBIAGI-DGCLKSJQSA-N 265.353 2.306 10 20 CECD CCC[C@@H](NCc1cccc(C)c1O)C(=O)OC 83385016 MSWJBOSZXQQKJV-GFCCVEGCSA-N 251.326 2.132 10 20 CECD C[C@@H]1COC[C@@H]1NCc1cc(Cl)cc(F)c1O 896735044 AOVMWJGDFCHQFL-HQJQHLMTSA-N 259.708 2.309 10 20 CECD COc1ccc(CNC(=O)/C=C\c2ccc(O)cc2)c(O)c1 794390121 HWYFFIXFEUIPSA-WTKPLQERSA-N 299.326 2.436 10 20 CECD C[C@H](NCCCO)c1cccc(C(F)(F)F)c1O 798179938 ULHZPKNDOGNVKE-QMMMGPOBSA-N 263.259 2.444 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1C/C=C\C1CC1 1325843821 JFSJOTPTGLZIQT-ARJAWSKDSA-N 286.331 2.123 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCCC(F)F 1332449682 QIUVGVMRBULWSK-XQRVVYSFSA-N 271.263 2.273 10 20 CECD c1cc(N2CCCC2)ccc1CN1CC[C@]2(CCNC2)C1 1345957677 YTAXFUQFYCEFGB-SFHVURJKSA-N 285.435 2.472 10 20 CECD COC(=O)C[C@@](C)(NCc1ccc(N)cc1)c1ccncc1 1356082856 FURNNZOHXSJVCP-QGZVFWFLSA-N 299.374 2.232 10 20 CECD CC(C)CN(CCC(=O)O)Cc1ccc(N)cc1 1603811941 OFLSCNFZHPKMPK-UHFFFAOYSA-N 250.342 2.202 10 20 CECD O=C(O)c1cnc(SC[C@@H]2CC3(CCC3)C(=O)O2)s1 1610862978 NHLABGGIFIGGDQ-ZETCQYMHSA-N 299.373 2.419 10 20 CECD C[C@@H](CN(Cc1cc(F)cc(F)c1O)C1CC1)C(=O)O 1592598737 JUMSZRSCADXJOR-QMMMGPOBSA-N 285.290 2.356 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@H](C(=O)O)C2)c1 1594105435 LYYMRWQAUDIAIK-GARJFASQSA-N 279.336 2.305 10 20 CECD C[C@@H](C[C@H](O)c1ccccc1)NC(=O)Cc1ccc(N)cc1 161509171 WGOQFHACODEKOH-GUYCJALGSA-N 298.386 2.440 10 20 CECD C[C@@H](NC(=O)N(C)Cc1ccccc1O)C1CCOCC1 151141198 ZEYWOBMYFBFIMO-GFCCVEGCSA-N 292.379 2.349 10 20 CECD Cc1ccc(O)c(CN[C@H](C)Cc2cnn(C)c2)c1 825045059 BFDJJOKEWYABHQ-GFCCVEGCSA-N 259.353 2.155 10 20 CECD COc1ccc(N(C)CC(=O)N[C@H](C)C(C)C)cc1 844353277 KDKZVGYCFYFAES-GFCCVEGCSA-N 264.369 2.292 10 20 CECD C[C@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H](C)C1(F)F 862437735 IMLBPMCYALDUIL-DTORHVGOSA-N 285.290 2.461 10 20 CECD COc1cccc(CNC[C@H]2CCN(C(C)C)C2)c1O 40621432 SZGLJYKYQGYKGD-CYBMUJFWSA-N 278.396 2.221 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@H](C)c1ccc(F)cc1O 188476462 YESBITJUGQZRDO-ZJUUUORDSA-N 268.332 2.049 10 20 CECD CCOc1cccc(CN2CCCC[C@@H]2CCN)c1O 70148529 JELFXUZHZQUUNX-CQSZACIVSA-N 278.396 2.494 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)OCO3)[C@H](C)CO1 403787804 CVFIMELOHWOTKQ-PWSUYJOCSA-N 279.336 2.120 10 20 CECD Cc1nnc(CN[C@H](C)c2ccc(N(C)C)cc2)n1C 393140332 BUYINBNWJXKOJH-LLVKDONJSA-N 273.384 2.040 10 20 CECD COc1cccc(CN2C[C@H](CN)[C@H](C)C[C@@H]2C)c1O 397356398 FQSAVTYNGXIMHO-DYEKYZERSA-N 278.396 2.206 10 20 CECD CC1(CCNCc2ccc3c(c2)CCCO3)OCCO1 921996466 AZRZXEDRYNBGRL-UHFFFAOYSA-N 277.364 2.254 10 20 CECD COc1cccc(CN[C@@H](C)[C@@H]2CCCO2)c1O 20206672 BNZNDJYMDCJRCN-JQWIXIFHSA-N 251.326 2.058 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2c(O)cccc2Cl)C1 126802008 SNLQXCVZMLVHCW-UWVGGRQHSA-N 254.761 2.215 10 20 CECD CN(CCn1cncn1)Cc1ccc(N2CCCCC2)cc1 66155431 PNDKDOOZJSLDMR-UHFFFAOYSA-N 299.422 2.400 10 20 CECD CCC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCO1 181270203 YLCWGWQWXZBAOU-VUDGCMKMSA-N 291.347 2.139 10 20 CECD CC[C@H](NCC(=O)N(C)CC)c1ccc(N(C)C)cc1 186813457 YDOMKUCUTWKHJW-HNNXBMFYSA-N 277.412 2.272 10 20 CECD NC(=O)c1ccc(CSc2nccs2)c([N+](=O)[O-])c1 48875326 CGDJQCNCSACCTR-UHFFFAOYSA-N 295.345 2.443 10 20 CECD CO[C@@H]1C[C@@H](NCc2cc(F)ccc2O)C1(C)C 226613491 GFCYOCWAXQRSML-CHWSQXEVSA-N 253.317 2.434 10 20 CECD CC[C@@H](C)[C@H](N)C(=O)NCc1ccc2c(c1)CCCN2C 236953178 PCFOCCFBHSPRLE-WBMJQRKESA-N 289.423 2.059 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNC2(C3CC3)CCOCC2)c1 364070945 XTRMNGYBMFUBAB-UHFFFAOYSA-N 292.335 2.349 10 20 CECD Cc1cccc(CN2CC[C@H]3CCN(C)C[C@H]32)c1O 272625514 MKGITCYIMNWNSH-UKRRQHHQSA-N 260.381 2.227 10 20 CECD CO[C@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)C1CC1 280825574 NQMSDDVVPAQGJD-HNNXBMFYSA-N 276.380 2.136 10 20 CECD Cc1cc(CN2CCC[C@](C)(O)C2)ccc1N(C)C 293704757 DDDAYHVHNSVJME-INIZCTEOSA-N 262.397 2.408 10 20 CECD COC(=O)c1cc(/C=C2/SC(=S)N(C)C2=O)oc1C 292476912 QIUWNUHORVLPNT-WEVVVXLNSA-N 297.357 2.206 10 20 CECD Cc1cc(CN2CCC[C@H](O)CC2)ccc1N(C)C 293021094 FMMUASRSLWVBKF-HNNXBMFYSA-N 262.397 2.408 10 20 CECD OC1(CNCCCSc2nccs2)CCC1 819062607 GPRSHTALKQBRNN-UHFFFAOYSA-N 258.412 2.130 10 20 CECD O=C1C[C@@H](NCc2cc(Cl)c(F)cc2O)CN1C1CC1 816562960 FVHVHNGYHZWZTG-SECBINFHSA-N 298.745 2.038 10 20 CECD COC(=O)c1ccc(NCc2cccc(OC)c2O)nc1 813590049 NIVHJNGRVYWQBF-UHFFFAOYSA-N 288.303 2.195 10 20 CECD CCCCC[C@@H](O)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 828884944 PDFZJGCWCVUYEU-BXUZGUMPSA-N 295.379 2.086 10 20 CECD COc1cccc(CN(C)Cc2nnc(C)s2)c1O 827799633 NYDOXXABPBNNGM-UHFFFAOYSA-N 279.365 2.193 10 20 CECD Cc1ccnc(CNC(=O)NCc2ccc(N(C)C)cc2)c1 836216490 BDHUNQRPIDYMNG-UHFFFAOYSA-N 298.390 2.455 10 20 CECD COC[C@](C)(CC(=O)O)NCc1ccc(N(C)C)cc1C 901792572 DKSOUOPKRZYWRJ-INIZCTEOSA-N 294.395 2.030 10 20 CECD C[C@@H]1c2cccn2CCN1C(=O)c1cc(O)cs1 731868146 NUBMXCQIDKKAKB-SECBINFHSA-N 262.334 2.472 10 20 CECD CCO[C@@H](CCN(C)C)CN[C@H]1CCc2cccc(O)c21 834620967 ZHVSPVVNXNTYNG-GJZGRUSLSA-N 292.423 2.326 10 20 CECD COc1cccc([C@@H](C)NC[C@@H]2CCCOC2)c1O 846143572 JPZBVYHWUHUFLD-NEPJUHHUSA-N 265.353 2.478 10 20 CECD COc1ccc(N(C)CCN(C)CCNC(C)(C)C)cc1 844902855 UVANEBZOWNGXDF-UHFFFAOYSA-N 293.455 2.451 10 20 CECD CCN(C(=O)/C=C\c1cncc(C)c1)c1cnn(C)c1 848343871 SYBYPMWKENIYIT-WAYWQWQTSA-N 270.336 2.190 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](c2cccnc2)C1 844145757 DHNZJZZYUBWGLD-NSHDSACASA-N 274.345 2.478 10 20 CECD CC[C@@H](NCc1cc(OC)ccc1O)[C@@H](O)C(C)C 840968279 QDMIIMHZICAVIO-HIFRSBDPSA-N 267.369 2.286 10 20 CECD COc1cccc(CN2CCC([C@@H](C)CO)CC2)c1O 846057312 GMRSLLKRQHWFIC-LBPRGKRZSA-N 279.380 2.241 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](CN)C2)cc1F 843048559 HKJWSRVLSMMOBE-AWEZNQCLSA-N 279.403 2.453 10 20 CECD Cc1cc(C)c(O)c(CN(C)Cc2nc(C)no2)c1 848503582 IXXHSQDHFKGUTQ-UHFFFAOYSA-N 261.325 2.332 10 20 CECD CCN1CC[C@@H](CN[C@@H](C)c2cccc(OC)c2O)C1 846142291 ZVKIHDFJTONYLT-STQMWFEESA-N 278.396 2.393 10 20 CECD CCOCCN1CCN(Cc2cccc(CC)c2O)CC1 848880085 CRNUHGGAZGJQGB-UHFFFAOYSA-N 292.423 2.109 10 20 CECD Nc1ccc(CCNC(=O)N2C[C@H]3[C@H]4CC[C@@H](C4)[C@@H]3C2)cc1 841956126 WAGMBTWAPKMBMN-OTRWWLKZSA-N 299.418 2.499 10 20 CECD Cc1cc(CN(C)c2ccc(OCC(=O)O)cc2)on1 846279429 DONSFCCIVWMRQW-UHFFFAOYSA-N 276.292 2.083 10 20 CECD CCOc1ccc(CN2CC[C@H](N)[C@H](CC)C2)c(O)c1 843053873 VRRZMOWPNWPWHX-DOMZBBRYSA-N 278.396 2.350 10 20 CECD COCC1(N[C@H](C)c2cc(OC)ccc2O)CC1 756849928 HGVBMGBSRZBOBB-SNVBAGLBSA-N 251.326 2.230 10 20 CECD Cc1noc(C)c1CCOC(=O)c1cc(O)cs1 756189898 IRRBRESJCXGVCS-UHFFFAOYSA-N 267.306 2.458 10 20 CECD Cc1nnc([C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)o1 759597448 ZPRZYTYXTPDBNO-YZCDNWJKSA-N 290.275 2.107 10 20 CECD COC(=O)C(=O)CCCSc1ncc(Cl)s1 850000357 RTHPVNXWCBEYFM-UHFFFAOYSA-N 279.770 2.411 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2cc(F)cc(F)c2O)CC1 756365759 ZMTJRHUGSGUMMI-SECBINFHSA-N 298.333 2.332 10 20 CECD CC[C@H](N[C@@H]1CCN(C)C1)c1ccc(N(C)C)cc1 765769588 LHVHGFBIGZGCMC-ZBFHGGJFSA-N 261.413 2.497 10 20 CECD CC(C)C1(O)CN(Cc2cc(F)c(N(C)C)cc2F)C1 862389546 LSVUGFKKHDNYIF-UHFFFAOYSA-N 284.350 2.234 10 20 CECD CCOc1ccc(CN2Cc3cnn(C)c3C2)c(O)c1 877632514 CFVWWAIMTQDMCM-UHFFFAOYSA-N 273.336 2.040 10 20 CECD C[C@H](O)CCN(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776250285 UBDUUFYPHTWCOJ-STQMWFEESA-N 293.411 2.226 10 20 CECD C[C@@H](NC(=O)/C=C\c1cnn(C)c1)c1ccc(N(C)C)cc1 772999813 MQZNKDSOBLOXPV-OMPYUXFZSA-N 298.390 2.377 10 20 CECD C[C@H](NC(=O)NCCC(C)(C)O)c1ccc(N(C)C)cc1 773613408 QRJUZUJWNMFPHY-LBPRGKRZSA-N 293.411 2.274 10 20 CECD CC[C@@]1(O)CCN(Cc2cc(Cl)ccc2O)C1 779218406 DNRJKFBZYDRRJU-CYBMUJFWSA-N 255.745 2.392 10 20 CECD COc1cccc(CNC(=O)C2(F)CCCC2)c1O 773406397 CNSJOAYYYSEQPD-UHFFFAOYSA-N 267.300 2.299 10 20 CECD C[C@H](NCCCN1CCC(O)CC1)c1c(O)cccc1F 886511463 UNNGTVZFJSYSKC-LBPRGKRZSA-N 296.386 2.029 10 20 CECD O=C(CCC(F)(F)F)NCc1cccc(O)c1O 1123889955 RYHBWJYDZZJNOR-UHFFFAOYSA-N 263.215 2.057 10 20 CECD C[C@@H](N[C@H](CO)C1CCOCC1)c1ccc(N(C)C)cc1 782776300 AMDDLBCKMUFJPN-CXAGYDPISA-N 292.423 2.191 10 20 CECD COc1ccc(CNCCCOCC2CC2)c(O)c1OC 892461999 LNDSOIPFHLMJBX-UHFFFAOYSA-N 295.379 2.316 10 20 CECD NC(=O)c1ccc(NCc2cc(F)ccc2O)cc1 83439270 OZZKQZDQBAIFMP-UHFFFAOYSA-N 260.268 2.242 10 20 CECD COCCN1CC[C@@H](N[C@@H](C)c2ccc(C)cc2O)C1 273604693 SVOUTIAQPNFXPD-UONOGXRCSA-N 278.396 2.072 10 20 CECD COC1(CN[C@H](C)c2cc(F)ccc2O)CCOCC1 186147246 UMMRRVQBMCVCOL-LLVKDONJSA-N 283.343 2.378 10 20 CECD CC[C@@H](NC[C@H](O)c1cnn(C)c1)c1ccc(F)cc1O 796790160 XPNRFFLKDCCONH-HIFRSBDPSA-N 293.342 2.039 10 20 CECD CCOc1ccc(CN=c2cc[nH]cc2F)c(O)c1 792685830 ILJCNMZFNIMZOP-UHFFFAOYSA-N 262.284 2.359 10 20 CECD CN(C)c1ccc(CNC2CC(C)(C(=O)O)C2)cc1 1777039958 KNERHOKAIWQXJT-UHFFFAOYSA-N 262.353 2.096 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C[C@H]1COCCO1 1350594996 ZDTFUMKWLABRLM-KRWDZBQOSA-N 290.407 2.134 10 20 CECD C[C@H]1CCSCCN1C(=O)NCc1ccc(N)cc1 1357791312 KETKKGUXJXGARA-NSHDSACASA-N 279.409 2.306 10 20 CECD O=C(O)C1(CNCc2cc(Cl)c(F)cc2O)CC1 1601707765 OHWWFNJPVUHHSX-UHFFFAOYSA-N 273.691 2.139 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H](CN)C2)c1O 229102573 WJPHNEJAADUVHS-SNVBAGLBSA-N 284.787 2.225 10 20 CECD C[S@](=O)CCNCc1ccc(N2CCCCC2)cc1 134738836 NQYJGAZLPVSKRG-LJQANCHMSA-N 280.437 2.145 10 20 CECD Cc1nn(C)cc1CNCc1ccc2c(c1)CCCN2C 157705565 LVKIMOBRFAJLHJ-UHFFFAOYSA-N 284.407 2.401 10 20 CECD COc1cccc(CN[C@@H](C)c2cnn(C)c2C)c1O 20352714 FBVBDZJWKCKQGW-JTQLQIEISA-N 275.352 2.294 10 20 CECD CN(C)c1ccc(CNC(=O)NCC(F)(F)F)cc1 48140734 TZUPKXNJSYVCJK-UHFFFAOYSA-N 275.274 2.114 10 20 CECD C[C@@H](NC[C@H]1CCCCS1(=O)=O)c1ccccc1O 694515737 QUEGGZPVRODAIP-VXGBXAGGSA-N 283.393 2.010 10 20 CECD COc1ccc(O)c([C@H](C)NCc2c(C)cnn2C)c1 394076538 BUOMVHDCSOQMDD-NSHDSACASA-N 275.352 2.294 10 20 CECD CCOC(=O)N[C@@H]1CCCN(Cc2ccccc2O)C1 179557426 ZMGHEDSENPOPRU-CYBMUJFWSA-N 278.352 2.103 10 20 CECD COc1ccccc1C(=O)NCc1cccc(OC)c1O 68488695 HBJYWUJQXJKCDX-UHFFFAOYSA-N 287.315 2.339 10 20 CECD COc1ccc(O)c(CN2CCC(n3ccnc3)CC2)c1 179902855 DONCTAQMBMJWEJ-UHFFFAOYSA-N 287.363 2.434 10 20 CECD CO[C@H](CNC(=O)NCc1ccc(N(C)C)cc1)C(C)C 72930521 SMKDTAMQPZVWMO-OAHLLOKOSA-N 293.411 2.223 10 20 CECD COc1cc(CNCc2ccccc2O)cc2c1OCO2 134237214 FBKMXODPEDKFEH-UHFFFAOYSA-N 287.315 2.419 10 20 CECD CCc1nc(CN(C)c2ccc(OC)cc2OC)no1 131666535 KXXFHWVWWFOQTH-UHFFFAOYSA-N 277.324 2.286 10 20 CECD COc1cc(O)c(CN2CCCOC(C)(C)C2)cc1OC 367221714 PSFBXFZJMVRDTL-UHFFFAOYSA-N 295.379 2.410 10 20 CECD C[C@H](N[C@@H]1C[C@H](O)C1(C)C)c1ccc(F)c(F)c1O 276986869 WUASNRXCRZVGJP-XROYCOCOSA-N 271.307 2.480 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H](CO)[C@H]2CCOC2)c(O)c1 284940796 DUTQUSDYPAIOMS-SOUVJXGZSA-N 293.407 2.305 10 20 CECD CC[C@H](N[C@H](C)C(=O)NCCF)c1ccc(N(C)C)cc1 282821458 RTXAMUAZWACFSH-DOMZBBRYSA-N 295.402 2.268 10 20 CECD Cc1oc(C(C)C)nc1C(=O)NCc1ccc(O)c(O)c1 286784197 OXPXLAGSIVKBPO-UHFFFAOYSA-N 290.319 2.448 10 20 CECD CC[C@H](N[C@H](CO)CCOC)c1cccc(Cl)c1O 287055931 NENGKEULSVCQFM-GWCFXTLKSA-N 287.787 2.484 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2ccc(OC)nn2)c1 801529215 LYNYCQRICDYKKT-SNVBAGLBSA-N 289.335 2.050 10 20 CECD COc1cccc(CN2CC[C@@H](n3cccn3)C2)c1O 291202025 HRTDIIVGKRZHRI-CYBMUJFWSA-N 273.336 2.044 10 20 CECD Cc1cc(CN(C)CC(=O)N2CCCC2)ccc1N(C)C 815008927 TXOOARQVHMIFSM-UHFFFAOYSA-N 289.423 2.115 10 20 CECD COCCc1noc(CSc2nccs2)n1 728791043 NMXCJRJNHZMADL-UHFFFAOYSA-N 257.340 2.007 10 20 CECD CCN(CC)C(=O)CCC(=O)N[C@H](C)c1ccccc1O 827937200 OIRTYTCMCVKPRJ-GFCCVEGCSA-N 292.379 2.218 10 20 CECD CN(C[C@@](C)(O)c1ccccc1)C(=O)c1cc(O)cs1 822438884 YJWFEZSMLPXVIK-OAHLLOKOSA-N 291.372 2.433 10 20 CECD CC(C)(O)C1CN(Cc2cc(Cl)cc(F)c2O)C1 839139683 JTOZRGPVGZHNGR-UHFFFAOYSA-N 273.735 2.387 10 20 CECD CN(C[C@@H]1CCCOC1)c1ccc(OCC(=O)O)cc1 833693262 RCULPDPYYLWLSS-LBPRGKRZSA-N 279.336 2.013 10 20 CECD COc1ccc(O)c(CNC(=O)Cc2occc2C)c1 830544267 NHVPKLWUHKAJEH-UHFFFAOYSA-N 275.304 2.161 10 20 CECD O=C(NCCC[C@H]1CCOC1)c1cc(O)cs1 839788256 DBMVLEDSWAOHCV-VIFPVBQESA-N 255.339 2.000 10 20 CECD COC[C@@H](C)NC(=S)NCc1ccc(N(C)C)cc1C 734383836 FUILEWPBWWAERN-GFCCVEGCSA-N 295.452 2.060 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)C2(C)CCC2)cc1 832265910 BGZZNRSYDXDMHN-CQSZACIVSA-N 275.396 2.059 10 20 CECD Nc1ccc(CCNCc2ccc3c(c2)CNCC3)cc1 849350736 UPOPHANIOLOZPR-UHFFFAOYSA-N 281.403 2.247 10 20 CECD COc1cccc([C@@H](C)NCCOC[C@H]2CCCO2)c1O 846142577 ATWPFCQRXLMCDI-CHWSQXEVSA-N 295.379 2.247 10 20 CECD CCc1cccc(CN2C[C@H](C)O[C@H](COC)C2)c1O 848905155 HVTVLUBQZGOPQU-WFASDCNBSA-N 279.380 2.190 10 20 CECD O=C(O)c1ccc(C(=O)NCc2ccccc2O)cc1 821544505 SLZWEAOJCZCFJJ-UHFFFAOYSA-N 271.272 2.020 10 20 CECD CN1CCCc2cc(CN[C@@H]3[C@@H]4C[C@H]5[C@H](CN[C@H]53)C4)ccc21 925532530 SPPPRTBHBBSXTG-BEIYGRMHSA-N 297.446 2.155 10 20 CECD CCc1cc(C)nc(NCCc2ccc(O)c(O)c2)n1 753562256 AWQVJGSBUJVZQB-UHFFFAOYSA-N 273.336 2.413 10 20 CECD CC[C@@H](C(=O)NCc1cc(OC)ccc1O)N(CC)CC 750023273 XCIPHGHBQKWFHY-AWEZNQCLSA-N 294.395 2.137 10 20 CECD CCCCCCNC(=O)CN(C)c1ccc(N)cc1 863556726 DEXUJEQHQJPNBD-UHFFFAOYSA-N 263.385 2.402 10 20 CECD O=C1N[C@@H](c2cc(F)ccc2O)N2CCc3ccccc3[C@H]12 877856468 SLQNSYOBYRLCPP-HZPDHXFCSA-N 298.317 2.259 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](C)c1ccc(N(C)C)cc1 773130267 HUAXDAGWXJSHSI-MAZHCROVSA-N 289.423 2.318 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](O)[C@@H](C)C2)cc1 773846869 LHIPTTUFKYKLHX-BBRMVZONSA-N 262.397 2.345 10 20 CECD COc1ccc(C(=O)NCc2ccccc2O)cc1F 133773281 PPZQTGUMXLXFAA-UHFFFAOYSA-N 275.279 2.470 10 20 CECD Cc1ccc(NC(=S)NNc2nc3ccccn3n2)cc1 790344207 IHBYYBQERCQEOA-UHFFFAOYSA-N 298.375 2.351 10 20 CECD CN(C)c1cc(F)c(CN[C@H](C(=O)O)C2CCC2)cc1F 1262163751 FPISKGLDKNMUPA-AWEZNQCLSA-N 298.333 2.374 10 20 CECD CS(=O)(=O)c1ccc(Sc2nccs2)nc1 1342658127 RZAYKMYNYCOTOQ-UHFFFAOYSA-N 272.376 2.093 10 20 CECD COCn1ncc(C)c1CNCc1cc(Cl)ccc1O 1262373382 WKFPDIJESSPGEB-UHFFFAOYSA-N 295.770 2.444 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)C1CCOCC1 1344043366 ZIRCHVUJCNCOTC-UHFFFAOYSA-N 281.699 2.241 10 20 CECD COc1ccc(O)c(CNCCOCC(F)(F)F)c1 104435350 JBLGBZLRJZHPAQ-UHFFFAOYSA-N 279.258 2.069 10 20 CECD CO[C@H](C(=O)NCc1cccc(O)c1O)C1CCCCC1 1521852855 ZUBZANQGBJHCNH-HNNXBMFYSA-N 293.363 2.309 10 20 CECD O=C(O)CC1(NCc2cc(F)ccc2O)CCC1 1608688020 UDWKBPVYNBFQNP-UHFFFAOYSA-N 253.273 2.018 10 20 CECD c1cc2c(cc1CNC[C@@H]1CCCNCC1)CCO2 1580889912 FFRDZWSMKFXJHV-CYBMUJFWSA-N 260.381 2.101 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CCO)C(C)C)c1 230664188 NLTIHQNIFIVZBM-BXUZGUMPSA-N 267.369 2.458 10 20 CECD Cc1ncc(S(=O)(=O)Nc2ccc(O)cc2F)s1 230697220 FKIBSXKKLILNAC-UHFFFAOYSA-N 288.325 2.097 10 20 CECD C[C@H](NC(=O)[C@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 1589088163 IJXVZNMQZBFJNK-IINYFYTJSA-N 290.363 2.041 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@](C)(O)C2)c1O 124254712 VUGQKRYIXDUYPM-HNNXBMFYSA-N 281.327 2.081 10 20 CECD C[C@H](N[C@@H](C)c1ccc(F)cc1O)c1ncn(C)n1 275802441 YNGJADDUCWSGBN-IUCAKERBSA-N 264.304 2.072 10 20 CECD CO[C@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2O)C1 175634350 UBKGYGOJKBUYGL-ZDUSSCGKSA-N 281.327 2.345 10 20 CECD Cc1ccc([C@@H](C)NCCCC(=O)N(C)C)c(O)c1 185194346 FCJLHLQTPWNDEP-GFCCVEGCSA-N 264.369 2.220 10 20 CECD Oc1c(Cl)cccc1CNC[C@H](O)C1CCC1 316562741 LAMZSBFGIOBQSY-LBPRGKRZSA-N 255.745 2.296 10 20 CECD COc1ccc(CN[C@H](CCO)C(F)(F)F)cc1C 821206433 DBZHPMNOAPFRCL-GFCCVEGCSA-N 277.286 2.407 10 20 CECD CC[C@H](CSC)NC(=O)NCc1cccc(OC)c1O 179979483 YXDSQQVXMAWRRD-LLVKDONJSA-N 298.408 2.342 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](OC)C2)c1 179749730 HLNDBLJIVRGLST-CYBMUJFWSA-N 251.326 2.012 10 20 CECD COc1cccc(CCNC(=O)c2cccc(O)c2O)c1 186949508 COSHVHFCPKQFCR-UHFFFAOYSA-N 287.315 2.079 10 20 CECD C[C@H](NCc1cc(F)ccc1O)c1nnc2ccccn12 226583466 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CECD CC(C)N1CC[C@@H](N(C)C(=O)c2cc(O)cs2)C1 839790517 AXJLYXZHXQNOIM-SNVBAGLBSA-N 268.382 2.008 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)c1cn[nH]c1 742475439 NOSYDTKDYQSSQE-UHFFFAOYSA-N 284.363 2.330 10 20 CECD Oc1cc2c(cc1CN[C@@H]1CCC[C@@H](F)C1)OCO2 1328512103 PXENJKILKDBLOJ-GHMZBOCLSA-N 267.300 2.491 10 20 CECD CCc1cccc(CN2CCCC3(C2)OCCO3)c1O 848901037 NLCQEOYINIYCPU-UHFFFAOYSA-N 277.364 2.294 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C1CC(N)C1 843124880 KFVCXJDKJOHUCT-UHFFFAOYSA-N 258.724 2.106 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCNC(=O)C(C)C 840937842 YJUZTLSJZIFQDU-UHFFFAOYSA-N 291.439 2.313 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)/C=C/SC)cc1 844854202 JSGQRDQCSNKXSN-FMIVXFBMSA-N 294.420 2.467 10 20 CECD CC[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CC[C@@H]1N 843376553 AXEXLBAIKFXIGQ-ABAIWWIYSA-N 294.370 2.293 10 20 CECD CCN(CC)c1ccc(CN[C@H]2C[C@H](C(=O)O)C2)cc1 849230406 FXTCBQSWXBJZBK-HDJSIYSDSA-N 276.380 2.486 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)Cn2cccn2)c1O 846146779 LLENTPHDJSUDAF-RYUDHWBXSA-N 275.352 2.337 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)C1CCNCC1 843044643 DKYQHWGXNXFTDJ-UHFFFAOYSA-N 272.751 2.369 10 20 CECD C[C@H]1CCN(Cc2cccc(Cl)c2O)C[C@H]1CO 857061310 OGTNMWXQUPEDFZ-JQWIXIFHSA-N 269.772 2.496 10 20 CECD Cc1nonc1[C@H](C)NCc1ccc(N(C)C)c(F)c1 924860658 DQEWATRJPUQAIV-VIFPVBQESA-N 278.331 2.434 10 20 CECD OC[C@@H](C[C@H]1CCCO1)NCc1ccc2c(c1)CCCO2 922341574 SEYRQVJKKMUDJF-HZPDHXFCSA-N 291.391 2.031 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2C[C@H]2C)cc1 754150436 RVTJYGZMRAUFHD-NEPJUHHUSA-N 263.337 2.331 10 20 CECD COc1cccnc1NC(=O)N(C)Cc1ccccc1O 753939784 UGNJRLZWQVFIJG-UHFFFAOYSA-N 287.319 2.460 10 20 CECD CC(C)CO[C@@H]1CCN(C(=O)c2cc(O)cs2)C1 759357871 NYPRENIBHJKZOP-LLVKDONJSA-N 269.366 2.341 10 20 CECD Cc1ncoc1C(=O)NCc1cc(Cl)ccc1O 857547793 UIRUNDOLDUMQMY-UHFFFAOYSA-N 266.684 2.272 10 20 CECD CN(C)CCOc1ccc(N(C)C[C@H]2CCCOC2)cc1 761221848 FRRCWPKOZSGRHC-OAHLLOKOSA-N 292.423 2.490 10 20 CECD CN1CCCN(C(=O)/C=C\c2cn(C)cn2)c2ccccc21 933217984 NQCFPRKGJRIQPL-HJWRWDBZSA-N 296.374 2.306 10 20 CECD CCC1(O)CCN(Cc2cc(OC)c(C)cc2O)CC1 768466708 VEFYNGVZDUDQPJ-UHFFFAOYSA-N 279.380 2.446 10 20 CECD CCOc1ccc(CN2CCN(CC)[C@@H](C)C2)c(O)c1 769382625 ZMXSMAZQIFJVBG-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD C[C@]1(CNC(=O)c2cc(O)cs2)CCO[C@H]1C1CC1 768737517 QTOHSJDQSMVROJ-GXTWGEPZSA-N 281.377 2.389 10 20 CECD CC[C@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(N(C)C)cc1 773101146 ANZKKUGLAARCRC-DOMZBBRYSA-N 298.452 2.226 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1C[C@H]1C(F)(F)F 871208381 OMWGSCKXOBQHPI-HWTYGCMBSA-N 287.237 2.178 10 20 CECD COc1cccc(CNC(=O)c2coc(C3CC3)n2)c1O 777274201 HCMSWVXFKDCQEK-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CCc1nc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)co1 773744798 WHEWBRFHWFHZGZ-SECBINFHSA-N 290.319 2.009 10 20 CECD CC(C)[C@H]1C[C@H](NC(=O)c2cc(O)cs2)CCO1 772932662 JPBJPZCMOVORBP-MWLCHTKSSA-N 269.366 2.387 10 20 CECD CC[C@H](C)[C@@](C)(O)CNC(=O)/C=C\c1ccc(O)c(O)c1 779525842 SUIPCFBZOVHNEM-DQQDKVODSA-N 293.363 2.024 10 20 CECD COC[C@H](N[C@@H](C)c1ccc(F)cc1O)[C@@H]1CCCO1 788619617 QKBVQESWRIQOOK-XEGUGMAKSA-N 283.343 2.376 10 20 CECD COc1ccc(O)c(CN2CC[C@H](C)C[C@H]2[C@@H](C)O)c1 785987210 GJJRDIGHVQWXPO-ZOWXZIJZSA-N 279.380 2.382 10 20 CECD Cn1ncnc1CNCc1cc(Cl)cc(Cl)c1O 80548108 DCBBNQNGYKKVMW-UHFFFAOYSA-N 287.150 2.117 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1Cc2ccc(F)cc21 793679997 GSRLLZPRJBVSMR-CQSZACIVSA-N 271.291 2.487 10 20 CECD Cc1cc(CNC(=O)c2cccc(O)c2O)ccc1F 186822243 PVZFBDAXLACFMU-UHFFFAOYSA-N 275.279 2.475 10 20 CECD C[C@H]1COCCN1Cc1c(O)ccc(Cl)c1F 792166410 AFGUIOGIZFWIDI-QMMMGPOBSA-N 259.708 2.405 10 20 CECD C[C@H]1CC[C@H](C)N1CC(=O)N(C)c1ccc(N)cc1 706291731 SAEMOLVLXQAZOH-RYUDHWBXSA-N 261.369 2.104 10 20 CECD Cc1ccccc1C(=O)NCCc1ccc(O)c(O)c1 98074482 GEUNRHVPLRDXKK-UHFFFAOYSA-N 271.316 2.379 10 20 CECD Cc1csc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 1321558562 FIPFAVSPSFYXLH-MRVPVSSYSA-N 292.360 2.224 10 20 CECD COc1ccc(CNC(=O)c2ncc(Cl)s2)c(O)c1 1326892599 SLIXCCDLFHVHNG-UHFFFAOYSA-N 298.751 2.441 10 20 CECD CCOC(=O)c1cnc(NCc2cc(C)ccc2O)cn1 1348123278 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NKHRCUWTMHKRAC-UHFFFAOYSA-N 295.136 2.413 10 20 CECD CO[C@]1(C)C[C@@H](NCc2cc3c(cc2O)OCO3)C1(C)C 174137472 ZUGLWJSAXKVUPF-GDBMZVCRSA-N 293.363 2.414 10 20 CECD COc1cccc(CNc2ncccc2[N+](=O)[O-])c1O 66812682 RBAFEWYYPUNHBI-UHFFFAOYSA-N 275.264 2.316 10 20 CECD COc1ccc(O)c(CN2CCS[C@H](C)C2)c1 180041442 BNRIXTYKBGPZFS-SNVBAGLBSA-N 253.367 2.338 10 20 CECD CC[C@](C)(CCO)NC(=O)NCc1ccc(N(C)C)cc1 305089236 WBZFWKVXQPYLKK-MRXNPFEDSA-N 293.411 2.103 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)CO[C@@H]2CCOC2)c1 185673379 CFPTUJKDTYMSCH-SGMGOOAPSA-N 295.379 2.245 10 20 CECD C[C@@H](NCc1ccc(C(N)=O)cc1)c1ccc(F)cc1O 184861996 OQXUBQHZKFVIHA-SNVBAGLBSA-N 288.322 2.481 10 20 CECD CN(C)c1ccc(CN2CCC(C)(CO)CC2)cc1 184071618 VHDNHOCEPSRBCZ-UHFFFAOYSA-N 262.397 2.347 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](C)CCO)c1 97440110 NXGAXIUNOODUCV-WDEREUQCSA-N 253.342 2.070 10 20 CECD CCCOCC(=O)N(C)Cc1ccc(N(C)C)cc1 147020017 JKRCLVXBJYAHPO-UHFFFAOYSA-N 264.369 2.138 10 20 CECD CCOc1ccc(N2CCN(C(=O)C(C)C)CC2)cc1 242585479 CIKBIODJOCDERJ-UHFFFAOYSA-N 276.380 2.390 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1[C@H](C)[C@H]1C1CC1 528997044 RTNRUEVFWSIGSM-VNWXUBODSA-N 289.375 2.437 10 20 CECD COCCC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 263929918 SYFBYQZUIRYXHS-UHFFFAOYSA-N 276.380 2.280 10 20 CECD CN(C)c1ccc(CN2CCN(C3CCC3)CC2)cc1 271179311 LQIAASDPJMGRDM-UHFFFAOYSA-N 273.424 2.423 10 20 CECD CCCN(CCO)Cc1cc(Cl)cc([N+](=O)[O-])c1O 271053964 XXLGZNPIIGWDCN-UHFFFAOYSA-N 288.731 2.158 10 20 CECD C[C@@H](C[S@](C)=O)N(C)Cc1ccc(N(C)C)c(F)c1 275321162 SIQHJYGTSMJPQV-WLRWDXFRSA-N 286.416 2.091 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@H](n2cncn2)C1 377282301 DCOCZZWZPKBOJI-LBPRGKRZSA-N 278.743 2.084 10 20 CECD Cc1ccc(O)c(CN2CCO[C@H](COC(C)C)C2)c1 372124877 WGKOYMOBWOSHRL-HNNXBMFYSA-N 279.380 2.326 10 20 CECD COC[C@H](O)CN[C@H](C)c1ccc(Cl)c(Cl)c1O 283348236 MGNVKELTJZUHIL-HTQZYQBOSA-N 294.178 2.357 10 20 CECD CC(=O)C(=O)CSc1nnc(CCC2CCCC2)[nH]1 289770222 WEYJDPQGNRZURB-UHFFFAOYSA-N 281.381 2.178 10 20 CECD C[C@@H]1COCC[C@H]1CNCc1ccc2c(c1)CCO2 285556849 REKRXFKRERLNLW-DOMZBBRYSA-N 261.365 2.384 10 20 CECD Cc1ccc(C(=O)NCc2ccc(N(C)C)cc2)c(O)n1 298674742 GZNXCMKJVNSZEW-UHFFFAOYSA-N 285.347 2.092 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H]1c1cc[nH]n1 807432273 KBFQSYAWSXNXDZ-JTQLQIEISA-N 263.322 2.154 10 20 CECD CCN(C)c1ccc(CN2CC(=O)N(CC3CC3)C2)cc1 815103908 VEVZPBKTSNWVQF-UHFFFAOYSA-N 287.407 2.154 10 20 CECD COc1ccc(N2CCC(N[C@H](C)C[C@H](C)N)CC2)cc1 817903504 QBESFDDPOUIGSD-UONOGXRCSA-N 291.439 2.379 10 20 CECD NC(=O)C[C@@H](NCc1ccccc1O)c1ccccc1 815153182 DHAQQSHJZFUAIX-CQSZACIVSA-N 270.332 2.099 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cnc3cnccn23)c1 813331774 USGOJRGOGKAPTQ-NSHDSACASA-N 298.346 2.294 10 20 CECD CN1CCN(c2ccc(CN3CC[C@@H]4C[C@@H]4C3)cc2)CC1 827507684 YVXCVMHBMJQALA-IAGOWNOFSA-N 285.435 2.280 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@H]1C[C@@H](O)C1 822949469 LMLNLHDGAQAXEP-KZCWHLCOSA-N 290.146 2.086 10 20 CECD Cc1ccnc(NC(=O)/C=C\c2ccc(O)c(O)c2)c1 588403517 NJJCONOQLSHKJP-HYXAFXHYSA-N 270.288 2.453 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CCC[C@@H]2C[C@H]12 838256475 SGYNPGXINUWGIK-KPUOMAHNSA-N 273.332 2.416 10 20 CECD CN(C)c1ccc(CNC(=O)NOCC2CC2)cc1F 838606666 NFRUKCRGZMYHTC-UHFFFAOYSA-N 281.331 2.033 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1CCC(F)(F)C1 910945999 HMUHEEDRIIINAP-MRVPVSSYSA-N 271.263 2.149 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(N(C)C)cc1C 840936562 LGKIURFSIRLYQI-HZPDHXFCSA-N 289.423 2.065 10 20 CECD CCC(C)(C)N1CCN(C(=O)c2cc(O)cs2)CC1 848391059 SHTOKHWCSGJZBR-UHFFFAOYSA-N 282.409 2.400 10 20 CECD CN(C)C1(C(=O)NCc2cc(Cl)ccc2O)CCC1 846474711 AMWXQAGEFBLFQB-UHFFFAOYSA-N 282.771 2.146 10 20 CECD COCC1(CC(=O)NCc2cc(Cl)ccc2O)CC1 846475721 GRWZWCSSEADQFF-UHFFFAOYSA-N 283.755 2.479 10 20 CECD C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)CCN1C 745855149 RYUCAHZLEAAWJD-OCCSQVGLSA-N 291.395 2.016 10 20 CECD COc1cc(CN2C[C@H]3[C@H](C2)C3(F)F)c(O)cc1C 844758235 SXRKVHZPQYSMAF-QWRGUYRKSA-N 269.291 2.406 10 20 CECD N[C@]12CCC[C@H]1CN(Cc1c(O)ccc(Cl)c1F)C2 857226147 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MSSHJLCGRBEMHT-UHFFFAOYSA-N 263.224 2.195 10 20 CECD Cc1c[nH]nc1C(=O)NCCCSc1nccs1 799630879 UGZYRZUPXUYMKY-UHFFFAOYSA-N 282.394 2.087 10 20 CECD CCc1ncncc1C(=O)N(C)Cc1ccccc1O 743312835 PZGHMDOKZKHBIV-UHFFFAOYSA-N 271.320 2.017 10 20 CECD COc1cccc(O)c1CN1CC[C@]2(CCOC2)C1 769532501 KFHUVPPNHUGXPS-HNNXBMFYSA-N 263.337 2.013 10 20 CECD COc1ccc(O)c(CNC[C@@H](OC)C(F)(F)F)c1 776175149 XBEUTTSMXVSWAF-LLVKDONJSA-N 279.258 2.068 10 20 CECD COC(=O)CN(Cc1cc(F)ccc1O)CC(C)C 1319907660 RVRXRVLEVKTLOS-UHFFFAOYSA-N 269.316 2.162 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1328400769 WQDUAMBGXXZWMJ-FMCLSXCISA-N 277.364 2.252 10 20 CECD CC[C@H](F)C(=O)NCc1ccc2c(c1)CCCN2C 1337096829 TYFHVAJNBYTBKB-ZDUSSCGKSA-N 264.344 2.433 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H](N)C(C)(C)C)cc1F 1341587024 SPRQNQLVESIYDL-CQSZACIVSA-N 295.402 2.271 10 20 CECD CCN(CC)c1ccc(CNCCC[S@](C)=O)cc1 116920068 LQGVBZMICGMZLH-LJQANCHMSA-N 282.453 2.391 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@H]1C(=O)O 1599865956 PDOZYCWVMPBBEZ-HTQZYQBOSA-N 287.718 2.337 10 20 CECD COc1cc(O)c(CN(C)CC2CCOCC2)cc1OC 160528322 ZXJQWFRLAXNZNS-UHFFFAOYSA-N 295.379 2.268 10 20 CECD CS[C@H](C)CNC(=O)NCc1ccc(N(C)C)c(F)c1 163832941 NYFLFXWKBCEACY-SNVBAGLBSA-N 299.415 2.442 10 20 CECD C[C@@H](C(=O)NCCc1ccc(N)cc1)N1CCCCCC1 152501459 ZLKHZCOMTBSRKS-AWEZNQCLSA-N 289.423 2.192 10 20 CECD COc1ccc(N(C)CC(=O)N2CCC[C@@H](C)C2)cc1 844353772 ZXFFOFOMZPZNJG-CYBMUJFWSA-N 276.380 2.390 10 20 CECD Cc1cc(C(=O)NCCc2ccc(N)cc2)oc1C 846666290 TVULDWLILSHJLK-UHFFFAOYSA-N 258.321 2.451 10 20 CECD CCn1cc(CN[C@H]2CCc3cccc(O)c32)cn1 296890247 OMAWLXMOPZDXEM-ZDUSSCGKSA-N 257.337 2.386 10 20 CECD CC(C)N1CC[C@@H](N[C@@H](C)c2ccc(F)cc2O)C1=O 186047868 XHZZLJZVJIJIFI-GXFFZTMASA-N 280.343 2.191 10 20 CECD COc1ccc(CN[C@H](C)c2n[nH]c(C)n2)cc1C 392428240 ZFSLQNAAEDVNPF-SNVBAGLBSA-N 260.341 2.281 10 20 CECD C[C@@H]1CC[C@@H](C(=O)O)CN1Cc1ccc(N(C)C)cc1 397048459 QDCANELPCFDMRJ-TZMCWYRMSA-N 276.380 2.438 10 20 CECD COc1ccc(O)c(CNCc2cncs2)c1 133110046 LFZDUJMETVTELT-UHFFFAOYSA-N 250.323 2.147 10 20 CECD CC[C@@H]1CN(Cc2cc(C)cc(OC)c2O)CCO1 178849107 JRBCSJTZQUPHRE-CYBMUJFWSA-N 265.353 2.320 10 20 CECD CCN(CCNC(=O)N(C)Cc1ccccc1O)C1CC1 102066473 PGVLNEOLUSAIJS-UHFFFAOYSA-N 291.395 2.018 10 20 CECD COc1cc(C)cc(CN2CCC[C@H](OC)C2)c1O 178886425 GMAKEAQJXHLLHM-ZDUSSCGKSA-N 265.353 2.320 10 20 CECD Oc1ccccc1CN1CCN(c2ccccc2O)CC1 179552464 XHZKKSTUEYKGIR-UHFFFAOYSA-N 284.359 2.420 10 20 CECD Nc1ccc(CCNC(=O)CCc2cscn2)cc1 179042611 OMSYVWGGDYCCTI-UHFFFAOYSA-N 275.377 2.017 10 20 CECD Cc1ccc(C(=O)N(CC(F)F)C2CC2)c(O)c1O 179485757 RBYAQDWPGABWSO-UHFFFAOYSA-N 271.263 2.276 10 20 CECD Cc1nc(C(=O)NCc2ccc3c(c2)CCCN3C)co1 187044332 GDDGATHDMAIDLQ-UHFFFAOYSA-N 285.347 2.295 10 20 CECD CONC(=O)c1cc(C)n(-c2ccc(OC)cc2)c1C 73084549 PFZRSCSZEPOMNI-UHFFFAOYSA-N 274.320 2.394 10 20 CECD CN(C)CCN(C)Cc1cc(Br)ccc1O 132737323 JYOHTWHZPFKTBH-UHFFFAOYSA-N 287.201 2.148 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1cc(Cl)ccc1O 186223554 MDHUWNOILBADHX-VIFPVBQESA-N 284.787 2.468 10 20 CECD CCc1nnc(CNCc2cc(OC)ccc2O)s1 290761908 BOPMUFAWVKYQTH-UHFFFAOYSA-N 279.365 2.105 10 20 CECD Cc1cc(O)c(CN2CCC[C@]23CCOC3=O)cc1C 190036994 WGZNNDQRGOFRQU-MRXNPFEDSA-N 275.348 2.291 10 20 CECD COc1cc(O)c(CN2CCCCC2)cc1OC 138356636 LVUSEBTWBSTGPH-UHFFFAOYSA-N 251.326 2.395 10 20 CECD CCOc1ccc(O)c(CNCC23CC(CO2)C3)c1 527790171 SJTRUKOQWWXGLE-UHFFFAOYSA-N 263.337 2.060 10 20 CECD C/C=C/C[C@H](CO)N[C@H](C)c1cc(C(=O)OC)ccc1O 274646774 SEACEBDTPDFLFU-WPCUQIPDSA-N 293.363 2.157 10 20 CECD CCn1ccnc1[C@H]1OCC[C@@H]1NCc1ccccc1O 275620629 RNYXOYOQMDFRTN-ZFWWWQNUSA-N 287.363 2.228 10 20 CECD CC[C@@H](NCCCOCCO)c1ccc(C)cc1O 280095476 MSKZNLOHLRRPMB-CQSZACIVSA-N 267.369 2.140 10 20 CECD CC[C@H](N[C@@H](C)C[S@](C)=O)c1ccc(F)cc1O 286272460 VOYPFZPDVGEYFN-BMKPQVEQSA-N 273.373 2.339 10 20 CECD COCC1(O)CCN(Cc2ccc(N(C)C)c(C)c2)CC1 293790293 MLKPDKFQNCVVFU-UHFFFAOYSA-N 292.423 2.034 10 20 CECD Cc1cc(CN2C[C@@H](C)S(=O)[C@H](C)C2)ccc1N(C)C 815100073 BXDAEJGITCJHQE-ZIAGYGMSSA-N 294.464 2.402 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCc2cccnc21 816912132 KVJJBHIMZDBGPX-CYBMUJFWSA-N 268.316 2.133 10 20 CECD CN1CCN(c2ccc(CNCC(C)(F)F)cc2)CC1 815146749 IXXGDCRAWAMEPD-UHFFFAOYSA-N 283.366 2.183 10 20 CECD C[C@H](N)CN[C@@H](C)c1cccc(C(F)(F)F)c1O 817973283 SJJDJLWSRVZRRS-YUMQZZPRSA-N 262.275 2.409 10 20 CECD CCCCn1nnnc1COc1ccc(N(C)C)cc1 810000040 CUUMPKKTOWWMTF-UHFFFAOYSA-N 275.356 2.118 10 20 CECD COc1ccc2c(c1)CCCN2Cc1cc(=O)c(O)co1 736309119 ZYMHCOPAQFOLCY-UHFFFAOYSA-N 287.315 2.307 10 20 CECD Cc1cccc(CNC2(CO)CCSCC2)c1O 839182051 MCCRFLZVWAOFNX-UHFFFAOYSA-N 267.394 2.048 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H]1C[C@@H](O)C1 839789581 AQJMWFLKMZLJMD-TXEJJXNPSA-N 290.388 2.409 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1cccc(CC)c1O 848903502 UTLMWUQELNFTBZ-GJZGRUSLSA-N 279.380 2.238 10 20 CECD COc1ccc(CN[C@H](C)[C@@H]2CCCNC2)cc1C 841032848 GEPVHLODUSXTPD-UKRRQHHQSA-N 262.397 2.481 10 20 CECD COCCOCCc1nc(-c2ccc(O)c(O)c2)cs1 843268578 JONOWNJYGFSMGJ-UHFFFAOYSA-N 295.360 2.427 10 20 CECD CC(C)[C@@H](CNCc1ccc(N(C)C)c(F)c1)C(=O)O 848638672 BNPBJJGQVVLGDA-GFCCVEGCSA-N 282.359 2.338 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1cccc(Cl)c1O 843121722 IQZZEJHFKMNHLX-QWRGUYRKSA-N 272.751 2.177 10 20 CECD CCOCc1cc(CNC[C@H](N)CC)ccc1OC 841070140 MBGXOFFYVCSUAA-CQSZACIVSA-N 266.385 2.059 10 20 CECD COCCCN(C)CCN[C@H](C)c1cccc(OC)c1O 846146229 OPGOZJMNZKJCJD-CYBMUJFWSA-N 296.411 2.020 10 20 CECD O=C(O)c1ccc(CCNC(=O)c2cc(O)cs2)cc1 740122503 QCSXYUGCVGEBGQ-UHFFFAOYSA-N 291.328 2.124 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=S)NCC1CC1 849252934 OKRBETWUDWQLQW-UHFFFAOYSA-N 277.437 2.469 10 20 CECD CCCONC(=O)NCc1cc(Cl)ccc1O 845280821 GQHAYBJWTRLRGF-UHFFFAOYSA-N 258.705 2.186 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CCS[C@@H]2C)c1 858579713 XTKHBJMCSXOLOJ-PWSUYJOCSA-N 280.393 2.394 10 20 CECD Cc1cc(CN2CCO[C@@H]3COCC[C@@H]32)ccc1N(C)C 933966058 ZMGXYTIJAMWTRY-DLBZAZTESA-N 290.407 2.051 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@H]2O)C(C1CC1)C1CC1 768444649 MUGAFHVWICFNIR-OAHLLOKOSA-N 289.375 2.438 10 20 CECD CC(C)[C@H]1C[C@@H](C(=O)NCc2ccccc2O)CCO1 934936688 WDINKYMRGTZPAS-SWLSCSKDSA-N 277.364 2.460 10 20 CECD Cc1nnc(CNC(=O)N[C@H](C)c2ccccc2O)s1 868486425 JSXZEWYIMPRBES-MRVPVSSYSA-N 292.364 2.113 10 20 CECD C[C@@H](Cc1cnn(C)c1)NCc1ccc(N(C)C)c(F)c1 768404068 UQEMQDZRUFLRAG-LBPRGKRZSA-N 290.386 2.346 10 20 CECD CCC[C@H]1NC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 761361116 KYQHNSOCRQUVRR-OAHLLOKOSA-N 299.374 2.283 10 20 CECD C[C@H]1CCCCN1C(=O)CN[C@H](C)c1ccccc1O 879649684 SJVNHSIQWOFTHG-QWHCGFSZSA-N 276.380 2.444 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2CC=CC2)c1 875289745 MTZRDKULEGHPOG-UHFFFAOYSA-N 276.336 2.166 10 20 CECD C[C@@H](NC(=O)[C@]1(C)CCOC1)c1ccc(N(C)C)cc1 773011255 DYAKRFVYRZMPQU-MLGOLLRUSA-N 276.380 2.356 10 20 CECD CN(C[C@@H]1CCCC[C@@H]1O)C(=O)c1cc(O)cs1 778515211 PCRFWTUFTISFDY-ONGXEEELSA-N 269.366 2.077 10 20 CECD COc1cc(O)c(CN2CCC(F)(F)C2)cc1OC 776293772 UYJFHGQJRZGXPM-UHFFFAOYSA-N 273.279 2.250 10 20 CECD CC(C)c1cc(NS(=O)(=O)c2cnc[nH]2)ccc1O 882799324 YKPWUJAQBCNZHS-UHFFFAOYSA-N 281.337 2.040 10 20 CECD CN(C)c1ccc(CNS(=O)(=O)CC2(C)CCC2)cc1 881761140 NVZDYLCRMASZDJ-UHFFFAOYSA-N 296.436 2.362 10 20 CECD CC(=O)Nc1ccc(CNCc2cc(F)ccc2O)cn1 789752824 STCAVYCWCJVZCE-UHFFFAOYSA-N 289.310 2.175 10 20 CECD C[C@@H](NCCc1cncn1C)c1cc(F)cc(F)c1O 788257355 NUXIOYGBSUHSGS-SECBINFHSA-N 281.306 2.297 10 20 CECD C[C@@H](NC(=O)NCCC(C)(C)N)c1ccc(N(C)C)cc1 891812910 GTHWKXMSWJHORU-GFCCVEGCSA-N 292.427 2.240 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@]2(C)CCCOC2)c1 781352006 RVZVARAHDUCUJV-BDJLRTHQSA-N 293.363 2.395 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCCC[C@@H]2O)c1O 190265001 PGSBXIFBABFXDX-RYUDHWBXSA-N 285.771 2.447 10 20 CECD CCCN(Cc1ccccc1O)[C@@H](COC)C(=O)OCC 792185972 NIDSWSSXNMKHLO-AWEZNQCLSA-N 295.379 2.182 10 20 CECD Cc1ccc(O)c(CN2C[C@@H](C)S(=O)[C@H](C)C2)c1 792191790 ADTWPHKWLYXNTH-VXGBXAGGSA-N 267.394 2.042 10 20 CECD CCOC(C)(C)CNCc1c(O)cccc1OC 780583327 MMNNLYJWTRNQHU-UHFFFAOYSA-N 253.342 2.306 10 20 CECD COc1cc(C)c(CN[C@H]2CCC[C@H]2C(=O)O)c(O)c1 1604695309 LVERNKIEKTYJEX-YPMHNXCESA-N 279.336 2.052 10 20 CECD C[C@H](C(=O)O)N(Cc1cc(F)cc(F)c1O)C1CC1 1588597823 TWUZNCOCUXUKHR-SSDOTTSWSA-N 271.263 2.108 10 20 CECD CN(C)c1ccc(CNC(=O)NC2CC=CC2)cc1 162396360 KJKWYBMSJICRBS-UHFFFAOYSA-N 259.353 2.270 10 20 CECD C[C@H]1CC(=O)CC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 159143170 RTZNABKGNLBPBI-LRDDRELGSA-N 288.391 2.374 10 20 CECD C[C@@H]1CCNCC[C@H]1NCc1ccc(N(C)C)cc1 817896568 KQCUDEZQTWIPLR-CZUORRHYSA-N 261.413 2.230 10 20 CECD CCCCNC(=O)CN(C)c1ccc(OC)cc1 844353575 RMCFHSXLOZARSG-UHFFFAOYSA-N 250.342 2.048 10 20 CECD CCc1cccc(CNCC(C)(C)CCO)c1O 691493915 MBGSFKVGHWUIKP-UHFFFAOYSA-N 251.370 2.453 10 20 CECD COc1cc(CNCc2cccc(OC)c2O)sn1 399019095 DAWFRNCXPOACQV-UHFFFAOYSA-N 280.349 2.156 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](O)C2)cc1F 179950455 BEUYPOHSOWOINP-CYBMUJFWSA-N 266.360 2.239 10 20 CECD CN(C)c1ccc(CNC(=O)c2cncc(F)c2)cc1F 126309586 DCCVTKFTPYUJIJ-UHFFFAOYSA-N 291.301 2.356 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)CCC1CCC1 290665068 FXXYZAVUCJISBS-UHFFFAOYSA-N 283.393 2.344 10 20 CECD CN(C)c1ccc(CCNC(=O)Cc2ccc(N)cc2)cc1 237076537 YUDUUSSAEWYAQS-UHFFFAOYSA-N 297.402 2.236 10 20 CECD CN(C)c1ccc(CN2CCO[C@H]([C@H]3CCCO3)C2)cc1 246477860 OSTWOFGMMULVDC-SJORKVTESA-N 290.407 2.132 10 20 CECD Cn1ccnc1[C@@H]1CCN(Cc2ccccc2O)C1 368131662 BDWKAAXSXKARIE-CYBMUJFWSA-N 257.337 2.115 10 20 CECD COc1ccc(N(C)CCN2C[C@@H]3CC[C@H](C2)O3)cc1F 367764442 XSVXRWONQFFQPK-OKILXGFUSA-N 294.370 2.134 10 20 CECD C[C@H](NC[C@@]1(O)CCO[C@H]1C)c1cc(Cl)ccc1O 278909018 VPAQOIHPWHZEPJ-BHDSKKPTSA-N 285.771 2.236 10 20 CECD O=C(NCc1cccc(Br)c1O)NCC1CC1 278272670 FTOWOXQXAIPTKA-UHFFFAOYSA-N 299.168 2.364 10 20 CECD COc1ccc(O)c(CN2CCOCC3(CCC3)C2)c1 363928390 PCDXJVCSNUKKBL-UHFFFAOYSA-N 277.364 2.403 10 20 CECD CSCC(C)(C)C(=O)NCCc1ccc(O)c(O)c1 282283210 FABMDDLVXXGGDV-UHFFFAOYSA-N 283.393 2.146 10 20 CECD CCN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H](C)CO 293698628 RGYIAOOCXKLTPQ-QMMMGPOBSA-N 288.731 2.157 10 20 CECD Cc1cc(CN2CCOC[C@H]2C[C@@H](C)O)ccc1N(C)C 294487799 HQCHUTTXMXNWPG-GDBMZVCRSA-N 292.423 2.033 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)NCCF)c1ccc(C)cc1O 800498478 LCIVVKOZGWIATI-WCQYABFASA-N 282.359 2.216 10 20 CECD COc1ccc(CNCc2ccccc2O)c(OC)n1 810177116 KKLJZBOXGFQDOJ-UHFFFAOYSA-N 274.320 2.094 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)N2CCCC2)c1 728937654 FRODBHSDCDMEKU-JTQLQIEISA-N 264.325 2.267 10 20 CECD Cc1cc(O)c(CNC[C@@H](O)C2CCOCC2)cc1Cl 825287730 LURQVHMVWBZIPH-OAHLLOKOSA-N 299.798 2.231 10 20 CECD CC1=NO[C@@H](CNCc2c(O)cccc2Cl)C1 822324376 JWEHNICFKYTPFM-SECBINFHSA-N 254.717 2.300 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H](OC)C2CC2)cc1 822840759 BXLIXVVLFQASJR-OAHLLOKOSA-N 293.363 2.100 10 20 CECD CC[C@H](NC1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)O 824922253 YPRDBVRBXJORLU-DYVFJYSZSA-N 292.423 2.413 10 20 CECD COc1cccc(O)c1CN[C@H](C1CC1)[C@H](CO)C1CC1 824846453 SHFFLVDDQXTLDH-RHSMWYFYSA-N 291.391 2.288 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H](F)C2)cc1F 838029632 JQSSDJQRNHIWMF-NSHDSACASA-N 283.322 2.145 10 20 CECD CC(C)O[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)C1 838060329 HOZRZCZODBNOAN-BETUJISGSA-N 278.352 2.147 10 20 CECD C[C@H](NC[C@H]1CCCN1CCCO)c1cc(F)ccc1O 834850660 OYOJBXJYAGGTKU-GXTWGEPZSA-N 296.386 2.029 10 20 CECD CCN(CC1CCC1)C(=O)c1c(F)ccc(O)c1O 831015423 UYXHLCHCXOIQIG-UHFFFAOYSA-N 267.300 2.499 10 20 CECD Oc1c(F)cccc1CNCCC[C@@H]1CCCN1 841072408 JNUYVZLIYQJFOD-GFCCVEGCSA-N 252.333 2.153 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H](C)CCCN 841999233 DRSFFMAEMCVBRY-CYBMUJFWSA-N 293.411 2.441 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 843057672 QNWRQSALDOKRMO-DTWKUNHWSA-N 272.751 2.354 10 20 CECD C[C@@H](CCO)N(C)Cc1ccc(N(C)C)c(F)c1 846109104 CYDUVHKQCKOAQZ-NSHDSACASA-N 254.349 2.094 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1cc(Cl)ccc1O 840956673 BMIQHICYDMXCGU-GFCCVEGCSA-N 283.755 2.477 10 20 CECD Cc1ncsc1CNC[C@@H](N)c1ccc(N(C)C)cc1 841045788 QBZFNZIFLJWMGL-CQSZACIVSA-N 290.436 2.307 10 20 CECD CC[C@H](O)[C@@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 912125200 MHWNFBGHXQHWJX-STQMWFEESA-N 293.363 2.172 10 20 CECD CN(C)C(=O)[C@H]1CCN(Cc2ccc3ccccc3c2O)C1 840959065 XRVIVLJLQWISCG-HNNXBMFYSA-N 298.386 2.456 10 20 CECD CCOc1cccc(CN[C@H]2CCCC[C@@H]2CN)c1O 841031809 YLNBMJZIJBYSET-OCCSQVGLSA-N 278.396 2.398 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cccc(CC)c2O)[C@@H]1OC 848902699 GQBZKOOHNTWVHN-FMKPAKJESA-N 279.380 2.237 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)N2CCCC2)cc1 844777197 GJHKBWFRGWPEON-UHFFFAOYSA-N 291.395 2.279 10 20 CECD C[C@H](N[C@H](C)C[S@](C)=O)c1cc(F)cc(F)c1O 757654494 ASJRBSFPSUVQLQ-MPSDLYAZSA-N 277.336 2.088 10 20 CECD Cc1ccc([C@H](C)N[C@H](CO)C2CCOCC2)c(O)c1 757660051 ZFYCLKMMDBKIJW-SWLSCSKDSA-N 279.380 2.139 10 20 CECD CCOc1ccc(CN[C@H]2CC[C@@H](CO)CC2)c(O)c1 757702797 QDPCYPUBABPVKS-XBXGTLAGSA-N 279.380 2.432 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)N(C)C)cc1F 750196583 VKFVWEQMMQXBAU-LBPRGKRZSA-N 295.402 2.238 10 20 CECD CN(C)c1ccc(CN[C@H](CO)CC2CC2)cc1F 754832605 GRWZRNIGLAHAIL-ZDUSSCGKSA-N 266.360 2.142 10 20 CECD CCOc1ccc(CN2CC[C@H](C)[C@H](CO)C2)c(O)c1 857060666 DIFABNXPOYCYPV-JSGCOSHPSA-N 279.380 2.241 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@@H](C)n2cccn2)c1 862755500 UNIXXVFUMFPYJE-GFCCVEGCSA-N 273.336 2.165 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCCC(F)(F)CC1 863937586 HQJFCOJAONHISY-UHFFFAOYSA-N 289.253 2.498 10 20 CECD COc1ccc(N(C)C[C@@H]2CC3(CC3)C(=O)O2)c(OC)c1 763737374 PTAGRGOTYWQKMZ-LBPRGKRZSA-N 291.347 2.236 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC2COC2)cc1F 769714219 TYCRBQVMJUAPQA-UHFFFAOYSA-N 294.370 2.325 10 20 CECD O=C(CC1(O)CCCCC1)NCc1ccccc1O 769361751 UEWJHUTXZJKYPT-UHFFFAOYSA-N 263.337 2.094 10 20 CECD O=C(O)C1CC(NCc2cc(Cl)cc(F)c2O)C1 874055548 BWXLFYJHBYDOLB-UHFFFAOYSA-N 273.691 2.138 10 20 CECD Cc1ccn(C[C@H](C)C(=O)N(C)c2ccc(N)cc2)n1 877077167 YJGUWNYKYUNHDZ-NSHDSACASA-N 272.352 2.073 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCc1ccco1 779489793 UMXAUQYEYIMJLI-XQRVVYSFSA-N 273.288 2.063 10 20 CECD CC1(C)C[C@H]1CNC(=O)/C=C/c1ccc(O)c(O)c1 779517305 PHQHKUZPRPTXPB-MALLOTDXSA-N 261.321 2.273 10 20 CECD CCN(C)c1ccc(CN2CCc3nnc(O)cc3C2)cc1 773862434 YUXLPYXHZFZYFP-UHFFFAOYSA-N 298.390 2.197 10 20 CECD CC[C@@H](NCCCn1cncn1)c1ccc(N(C)C)cc1 776975378 PYCUWVCCOPYMKX-MRXNPFEDSA-N 287.411 2.475 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)c1nccnc1CN 1120828468 QZCDNCSJSBEXRW-UHFFFAOYSA-N 285.395 2.028 10 20 CECD COc1cc(C)cc(CNCCCc2cnn(C)c2)c1O 894214993 NPMNOFHBQVGUEI-UHFFFAOYSA-N 289.379 2.165 10 20 CECD COc1ccc(CN[C@@H](C)C(F)(F)F)c(O)c1OC 894518701 LHGOXJWSUQBTBW-ZETCQYMHSA-N 279.258 2.450 10 20 CECD CNC(=O)C(C)(C)CN[C@H](C)c1ccc(C)cc1O 186223907 SNCDZJGLPFMPCF-LLVKDONJSA-N 264.369 2.123 10 20 CECD CNC[C@@H](C)CN[C@H](C)c1cc(F)cc(F)c1O 1329022575 FTBTWLSYHKCHMO-RKDXNWHRSA-N 258.312 2.177 10 20 CECD CN(C)[C@@H]1CCCC[C@@H]1NCc1cc2c(cc1O)OCO2 1254184555 PECUEBRQYOAGRV-QWHCGFSZSA-N 292.379 2.083 10 20 CECD C[C@@H](CC(F)(F)F)NC(=O)NCc1ccc(N)cc1 1262603312 FASKOFGMFZQINN-QMMMGPOBSA-N 275.274 2.409 10 20 CECD Cc1cccc(O)c1CNCC1(C(=O)O)CCCC1 1600543506 ZYGVZJCGSWFHJP-UHFFFAOYSA-N 263.337 2.435 10 20 CECD C[C@@H](CN(C)Cc1cc(Cl)cc(F)c1O)C(=O)O 1603155316 HXOAAVISVXLMHS-ZETCQYMHSA-N 275.707 2.337 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1cc(OC)c(OC)cc1O 1604903618 PODYPNBTKCOZCF-HNNXBMFYSA-N 297.351 2.142 10 20 CECD CCN1CCc2cc(CN[C@@H](CC(F)F)C(=O)O)ccc21 1776877167 RCUDQHWJNJPSTH-LBPRGKRZSA-N 298.333 2.267 10 20 CECD COC(=O)N1CCC(NCc2c(C)cccc2O)CC1 876972235 XSTQKCYGLCVPHS-UHFFFAOYSA-N 278.352 2.021 10 20 CECD CCN1CCC(N[C@H]2CCc3cccc(O)c32)CC1 295819087 DFJLXMAMRWTLOP-AWEZNQCLSA-N 260.381 2.453 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@]3(C(=O)O)C2)c1 701499625 DYTITPVXXIFDOH-BBRMVZONSA-N 275.348 2.387 10 20 CECD Oc1ccccc1CN1CCC[C@H](N2CCCC2)C1 374258070 IDFOHJFEMVCYHF-HNNXBMFYSA-N 260.381 2.452 10 20 CECD OC[C@H](C[C@@H]1CCCO1)NCc1cc(Cl)ccc1O 886229736 VBCQTNPMWJNZAJ-STQMWFEESA-N 285.771 2.065 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@H]1C[C@H](C)c2c(C)ccc(O)c21 1327377096 WQDUAMBGXXZWMJ-ZJQBRPOHSA-N 277.364 2.252 10 20 CECD COc1cc(O)c(CN2CCSC[C@H]2C)cc1OC 179444574 OAIMJDFKQQEHHY-SNVBAGLBSA-N 283.393 2.347 10 20 CECD Oc1c(Cl)cccc1CNC[C@@H](O)c1ccco1 305779370 NFPPHZKZAORSGU-LLVKDONJSA-N 267.712 2.462 10 20 CECD O=C(CCCn1cccc1)NCCc1ccc(O)c(O)c1 122796737 KMHFFFJQNDHCAR-UHFFFAOYSA-N 288.347 2.038 10 20 CECD Oc1c(Br)cccc1CNC1CSC1 307640215 FGVVJAJQBHAWLD-UHFFFAOYSA-N 274.183 2.360 10 20 CECD CC[C@H](SC)C(=O)N(C)Cc1ccccc1O 124860577 BZMIDUBDJLTBJI-LBPRGKRZSA-N 253.367 2.492 10 20 CECD C[C@@H](CN[C@H](C)c1cc(F)ccc1O)CN1CCOCC1 185505648 KGOWRUVTZNMLLX-QWHCGFSZSA-N 296.386 2.150 10 20 CECD CC[C@H](N[C@H](C)CCS(C)(=O)=O)c1ccccc1O 156382799 RAMRENSWCTXHIL-YPMHNXCESA-N 285.409 2.256 10 20 CECD COCCCN(C)CCN[C@H](C)c1ccc(C)cc1O 185554073 QHZMNCQPNHNMCQ-CQSZACIVSA-N 280.412 2.320 10 20 CECD C[C@H](NCC1(CO)COC1)c1ccc2ccccc2c1O 186146251 UTXIBRMSUAFURW-LBPRGKRZSA-N 287.359 2.205 10 20 CECD CCOC(=O)N1CC[C@@H](N[C@H](C)c2ccc(F)cc2O)C1 186468410 CRSKYAGRRMPQIU-ZYHUDNBSSA-N 296.342 2.413 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@H]3CC[C@H]2NC3)c(O)c1 530247215 XZCRXVDFYRSPRG-KCPJHIHWSA-N 276.380 2.021 10 20 CECD CN(C)c1ccc(CN(Cc2nccc(N)n2)C2CC2)cc1 269667205 QHBLUNCXJOWNDH-UHFFFAOYSA-N 297.406 2.289 10 20 CECD CC[C@H](C)CN(C)C(=O)c1c(F)ccc(O)c1O 276548015 HCTSHIQROSLDBQ-QMMMGPOBSA-N 255.289 2.355 10 20 CECD COC[C@@H](N[C@@H](C)c1cc(C(=O)OC)ccc1O)C1CC1 273460333 HXVVEYKFUNRLCA-IINYFYTJSA-N 293.363 2.254 10 20 CECD C[C@H]1[C@@H](C)N(Cc2ccc(N(C)C)c(F)c2)CC[S@@]1=O 271200522 PSPXTASXTPLJFS-JGRMJRGVSA-N 298.427 2.233 10 20 CECD CC[C@H](N[C@H](CCO)COC)c1ccc(C)cc1O 280018454 HECPOCHVENVTDQ-OCCSQVGLSA-N 267.369 2.139 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@]2(CCO[C@@H]2C)O1 280358008 CJWQGBYLMDNNLE-HSMVNMDESA-N 295.354 2.300 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C)CSC 808095573 KEUSSXPZODQZMN-SNVBAGLBSA-N 288.409 2.493 10 20 CECD COc1ccc(O)c(CNCCc2cccnc2OC)c1 290975850 SXTKWVDXBCOPBQ-UHFFFAOYSA-N 288.347 2.137 10 20 CECD CCOC(=O)[C@@H](F)C1CN(Cc2cc(C)ccc2O)C1 293510845 ABQRJUDZDDQHSG-AWEZNQCLSA-N 281.327 2.034 10 20 CECD CCCN(Cc1ccnc(OC)n1)c1ccc(CN)cc1 296635748 CCGNTOYGCYYMOW-UHFFFAOYSA-N 286.379 2.361 10 20 CECD O=C(NCc1ccccc1O)c1ccnc(-c2ncc[nH]2)c1 815834047 PUJQHEBLBFPZDC-UHFFFAOYSA-N 294.314 2.107 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)/C=C/[C@@H]2CCOC2)c1 827303197 CBCBSDWJRTZIOD-CXILLOQGSA-N 291.347 2.171 10 20 CECD COC1CCN(c2ccc(CN3CCOCC3)cc2)CC1 827294941 XSWNLHQCHQUODO-UHFFFAOYSA-N 290.407 2.134 10 20 CECD COc1cccc(CNC2CCN(CC3CC3)CC2)c1O 725846364 AMKWFQHKWKTECU-UHFFFAOYSA-N 290.407 2.365 10 20 CECD C[C@@H](c1ncccn1)N1CCCc2cc(CN)ccc21 903423582 XNPKWDICEFSDMQ-LBPRGKRZSA-N 268.364 2.449 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C\c2cccc(O)c2)c1 588537018 IQYGWCDJXQHOAP-YVMONPNESA-N 299.326 2.436 10 20 CECD CC[C@@H](O)[C@H](C)C(=O)NCc1cc(Cl)ccc1O 911898955 SXRKWLLUPOJNEZ-GZMMTYOYSA-N 271.744 2.069 10 20 CECD CC1=NO[C@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 832431453 PJHVJUYZMXNQIK-RISCZKNCSA-N 275.352 2.095 10 20 CECD C[C@@H](NC(=O)c1cc2n(n1)CCCC2=O)c1ccccc1O 913763761 QPAZCTJCWXDBQR-SNVBAGLBSA-N 299.330 2.056 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](O)c2ccco2)c1O 846139740 YNJWPJCJQUAHHA-ZYHUDNBSSA-N 277.320 2.378 10 20 CECD C[C@](O)(CNC(=O)c1cc(O)cs1)c1cccs1 740155048 AHDMWTILVWKEPD-LBPRGKRZSA-N 283.374 2.153 10 20 CECD CCn1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)n1 843830587 JCFMASVSNFVZHG-UHFFFAOYSA-N 299.374 2.417 10 20 CECD CC(C)[C@@H](CNCc1cccc(Cl)c1O)C(=O)O 848639754 KXVRPQFIDAZXNO-SNVBAGLBSA-N 271.744 2.492 10 20 CECD COC(=O)N(C)CCN[C@H](C)c1cc(F)cc(F)c1O 850548441 RLPRULVRYNMTPG-MRVPVSSYSA-N 288.294 2.019 10 20 CECD Cc1cc(CN2CC[C@H](N)C[C@@H]2C)ccc1N(C)C 923392227 ITRCPSYPQKBMEU-ZFWWWQNUSA-N 261.413 2.373 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2n[nH]c3c2CCCC3)c1 862757533 XMLMDUANHDVODF-UHFFFAOYSA-N 299.374 2.161 10 20 CECD C[C@@H](NC(=O)COC(F)(F)F)c1ccc(N(C)C)cc1 935464957 OGPLEWDEOONDMC-SECBINFHSA-N 290.285 2.466 10 20 CECD COC(=O)[C@H]1CCCN(Cc2ccc(C)cc2O)C1 876556408 QLUPRNLYWAQEQI-ZDUSSCGKSA-N 263.337 2.086 10 20 CECD CCN(C)c1ccc(CN(CCO)CC2CC2)cc1 773748362 DXYCTLIKWARTOG-UHFFFAOYSA-N 262.397 2.347 10 20 CECD Cc1ccc(CN(C)[C@H]2CC(C)(C)OC2=O)c(O)c1 877547605 CNTWZVDFQXZPEL-LBPRGKRZSA-N 263.337 2.227 10 20 CECD CC[C@]1(O)CCN(Cc2ccc(N(C)C)c(F)c2)C1 779220127 XXSLLZFRLFADFY-HNNXBMFYSA-N 266.360 2.239 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 896959571 BZPJNFRBVABWMY-LLVKDONJSA-N 283.755 2.431 10 20 CECD COCCOc1ccc(CNCc2ccccc2O)o1 892790763 IJMPYPQBYISSRZ-UHFFFAOYSA-N 277.320 2.300 10 20 CECD Cc1cc(O)c(CN2[C@H](C)C(=O)N[C@H](C)[C@H]2C)cc1C 895117745 WAYHFRCQWAUNNZ-JHJVBQTASA-N 276.380 2.106 10 20 CECD C[C@@H]1OCC[C@@H]1NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898449282 AJLIOLUBVPQVER-JQFCIGGWSA-N 291.439 2.122 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cccc(OCC)c2O)C1 896962347 MIJKYCQZZSEREL-ZDUSSCGKSA-N 293.363 2.176 10 20 CECD COCCOC[C@H](C)NCc1c(O)ccc(Cl)c1F 790974871 YHFLPVWAKOKRFG-VIFPVBQESA-N 291.750 2.326 10 20 CECD C[C@H](N[C@H](CCO)C1CC1)c1cc(F)ccc1O 756740712 SSJFWUKMVCHBSS-TVQRCGJNSA-N 253.317 2.343 10 20 CECD Oc1cc(Br)ccc1CN1C[C@@H]2CC[C@H](C1)N2 1580888378 KBOBLWPLOXHQJS-TXEJJXNPSA-N 297.196 2.091 10 20 CECD NCc1nccnc1NCc1c(O)ccc2c1CCCC2 1339597417 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CCN(C)c1ccc(CNCC[C@@H](F)C(=O)O)c(C)c1 1776856269 APYHUZDKJODNFT-CQSZACIVSA-N 282.359 2.354 10 20 CECD C[C@@]1(NCc2cc(F)cc(F)c2O)CCC[C@@H]1C(=O)O 1777409757 BNJDOQJNCNCVHA-QMTHXVAHSA-N 285.290 2.403 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]2[C@H](C)O)c1O 852559186 GZUWALKXARUOPF-IINYFYTJSA-N 281.327 2.079 10 20 CECD COc1ccc(O)c(CNC2C[C@@H]3CC[C@H](C2)N3C)c1 192997389 DZYBYDBWKNRFMG-AGUYFDCRSA-N 276.380 2.116 10 20 CECD COc1cccc(CN2C[C@H](CN)[C@@H](C)C[C@H]2C)c1O 397356401 FQSAVTYNGXIMHO-SCRDCRAPSA-N 278.396 2.206 10 20 CECD C[C@@H](NC[C@@](C)(O)C1CC1)c1cc(F)ccc1O 310981739 RDOYJVOZTCVHEH-YMTOWFKASA-N 253.317 2.343 10 20 CECD CCCCNC(=O)CN1CCCc2cc(OC)ccc21 27579226 LRVUBBYGYOUSOG-UHFFFAOYSA-N 276.380 2.364 10 20 CECD COc1ccc(C(=O)NCc2cc(OC)ccc2O)cc1 114540710 VLTMHSGSTCLSKN-UHFFFAOYSA-N 287.315 2.339 10 20 CECD COCCCOC1CCN(Cc2ccccc2O)CC1 179578102 NPRQZPPXBDGJJV-UHFFFAOYSA-N 279.380 2.410 10 20 CECD Cc1cc(C(=O)Nn2cnnc2)c(C)n1-c1ccc(F)cc1 181436001 WEXLMDSDPXCXMJ-UHFFFAOYSA-N 299.309 2.209 10 20 CECD Cc1ccc(O)c(CN2CCCC3(C2)OCCO3)c1 184721879 FTPBJOBBDTWECX-UHFFFAOYSA-N 263.337 2.040 10 20 CECD C[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 180583545 ZRUYEIIVDFTOHG-OKPNEXGHSA-N 261.321 2.370 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(OC)ccc2O)C[C@H]1C 188112019 BYWHPQACUYIVIU-RISCZKNCSA-N 293.363 2.032 10 20 CECD Oc1ccccc1CN1CCN(Cc2cccnc2)CC1 183666782 OAJCKVKSWQSQPZ-UHFFFAOYSA-N 283.375 2.105 10 20 CECD CC(C)NC(=O)CCN[C@H](C)c1ccc(F)c(F)c1O 191198076 ZUXKBJNWRCCGJJ-SECBINFHSA-N 286.322 2.236 10 20 CECD COCCOCCNCc1cc(Cl)cc(Cl)c1O 44693700 KMPZDRFUJRTIJG-UHFFFAOYSA-N 294.178 2.452 10 20 CECD CN1CCC[C@H]2CN(Cc3cc(F)ccc3O)CC[C@@H]21 180280367 SGRJFCSVXHKMJN-WFASDCNBSA-N 278.371 2.447 10 20 CECD CN1C[C@@H](NCc2cc(-c3ccccc3)ccc2O)CC1=O 263743802 NYLOTYRUHXBQCE-INIZCTEOSA-N 296.370 2.380 10 20 CECD Cc1ccc(C(=O)N2CCOCC3(CCC3)C2)c(O)c1O 368869870 QEIQFKNINXJCOI-UHFFFAOYSA-N 291.347 2.049 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(C)COC1 272890004 YIPMLYWGGQHIHI-UHFFFAOYSA-N 276.380 2.138 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](O)CCSC 270834544 UKFVKPMNNOLONE-AWEZNQCLSA-N 297.420 2.245 10 20 CECD Cc1ccc(O)c(CN(CCN(C)C)C[C@H]2CCCO2)c1 809738023 PKNMBPRGBPRGMN-MRXNPFEDSA-N 292.423 2.243 10 20 CECD CCN(CC)C(=O)CN(C)Cc1ccc(N(C)C)c(C)c1 293355287 DWGKQIODQURJFZ-UHFFFAOYSA-N 291.439 2.361 10 20 CECD CC(C)OC[C@H](CO)N(C)Cc1cccc(Cl)c1O 809768728 VIZICQVTKKPPPM-LBPRGKRZSA-N 287.787 2.263 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC(CF)CC2)c1O 295085008 QWEFUOKCMUSFCG-UHFFFAOYSA-N 298.314 2.491 10 20 CECD Oc1ccc(F)cc1CN1CC(O)(c2ccccc2)C1 291587325 PMQFNAINLSZKIL-UHFFFAOYSA-N 273.307 2.235 10 20 CECD Cc1cc(CN2CC[C@@H](CN(C)C)C2)ccc1N(C)C 293212264 UZPIAAGBUIIVCM-INIZCTEOSA-N 275.440 2.445 10 20 CECD Cc1cc(CN[C@@H](CCO)C2CC2)ccc1N(C)C 815090833 PDHITGBPFHKADV-HNNXBMFYSA-N 262.397 2.312 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CCCNC2)c1 817946127 RZMKOSFYZXUJIB-NEPJUHHUSA-N 264.369 2.051 10 20 CECD C[C@@H](NCCc1ccc(N)cc1)C1CCN(C)CC1 817956122 RCORIPIZQDKBGK-CYBMUJFWSA-N 261.413 2.131 10 20 CECD CO[C@@H](C)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 839919113 PLVZEEWKGUJOME-STQMWFEESA-N 278.396 2.143 10 20 CECD Cc1cccc(CN[C@@H](C)[C@@H](O)C(F)(F)F)c1O 877693800 QYMQSPBZSJYRAO-GZMMTYOYSA-N 263.259 2.102 10 20 CECD COCCOC1CN(Cc2cc(Cl)c(F)cc2O)C1 838987576 ORHRGMQQUHRQDG-UHFFFAOYSA-N 289.734 2.032 10 20 CECD CCNC(=O)C(C)(C)NCc1cc(Cl)c(F)cc1O 835075779 AZYFMQVDUFVJKY-UHFFFAOYSA-N 288.750 2.189 10 20 CECD CC(=O)N1CCC(NCc2cc(C)c(C)cc2O)CC1 742217067 GPAXARNVIDNULU-UHFFFAOYSA-N 276.380 2.110 10 20 CECD CN(C)c1ccc(CNC(=O)CN[C@@H]2CCC2(C)C)cc1 846957616 JPUPOCVUKWFXPH-OAHLLOKOSA-N 289.423 2.147 10 20 CECD Cn1ncc(/C=C2\SC(=S)N(C3CC3)C2=O)c1Cl 841497832 YXHOHWRCJISVGW-YWEYNIOJSA-N 299.808 2.437 10 20 CECD O=C(NCCCSc1nccs1)O[C@H]1CCOC1 914105794 NKUDCZFYCUIISH-VIFPVBQESA-N 288.394 2.140 10 20 CECD Oc1ccc(Cl)cc1CNCCCNC1CC1 841092982 PJWHXLUJJSMAGF-UHFFFAOYSA-N 254.761 2.277 10 20 CECD Oc1ccc(Cl)c(F)c1CNCCCNC1CC1 841091001 RZGGEJRKNXGPDI-UHFFFAOYSA-N 272.751 2.416 10 20 CECD Cc1ccc(NC(=O)c2cc(O)cs2)c(O)n1 758683191 KXVBCYXRJXHEJV-UHFFFAOYSA-N 250.279 2.115 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](CO)C(C)C 840946268 MLIIYHPNPOBXTF-OAHLLOKOSA-N 264.413 2.415 10 20 CECD CN(C)c1ncc(CNCc2cc(Cl)ccc2O)n1C 846056281 SMBOAEHJDRHTLT-UHFFFAOYSA-N 294.786 2.135 10 20 CECD C[C@H]1C[C@@H](NCCN2CCC2)c2c(O)ccc(F)c21 756769922 RVRHNZKEOVTUJO-CMPLNLGQSA-N 264.344 2.375 10 20 CECD Cc1cccc(-n2c(C)cc(CNS(C)(=O)=O)c2C)c1 859363408 XLYDICLDKIWETC-UHFFFAOYSA-N 292.404 2.452 10 20 CECD Cc1cc(O)c(CN2CC[C@@H]3NC(=O)CC[C@@H]3C2)cc1C 853554618 BPBZBEDQWRNISE-HIFRSBDPSA-N 288.391 2.110 10 20 CECD CO[C@@H](C1CC1)[C@@H](C)NC(=O)NCc1cc(C)ccc1O 858521275 LZWRTHUWAKNWHV-IAQYHMDHSA-N 292.379 2.313 10 20 CECD CCCCOC(=O)CSc1ncc([N+](=O)[O-])s1 866031106 XJDLXFKUPRSUAU-UHFFFAOYSA-N 276.339 2.487 10 20 CECD COCC(C)(C)CNC(=O)N[C@H](C)c1ccccc1O 868640078 JCTDWNLQZDEMDI-LLVKDONJSA-N 280.368 2.425 10 20 CECD CC[C@]1(C)CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768464177 OARHNSSODOJADR-GOEBONIOSA-N 277.364 2.440 10 20 CECD CCOc1ccc(CN2CCCOC[C@@H]2C)c(O)c1 769457156 NWDRINAASNFVBF-LBPRGKRZSA-N 265.353 2.402 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@]23CCC[C@@H]2C3)c1 934942167 KFSBVYCPDRSLBS-IAQYHMDHSA-N 261.321 2.207 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H]2CCN(C)C2)cc1 765767792 HMUVLMCPKXGCTG-HIFRSBDPSA-N 261.413 2.497 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CCCC1 768442043 NZQYPLIFIQUPPN-AWEZNQCLSA-N 263.337 2.192 10 20 CECD Cc1cnc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cn1 773013111 IOHWEQYNEUOSOI-LBPRGKRZSA-N 284.363 2.342 10 20 CECD CCc1nnc(NCc2ccc(OC)cc2O)nc1CC 1116876992 IZCLOGPGZWBCAM-UHFFFAOYSA-N 288.351 2.323 10 20 CECD COc1cc(N2CCOC[C@@H](C)C2)c([N+](=O)[O-])cc1OC 874082691 YKXIAMTYPZKYTI-JTQLQIEISA-N 296.323 2.085 10 20 CECD CC[C@H](CO)C(=O)NCc1ccc(N2CCCCC2)cc1 779752004 JWMNKAWLKPYGTA-OAHLLOKOSA-N 290.407 2.312 10 20 CECD C[C@@H](NC(=O)[C@H](O)C(C)(C)C)c1ccc(N(C)C)cc1 775412306 WJBGRLZBVGMTSY-RISCZKNCSA-N 278.396 2.337 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1c(O)cccc1F)CC2 886521136 VBHURTPQGNEDDV-ONGXEEELSA-N 290.342 2.097 10 20 CECD CC(C)(C)N1CC[C@@H](NCc2cc(F)cc(F)c2O)C1=O 883152303 QVXBCDSZISLYQX-GFCCVEGCSA-N 298.333 2.159 10 20 CECD CN1CCCc2cc(CNS(=O)(=O)C3CCC3)ccc21 881842909 JLGOGBOANQLTLF-UHFFFAOYSA-N 294.420 2.041 10 20 CECD COc1cc(C)cc(CNC[C@](C)(O)C(F)(F)F)c1O 894361656 LSCWZSYDVXFILX-LBPRGKRZSA-N 293.285 2.112 10 20 CECD COc1ccc(CN[C@@H]2CCC[C@H]2OC)c(O)c1OC 894731113 ZNHFSDBESXPCIW-VXGBXAGGSA-N 281.352 2.067 10 20 CECD Oc1ccc(Cl)c(F)c1CNCCNc1cnccn1 790977249 SNVYUCKZUMMGSY-UHFFFAOYSA-N 296.733 2.176 10 20 CECD CC[C@@H](Nc1cnn(CCO)c1)c1ccc(F)cc1O 796893305 QUGRLTVWCIIRPB-CYBMUJFWSA-N 279.315 2.283 10 20 CECD Nc1ccc(CNC(=O)NC[C@H]2CCCSC2)cc1 1262582378 TUTKLDIUSOCVMR-GFCCVEGCSA-N 279.409 2.211 10 20 CECD COc1cccc2c1OC[C@@H](NCc1ccc(N)cc1)C2 1262487848 ICDZMHIDOKYONX-HNNXBMFYSA-N 284.359 2.371 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1CCCCO1 158246227 JKQMOLPOYLQWFT-SNVBAGLBSA-N 286.422 2.311 10 20 CECD O[C@H]1CC[C@H](NCc2ccc3c(c2)CCCO3)CC1 921927916 OGXNZPZPUQPKDJ-SHTZXODSSA-N 261.365 2.405 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCO2)C1(CO)CC1 922245041 IQIYRGNPFOWUAA-LBPRGKRZSA-N 261.365 2.262 10 20 CECD C[S@@](=O)C1(CN[C@H]2CCc3cccc(O)c32)CCC1 296240968 AUUXTQBWMRWVEP-HXPMCKFVSA-N 279.405 2.270 10 20 CECD Cc1cccc(CN2CCN(C)C[C@H]2C(C)C)c1O 248405919 BKBGYILXHPGHNQ-HNNXBMFYSA-N 262.397 2.473 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ncccc1O 194645716 UYSDFMFIHNQDKQ-UHFFFAOYSA-N 285.347 2.125 10 20 CECD CNC[C@H]1CCN(Cc2cc(Cl)cc(OC)c2O)C1 229103419 MOVCQBHVPPTCPR-SNVBAGLBSA-N 284.787 2.096 10 20 CECD C[C@H](O)C[C@@H](C)NCc1cc(Br)ccc1O 228562072 TYRGURJMKIJYCI-BDAKNGLRSA-N 288.185 2.404 10 20 CECD C[C@H](C(=O)NCCc1ccc(N)cc1)c1cccnc1 237430223 HRCORVWKYYJKNU-LBPRGKRZSA-N 269.348 2.126 10 20 CECD Cc1ccc(O)c(CN2CC[C@H]3CCN(C)C[C@@H]32)c1 272261099 ARCLJNKWMYBRKH-HIFRSBDPSA-N 260.381 2.227 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@@H]2[C@H]2CCCO2)c1 377709398 YVMQGJYUPPSPBE-GDBMZVCRSA-N 277.364 2.080 10 20 CECD Cc1nccnc1CCN[C@@H]1CCc2cccc(O)c21 297475501 YVEQPZJMRLXMHO-CQSZACIVSA-N 269.348 2.310 10 20 CECD C[C@@H](CNCc1ccc(N(C)C)c(F)c1)CN(C)C 291815677 YOWOFVMLUNBZGY-LBPRGKRZSA-N 267.392 2.179 10 20 CECD Cn1cnc(/C=C2\C(=O)N3CCCc4cccc2c43)c1 817346276 QRLLQDTZWXDUAG-ZSOIEALJSA-N 265.316 2.254 10 20 CECD CCOc1ccc(CN2CCC[C@H](CO)CC2)c(O)c1 816665487 JHXMQCZXVTZSTC-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD C[C@@H](CN)CN[C@@H](C)c1cc(Br)ccc1O 817962011 GKGAEOKDJSLNAJ-IUCAKERBSA-N 287.201 2.400 10 20 CECD C[C@H]1CC[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1 829680866 GSKLEENOMXHZJI-JGVFFNPUSA-N 253.273 2.155 10 20 CECD CCC[C@H](O)CN1CCCN(c2ccc(OC)cc2)CC1 827468060 KMICBSGWQAIXOL-INIZCTEOSA-N 292.423 2.368 10 20 CECD CCOc1cccc(CN2CC(C)(OC)C2)c1O 839102114 KPRVLCARXHVCIY-UHFFFAOYSA-N 251.326 2.012 10 20 CECD CC(C)C1(O)CN(Cc2cc(Cl)cc(F)c2O)C1 839133642 SFEXKNXNYLQXMK-UHFFFAOYSA-N 273.735 2.387 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1cccc(Cl)c1O 840833218 LYZCVSUOWHDJTJ-NSHDSACASA-N 268.744 2.275 10 20 CECD CN(C)c1ccc([C@@H](N)CNCc2ccccc2O)cc1 841044850 ZEDVMYBIUXFPQZ-INIZCTEOSA-N 285.391 2.248 10 20 CECD COC[C@@H](NC(=O)c1cc(O)cs1)c1ccc(C)o1 746697110 LAHGXVBDDFXURY-SNVBAGLBSA-N 281.333 2.473 10 20 CECD O=C(C[C@H]1CCCO1)NCc1cc(Cl)ccc1O 846471861 BVJIJSMSVULCMS-LLVKDONJSA-N 269.728 2.231 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCC1(N)CCC1 841969036 HUBFUVRLARWJPF-UHFFFAOYSA-N 291.395 2.195 10 20 CECD CN(C[C@H](O)COc1ccccc1)c1ccc(N)cc1 923400812 OMJZIRCXXQXDER-HNNXBMFYSA-N 272.348 2.145 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@@H]1CO 857061205 LXPZOBDMRFAHNT-TZMCWYRMSA-N 280.387 2.342 10 20 CECD COC1CCN(CCN[C@@H](C)c2ccc(F)cc2O)CC1 756641910 JLLGATRANICEQU-LBPRGKRZSA-N 296.386 2.293 10 20 CECD COC[C@H]1CCCN1C(=O)NCc1ccc(N(C)C)cc1 751993153 GVVPLKVCTOPAPZ-OAHLLOKOSA-N 291.395 2.073 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cc(C)cc(OC)c2O)C1 754735848 DTEIRLOEXPBPNP-CQSZACIVSA-N 292.423 2.483 10 20 CECD COc1cc(O)c(CN[C@H](CO)CCC(C)C)cc1OC 862480944 PMDZHPYVEYDJBM-ZDUSSCGKSA-N 297.395 2.296 10 20 CECD CCOC[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CCO1 862502178 CQIURWSZJSLOMX-CQSZACIVSA-N 296.386 2.129 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1CCOC2(CCOCC2)C1 779092561 IQSJEPBYTIWITQ-CQSZACIVSA-N 295.354 2.349 10 20 CECD CCOC(=O)CN(C)Cc1cc(Cl)cc(F)c1O 775650412 ZUUBDNWTFXIHBZ-UHFFFAOYSA-N 275.707 2.180 10 20 CECD Cc1ccc(CN2CCO[C@]3(CCO[C@H]3C)C2)c(O)c1 877487286 SDCYYXWEIKIOIB-XJKSGUPXSA-N 277.364 2.080 10 20 CECD CCOc1ccc(N(C)CCc2ccnn2C)cc1 788481795 UNEFBLKKTXTKMU-UHFFFAOYSA-N 259.353 2.498 10 20 CECD C[C@H](NCCOC[C@@H]1CCOC1)c1c(O)cccc1F 886525905 ASIFQOXZKRBDPG-NWDGAFQWSA-N 283.343 2.235 10 20 CECD COc1cc(CNCCN(C)OC)c(O)c(C(C)(C)C)c1 883170710 AFPINFGTXINVCU-UHFFFAOYSA-N 296.411 2.281 10 20 CECD C[C@@H](N[C@H](C)c1cc(F)ccc1O)c1ncn(C)n1 275774204 VFFSEGNROMTZHP-RKDXNWHRSA-N 264.304 2.072 10 20 CECD Oc1c(CNCCO[C@@H]2CCOC2)ccc2ccccc12 897201958 OSLGJOIRZWITPR-OAHLLOKOSA-N 287.359 2.441 10 20 CECD Oc1ccc(Cl)c(F)c1CNCc1cc[nH]n1 790960887 KABYMDKBRKBMFX-UHFFFAOYSA-N 255.680 2.198 10 20 CECD Oc1ccccc1CN1C[C@@H](O)[C@H](Cc2ccccc2)C1 898142132 IZNBTLLRNKXEIG-SJLPKXTDSA-N 283.371 2.428 10 20 CECD OCCCCNCc1cc(Br)ccc1O 193253529 HEIUGMRSUOZRNS-UHFFFAOYSA-N 274.158 2.017 10 20 CECD CCCCNC(=S)NCc1ccc(OC)cc1O 795032695 WITIQYNLBVKNTI-UHFFFAOYSA-N 268.382 2.165 10 20 CECD CO[C@H]1CC[C@@H](NC(=O)NCc2cc(Cl)ccc2O)C1 1329778306 FNKRJZPOJVJRPY-NEPJUHHUSA-N 298.770 2.412 10 20 CECD Nc1ccc(CC(=O)N[C@@H](c2ccccn2)C2CC2)cc1 1341749706 OOKSEVFWLPSJFU-QGZVFWFLSA-N 281.359 2.474 10 20 CECD CCN(CC)c1ccc(CNC(=O)CNCC(C)C)cc1 1261501695 KDNGYBQPTRROSZ-UHFFFAOYSA-N 291.439 2.395 10 20 CECD C[C@@H]1C[C@H]2CC[C@@H](C(=O)NCc3ccccc3O)CN2C1 1521266156 MMENUIMBAGZACF-BPLDGKMQSA-N 288.391 2.129 10 20 CECD Cc1cccc(CN(CCC(=O)O)C[C@@H]2CCCO2)c1O 1607851377 WQVYMQYRTXNWRD-AWEZNQCLSA-N 293.363 2.156 10 20 CECD CN1CCC[C@H]2CN(Cc3ccc(N)cc3)CC[C@H]21 227328280 GDRLRKQZJWBIHM-GOEBONIOSA-N 259.397 2.185 10 20 CECD Cc1cc2c(NCc3ccccc3O)nccn2n1 228428421 HIBBYYYWBCPAKZ-UHFFFAOYSA-N 254.293 2.355 10 20 CECD CC(=O)c1ccccc1C(=O)NCc1ccc(N)cc1 1575041037 OBSRFHFDTHYFQO-UHFFFAOYSA-N 268.316 2.401 10 20 CECD CN(Cc1ccncc1)c1ccc(OCC(=O)O)cc1 1598531285 GOMUIZKKNIUBFF-UHFFFAOYSA-N 272.304 2.181 10 20 CECD CC(=O)c1cc(F)cc(CN(C)[C@@H]2CCCOC2)c1O 401648553 FAAIPNDFCFODRW-CYBMUJFWSA-N 281.327 2.345 10 20 CECD Cc1cc(C)n(CCC(=O)N(C)c2ccc(N)cc2)n1 702119768 HPINOUJOOBDJTE-UHFFFAOYSA-N 272.352 2.135 10 20 CECD COc1ccc(O)c(CN[C@@H]2C[C@H](OC)C23CCC3)c1 713481306 SPWMOAGPEKDHKW-CABCVRRESA-N 277.364 2.448 10 20 CECD O=C(O)[C@@H]1CN(C(=O)/C=C/c2cccnc2)c2ccccc21 177469493 LKOPIAIRGNWYIE-HSBSLETESA-N 294.310 2.310 10 20 CECD CC[C@H](CCO)NC1CCN(c2ccc(OC)cc2)CC1 305198175 ZTMNQNBKNUMNHC-CQSZACIVSA-N 292.423 2.415 10 20 CECD C[C@H](NC[C@]1(O)CCOC1)c1ccc2ccccc2c1O 186178003 PSWICIGMLIBABD-YVEFUNNKSA-N 287.359 2.347 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2ccc(C)cc2O)C1 185788591 UHGFOBPWLBJWAZ-CHWSQXEVSA-N 276.380 2.362 10 20 CECD C[C@@H](NCCN1CCOC(C)(C)C1)c1cc(F)ccc1O 185361791 HYKQSQPOHCSSIV-GFCCVEGCSA-N 296.386 2.293 10 20 CECD C[C@H](CC[S@](C)=O)NCc1c(O)cccc1Cl 125477470 NDDVLVIBHHKFPX-VVVCHXIZSA-N 275.801 2.292 10 20 CECD CCOC1CC(CC(=O)NCc2cccc(OC)c2O)C1 190723952 AXFBECAMUUZDJD-UHFFFAOYSA-N 293.363 2.222 10 20 CECD CN1CCCc2cc(CNCC3(O)CCCC3)ccc21 87015749 MOUZPJLOXKAKFV-UHFFFAOYSA-N 274.408 2.464 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1nc[nH]c1C 278770021 GPEZVKATWGBMKO-UHFFFAOYSA-N 287.363 2.405 10 20 CECD COC(=O)[C@H]1CC12CCN(Cc1ccccc1O)CC2 272241887 GRYJXGYEQCVLDP-CYBMUJFWSA-N 275.348 2.167 10 20 CECD COC(=O)[C@H]1CCN(Cc2cccc(F)c2O)C[C@@H]1C 276517631 UTQDNMYZXSXJQU-JQWIXIFHSA-N 281.327 2.162 10 20 CECD C/C=C/C[C@@H](CO)N[C@@H](C)c1cc(C(=O)OC)ccc1O 274646764 SEACEBDTPDFLFU-JQBPPHQNSA-N 293.363 2.157 10 20 CECD C[C@@H](O)[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 272543284 PPNXEPSESJJJMF-YPMHNXCESA-N 266.360 2.094 10 20 CECD C[C@@H](NCC1=CCN(C)CC1)c1cc([N+](=O)[O-])ccc1O 273502077 QHHQSXDOIWPELX-LLVKDONJSA-N 291.351 2.213 10 20 CECD CCc1[nH]ccc1C(=O)NCc1cccc(OC)c1O 286823059 TYFPWTPHQDFTFE-UHFFFAOYSA-N 274.320 2.221 10 20 CECD Cc1cc(CN(CCO)CC2CC2)ccc1N(C)C 815023725 FYIHXKOMNCLFJS-UHFFFAOYSA-N 262.397 2.265 10 20 CECD OC[C@@H]1[C@H]2CN(Cc3ccc4ccccc4c3O)C[C@H]21 816617391 XSKHNQPRBNCAGE-ZSHCYNCHSA-N 269.344 2.216 10 20 CECD C[C@@H](NC(=O)CCc1ccon1)c1ccccc1O 827952013 CWPPEUWJYMUTMK-SNVBAGLBSA-N 260.293 2.190 10 20 CECD COC(=O)c1cnc(SCCC[C@H](C)O)s1 829677500 AGDYPOYHOUESDP-ZETCQYMHSA-N 261.368 2.183 10 20 CECD CN(Cc1ccncc1)C(=O)/C=C\c1ccc(O)c(O)c1 588403581 PFKTZWIYFWNVBL-HYXAFXHYSA-N 284.315 2.165 10 20 CECD Cc1cccc(CN2CC(OCC(F)F)C2)c1O 839137731 HRVAZDUEQPJWHF-UHFFFAOYSA-N 257.280 2.167 10 20 CECD CCN(C)c1ccc(CN(CCOC)CCC(=O)O)cc1 846271230 BQKZMYIQYCYOKK-UHFFFAOYSA-N 294.395 2.066 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](N)C2)cc1F 843044475 CTPKZAGSXCAIEY-CYBMUJFWSA-N 265.376 2.205 10 20 CECD Cc1ccc(CNC(=O)NCc2ccccc2O)cn1 748459413 GOMRRUOZAQUXIQ-UHFFFAOYSA-N 271.320 2.095 10 20 CECD Cc1ccc(C(=O)N2CCC[C@H]2c2ncccn2)c(O)c1O 912645385 AOLKBNNVMDHYDR-LBPRGKRZSA-N 299.330 2.174 10 20 CECD O=C(NCc1ccccc1O)Nn1cnc2ccccc21 748463192 MLXMIGNVONDBEU-UHFFFAOYSA-N 282.303 2.195 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)N[C@@H](C)CN 841981591 BKSUNKNBAMUGHF-LBPRGKRZSA-N 279.384 2.051 10 20 CECD CCC(O)(CC)C(C)(C)CNC(=O)c1cccc(O)c1O 855346469 DEALMOHBDHMIOQ-UHFFFAOYSA-N 295.379 2.405 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](c2ccncc2)C1 854508743 WVVXDJYFZQKEMR-NSHDSACASA-N 274.345 2.478 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H]1C[C@@H](C)O 769451871 NWQDOJBGISCRIS-VXGBXAGGSA-N 265.353 2.136 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@](C)(O)COC)cc1 765934744 CRLDIFBROSLOKD-BBRMVZONSA-N 280.412 2.191 10 20 CECD CCC[C@H](OCC)C(=O)NCc1ccccc1O 860232651 CMYJWNZEIVDNNR-ZDUSSCGKSA-N 251.326 2.214 10 20 CECD CN(Cc1cc(Cl)ccc1O)CC1(O)CCC1 761218314 AIYRSJKYISQHRY-UHFFFAOYSA-N 255.745 2.392 10 20 CECD C[C@@H](CSCCNCc1ccc2c(c1)CCO2)C(=O)O 1118195931 TZLHFAJLOCDCTJ-NSHDSACASA-N 295.404 2.165 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)NCc1c(C)cccc1O 877147675 ZIBMZWJXLFCKPX-RYUDHWBXSA-N 264.369 2.093 10 20 CECD Cc1cccc(O)c1CNC[C@@]1(N(C)C)CCSC1 877074419 JKTCMFNEGHIBJN-HNNXBMFYSA-N 280.437 2.228 10 20 CECD CC(C)[C@@H]1CCN1C(=O)/C=C\c1ccc(O)c(O)c1 779545282 RKHRNESKQAIIPM-RNZFLTOJSA-N 261.321 2.368 10 20 CECD Cc1ccc(C(=O)N2CCOc3ccccc3C2)c(O)c1O 780904486 PGVTYIVMKKEKAA-UHFFFAOYSA-N 299.326 2.441 10 20 CECD CO[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 783635751 KRGRKJBMGFUYTQ-SCXUMTSISA-N 291.347 2.139 10 20 CECD CCn1cnc2c1CCN(Cc1c(C)cccc1O)C2 897334456 UQSZKWLMYPAGGK-UHFFFAOYSA-N 271.364 2.475 10 20 CECD CC[C@H](COC)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898450674 SONNWIGHKWZNAZ-WBVHZDCISA-N 293.455 2.370 10 20 CECD O=C(Nc1n[nH]c2ccc(F)cc12)c1cccc(O)c1O 790646487 KYNJEZIHYGIOLJ-UHFFFAOYSA-N 287.250 2.366 10 20 CECD COc1cc(C)cc(CN2CC[C@]3(CCN(C)C3)C2)c1O 793770991 XRUNLNGLSURWHX-KRWDZBQOSA-N 290.407 2.237 10 20 CECD CCOc1ccc(CNCc2cc(C)nn2C)c(O)c1 790601283 JDXWXHJNNZXJSH-UHFFFAOYSA-N 275.352 2.123 10 20 CECD OC[C@@H](CC(F)(F)F)NCc1cccc(Cl)c1O 717714208 WZDHGDSCAMMEFS-MRVPVSSYSA-N 283.677 2.449 10 20 CECD CCOc1cccc(CN[C@@H]2CCN(C)[C@H](C)C2)c1O 90721531 VWYUFMJQRUEVLT-TZMCWYRMSA-N 278.396 2.363 10 20 CECD C[C@@H]1CC(NC(=O)NCc2ccc(N)cc2)C[C@@H](C)O1 1335545417 GUAZVVLNZXUJJX-GHMZBOCLSA-N 277.368 2.024 10 20 CECD CCCC[C@@H](NCc1cc(F)c(F)cc1O)C(=O)O 1605244924 KDNXOYOFRPHOAP-LLVKDONJSA-N 273.279 2.403 10 20 CECD O=C(O)C1(CNCc2cccc(F)c2O)CCCC1 1601708282 DTPASLXIMKCHFU-UHFFFAOYSA-N 267.300 2.266 10 20 CECD COc1cccc(CNCCNC(=O)OC(C)(C)C)c1O 227600753 NTHMDTBKRYQDSK-UHFFFAOYSA-N 296.367 2.015 10 20 CECD Cc1ccc(CN2CC[C@]3(CCCCN3)C2)c(O)c1 1579691683 GWLKVAACWBARPE-MRXNPFEDSA-N 260.381 2.419 10 20 CECD CCC[C@](C)(NCc1cccc(C)c1O)C(=O)O 1595560411 XKYPHKSEOOSIHB-AWEZNQCLSA-N 251.326 2.434 10 20 CECD CN1CCCc2cc(CNCc3cn(C)cn3)ccc21 808386092 VZSSGRGPEBSIAX-UHFFFAOYSA-N 270.380 2.092 10 20 CECD CS(=O)(=O)Nc1cccc(NCc2ccccc2O)c1 20202691 FWGCWGUVKZORRV-UHFFFAOYSA-N 292.360 2.376 10 20 CECD Oc1cc2c(cc1CNC[C@H](O)c1ccsc1)OCO2 152546163 HAZMHWCNIUNTQQ-LBPRGKRZSA-N 293.344 2.006 10 20 CECD C[C@H](N[C@@H](C)c1ncn(C)n1)c1ccc(N(C)C)cc1 275700226 KPQWOARCLNKIKC-RYUDHWBXSA-N 273.384 2.293 10 20 CECD C[C@@H](NCc1csnn1)c1ccc(N(C)C)cc1 398248940 UYNNSACMBKRDST-SNVBAGLBSA-N 262.382 2.455 10 20 CECD CCOc1cccc(CN2CCCOC[C@H]2C)c1O 398910760 HSRTXDQFDOKQKH-GFCCVEGCSA-N 265.353 2.402 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)C[C@H](C)O)c1O 228677806 KFOFEGHTMZISMZ-IUCAKERBSA-N 273.760 2.303 10 20 CECD CC(C)C[C@H](CO)NCc1ccc(N(C)C)c(F)c1 113326921 UIOJXEXZINSIAP-CYBMUJFWSA-N 268.376 2.388 10 20 CECD C[C@@H]1CC(=O)N(CN(C)Cc2ccc(N(C)C)cc2)C1 113238684 MAEUOTAWXODXLN-CYBMUJFWSA-N 275.396 2.010 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H](C)CN2CCOCC2)c1 185504724 GQSGABZFUCWGEE-HUUCEWRRSA-N 292.423 2.320 10 20 CECD C[C@H](O)CCCNCc1cc(Br)ccc1O 227952901 MPJHYXUIRNNSEK-VIFPVBQESA-N 288.185 2.405 10 20 CECD CN(C)c1ccc(CN[C@@](C)(C(N)=O)c2ccccc2)cc1 193420193 BASHASSNGWAMCZ-GOSISDBHSA-N 297.402 2.243 10 20 CECD CCN(Cc1cc(C)ccc1O)[C@@H](C)CS(=O)(=O)CC 93414190 CLBYCIGOGVABEM-ZDUSSCGKSA-N 299.436 2.346 10 20 CECD Nc1ccc(CC(=O)NCCNC2CCCCCC2)cc1 238112937 KSJIVONSZVLORB-UHFFFAOYSA-N 289.423 2.240 10 20 CECD C[C@H]1CCN(Cc2cc(Cl)ccc2O)C[C@H]1CN 253189204 KGHBBNJMCHHLCD-CMPLNLGQSA-N 268.788 2.462 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CC(=O)OCC 269175282 SMQWFHHIAOVVNS-UHFFFAOYSA-N 279.336 2.084 10 20 CECD CC1(C)COCCN1CCNCc1c(O)cccc1Cl 264930057 ADPVMIPXDFNLAZ-UHFFFAOYSA-N 298.814 2.246 10 20 CECD Oc1ccccc1CNCCOCC(F)(F)C(F)F 277486535 NEXFAOQYUXNIDR-UHFFFAOYSA-N 281.249 2.399 10 20 CECD O=C(N[C@@H]1CC=CCC1)c1c(F)ccc(O)c1O 277805816 WBGKKHZXSNZJTB-MRVPVSSYSA-N 251.257 2.075 10 20 CECD C[C@H](NC[C@@H](O)c1cnn(C)c1)c1cc(Cl)ccc1O 273464217 DIAOWOVZGVCLMI-LKFCYVNXSA-N 295.770 2.163 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCCC[C@H]2O)c1 274748879 AEBBDKCEVHSEHU-WDBKCZKBSA-N 293.363 2.133 10 20 CECD C[C@H](NC[C@@]1(O)CCO[C@@H]1C)c1cc(Cl)ccc1O 278909022 VPAQOIHPWHZEPJ-RBZYPMLTSA-N 285.771 2.236 10 20 CECD CN(C)c1ccc(CN[C@@H](CC(N)=O)c2ccccc2)cc1 292971046 KFYXBUCBWLRYGM-KRWDZBQOSA-N 297.402 2.459 10 20 CECD Cc1cc(CN2CC[C@H]([C@@H](C)O)C2)ccc1N(C)C 294773585 ZJSFYRZVJISFHY-HIFRSBDPSA-N 262.397 2.264 10 20 CECD CCCOC(=O)[C@@H](C)Sc1ncc(C(=O)OC)s1 295422804 YJMICTBHNQIPFU-SSDOTTSWSA-N 289.378 2.364 10 20 CECD OC[C@@H]1CCCN(Cc2cc(F)ccc2O)CC1 816665363 DLGFCBURLPWHTA-LLVKDONJSA-N 253.317 2.126 10 20 CECD Cc1c(CNC(=O)[C@@H]2CN(C)C[C@@H]2C)n(C)c2ccccc12 487554679 RULYFMSEMDHBPI-SWLSCSKDSA-N 299.418 2.301 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCC2CNC2)c1O 817965141 MQSCZFUSEPDDRE-VIFPVBQESA-N 254.761 2.224 10 20 CECD C[C@@H](NCCC[C@@H]1CCCN1)c1cc([N+](=O)[O-])ccc1O 817981855 VVYIAMJOJYMVKB-VXGBXAGGSA-N 293.367 2.483 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2cc(F)ccc2O)n1 818345021 IEZJLFQQLLQRGT-VIFPVBQESA-N 278.331 2.302 10 20 CECD Cn1ncc2c1CCC[C@H]2NCCc1ccc(N)cc1 817956291 VTPTWLCECGGTKR-OAHLLOKOSA-N 270.380 2.212 10 20 CECD C[C@@H]1C[C@@H](O)CN1Cc1cc(Cl)c(F)cc1O 816589429 XZTQOGJHLMCUMH-VXNVDRBHSA-N 259.708 2.140 10 20 CECD Cc1cc(Br)cc(CNC/C=C\CO)c1O 826936760 DUPKOZHSTKXJGU-IHWYPQMZSA-N 286.169 2.101 10 20 CECD O=C(/C=C/[C@@H]1CCOC1)NCCCSc1nccs1 823298077 NLTPZFXXHGOKOB-KXMPLOMGSA-N 298.433 2.334 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@@H](C)c1ccccc1O 834880664 ASQCXFWDNHIMPA-YWPYICTPSA-N 265.353 2.094 10 20 CECD O=C1[C@H](N[C@@H]2CCc3cccc(O)c32)C[C@@H]2CCCCN12 834911856 BGJONJJSLUWRLF-BFHYXJOUSA-N 286.375 2.123 10 20 CECD O=C(COC(=O)c1cccs1)c1ccc(O)c(O)c1 916589899 FREZIHVNNDEZDK-UHFFFAOYSA-N 278.285 2.199 10 20 CECD C[C@H](Cc1cnccn1)NCc1ccc2c(c1)CCO2 742723362 JVFPKNUPDJIPLB-GFCCVEGCSA-N 269.348 2.132 10 20 CECD C[C@@H]1CC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)C[C@H]1C 841088430 WKRQFWXUIRGWSR-GYSYKLTISA-N 289.379 2.148 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCn2ccnc2C1 840938371 OEYSCSSRGMKKGF-OAHLLOKOSA-N 284.407 2.362 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 843058673 VSJXVTDCYSQTPM-DGCLKSJQSA-N 265.376 2.061 10 20 CECD CC[C@]1(O)CCN(Cc2ccc(N(C)C)cc2C)C1 840939488 NZNFYMAWSUIIOF-INIZCTEOSA-N 262.397 2.408 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CC(=O)N(C3CC3)C2)c(O)c1 846204645 AGNYHRXPPZXHBT-STQMWFEESA-N 288.391 2.362 10 20 CECD C[C@@H](CN)NCc1ccc(OCc2ccccc2)cc1O 841062730 CAOZAPYLTDMKPP-ZDUSSCGKSA-N 286.375 2.408 10 20 CECD COc1cc(Cl)cc(CN(C[C@@H](C)O)C2CC2)c1O 848929456 XAZQGQVMFGMLGV-SECBINFHSA-N 285.771 2.399 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@H]([C@@H](C)N)C2)cc1 843056918 CAYZIMTZWAXRTM-PBHICJAKSA-N 291.439 2.081 10 20 CECD CCc1ncc(CN(C)c2ccc3c(c2)OCO3)cn1 840937671 UJTOQDZWUWMNOQ-UHFFFAOYSA-N 271.320 2.404 10 20 CECD CCCN(CC(=O)NCc1ccc(N(C)C)cc1)C(C)C 847032250 JWLWAMYXLIOJQL-UHFFFAOYSA-N 291.439 2.489 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H](C)[C@H]1C 841692496 RRWQGVNHONOLIZ-LMCGPQHNSA-N 277.364 2.294 10 20 CECD C[C@H](NCCN1CCCC1=O)c1ccc(Cl)cc1O 846206913 VSKBRBYDWIONNT-JTQLQIEISA-N 282.771 2.319 10 20 CECD CCCN(CC(=O)O)Cc1ccc(N(C)C)c(C)c1 846265237 DEOIFWZJJMEIBB-UHFFFAOYSA-N 264.369 2.358 10 20 CECD Cc1cc(Br)cc(CNC[C@@H](N)C2CC2)c1O 841049736 NISHUAAWRXSJAQ-GFCCVEGCSA-N 299.212 2.290 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H](C)[C@@](C)(CO)C2)c1O 852701913 VTONRMMJIFCCOI-MGPLVRAMSA-N 295.354 2.184 10 20 CECD CN(C[C@@H](O)Cc1ccccc1)c1ccc(N)cc1 923401548 WFNUKDZTQXVDDR-INIZCTEOSA-N 256.349 2.309 10 20 CECD CC[C@H](CCO)NCc1cc(F)c(N(C)C)cc1F 858142734 KXDJTYPLHNOPRP-LLVKDONJSA-N 272.339 2.281 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H]1CCCOC1 935945998 SJOXTIXUURKBFE-GFCCVEGCSA-N 298.379 2.311 10 20 CECD CO[C@H](C(=O)NCc1ccc2c(c1)CCCN2C)C(C)C 769908127 JKESUZIGQHLOLK-INIZCTEOSA-N 290.407 2.356 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C)nnc2C)c1 862758232 TXFDYBSOOAIWBZ-UHFFFAOYSA-N 271.320 2.037 10 20 CECD C[C@H]1C[C@H](NC[C@H]2C[C@@H](N)C2)c2c(O)ccc(F)c21 873250444 HRGDXMLYXKFHRT-GUDRVLHUSA-N 264.344 2.407 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@]1(O)CCSC1 776231996 QJUKCCCLGMWRQW-GFCCVEGCSA-N 291.775 2.142 10 20 CECD COC(=O)[C@H]1CCC[C@H]1NCc1ccc(N(C)C)cc1 1116771996 XUXCIMFTQQNLNM-LSDHHAIUSA-N 276.380 2.184 10 20 CECD CC[C@@H](NCCN1CCOC[C@H]1C)c1ccccc1O 775499177 PJOPINMQSJBBRM-UKRRQHHQSA-N 278.396 2.154 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](n3ccnc3)C2)c1 775674884 NOUGLGFPFSVKIC-AWEZNQCLSA-N 287.363 2.434 10 20 CECD C[C@H](NCc1ccc(-n2cncn2)nc1)c1ccccc1O 783502611 NRJXZCMQABJGEF-LBPRGKRZSA-N 295.346 2.219 10 20 CECD CC[C@@H](CN1CCCC1)NC(=O)c1ccc(C)c(O)c1O 780944333 LZRXTXTZZBDZPA-LBPRGKRZSA-N 292.379 2.010 10 20 CECD Nc1c(C(=O)O)sc2nc(C3CC3)cc(C(=O)O)c12 409440260 KFRMHHUYQNPGLK-UHFFFAOYSA-N 278.289 2.152 10 20 CECD CC[C@H](N[C@@H](C)c1ncnn1C)c1ccccc1O 276696456 VHQVQCAZWHKUFU-JQWIXIFHSA-N 260.341 2.323 10 20 CECD C[C@@H](NC(=O)CNC(=O)OC(C)(C)C)c1ccccc1O 827930452 KOHLDFSKYVJARR-SNVBAGLBSA-N 294.351 2.094 10 20 CECD Oc1ccccc1CNc1ncnc2ncccc12 752633385 UHGLSRYECFLIHV-UHFFFAOYSA-N 252.277 2.343 10 20 CECD CCOCCCN1CCOc2cc(N(C)C)ccc21 746492198 CKLISWLTTRISCH-UHFFFAOYSA-N 264.369 2.378 10 20 CECD Cc1ccc(O)c(CN(C)CC2CCN(C)CC2)c1 133999272 WJWMTBQAWFPGAG-UHFFFAOYSA-N 262.397 2.474 10 20 CECD CCC[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1 1776748108 IHISCKKHCIDBGL-CQSZACIVSA-N 264.369 2.438 10 20 CECD CCNc1cccnc1C(=O)N(C)Cc1ccccc1O 1528025056 VWVILUWBVKONFL-UHFFFAOYSA-N 285.347 2.491 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)Cn2cccn2)c1O 228670940 SPPVDJZQYBLEKM-JTQLQIEISA-N 295.770 2.429 10 20 CECD COc1cc(Cl)cc(CN2CCNCC2(C)C)c1O 229104013 NIPPHHSTEGKQGR-UHFFFAOYSA-N 284.787 2.238 10 20 CECD C[C@H](NCCCn1ccnc1)c1cc(C(=O)O)ccc1O 1593268496 VREPLAKLFYBQJB-NSHDSACASA-N 289.335 2.028 10 20 CECD COc1ccc(O)c(CNc2ncc(C(=O)O)s2)c1 1777367667 CAEIDRSOBZIPRO-UHFFFAOYSA-N 280.305 2.168 10 20 CECD C[C@H]1CN(C(=O)/C=C/c2cccnc2)c2cccnc2O1 158410613 JOZOLBSALHMOGZ-SYTKJHMZSA-N 281.315 2.304 10 20 CECD CCCNCc1ccc(N2CCN(C)CC2)c(F)c1 34823178 KUGBISTYLJUSNV-UHFFFAOYSA-N 265.376 2.077 10 20 CECD CN(C)C[C@H]1CCN(Cc2c(O)cccc2Cl)C1 271165236 HEZIVFRBENUBJJ-LLVKDONJSA-N 268.788 2.429 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(CO)CCC2)c1 186547070 ILDQBYPRGSZBHO-LLVKDONJSA-N 265.353 2.214 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@](C)(O)C2CC2)c1 311694749 SVOXSPGLBPRYOL-MEBBXXQBSA-N 265.353 2.212 10 20 CECD O=C(Cc1ccc(F)cc1)NCc1ccccc1O 82284602 FIRUFAUINMFZOT-UHFFFAOYSA-N 259.280 2.390 10 20 CECD CCc1nc(CN2CCCc3cc(CN)ccc32)no1 700928871 ZMXYKEZWHCMFNO-UHFFFAOYSA-N 272.352 2.044 10 20 CECD CN(Cc1ccccc1O)C(=O)CCc1nccs1 55285961 RJUPFGNOHKTCHJ-UHFFFAOYSA-N 276.361 2.440 10 20 CECD COc1ccc(N(Cc2ncnn2C)C(C)C)cc1F 177099516 VBXSBHSZYBMVGG-UHFFFAOYSA-N 278.331 2.378 10 20 CECD CCO[C@H]1C[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 174519716 ACKGHCDMUAPIMZ-BBRMVZONSA-N 289.375 2.312 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1cc(C)c(C)cc1O 124769442 BCKNCIPJPKMOBZ-ZDUSSCGKSA-N 263.337 2.146 10 20 CECD COc1ccc(O)c(CN2C[C@H](C)O[C@H](C)C2)c1 128741716 JGUFZJYISLBBAB-PHIMTYICSA-N 251.326 2.010 10 20 CECD Cn1nccc1CNCc1cc(Cl)ccc1O 71138203 AAPXESZVAJOFGB-UHFFFAOYSA-N 251.717 2.069 10 20 CECD O=C1CN(Cc2c(O)cccc2Cl)[C@H]2CCCC[C@H]2N1 123603601 YJKLWJILSXKQAQ-OLZOCXBDSA-N 294.782 2.289 10 20 CECD COC(=O)COc1ccc(N(C)Cc2ccco2)cc1 183228980 KHAXPSJBXFFCQU-UHFFFAOYSA-N 275.304 2.468 10 20 CECD CC(C)NC(=O)CN[C@H](C)c1cc(Cl)ccc1O 184895980 SARQKSUMVLJXGC-SECBINFHSA-N 270.760 2.221 10 20 CECD Cc1ccc([C@@H](C)NC[C@H]2CCCS(=O)(=O)C2)c(O)c1 287128161 RNOVYVBSQJIANP-CHWSQXEVSA-N 297.420 2.176 10 20 CECD CO[C@@H](C)CNC(=O)NCc1ccc(N2CCCC2)cc1 190324635 HFYMLZTUNOLGEI-ZDUSSCGKSA-N 291.395 2.121 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)OC)cc1F 192378735 QWLMYXIUALINDA-UHFFFAOYSA-N 283.347 2.375 10 20 CECD CN1CCCc2cc(CNC(=O)c3ccc(CN)o3)ccc21 237129325 AXTPYQSLXOMBDO-UHFFFAOYSA-N 299.374 2.051 10 20 CECD CC[C@H](C)N(CCO)Cc1ccc(N(C)C)cc1 267153221 NCQWUVWQZNOKRX-ZDUSSCGKSA-N 250.386 2.345 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCN1C 264591450 AVQGAWWUNSWFSW-MRXNPFEDSA-N 289.423 2.195 10 20 CECD O=S1(=O)CC[C@H](COc2ccc(N3CCCC3)cc2)C1 278668249 NWWWPQUJEPHKFT-CYBMUJFWSA-N 295.404 2.100 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@H]2c2cccnc2)c(O)c1 373666271 FVZDOBOZKTUDOW-LSDHHAIUSA-N 298.342 2.216 10 20 CECD CC[C@H](NCCS(C)(=O)=O)c1cccc(Cl)c1O 287314631 DBICOFDUCGZJCE-NSHDSACASA-N 291.800 2.131 10 20 CECD COC(=O)COc1ccc(N(C)CCCCF)cc1 285528939 GXXOAFGOAGYRBX-UHFFFAOYSA-N 269.316 2.424 10 20 CECD C[C@@H](N[C@H]1CC[C@@H](CO)C1)c1cc(F)ccc1O 296500251 PAULLJUNIYTUPK-FOGDFJRCSA-N 253.317 2.343 10 20 CECD CCC[C@@H](CNC(=O)N(C)Cc1ccccc1O)OC 297806188 YLUJPWQOAHNXLX-ZDUSSCGKSA-N 280.368 2.349 10 20 CECD COC[C@@H](O)CN[C@@H](C)c1cc(Cl)cc(C)c1O 808717012 BRDCSOWUGIKDBH-ONGXEEELSA-N 273.760 2.012 10 20 CECD Cc1nccnc1[C@@H](C)NC[C@H](N)c1ccc(N(C)C)cc1 817944171 XUUGNMMEBXEZOK-CJNGLKHVSA-N 299.422 2.202 10 20 CECD CC[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](CC)O1 817766710 OHNUEOKRXYMICV-GHMZBOCLSA-N 269.366 2.483 10 20 CECD CC(C)(C)NCCC(=O)NCc1cc(Cl)ccc1O 823986044 FBQCVBGDWRDQOM-UHFFFAOYSA-N 284.787 2.440 10 20 CECD CC(C)(C)N1C[C@H](CNCc2cc(F)ccc2O)CC1=O 827555054 MRZLZUIWZVVDRV-NSHDSACASA-N 294.370 2.268 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)cc1 834906344 DGONNEQMEPCXSS-VHDGCEQUSA-N 289.423 2.447 10 20 CECD COc1ccc(N2CCCN(Cc3cnccn3)CC2)cc1 838801539 ARDWHMYRZFAEJK-UHFFFAOYSA-N 298.390 2.198 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)C2CCC2)c1 837484583 HZOTVDPHGQDRQI-JTQLQIEISA-N 263.337 2.453 10 20 CECD Cc1cc(Br)c(O)c(CN[C@@H](C)CCN)c1 841049187 CJCZDTLUHIUZOX-VIFPVBQESA-N 287.201 2.290 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@@H](CC)CO1 846373851 FYPCBRCAESRBBO-RYUDHWBXSA-N 293.363 2.436 10 20 CECD CC[C@@H](CSc1ncc(C(=O)OC)s1)OC 841671716 ZPGPNKIOVGUVKK-ZETCQYMHSA-N 261.368 2.447 10 20 CECD CC[C@@H](NC[C@H]1CCCNC1=O)c1ccc(F)cc1O 840826132 QLSPIQXFCYHFOT-ZWNOBZJWSA-N 280.343 2.098 10 20 CECD CC(C)C(=O)NCCCNCc1ccc2c(c1)CCCO2 921934630 SVFUNASIMYBEDZ-UHFFFAOYSA-N 290.407 2.264 10 20 CECD C[C@@H](N[C@H]1CCN(C)C1)c1cc(F)cc(F)c1O 756534701 NAEKDOUHCWCKMU-SCZZXKLOSA-N 256.296 2.025 10 20 CECD COc1ccc2c(c1)CCCN2C(=O)/C=C/c1cn(C)cn1 929699606 BTOLLMAMDBSAEJ-VMPITWQZSA-N 297.358 2.421 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2C=CCC2)cc1F 852512769 PYKPHHSDVFPBDB-LBPRGKRZSA-N 277.343 2.410 10 20 CECD O=C(Cc1cncc(O)c1)NCc1cc(Cl)ccc1O 857548634 RMKJQAWZIHMSQN-UHFFFAOYSA-N 292.722 2.005 10 20 CECD CCO[C@H](C(=O)N(C)Cc1ccccc1O)C1CC1 860047994 OERDNBPJDYSVHZ-AWEZNQCLSA-N 263.337 2.166 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H]2COC[C@H]2C)c1O 932495594 DEZPXGNVJCWWKD-OQPBUACISA-N 283.755 2.373 10 20 CECD c1cc(N2CCCCC2)ccc1CN1C[C@@H]2CNC[C@H]2C1 770394825 NKMCEEORHNQQLP-IRXDYDNUSA-N 285.435 2.328 10 20 CECD Cc1ccc(C(=O)N2C[C@H](C)S[C@@H](C)C2)c(O)c1O 770498779 GCDBGUZADJSGIY-UWVGGRQHSA-N 281.377 2.372 10 20 CECD Cc1cccc(O)c1CN1CCC(O)(C(F)F)CC1 877437789 WAGWWZUVVHIPQA-UHFFFAOYSA-N 271.307 2.293 10 20 CECD C[C@@H](NC[C@@](C)(O)C1CC1)c1c(O)cccc1F 886526025 CQTOCNYYTFBADO-YMTOWFKASA-N 253.317 2.343 10 20 CECD COc1ccc(O)c(CN(C)Cc2cccc(O)n2)c1 897392053 LAGATRQDFCHDHP-UHFFFAOYSA-N 274.320 2.133 10 20 CECD COc1cc(C)cc(CNC[C@H](O)CC(C)C)c1O 894211419 PNPDEKXDPDFYLN-CYBMUJFWSA-N 267.369 2.206 10 20 CECD O=C(N[C@H](c1ccncc1)C1CC1)c1cccc(O)c1O 890907227 CNNUKYSGXCZDBI-AWEZNQCLSA-N 284.315 2.374 10 20 CECD CCC[C@@](C)(CO)NCc1ccc(N(C)C)cc1 83469686 OGODVALZINWCGI-HNNXBMFYSA-N 250.386 2.393 10 20 CECD C[C@H]1C(=O)N(C)[C@H](C)[C@H](C)N1Cc1cc(F)cc(F)c1O 895924117 ZKJXROAGRHGRMF-UTLUCORTSA-N 298.333 2.110 10 20 CECD O=S(=O)(Nc1ccc(O)cc1F)c1ccccc1 85203896 QNDJQAGJCKDYLG-UHFFFAOYSA-N 267.281 2.332 10 20 CECD C[C@H]1C[C@H](NCc2c(O)cccc2Br)CO1 706835615 CEMZIDMGYNCVSM-IUCAKERBSA-N 286.169 2.422 10 20 CECD O=S(=O)(NCc1ccccc1O)c1cc(F)cc(F)c1 751151729 VZTOKOKCAHULCN-UHFFFAOYSA-N 299.298 2.149 10 20 CECD COc1ccc(O)c(CNCC[C@@H]2CCCC[C@@H]2O)c1 897536151 IRWBEMSMYQEQEM-WFASDCNBSA-N 279.380 2.432 10 20 CECD CC(C)N(CCO)Cc1ccc(N2CCCC2)cc1 1319797947 WELHKFJKZPRUOT-UHFFFAOYSA-N 262.397 2.490 10 20 CECD O=C(NCc1cccc(O)c1O)C1(C(F)(F)F)CCC1 1350299467 AOMLXZFVKIPJMP-UHFFFAOYSA-N 289.253 2.447 10 20 CECD Cc1ncc(C(=O)NCc2ccc(N)cc2)c(C2CC2)n1 1524008680 JGXFHINMMAONMQ-UHFFFAOYSA-N 282.347 2.175 10 20 CECD CC[C@H](NCc1ccc(N(C)CC)cc1C)C(=O)O 1776721885 STKXVPBTAFAAMM-AWEZNQCLSA-N 264.369 2.404 10 20 CECD COc1ccc(N(C)CCCCC(=O)O)cc1OC 258855427 JLZFDQBIZKPZQZ-UHFFFAOYSA-N 267.325 2.395 10 20 CECD C[C@H](O)CCCN1CCOc2cc(N(C)C)ccc21 828538295 JZIOTYGEINLNLP-LBPRGKRZSA-N 264.369 2.112 10 20 CECD COc1cccc(CNCC2(CO)CCCC2)c1O 135066989 CVFNGPNIEVCGSX-UHFFFAOYSA-N 265.353 2.043 10 20 CECD c1cn(CCNCc2ccc(N3CCCC3)cc2)cn1 41119603 MMADVNHTQVLCKD-UHFFFAOYSA-N 270.380 2.273 10 20 CECD CCC(CC)N(CCOC)C(=O)Cc1ccc(N)cc1 37812366 VTCRRQLKOZINQJ-UHFFFAOYSA-N 278.396 2.475 10 20 CECD CN(Cc1cc(Br)ccc1O)C1(CN)CCC1 385161046 KBHBPWFHZLLDNG-UHFFFAOYSA-N 299.212 2.468 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2CCO)c1O 50132854 LTYRZVRHTCEYEZ-CQSZACIVSA-N 295.354 2.471 10 20 CECD CCn1cc(CNCc2ccc(N(C)C)c(F)c2)cn1 112097853 VRASQNNXYZSPCC-UHFFFAOYSA-N 276.359 2.398 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc3ccncc23)CCO1 22005044 XSDYIVHJWQYXQH-LLVKDONJSA-N 258.321 2.161 10 20 CECD C[C@@H](NCc1nnc2n1CCCC2)c1cc(F)ccc1O 183867662 UYVWTTCYQKHDOB-SNVBAGLBSA-N 290.342 2.310 10 20 CECD O=C1NCCCC[C@H]1NCc1ccc(N2CCCC2)cc1 37282700 MCWPFFGNEGAXDW-MRXNPFEDSA-N 287.407 2.045 10 20 CECD CC[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H](C)O1 181067605 YVIDJNXMBVOHNO-BVKQBWKVSA-N 291.347 2.137 10 20 CECD COc1ccc(N(C)CC(=O)c2cccn2C)c(OC)c1 131654738 HIFJUVVBFHZDEH-UHFFFAOYSA-N 288.347 2.361 10 20 CECD C[C@]1(NCc2ccc(N3CCOCC3)cc2)CCCOC1 221340784 JEKATRYEFLQCTR-KRWDZBQOSA-N 290.407 2.182 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@]1(C)C[C@H]1F 335602417 ZNJJKIYVQXKCDG-UKRRQHHQSA-N 278.327 2.226 10 20 CECD CCOc1cccc(CN2CCCC[C@@H]2C(=O)OC)c1O 93441008 SOMYQVOZLVJKLU-CYBMUJFWSA-N 293.363 2.318 10 20 CECD Oc1c(Br)cccc1CNCCn1cccn1 42539662 FKHYYZBTYJQHAU-UHFFFAOYSA-N 296.168 2.141 10 20 CECD O=[N+]([O-])c1ccc(O)c(CN[C@@H]2CCOC3(CCC3)C2)c1 268998198 YLOWYHVEPGCBMO-GFCCVEGCSA-N 292.335 2.492 10 20 CECD CN(C)c1ccc(CN2CC[C@](O)(C3CC3)C2)cc1 365853014 BUAGJUGAUALBOB-MRXNPFEDSA-N 260.381 2.099 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](C)[S@](=O)CC2)c1 277395164 GPEBYGUWFZVGNC-KZULUSFZSA-N 267.394 2.044 10 20 CECD CCCN(Cc1cc(OC)ccc1O)CC(C)(C)O 271698803 BZKZJQVXSXFWSG-UHFFFAOYSA-N 267.369 2.384 10 20 CECD CC[C@@H]1C[C@H](C(=O)NCc2ccccc2O)CCO1 272570364 RVJZUKNOLUSJSC-DGCLKSJQSA-N 263.337 2.214 10 20 CECD C[C@H](CF)NC(=O)NCc1ccc(N(C)C)c(F)c1 287261553 QDGOFTOTJUPECW-SECBINFHSA-N 271.311 2.049 10 20 CECD CCC[C@]1(CO)CCN(Cc2cc3c(cc2O)OCO3)C1 377835233 RYHFYDRRRZUHJP-INIZCTEOSA-N 293.363 2.105 10 20 CECD CCOC(=O)[C@H](F)C1CN(Cc2ccc(N(C)C)cc2)C1 294012541 UHTVHJJPVMDLTA-OAHLLOKOSA-N 294.370 2.086 10 20 CECD Cc1cnn(C)c1CN(C)c1ccc2c(c1)OCO2 290237252 GIVIZJHKIGHHRC-UHFFFAOYSA-N 259.309 2.094 10 20 CECD CCCN1C[C@@H](CNCc2cc(C)c(C)cc2O)CC1=O 817410720 GLHRNRRGUXAHRT-CQSZACIVSA-N 290.407 2.357 10 20 CECD CCOc1ccc(CN2CCC[C@@H](O)CC2)c(O)c1 816667146 DSVBQHFCFKVJDE-CYBMUJFWSA-N 265.353 2.138 10 20 CECD COC[C@@H](C)[C@H](C)C(=O)N[C@H](C)c1ccccc1O 827946880 UEVIPKOXHBPSDH-GRYCIOLGSA-N 265.353 2.488 10 20 CECD Oc1c(Cl)cccc1CN1C[C@@H]2CCNC[C@@H]2C1 904420179 FSWRJRVOZOYQPI-CMPLNLGQSA-N 266.772 2.087 10 20 CECD C/C(Cl)=C/C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 907274562 RLCNJSWHLYYFBG-RDOCRHDPSA-N 269.728 2.288 10 20 CECD CC[C@@H](NCCN1CCC(O)CC1)c1ccc(C)cc1O 834903662 KUYYWFFBYDSSNQ-MRXNPFEDSA-N 292.423 2.198 10 20 CECD CCCC1(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CC1 832266501 GRKZNTSCNHTSFK-HNNXBMFYSA-N 289.423 2.449 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCN(CC(F)F)C2)c1 841893675 HVLGJXCOMRNFQP-GFCCVEGCSA-N 270.323 2.130 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H]2CCCN[C@@H]2C1 840917428 KHGPYPULPJQCRW-DOTOQJQBSA-N 273.424 2.245 10 20 CECD Cc1cc(CN(C)[C@@H](C)CCO)ccc1N(C)C 844451600 SOZKVMTUNQFUEF-ZDUSSCGKSA-N 250.386 2.264 10 20 CECD COC1CCC(NC[C@@H](N)c2ccc(N(C)C)cc2)CC1 841044896 FSJPQVYGTAZNJJ-BDVYOWHSSA-N 291.439 2.300 10 20 CECD COc1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)o1 847695787 IDPBJAORLIJHBH-SECBINFHSA-N 291.303 2.060 10 20 CECD COC/C(C)=C\C(=O)NCCCSc1nccs1 845504284 BNBPIBSBPRYXCD-NTMALXAHSA-N 286.422 2.334 10 20 CECD CC(C)OCC(=O)NCc1cc(Cl)ccc1O 846472503 KXOUQNOYMANJLY-UHFFFAOYSA-N 257.717 2.087 10 20 CECD C[C@H](NCCCSc1nccs1)c1cnn(C)n1 925104191 WHIJQSQMVYGLPB-VIFPVBQESA-N 283.426 2.105 10 20 CECD COCCOC[C@@H](C)NCc1ccc2c(c1)CCCO2 921782077 DLSRTJRUTBVFGQ-CYBMUJFWSA-N 279.380 2.153 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCn2cccc2)c1 751060709 KQIOWEDCECLQAC-GFCCVEGCSA-N 288.347 2.470 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)c1cn(C)cn1 924861680 KZDGUBQMNZRGNY-NSHDSACASA-N 276.359 2.476 10 20 CECD CCN(C(=O)/C=C/c1cn(C)cn1)c1cccc(OC)c1 930064539 CJQZIHBHWRHVBX-CMDGGOBGSA-N 285.347 2.495 10 20 CECD COC1CC(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 860949807 DQNJLCARIHDWPL-NUYPLMSZSA-N 276.380 2.355 10 20 CECD COc1ccc(CNCc2c(C)cccc2O)c(OC)n1 877542984 UPMVSEWNXCUOLL-UHFFFAOYSA-N 288.347 2.403 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCc2c[nH]nc2C1 775712266 FYAHCDIDZZFLRB-UHFFFAOYSA-N 281.718 2.466 10 20 CECD CN(C)c1ccc(CNCc2cc3c(cn2)OCCO3)cc1 876905124 CUZDNBLGMVELFE-UHFFFAOYSA-N 299.374 2.209 10 20 CECD O=C1NC(=O)/C(=C\c2cc(F)c(F)c(F)c2)S1 874927495 IIXKWSSTCCKESQ-XVNBXDOJSA-N 259.208 2.428 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)NCc1ccc(C)cc1O 877145742 BJHYLUPLBJQXKU-NEPJUHHUSA-N 264.369 2.093 10 20 CECD OC[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 775634043 NZKFMDLVPZTAMB-SECBINFHSA-N 273.735 2.389 10 20 CECD C[C@H](N[C@@H]1CCn2ccnc2C1)c1c(O)cccc1F 886594725 SLCAIABDIFLJAZ-WDEREUQCSA-N 275.327 2.393 10 20 CECD Cc1ccc([C@@H](C)NCCOCCN(C)C)c(O)c1C 774379759 FVZSALXMDYKICP-CQSZACIVSA-N 280.412 2.238 10 20 CECD C[C@@H](NC[C@]1(O)CCSC1)c1c(O)cccc1F 886536984 ROODOAFWKJSCFT-NOZJJQNGSA-N 271.357 2.050 10 20 CECD COc1cccc(CNC(=O)c2ncc(C)cc2C)c1O 780467549 CGPFGTURXKLJCJ-UHFFFAOYSA-N 286.331 2.343 10 20 CECD CCOC(=O)[C@H](C)[C@@H](C)NCc1cc(F)cc(F)c1O 894454713 VGLZTTZSXDSPRM-RKDXNWHRSA-N 287.306 2.348 10 20 CECD COC(=O)COc1ccc(N(C)CC[C@H]2CCOC2)cc1 783668077 YLILMHSGFUZOGC-ZDUSSCGKSA-N 293.363 2.101 10 20 CECD O=C(COC(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1ccc(O)c(O)c1 782575349 QBSULIBJXHHSRN-NHCYSSNCSA-N 290.315 2.260 10 20 CECD CCOc1ccc(O)c(CN2CCN(C)C(C)(C)C2)c1 895565335 YNNSWPICDHPJSN-UHFFFAOYSA-N 278.396 2.317 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@@H](C)S1=O 894552545 UWSATXCKUVOODI-RKDXNWHRSA-N 289.347 2.012 10 20 CECD CCOc1cccc(CNC[C@@H]2CC[C@@H](C)O2)c1O 398072110 AHCCKYQYRVNMKM-YPMHNXCESA-N 265.353 2.448 10 20 CECD CN(Cc1cnn(C)c1)Cc1cc(F)cc(F)c1O 893909688 RXONZCWGMQLAMU-UHFFFAOYSA-N 267.279 2.036 10 20 CECD O=C(NCc1ccccc1O)[C@H]1Cc2ccc(F)cc21 793679995 GSRLLZPRJBVSMR-AWEZNQCLSA-N 271.291 2.487 10 20 CECD CN(C)c1ccc(CN2CC(F)(F)C[C@H]2C(=O)O)cc1 713617456 DPOYDXOFHRXACX-LBPRGKRZSA-N 284.306 2.047 10 20 CECD NC1CCN(Cc2ccc(Br)cc2O)CC1 691477771 PTHFJNIZKROOKN-UHFFFAOYSA-N 285.185 2.078 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@H]2[C@@H]2CCCO2)cc1 1337070832 XSYNJLHSMDEVSD-GJZGRUSLSA-N 289.379 2.122 10 20 CECD CC[C@H](CCNCc1cc(F)cc(F)c1O)C(=O)O 1339239207 ALRBGJBLIOSJLO-MRVPVSSYSA-N 273.279 2.261 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@@H]2[C@@H]2CCCO2)cc1 1337070831 XSYNJLHSMDEVSD-CABCVRRESA-N 289.379 2.122 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CCC(F)(F)C1 1355344228 JZZHOQPMNKEEFR-UHFFFAOYSA-N 286.307 2.095 10 20 CECD O=C(O)c1cnc(SC[C@H]2CC3(CC3)C(=O)O2)s1 1602536965 IULUBXBDIUFUPR-ZCFIWIBFSA-N 285.346 2.029 10 20 CECD C[C@@]1(C(=O)O)CC[C@H](NCc2ccc3c(c2)CCO3)C1 1776501077 YFEHQDIWOKNNCT-XJKSGUPXSA-N 275.348 2.355 10 20 CECD COc1cc(O)c(CN2CCO[C@@H](C)[C@H]2C)cc1OC 160431790 BCNOQCBPZBMSJE-MNOVXSKESA-N 281.352 2.019 10 20 CECD C[C@H](NCC(C)(C)O)c1ccc(N2CCOCC2)c(F)c1 160655180 MPUJLWDDEMGGDQ-LBPRGKRZSA-N 296.386 2.084 10 20 CECD CC[C@@H](NCC(=O)NC(C)C)c1ccc(N(C)C)cc1 160953776 YMJPHAWQFDQAFY-OAHLLOKOSA-N 277.412 2.318 10 20 CECD CCc1cccc(CN[C@@H](C)[C@H](O)C(F)(F)F)c1O 877693779 QSEQFLOBQWCHAQ-UFBFGSQYSA-N 277.286 2.356 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H]([C@H](C)N)C2)c1O 252848678 HYQBRHYMTUHHRU-VHSXEESVSA-N 284.787 2.223 10 20 CECD Cc1c(CN[C@H]2CCc3cccc(O)c32)cnn1C 296796687 LHDSVNBVDMGRAT-ZDUSSCGKSA-N 257.337 2.211 10 20 CECD CCOc1cccc(CN2CCC(CNC)CC2)c1O 63158796 QLURPTSPFSBXGE-UHFFFAOYSA-N 278.396 2.222 10 20 CECD COCC(C)(C)CNCc1ccc(OC)cc1O 311197847 GXRHDRQEJXBVHQ-UHFFFAOYSA-N 253.342 2.163 10 20 CECD CS[C@@H](C)C(=O)N1CCOc2cc(N(C)C)ccc21 173199250 HFBZHYWFCXVQEX-JTQLQIEISA-N 280.393 2.230 10 20 CECD COc1cc(N2CCOC(C)(C)C2)c([N+](=O)[O-])cc1OC 301912715 HEEHRNGXXCOJCC-UHFFFAOYSA-N 296.323 2.227 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@H]2CCOC2)cc1F 176959443 CXCFBOIAFQLLJC-LBPRGKRZSA-N 294.370 2.325 10 20 CECD CCNC(=O)[C@@H](C)NCc1cc(Cl)cc(Cl)c1O 36795147 WIBOBQZNISJXFX-SSDOTTSWSA-N 291.178 2.313 10 20 CECD OCc1cccc(NCc2cc3c(cc2O)OCO3)c1 42879951 SVYWISJWYUAORY-UHFFFAOYSA-N 273.288 2.225 10 20 CECD COC(=O)C1(CNCc2cc(Cl)cc(OC)c2O)CC1 188689138 OVKZXQMFHGFMOO-UHFFFAOYSA-N 299.754 2.097 10 20 CECD Cc1ccc(C(=O)N(C)C[C@H]2CCCC[C@H]2O)c(O)c1O 183004970 XCZYSHINIRNKFF-DGCLKSJQSA-N 293.363 2.029 10 20 CECD COC1(CNCc2cc(C)c(C)cc2O)CCOCC1 123135524 KFYUYAVMQXUSIZ-UHFFFAOYSA-N 279.380 2.294 10 20 CECD COc1cccc(CNC(=O)Nc2ccc(C)cn2)c1O 184301051 DISCSTOHLWUPAU-UHFFFAOYSA-N 287.319 2.426 10 20 CECD CN(C)c1ccc(CN2CCC[C@](C)(CO)C2)cc1F 124891165 IZMFPKIJVOZYSM-INIZCTEOSA-N 280.387 2.486 10 20 CECD Nc1ccc(CC(=O)N2C[C@H]3CC=CC[C@H]3C2)cc1 382886547 UATNAEZYVQANRF-OKILXGFUSA-N 256.349 2.236 10 20 CECD C[C@H](NC[C@@H](O)C(F)(F)F)c1cc(F)ccc1O 230659310 IOPOSMAQGAYLOE-QUBYGPBYSA-N 267.222 2.105 10 20 CECD CC[C@@H]1CC[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)O1 268131725 MLZHCGQSZPNKGC-DOMZBBRYSA-N 294.370 2.466 10 20 CECD CCc1ocnc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 274994150 ZITTUJVBAAXFAO-SECBINFHSA-N 290.319 2.009 10 20 CECD Cc1cccc(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c1O 271867448 RLWTXIMDOHMRCH-SOZUMNATSA-N 267.394 2.042 10 20 CECD COc1ccc(N(C)CCn2ccnc2C)cc1F 270865642 KVFLBDVBYQUYTC-UHFFFAOYSA-N 263.316 2.476 10 20 CECD Cc1cc(C(=O)N2CCOC[C@H]2C)c(C)n1-c1ccccn1 278472080 UCQBJUBZSKEXJQ-CYBMUJFWSA-N 299.374 2.350 10 20 CECD CN(C)c1ccc(CN(Cc2cnnn2C)C2CC2)cc1 271028943 BKPNJBFNJYKUSV-UHFFFAOYSA-N 285.395 2.046 10 20 CECD C[C@H]1CN(Cc2cc(F)ccc2O)C[C@]2(CCCOC2)O1 373634444 FAWQULBBIYKYFV-LRDDRELGSA-N 295.354 2.301 10 20 CECD C[C@@H]1CN(Cc2ccccc2O)C[C@@]2(CCO[C@@H]2C)O1 280570365 VSUIHONQSOKDCM-XJKCOSOUSA-N 277.364 2.161 10 20 CECD CC[C@H](N[C@@H](CO)CCOC)c1cccc(Cl)c1O 287055936 NENGKEULSVCQFM-MFKMUULPSA-N 287.787 2.484 10 20 CECD CC[C@H](N[C@H]1COC[C@@H]1OC)c1ccc(N(C)C)cc1 290189057 ODQMTVHIFBGAKE-JYJNAYRXSA-N 278.396 2.207 10 20 CECD COc1cc(O)c(CN[C@H]2CSC[C@H]2C)cc1OC 809702968 KUKPTVQOXKQUQH-KOLCDFICSA-N 283.393 2.251 10 20 CECD COc1cncc(COC(=O)c2cc(O)cs2)c1 808517056 WJTDXUHQMFRIEE-UHFFFAOYSA-N 265.290 2.214 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C1)OCO2 295117647 MPHLKNKWQSVMFX-AUZPSNTRSA-N 285.343 2.375 10 20 CECD COc1cc(O)c(CNC[C@]2(O)CCC[C@H]2C)cc1OC 293828737 AMQGYGXFXQGBIQ-BDJLRTHQSA-N 295.379 2.050 10 20 CECD CC(C)=CCCNC(=O)c1c(F)ccc(O)c1O 295558531 XSZDYXUXKOFWIF-UHFFFAOYSA-N 253.273 2.323 10 20 CECD COC[C@@H](C)[C@H](C)C(=O)NCc1ccc(N(C)C)cc1 812448908 FVMFTIXSJVISBS-OLZOCXBDSA-N 278.396 2.287 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(C)CCNCC2)c1 817964787 IOWPVLHGTBVKTE-LBPRGKRZSA-N 278.396 2.441 10 20 CECD C[C@H]1C[C@H](CO)CN(Cc2cccc(Cl)c2O)C1 817412438 LIMMRGKHNSLBEV-QWRGUYRKSA-N 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10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCn3ccnc3C2)c1 779064238 HPJYTHKFDUHKRK-NWDGAFQWSA-N 287.363 2.263 10 20 CECD CC[C@@H](CNCc1ccc(N2CCC(O)CC2)cc1)OC 877542102 VKOUILOEVSEJSC-KRWDZBQOSA-N 292.423 2.162 10 20 CECD COc1cccc(CNC(=O)NCc2ccc(C)o2)c1O 876048163 HGAZCASKHCBFQV-UHFFFAOYSA-N 290.319 2.302 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)Cc2ccco2)c(O)c1O 780880717 CUSMIAXOWIHRDC-JTQLQIEISA-N 275.304 2.360 10 20 CECD CN[C@@H](CC(C)C)C(=O)NCc1ccc(N(C)C)cc1 884180390 XFRDQLNBIINVTB-HNNXBMFYSA-N 277.412 2.003 10 20 CECD CCCCOCCNCc1ccc(OC)c(OC)c1O 892733807 SPUAPOUPMGZDFB-UHFFFAOYSA-N 283.368 2.316 10 20 CECD COc1ccc(O)c(CN2CC(C)(C)CC[C@@H]2CO)c1 895924252 UJPYCIBRNPGHRT-CYBMUJFWSA-N 279.380 2.384 10 20 CECD C[C@H]1C(=O)CC[C@H]1CC(=O)NCc1ccc(N(C)C)cc1 792846857 CBXGPIKMEZRCHX-OCCSQVGLSA-N 288.391 2.374 10 20 CECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)c1cccc(O)c1O 790729293 KIKYJSCYJJPCSC-CYBMUJFWSA-N 299.330 2.004 10 20 CECD COCCNCc1cc(Br)cc(F)c1O 715711581 GITGANZKRUAUPH-UHFFFAOYSA-N 278.121 2.030 10 20 CECD COc1cc(C)cc(CN2CCOC[C@H]2C2CC2)c1O 1331988704 DZRXICBLQRCXQO-AWEZNQCLSA-N 277.364 2.320 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2C[C@H]2C(F)(F)F)cc1 1337019779 UTTZAJYKGQWXAN-NXEZZACHSA-N 273.258 2.019 10 20 CECD CC[C@H](F)C(=O)NCc1ccc(N(C)C)c(F)c1 1335760137 WIIGTDIZNYHXRN-JTQLQIEISA-N 256.296 2.256 10 20 CECD C[C@@H]1O[C@H](C)[C@H](C(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 1334909499 UISAHHWIORBBTO-OQMKEHIESA-N 290.407 2.428 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc([N+](=O)[O-])o1 120276469 CFFYZYDVLSHMPU-UHFFFAOYSA-N 276.248 2.166 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCc1ncn(C)n1 230670199 CVSWZZNBSTYRSF-WDEREUQCSA-N 272.352 2.167 10 20 CECD COc1ccc(O)c([C@H](C)NCC[C@@H]2CCOC2)c1 230672494 AWKNSDHXVJRQOJ-NWDGAFQWSA-N 265.353 2.478 10 20 CECD c1csc(SCc2ccc(-c3nn[nH]n3)o2)n1 1582820638 SZXATQDXJSHNPO-UHFFFAOYSA-N 265.323 2.209 10 20 CECD C[C@H](N[C@H]1CCN(C)[C@@H](C)C1)c1cc(C(=O)O)ccc1O 1593220068 QCFZBWAAXZRYIU-GVXVVHGQSA-N 292.379 2.224 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](C(=O)O)C(C)C)c1O 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10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@@]2(CCOC2)O1 280363186 UOMJYSWZOWSSSE-XHDPSFHLSA-N 297.782 2.425 10 20 CECD COC(=O)C(C)(C)CCNCc1ccc(N(C)C)cc1 280019358 TWHAMAWTEITEPW-UHFFFAOYSA-N 278.396 2.432 10 20 CECD c1ncn(CCCNCc2ccc(N3CCCCC3)cc2)n1 394344906 JFVRBHCVVWIVGL-UHFFFAOYSA-N 299.422 2.448 10 20 CECD O=C(NCc1ccccc1O)[C@@H](O)c1ccc(Cl)cc1 813489354 WTLMAOIHAXRUSL-AWEZNQCLSA-N 291.734 2.395 10 20 CECD C[C@@H]1C[C@H](NC[C@@H]2C[C@H](F)CN2)c2c(O)ccc(F)c21 817977068 ZXVCZBRIISPTSD-WDCWCFNPSA-N 282.334 2.369 10 20 CECD C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C(F)(F)F 819624734 HJTHSCLOFYWCTC-GLCRXLCDSA-N 275.226 2.178 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@](C)(O)C2CCC2)c1 813489360 WWBVOKFCBCFMQX-QLJPJBMISA-N 293.363 2.129 10 20 CECD CCc1cccc(N(C)C(=O)c2c(C)c[nH]c2CC(N)=O)c1 909571502 HUOGCYCIRWOIKL-UHFFFAOYSA-N 299.374 2.190 10 20 CECD C[C@@]1(NC(=O)c2cc(O)cs2)CCO[C@H]1C1CC1 832127749 ZHOAXOWUUXNCDY-WCQYABFASA-N 267.350 2.141 10 20 CECD 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CN(C)c1ccc(CNC(=O)Cc2ccccc2CO)cc1 779582897 DWRBWPHEXHCANG-UHFFFAOYSA-N 298.386 2.104 10 20 CECD CCOCCN(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 776247913 XIDBSENQJVBEHH-CYBMUJFWSA-N 293.411 2.492 10 20 CECD Cc1cnccc1CCNC(=O)/C=C/c1ccc(O)c(O)c1 779542380 OTQQIZWYLBPKFK-HWKANZROSA-N 298.342 2.173 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@H]2C=CCC2)c1 883784316 QWBXRKBQBKUQOC-LBPRGKRZSA-N 260.337 2.466 10 20 CECD COc1cc(C)cc(CNCc2nnc(C)s2)c1O 894432026 UBOBSETYZYIQCB-UHFFFAOYSA-N 279.365 2.159 10 20 CECD Cc1nc([C@@H]2CCN(Cc3c(C)cccc3O)C2)n[nH]1 895011325 DDXIYRWJDVRGCQ-GFCCVEGCSA-N 272.352 2.117 10 20 CECD Cc1cc(Br)cc([C@H](C)NC[C@H](C)O)c1O 186902197 BNXUBZPGRKLIAA-IUCAKERBSA-N 288.185 2.495 10 20 CECD OCC1CCN(Cc2ccc(N3CCCC3)cc2)CC1 1204327810 JAWXWMVHJSAOFZ-UHFFFAOYSA-N 274.408 2.491 10 20 CECD CCO[C@H](CC(=O)NCc1ccc(OC)cc1O)C(C)C 794391199 UZOKLXHOCXAKPQ-OAHLLOKOSA-N 295.379 2.468 10 20 CECD COc1ccc(CNC(=O)Nc2nc(C)c(C)o2)c(O)c1 794760576 STZHQSRQGOKBLV-UHFFFAOYSA-N 291.307 2.327 10 20 CECD CCc1cccc(CN(CCOC)CCOC)c1O 692084036 CABGERVIZXNCDP-UHFFFAOYSA-N 267.369 2.049 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@H](C)S1=O 792192006 IMXWYFSHDGEFBJ-NXEZZACHSA-N 287.812 2.387 10 20 CECD O=C(NCC12CCC(CC1)C2)c1cccc(O)c1O 790906155 UCPFDZKDEWYCBC-UHFFFAOYSA-N 261.321 2.408 10 20 CECD COc1cc(C)cc(CN[C@@H](C)c2noc(C)n2)c1O 1350319013 AYWVQHWYSYHUEJ-VIFPVBQESA-N 277.324 2.251 10 20 CECD COCCOCCCCNCc1cc(C)ccc1O 113331784 NJISKSVHYMEQPA-UHFFFAOYSA-N 267.369 2.233 10 20 CECD COc1cc(Cl)cc(CNCc2cc[nH]n2)c1O 228670399 KMSCQPXXNNUJQO-UHFFFAOYSA-N 267.716 2.067 10 20 CECD Cc1nc(CN[C@H](C)c2ccc(N(C)C)cc2)no1 229595943 NFABVVGZWAVFOQ-SNVBAGLBSA-N 260.341 2.295 10 20 CECD Nc1ccc(CNCc2cn3ccnc3s2)cc1 1580446761 GIOZWAASIWUUNR-UHFFFAOYSA-N 258.350 2.268 10 20 CECD C[C@H](CNCc1c(O)ccc(Cl)c1F)[C@@H](F)C(=O)O 1776423154 BAWNAMWNZYSLBO-LHLIQPBNSA-N 293.697 2.333 10 20 CECD CCN1CCc2cc(CN[C@@H]3C=C[C@@H](C(=O)O)C3)ccc21 1776877507 OZYXJAYEODGHOI-HUUCEWRRSA-N 286.375 2.188 10 20 CECD CCOc1ccc(N(C)CC(=O)NCC2CCC2)cc1 150732556 ANLCQLBNVLLJEF-UHFFFAOYSA-N 276.380 2.438 10 20 CECD CC(C)CCn1cc(COc2ccc(N)cc2)nn1 864625883 ZNQWQSLUZHIZNZ-UHFFFAOYSA-N 260.341 2.485 10 20 CECD c1cc2c(cc1CN[C@@H]1CCN3CCCC[C@H]13)CCO2 37363291 WRNHFEGCICMEFG-HZPDHXFCSA-N 272.392 2.338 10 20 CECD COC(=O)C(C)(C)NCc1ccc(N2CCCC2)cc1 37304412 BAFBEQPXIJOCFP-UHFFFAOYSA-N 276.380 2.328 10 20 CECD COc1ccc(O)c([C@H](C)NCC2=CCN(C)CC2)c1 273472224 JZGBHMLBYYKNSL-LBPRGKRZSA-N 276.380 2.313 10 20 CECD C[C@H](NCCc1cnccn1)c1cc(F)ccc1O 390038511 IVCXKABDVIGBIM-JTQLQIEISA-N 261.300 2.215 10 20 CECD Cc1ccnc(NC(=O)c2ccc(C)c(O)c2O)c1 177661918 UGHPOQXRUMNNGB-UHFFFAOYSA-N 258.277 2.362 10 20 CECD CN(CC(=O)N(C)Cc1ccccc1)Cc1ccccc1O 109770821 XDPLWIMGYFYBRA-UHFFFAOYSA-N 298.386 2.483 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)Cn1cnnc1 118979435 ISOJITYAYZJNDX-UHFFFAOYSA-N 285.395 2.358 10 20 CECD CC(=O)[C@H](C)SCC(=O)NCc1ccc(N(C)C)cc1 175179666 QALQHKDFCOALMM-LBPRGKRZSA-N 294.420 2.080 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)NC1CC1 172592330 HLHHZXWOGCVXDE-UHFFFAOYSA-N 257.337 2.024 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2ccccc2O)C1 183565307 NAKMHBUUNRDXIB-NEPJUHHUSA-N 262.353 2.054 10 20 CECD CCC[C@](C)(NCc1cc(F)ccc1O)C(=O)OC 184046771 QHMDQSWYDRBDFY-AWEZNQCLSA-N 269.316 2.353 10 20 CECD COc1ccc(O)c(CN2C[C@@H](C)OC[C@@H]2C)c1 217779216 FASLEKXTSXJBQP-WDEREUQCSA-N 251.326 2.010 10 20 CECD CSCCCNC(=O)NCc1ccc(N(C)C)c(F)c1 77668172 MXTDGCHDVKGPOG-UHFFFAOYSA-N 299.415 2.444 10 20 CECD CC[C@@H](CCO)NCc1cccc(Br)c1O 125787789 HWHYDJBYUKTVKO-JTQLQIEISA-N 288.185 2.405 10 20 CECD CC(=O)N1CCN(Cc2ccc(N(C)C)cc2)C(C)(C)C1 182083499 BXONMVWQGJSMFB-UHFFFAOYSA-N 289.423 2.195 10 20 CECD Cc1cc(NC(=O)Cc2ccc(N)cc2)ccc1C(=O)O 44750456 JLRVFIYOKMURKN-UHFFFAOYSA-N 284.315 2.457 10 20 CECD COC[C@@H](NC(=O)Nc1ccc(N)cc1)C(C)C 86703449 QDLSNAPFMVRNLO-GFCCVEGCSA-N 251.330 2.061 10 20 CECD COCC[C@H]1COCCN1Cc1cc(Cl)ccc1O 368265180 IHJYIDALGMFVMA-ZDUSSCGKSA-N 285.771 2.283 10 20 CECD COC[C@H](O)CCN[C@H](C)c1ccc(C)c(C)c1O 273347915 BBHLHQWMNUBPDS-CHWSQXEVSA-N 267.369 2.057 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@]3(CCCOC3)C2)c1 366449957 FZAVJLWYZCDTCS-WMLDXEAASA-N 291.391 2.471 10 20 CECD COc1ccc(O)c(CN(C)CC2(O)CCCC2)c1 271901317 ZHEYVVKNEHYZPG-UHFFFAOYSA-N 265.353 2.138 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)CC[S@@]1=O 277647683 OBSLSVISSMSDIC-YUNKPMOVSA-N 298.427 2.235 10 20 CECD CCOC1CC(O)(CN[C@@H](C)c2cc(F)ccc2O)C1 278504522 QVIAWUILARNEKL-VLRKGOCCSA-N 283.343 2.112 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)C(C)(C)n1cncn1 284125140 NWZSPTIXQIALOL-CYBMUJFWSA-N 287.411 2.258 10 20 CECD COc1ccc(N2CCN(CCC3(O)CCC3)CC2)cc1 396781897 JNFRAWQBAAFPOB-UHFFFAOYSA-N 290.407 2.122 10 20 CECD CNC(=O)[C@H](C)N[C@H](C)c1cc(Cl)c(Cl)cc1O 291918247 NORXWZQJLXMOPJ-RQJHMYQMSA-N 291.178 2.484 10 20 CECD CC(=O)c1cc(F)cc(CN(C(C)C)C2COC2)c1O 295449325 PIWLCUYWDJMTJD-UHFFFAOYSA-N 281.327 2.343 10 20 CECD Cc1cc(CN(C)C[C@H](O)C(F)(F)F)ccc1N(C)C 815080004 DESSQJDZUOLJGR-ZDUSSCGKSA-N 290.329 2.416 10 20 CECD CC(=O)C1(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 816180549 SLNLEOLDSCEWAR-NSHDSACASA-N 274.364 2.299 10 20 CECD C[C@@H](NC[C@H]1CCCNC1)c1ccc(N(C)C)cc1 817946161 SRKYJKAKMOZYEQ-KGLIPLIRSA-N 261.413 2.403 10 20 CECD CN(Cc1ccccc1O)Cc1nc(C2CC2)nn1C 828062845 SWOJKTXXLXMITR-UHFFFAOYSA-N 272.352 2.030 10 20 CECD CN(C)c1ccc(CNC[C@H](O)C2CCC2)cc1F 825241216 XNCTVGRTCXIBJO-HNNXBMFYSA-N 266.360 2.142 10 20 CECD CC[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H](C)O 824921541 MWDYVWIDAYRIJF-MFKMUULPSA-N 254.349 2.141 10 20 CECD CCCCN(O)C(=O)NCc1ccc(N(C)C)cc1 904161278 ZXJQGYPGYURJGG-UHFFFAOYSA-N 265.357 2.454 10 20 CECD CN(CC(=O)NCc1ccccc1O)c1ccccc1 748345881 FTOSLLCCZCHPJY-UHFFFAOYSA-N 270.332 2.145 10 20 CECD C[C@H]1CC[C@H](CN(C)c2ccc(OCC(=O)O)cc2)O1 846280190 UNSLJZPOIPCHSX-SMDDNHRTSA-N 279.336 2.154 10 20 CECD CCOCc1cc(CNC2CCNCC2)ccc1OC 841027167 YIFNNRRHDKTJBG-UHFFFAOYSA-N 278.396 2.073 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](N)[C@H](C)C1 843052486 UPLZZGXAVSBEBT-CZUORRHYSA-N 261.413 2.230 10 20 CECD CNC[C@@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 843054987 BRHFXBAGRAECCE-ZDUSSCGKSA-N 265.376 2.076 10 20 CECD CCOC1CC(CN(C)c2ccc(OCC(=O)O)cc2)C1 846279575 GQGWBZWCMNOERK-UHFFFAOYSA-N 293.363 2.401 10 20 CECD Nc1ccc(NC(=O)NCC2(CCO)CCCC2)cc1 841299824 KKTREBJTWVCCGS-UHFFFAOYSA-N 277.368 2.333 10 20 CECD C[C@@H]1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)CCO1 845086046 FCBKLVOEACOHDU-BXKDBHETSA-N 298.770 2.412 10 20 CECD COC1(C)CCN(C(=O)NCCc2ccc(N)cc2)CC1 841957105 OBDRYSGUZGJJHG-UHFFFAOYSA-N 291.395 2.022 10 20 CECD C[C@@]1(CNCc2ccc3c(c2)CCO3)CCCNC1 841057958 UCPMTYXFDDQOLR-MRXNPFEDSA-N 260.381 2.101 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccc(CO)c2)cc1 745485442 NNYLXJVDGAPJAB-UHFFFAOYSA-N 284.359 2.175 10 20 CECD CC(C)C[C@@H](CCO)CNC(=O)c1cc(O)cs1 748398650 PABWVIHARIVCGT-SNVBAGLBSA-N 271.382 2.228 10 20 CECD COc1cccc(CN[C@H](C)COCC2CC2)c1O 846073878 SHRNGXRZWHYVOU-LLVKDONJSA-N 265.353 2.306 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C(N)=O)c1ccccc1 840928751 IIJTYABIFAKJHD-QGZVFWFLSA-N 297.402 2.377 10 20 CECD O=C(/C=C/[C@@H]1CCOC1)NCc1cc(Cl)ccc1O 846476173 JTMQMCHOCOHCHO-YEQXMLPJSA-N 281.739 2.255 10 20 CECD CCn1cnnc1CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756418352 APNIOPMGFAPUGY-MWLCHTKSSA-N 290.342 2.481 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@@H](C)c1cc(F)ccc1O 756776132 WPRGWVYLXLGWBX-UFGOTCBOSA-N 280.343 2.097 10 20 CECD CCC1(C(=O)NCCCSc2nccs2)COC1 755370590 SQPJUVVUWDXLLT-UHFFFAOYSA-N 286.422 2.168 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CCN(C3CC3)C2)cc1F 858128030 YOZUATWSLNFPJS-LBPRGKRZSA-N 295.377 2.357 10 20 CECD CCO[C@H](C(=O)N[C@@H](C)c1cc(OC)ccc1O)C1CC1 860241564 KTMIPWBWUVXIER-BONVTDFDSA-N 293.363 2.393 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2C2OCCO2)cc1 933898907 ITGXKXRDYRISHI-HNNXBMFYSA-N 276.380 2.090 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C)[C@@H]1C 764607007 CQGVNVXPYXOIDD-UKRRQHHQSA-N 290.407 2.471 10 20 CECD CC[C@H]1C(=O)N(CC)CCN1Cc1cccc(C)c1O 779217039 NUZNJLGZITVVQH-AWEZNQCLSA-N 276.380 2.143 10 20 CECD Cn1ncc2c1CN(Cc1cc(Cl)ccc1O)C2 877632783 NFOOFKCWJMEQAP-UHFFFAOYSA-N 263.728 2.295 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1[C@H]1CC12CCC2 871914153 KNBKYKUFWAXCLM-ZDUSSCGKSA-N 286.331 2.099 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCC(=O)c2cccn21 789982113 IGALAKHBNVXOIX-CQSZACIVSA-N 298.342 2.370 10 20 CECD CC[C@]1(C)COCCN1Cc1cc(OC)ccc1O 708281833 MOAAUQVSCBJQLL-OAHLLOKOSA-N 265.353 2.402 10 20 CECD CCOc1ccc(N2CCN(C[C@@H]3CCOC3)CC2)cc1 1202528400 CYYFAVLNBPUOBK-HNNXBMFYSA-N 290.407 2.244 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H]3CN(C)C[C@@H]3C2)c1O 194537368 YYPLHXWWUWJWQE-TXEJJXNPSA-N 296.798 2.048 10 20 CECD CN(Cc1ccccc1O)C(=O)c1nnc2ccccc2n1 798162569 XDOBLRFUWOCDCZ-UHFFFAOYSA-N 294.314 2.003 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCCC[C@H]2N(C)C)c(O)c1O 1323605726 PMCQOKNPSRDJAJ-CHWSQXEVSA-N 292.379 2.009 10 20 CECD CO[C@@H]1CCN(C(=O)c2cc(O)cs2)CC1(C)C 1328310773 ZGTGXIZRUTXDLV-LLVKDONJSA-N 269.366 2.341 10 20 CECD Nc1ccc(CN2CCC(c3ccncn3)CC2)cc1 1337837604 CWYRDJJOMBSKMV-UHFFFAOYSA-N 268.364 2.438 10 20 CECD Nc1ccc(CN[C@]2(CO)CCc3ccccc32)cc1 1334754251 NBHKIFWFBSJYQO-KRWDZBQOSA-N 268.360 2.192 10 20 CECD COC(=O)N1CC(N[C@H]2C[C@@H](C)c3c(C)ccc(O)c32)C1 1343304512 CRIQHYYJBQMIGM-PWSUYJOCSA-N 290.363 2.289 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1[C@H]2CCCO[C@H]21 1349605218 IFRUVJBUCGMENH-AKGNYGMASA-N 293.710 2.240 10 20 CECD CCOC(=O)c1cnc(SC[C@@H](C)C(=O)OC)s1 853342276 BRTSXFSFZKTLQL-SSDOTTSWSA-N 289.378 2.221 10 20 CECD Cc1cccc([C@H](NC(=O)c2cc(O)cs2)C(=O)O)c1 1574390811 FGNPQCOFHXUMHV-LBPRGKRZSA-N 291.328 2.318 10 20 CECD Cc1ccc(CN2CC[C@@]3(CCCCN3)C2)c(O)c1 1579691682 GWLKVAACWBARPE-INIZCTEOSA-N 260.381 2.419 10 20 CECD CCCN(Cc1cc(C(=O)O)no1)Cc1ccccc1O 1595885985 QZPOTYSOLVWVKR-UHFFFAOYSA-N 290.319 2.491 10 20 CECD Cc1cccc(CNc2ccc(-n3cnnn3)cc2)c1O 158015114 VCGSFXGNQXRMBM-UHFFFAOYSA-N 281.319 2.288 10 20 CECD CN(C)c1ccc(CNC2[C@H]3CC[C@H]2CC(N)C3)cc1 841074335 NXLJMDFCKXZXIP-JPQBHMHHSA-N 273.424 2.358 10 20 CECD C[C@@H](NC(=O)CC[C@@H]1CCCN1)c1ccccc1O 870988395 ONXYDYVKNRWPHI-NEPJUHHUSA-N 262.353 2.102 10 20 CECD Cc1cccc(O)c1CNCCC(=O)N1CCCCC1 876942813 GEZABTSKEHGBOO-UHFFFAOYSA-N 276.380 2.193 10 20 CECD CCC(CC)(CNC(=O)c1cccc(O)c1O)OC 294659658 NWLYRCYXXKSISM-UHFFFAOYSA-N 267.325 2.033 10 20 CECD CC[C@H](N[C@H]1CCN(C(C)C)C1=O)c1ccccc1O 183338869 IXMMHCNEGPJQQW-KBPBESRZSA-N 276.380 2.442 10 20 CECD CCCN1CC[C@H](N[C@H]2CCc3cccc(O)c32)C1 389205085 ATUONIACFVAWCX-KBPBESRZSA-N 260.381 2.453 10 20 CECD COc1cccc(CN2CCOCC2(C)C)c1O 133548392 IANDZCHGGNUSES-UHFFFAOYSA-N 251.326 2.012 10 20 CECD CSC1(CNC(=O)c2ccc(C)c(O)c2O)CC1 194664693 VXNUQMSVWPKAIR-UHFFFAOYSA-N 267.350 2.032 10 20 CECD CC(C)CC(=O)N[C@H](C(=O)Nc1ccc(N)cc1)C(C)C 236615217 JHXBAFYXASONIB-HNNXBMFYSA-N 291.395 2.394 10 20 CECD CCN(CC)c1ccc(CNC(=O)C(C)(C)CN)cc1F 236905925 QFTYPKAPPWDXCN-UHFFFAOYSA-N 295.402 2.273 10 20 CECD CC[C@@H](N[C@@H]1CCCCNC1=O)c1ccc(C)cc1O 279990259 FGUZHFRIMZETNF-ZIAGYGMSSA-N 276.380 2.410 10 20 CECD COC[C@@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCO1 278757338 WZOCXDAUIKYBJL-CVEARBPZSA-N 278.396 2.036 10 20 CECD COC[C@@H](CCO)N[C@@H](C)c1cc(Cl)ccc1O 273561420 IHHXLFPNGYJTGG-GXSJLCMTSA-N 273.760 2.094 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCO[C@]3(CCOC3)C2)cc1 374271980 PPICKJXBDVJUQQ-NVXWUHKLSA-N 290.407 2.180 10 20 CECD CC[C@@H](NCCC(=O)NC(C)C)c1ccc(F)cc1O 285518817 DUJOYXKILDEWQX-CYBMUJFWSA-N 282.359 2.487 10 20 CECD C[C@H](NCCC1(O)CCOCC1)c1ccc(F)cc1O 287405532 JIAZIBJCMSFFLN-NSHDSACASA-N 283.343 2.114 10 20 CECD CCN(C[C@@H](C)OC)C(=O)NCc1ccc(N(C)C)cc1 291973749 SLKARAMHDTVRRN-CYBMUJFWSA-N 293.411 2.319 10 20 CECD CCC[C@@H](OC(=O)c1cc(O)cs1)C(=O)OCC 801837529 GKYZWYAFQZVSAB-SECBINFHSA-N 272.322 2.342 10 20 CECD COc1ccc(N(C)C[C@@H](O)c2cccnc2)cc1F 296810580 QCJSIANZYIMQRP-CQSZACIVSA-N 276.311 2.399 10 20 CECD C[C@H](N[C@@H]1CCN[C@H](C)C1)c1ccc(F)cc1O 817971901 QZHGFDAELJUULV-JFGNBEQYSA-N 252.333 2.322 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)C(C)(F)F)C2)cc1 818090809 IXGOWMFVZTVYCV-NSHDSACASA-N 298.333 2.293 10 20 CECD CNCCCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 817939658 HTAMBKMENKUJCX-ONGXEEELSA-N 252.333 2.279 10 20 CECD C[C@H](NC(=O)c1cc(C=O)c[nH]1)c1ccc(N(C)C)cc1 816180137 GKDHRTABDVOHGW-NSHDSACASA-N 285.347 2.384 10 20 CECD C[C@H](N[C@@H]1CCCC[C@@H]1CN)c1cc([N+](=O)[O-])ccc1O 817959846 JREXJMCJCDWLFS-MISXGVKJSA-N 293.367 2.469 10 20 CECD CC[C@H](NC[C@H]1CCOC[C@H]1OC)c1ccccc1O 824710227 VZSZYXYHEUFOTF-IVMMDQJWSA-N 279.380 2.484 10 20 CECD CCc1cccc(CN(C)Cc2noc(C)n2)c1O 827898269 JASANXUIAXXLQN-UHFFFAOYSA-N 261.325 2.278 10 20 CECD COc1cccc(CNC(=O)[C@H](C)OCC(C)C)c1O 729859679 VRFNHAOHUKSDGB-NSHDSACASA-N 281.352 2.078 10 20 CECD CC[C@](C)(O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 822834516 XXZYXRGBMDOPER-GUYCJALGSA-N 292.423 2.269 10 20 CECD Cc1noc(C)c1[C@H](C)NC(=O)c1c(F)ccc(O)c1O 825830310 JKRAKFBVEBRJTM-LURJTMIESA-N 294.282 2.333 10 20 CECD CCn1cnc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1 832430472 FBRKLEHPLJCPGN-LBPRGKRZSA-N 286.379 2.460 10 20 CECD CC[C@H](N[C@@H]1CC(=O)N(CC)C1)c1ccc(C)cc1O 834892551 WAILKCSOHDAEPZ-OCCSQVGLSA-N 276.380 2.362 10 20 CECD CN(C)c1ccc([C@H](CNC(=O)OCCF)N(C)C)cc1 908460697 XVFMZXBNIFPHAQ-AWEZNQCLSA-N 297.374 2.051 10 20 CECD COc1ccc2ccc(O)c(CN3CC[C@@H]3CO)c2c1 902631467 WZJFNZLFUCPHDF-GFCCVEGCSA-N 273.332 2.121 10 20 CECD CCc1nc(C)c(CNC(=O)c2cc(O)cs2)o1 832819820 VLARSTCMNSGKFJ-UHFFFAOYSA-N 266.322 2.243 10 20 CECD CN(C)Cc1cccc(C(=O)NCc2ccccc2O)c1 741277609 IDKGCEQLGNUAAK-UHFFFAOYSA-N 284.359 2.384 10 20 CECD C[C@H](NC[C@]1(C)CCC(=O)N1)c1ccc(Cl)cc1O 841755578 JIVVNNRNHFUSLF-XPTSAGLGSA-N 282.771 2.365 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCN[C@H](C)C1 841062533 MQVXTKATEMGYLI-UKRRQHHQSA-N 261.413 2.291 10 20 CECD CO[C@H](CC(C)C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 841418461 TVVJFWJZPDSXFZ-XHDPSFHLSA-N 295.379 2.206 10 20 CECD CC[C@H](N)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 843486035 OZORYBCGPACTDT-HNNXBMFYSA-N 277.412 2.227 10 20 CECD C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)CS1 840415837 IPWFSNJIPSAACB-ZYHUDNBSSA-N 280.393 2.428 10 20 CECD C[C@H]1C[C@H](NCc2cccc(Cl)c2O)CCN1 841061176 FWGQDNUZVGBHAB-GXSJLCMTSA-N 254.761 2.276 10 20 CECD C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)CCN1C 745855150 RYUCAHZLEAAWJD-TZMCWYRMSA-N 291.395 2.016 10 20 CECD CC[C@@H](CN1CCOCC1)NCc1cc(C)c(C)cc1O 922590370 ROUGJXOFGLNDSD-INIZCTEOSA-N 292.423 2.209 10 20 CECD CCC(F)(F)C(=O)N1CCN(c2ccc(OC)cc2)CC1 854198476 KIDSMQKRZSRDQU-UHFFFAOYSA-N 298.333 2.389 10 20 CECD CC[C@@H](C)CONC(=O)NCc1cc(C)ccc1O 858480962 GIHAJWMLXNPERM-SNVBAGLBSA-N 266.341 2.478 10 20 CECD CC[C@@H](NCCN(C)OC)c1ccc(C)cc1O 850478285 RHRNXTUMMKVOMW-CYBMUJFWSA-N 252.358 2.235 10 20 CECD Cc1ccc(O)c([C@H](C)Nc2cnn(CCO)c2)c1 756855822 NNZOJLOYLRARPU-NSHDSACASA-N 261.325 2.063 10 20 CECD CC(C)CC(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 759597336 RCJPSAZKCMNQJW-GQCTYLIASA-N 278.304 2.269 10 20 CECD COc1cccc(O)c1CN1CCN(C2CCCC2)CC1 768241523 RGJUXAHMCDVKRX-UHFFFAOYSA-N 290.407 2.461 10 20 CECD COCCCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773017301 SXDQGVJARPHEEF-LBPRGKRZSA-N 264.369 2.356 10 20 CECD Cc1ccc(CN2CC[S@](=O)[C@H](C)[C@H]2C)c(O)c1 876755291 JECUGWJJHBRUOC-FMTVUPSXSA-N 267.394 2.042 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)C[C@H]2CCCC(=O)N2)c1 877652492 INBRISMUZNGBOH-GXTWGEPZSA-N 276.380 2.238 10 20 CECD C[C@@H](NCCNc1cnccn1)c1c(O)cccc1F 886541588 YEOVTIRROBSPBP-SNVBAGLBSA-N 276.315 2.084 10 20 CECD Nc1ccc(CCNC(=O)c2c[nH]cc2C2CC2)cc1 884028694 OKZYJVCTUYOMRI-UHFFFAOYSA-N 269.348 2.447 10 20 CECD CCCN(Cc1ccccc1O)[C@H](C)C(=O)NC1CC1 76074216 PCMMKBMVVWRZFB-GFCCVEGCSA-N 276.380 2.271 10 20 CECD CC[C@]1(O)CCCN(Cc2cc(F)cc(F)c2O)C1 895442948 HTKNTELJRWQXJH-AWEZNQCLSA-N 271.307 2.407 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCn3ccnc3C2)cc1 778189106 NEASZYWTJNFZFM-CQSZACIVSA-N 270.380 2.054 10 20 CECD C[C@H](NC(=O)C[C@@H](C)CC(=O)O)c1ccccc1O 1604105676 AZOWWISAWYMTBW-ZJUUUORDSA-N 265.309 2.070 10 20 CECD COc1cc(C)cc(CN[C@H]2CCC[C@@H]2CCO)c1O 1332004593 LYUBEQRRIXBRIG-OCCSQVGLSA-N 279.380 2.350 10 20 CECD COc1ccc(CN2CC[C@H](CF)C2)c(O)c1OC 1335551975 ODRDNGDIOFBCMA-SNVBAGLBSA-N 269.316 2.201 10 20 CECD COCCn1cc(CN[C@@H](C)c2c(O)cccc2F)cn1 1350086712 UXNODAOAZLWSQP-NSHDSACASA-N 293.342 2.225 10 20 CECD CC[C@H](C)N(C)CCNC(=O)Nc1ccc(N)cc1 220267575 LNZNGHNCASAOBF-NSHDSACASA-N 264.373 2.121 10 20 CECD CCc1cccc(CN2CC[C@](C)(C(=O)O)C2)c1O 1605830739 OCZWRBMCWPOHTF-HNNXBMFYSA-N 263.337 2.251 10 20 CECD C[C@H](NCCCSc1nccs1)[C@@H]1C[C@@H]1C(=O)O 1593267168 MHNMLMVTZIAQDT-GUBZILKMSA-N 286.422 2.324 10 20 CECD CCN(CC)C(=O)[C@H](C)Sc1ncc(C(=O)O)s1 1596237368 NDSQUAPNRPPDQD-ZETCQYMHSA-N 288.394 2.190 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(C(=O)O)CCOCC2)c1 1594373382 XLTMPOMLBSALOX-LBPRGKRZSA-N 293.363 2.233 10 20 CECD CCN(CC)C(=O)CN(C)Cc1c(O)cccc1Cl 155108163 AMZKOYRWIYVQNO-UHFFFAOYSA-N 284.787 2.346 10 20 CECD C[C@@H](NC(=O)[C@H]1CC[C@H](N)CC1)c1ccccc1O 870988312 MGZSGATXOHLYQL-IJLUTSLNSA-N 262.353 2.087 10 20 CECD C[C@H](NCC(C)(C)N1CCOCC1)c1ccccc1O 20120632 POWRSMWVUPNNKJ-ZDUSSCGKSA-N 278.396 2.154 10 20 CECD CC[C@H](NCCCOCCOC)c1ccccc1O 20192377 PZDDMXUSVFGUHW-AWEZNQCLSA-N 267.369 2.486 10 20 CECD Cc1ccc([C@@H](C)NCCCN2CCOCC2)c(O)c1 20142023 OJZYIYLJIPEKDG-CQSZACIVSA-N 278.396 2.074 10 20 CECD CC(C)CCOCCNC(=O)Nc1ccc(N)cc1 45110160 SCNGFUXNZXVPRQ-UHFFFAOYSA-N 265.357 2.453 10 20 CECD CN(C)c1ccc(CN[C@@H](C(=O)O)C(C)(C)C)cc1 756354062 UQDHRHNMGINYQE-ZDUSSCGKSA-N 264.369 2.342 10 20 CECD CCO[C@@H]1C[C@@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 185716716 GUSSLHRGMOMTSE-CHWSQXEVSA-N 293.363 2.373 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)CC[C@@H]1N 128350537 CGBVNTLKENAFBZ-SKDRFNHKSA-N 254.761 2.215 10 20 CECD CC(C)CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183481204 YBLHBJBOLMDQSH-SNVBAGLBSA-N 251.326 2.191 10 20 CECD CCN(C)c1ccc([C@@H](C)NCC(=O)NCC2CC2)cc1 181295233 LMXUTQGQUPFFDK-CYBMUJFWSA-N 289.423 2.320 10 20 CECD O=C(NCc1ccccc1O)c1ccc([N+](=O)[O-])cc1F 133751070 BMTPGVMNSHTAFZ-UHFFFAOYSA-N 290.250 2.370 10 20 CECD COc1ccc(OC)c(C(=O)NCc2ccccc2O)c1 133775472 BYCRZUNALDUXCQ-UHFFFAOYSA-N 287.315 2.339 10 20 CECD COc1cccc(CN(C)[C@H]2CCN(C)C[C@H]2C)c1O 290466437 NGVPPFVBGGCZOK-OCCSQVGLSA-N 278.396 2.173 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCCN 40855900 UAMZUEOPZIKFQG-UHFFFAOYSA-N 289.423 2.374 10 20 CECD C[C@H]1CCN(Cc2cccc(Cl)c2O)[C@@H]1CO 191179892 HGRYPUCGNJFJLF-JOYOIKCWSA-N 255.745 2.248 10 20 CECD CCN(CC)CC(=O)NCc1c(C)c2ccccc2n1C 337553435 HWBFUIFNGSNILW-UHFFFAOYSA-N 287.407 2.445 10 20 CECD COC(=O)[C@@]1(F)CCN(Cc2c(O)cccc2Cl)C1 271195883 HKPXJEPOXSWXMA-CYBMUJFWSA-N 287.718 2.133 10 20 CECD C[C@H](N[C@H]1CCO[C@]2(CCOC2)C1)c1ccccc1O 368602871 LIRYWQHBBSHGFY-HEHGZKQESA-N 277.364 2.381 10 20 CECD CC(C)C(=O)NCCN(C)Cc1c(O)cccc1Cl 271414157 YBOMBBYLYFKSIK-UHFFFAOYSA-N 284.787 2.250 10 20 CECD CC[C@H](N[C@@H]1CCN(CCOC)C1)c1ccc(F)cc1O 286015621 JMEFNVSQISNCCZ-HIFRSBDPSA-N 296.386 2.293 10 20 CECD CC[C@@H](NC[C@H]1CC[C@@H](CO)O1)c1ccc(N(C)C)cc1 294127048 LBKFMNXUYAAMAW-IXDOHACOSA-N 292.423 2.333 10 20 CECD COc1ccc(CNC(=O)N[C@H](C)C(F)(F)F)c(O)c1 808333662 PPPVTUCRMWUBIT-SSDOTTSWSA-N 292.257 2.151 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)CCCN)c1 817978160 XQNRFJPOLPAGBR-MNOVXSKESA-N 252.358 2.179 10 20 CECD COC[C@@H](CNCc1ccc2ccccc2c1O)OC 816566406 UUKKYNMXGXTXCO-CQSZACIVSA-N 275.348 2.296 10 20 CECD CC[C@@H]1NCC[C@H]1C(=O)NCCCSc1nccs1 829528619 UFACECIGFJDNMQ-MNOVXSKESA-N 299.465 2.130 10 20 CECD Cc1cccc(CN[C@@H](Cc2ccccc2)C(=O)O)c1O 821111993 FBEDBGWUGSOMOZ-HNNXBMFYSA-N 285.343 2.486 10 20 CECD CCn1nc(C)c(CNCc2cccc(Cl)c2O)n1 822494202 JGDDGHDYKFSUEW-UHFFFAOYSA-N 280.759 2.255 10 20 CECD Cc1cc(CN(C)[C@H](C)CCO)ccc1N(C)C 844451599 SOZKVMTUNQFUEF-CYBMUJFWSA-N 250.386 2.264 10 20 CECD CNc1snc(C)c1C(=O)NCc1ccccc1O 748347177 YDBUEYZSIYTUIM-UHFFFAOYSA-N 277.349 2.129 10 20 CECD Cc1cc(N(C)C)ccc1[C@@H]1NC2(CCCC2)C(=O)N1C 840820346 USRFDNLFMOTPEC-OAHLLOKOSA-N 287.407 2.434 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CCn1cccn1 840914620 FCYBUPQXGFSDAD-UHFFFAOYSA-N 272.396 2.390 10 20 CECD CCc1cccc(CN[C@H](C)CO[C@H]2CCOC2)c1O 848898540 DWSBIVSJCWHNDT-DOMZBBRYSA-N 279.380 2.238 10 20 CECD CC(C)(C)N1CC[C@@H](N[C@H]2CCc3cccc(O)c32)C1=O 842882264 PPJFXOYLJKDBQV-QWHCGFSZSA-N 288.391 2.369 10 20 CECD CN(CCNCc1ccc2c(c1)CCCO2)CC(F)F 922300364 WUWBKUOQDNQIMC-UHFFFAOYSA-N 284.350 2.298 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2CCCCS2)c(O)c1O 752798221 QEJLICSGHZYEJG-JTQLQIEISA-N 281.377 2.422 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@H]2CCCS2)c1 858292165 CVLDNSDCMNUOMS-GFCCVEGCSA-N 280.393 2.395 10 20 CECD CN(C)c1cc(F)c(CNCCc2cn[nH]c2)cc1F 858166012 WNMAHUUEBVSPMQ-UHFFFAOYSA-N 280.322 2.086 10 20 CECD CN(CC(=O)NCCCc1ccccc1)c1ccc(N)cc1 863556579 UQIJUBGOTHDXAV-UHFFFAOYSA-N 297.402 2.454 10 20 CECD Cc1ccc(O)c(CNC(=O)CCC(C)(C)[N+](=O)[O-])c1 862755262 PWKMTVQWQHJISA-UHFFFAOYSA-N 280.324 2.152 10 20 CECD CO[C@]1(CN[C@@H]2C[C@H](C)c3c(F)ccc(O)c32)CCOC1 763570466 FEFZJCSOYIJWJQ-IETSOEAISA-N 295.354 2.475 10 20 CECD CC(C)[C@@H](CO)CN[C@@H](C)c1c(O)cccc1F 886609631 YCRPSDWDQDLQEH-WDEREUQCSA-N 255.333 2.446 10 20 CECD CCN(CCN1C[C@@H]2CC[C@H](C1)O2)c1ccc(OC)cc1 775987419 WEASUFUQZKNXIK-CALCHBBNSA-N 290.407 2.385 10 20 CECD CCOCCN(C)Cc1ccc(N2CCC(O)CC2)cc1 877171550 AMCOGQPFGLREGR-UHFFFAOYSA-N 292.423 2.116 10 20 CECD CN(C)c1nccc(CNCc2c(O)cccc2Cl)n1 776496744 LSHYGJYMVQEQPL-UHFFFAOYSA-N 292.770 2.191 10 20 CECD CO[C@H]1CCC[C@H]1CNC(=O)N(C)Cc1ccccc1O 775459907 PKJZEIWQOHNXOY-WFASDCNBSA-N 292.379 2.349 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCc2n[nH]cc2C1 883016330 WHPWUNZKGDNOIN-NSHDSACASA-N 279.290 2.041 10 20 CECD C[C@H](N[C@H](C)c1ncnn1C)c1cc(F)cc(F)c1O 788983939 PDIGLSXGYMHENW-JGVFFNPUSA-N 282.294 2.211 10 20 CECD CC(C)(C)SCC(=O)NCc1cccc(O)c1O 1123890161 UWIWEHDAPTUGNB-UHFFFAOYSA-N 269.366 2.246 10 20 CECD COc1cc(C)cc(CN2CC([C@H]3CCOC3)C2)c1O 894605169 WFJGXRSOLNHLNE-LBPRGKRZSA-N 277.364 2.178 10 20 CECD CCOC(CCNCc1cc(F)ccc1O)OCC 276153572 GURUYCVOXFCOCS-UHFFFAOYSA-N 271.332 2.410 10 20 CECD CC[C@]1(CO)CCCN1Cc1cc(F)cc(F)c1O 894534297 RKPUUPAFPZQPQQ-CQSZACIVSA-N 271.307 2.407 10 20 CECD CC[C@H](CN1CCOCC1)NCc1cccc(Cl)c1O 896622147 UNCWZLPAODGHNA-CYBMUJFWSA-N 298.814 2.246 10 20 CECD COc1ccc(CN[C@H](C)C[C@H](C)NC(C)=O)cc1C 1133431898 LQTHRYNXIAOGRY-OLZOCXBDSA-N 278.396 2.396 10 20 CECD COc1cccc(NC(=O)c2cccc(O)c2O)c1O 790918294 KGONOINEXPBXMA-UHFFFAOYSA-N 275.260 2.064 10 20 CECD C/C=C(\C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891253350 RKASMKXZTJJYEQ-UDYBNVKDSA-N 289.423 2.438 10 20 CECD Nc1ccc(CN2CCC(O[C@@H]3CCOC3)CC2)cc1 1336118267 VQFUKCKIVHIFBP-MRXNPFEDSA-N 276.380 2.039 10 20 CECD C[C@H]1[C@H](C(=O)O)CCN1Cc1c(O)ccc(Cl)c1F 1604636640 OHOTZTZMABRHJC-JGVFFNPUSA-N 287.718 2.480 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](C)C[C@H]2C(=O)O)c1 1607277568 HQAITSFVYPYFAT-MFKMUULPSA-N 279.336 2.086 10 20 CECD CCOc1cccc(CN(C2CC2)[C@@H](C)C(=O)O)c1O 1592862995 MRVGQXBJBADZSS-JTQLQIEISA-N 279.336 2.228 10 20 CECD CNC(=O)[C@@H]1CCCCN1Cc1cccc(Cl)c1O 124536532 UFCNHUKJAYRUFL-LBPRGKRZSA-N 282.771 2.146 10 20 CECD COc1ccc(N(C)Cc2ccnc(OC)n2)cc1 844354296 AJILSOMJSXTCQF-UHFFFAOYSA-N 259.309 2.130 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC2CC(O)C2)c1 705245407 OGLURPBRWTUFOI-VOMCLLRMSA-N 265.353 2.212 10 20 CECD CCCC(=O)NCCNCc1ccc(OC)c(C)c1 393040324 LMRYCYCKHNHKIN-UHFFFAOYSA-N 264.369 2.010 10 20 CECD CCOC(=O)N1CCCN(Cc2cc(C)ccc2O)CC1 179748924 HLOHGQNQJJSJGN-UHFFFAOYSA-N 292.379 2.365 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H](C)c1ccc(F)cc1O 185511012 UEZVMYHBEJZZAH-JRKPZEMJSA-N 273.373 2.294 10 20 CECD Cc1nccc(N[C@H](C)Cc2ccc(O)c(O)c2)n1 184147003 HTJATJHIRQPMEN-SECBINFHSA-N 259.309 2.239 10 20 CECD CN1C[C@H](NCc2cc(Cl)cc(Cl)c2O)CC1=O 263722332 KKPBKLOUFNMWJW-SECBINFHSA-N 289.162 2.019 10 20 CECD C[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)n1cccn1 266448519 CGEPOXNKGJIWNE-GFCCVEGCSA-N 299.374 2.345 10 20 CECD CCCN(C)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 264798866 XSHYDPAEQAWIEZ-RMKNXTFCSA-N 288.391 2.405 10 20 CECD COCCOCCN(Cc1ccc(N(C)C)cc1)C1CC1 267500784 SZJDOQXXVXTMNJ-UHFFFAOYSA-N 292.423 2.380 10 20 CECD Cc1ccc(O)c(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c1 271196705 NZRGDDQDGFHBBP-SOZUMNATSA-N 267.394 2.042 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@H](C)C2)c1O 278330419 ZEKQTCHZOMHGMA-VIFPVBQESA-N 266.297 2.151 10 20 CECD C[C@H]1CCN(Cc2c(O)cccc2Cl)CC[S@@]1=O 277766787 VVHSPLFDWUCVNX-YPMLDQLKSA-N 287.812 2.389 10 20 CECD C[C@@H]1CCN(Cc2cccc(Cl)c2O)CC[S@@]1=O 277601069 LEKKNYUEPPUNOO-MGNBDDOMSA-N 287.812 2.389 10 20 CECD CCOc1cccc(CN(C)[C@@H]2CCC[C@H]2O)c1O 289756006 QVZOPEMRAMPYDG-CHWSQXEVSA-N 265.353 2.136 10 20 CECD Cc1cccc(CN2CCO[C@@H](COC(C)C)C2)c1O 372123854 DOENQNFELFUANE-OAHLLOKOSA-N 279.380 2.326 10 20 CECD O=S1(=O)C[C@H](NCc2ccccc2O)c2ccccc21 370355873 ULJZYEJVJCUDOQ-ZDUSSCGKSA-N 289.356 2.010 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)N(C)C)c1ccc(C)cc1O 280054242 JTNGOXHZLIKEGC-WCQYABFASA-N 264.369 2.218 10 20 CECD C[C@H](c1nc(N)nc(Cl)n1)N(C)Cc1ccccc1O 289482990 BUDQKIBVMKUNPX-MRVPVSSYSA-N 293.758 2.006 10 20 CECD CC[C@@H](C)[C@@H](CNCc1cc([N+](=O)[O-])ccc1O)OC 294919783 YOKKWHVIWIFQDD-QMTHXVAHSA-N 282.340 2.451 10 20 CECD CC(=O)C(=O)COC(=O)c1cc(Cl)ccc1Cl 808488624 LPZYZOZJXSZPHP-UHFFFAOYSA-N 275.087 2.308 10 20 CECD COC[C@@H](O)CCN[C@@H](C)c1c(C)cc(C)cc1O 294650401 GSYYZPOKPBDWCJ-STQMWFEESA-N 267.369 2.057 10 20 CECD CC(C)NC(=O)OC1CN(Cc2c(O)cccc2Cl)C1 297350205 GMOWIENXVRDORV-UHFFFAOYSA-N 298.770 2.364 10 20 CECD Cc1cc(Cl)nc(CNC(=O)c2cccc(O)c2O)c1 800575300 GDUPRABKMYCFDE-UHFFFAOYSA-N 292.722 2.385 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)C(C)(C)F)C2)cc1 819586474 QPEONFJSPLOQCL-GFCCVEGCSA-N 294.370 2.386 10 20 CECD C[C@@H](Nc1ccc(N2CCNCC2)cn1)c1ccccc1O 817950155 WZBQURVVKGYMGI-CYBMUJFWSA-N 298.390 2.370 10 20 CECD CN(C)c1ccc(OCCOC[C@H]2CCCO2)cc1 810000899 QLRSGVJKZPINIA-OAHLLOKOSA-N 265.353 2.327 10 20 CECD Cc1cc(CNCc2cc3c(cc2O)OCO3)cc(C)n1 817409735 FJESBOQXTNXSKS-UHFFFAOYSA-N 286.331 2.423 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H](O)C1 822756984 LHWFYMIBZSQXMG-OKILXGFUSA-N 277.364 2.292 10 20 CECD CC[C@H](CN1CCOCC1)N[C@@H]1CCc2cccc(O)c21 903342012 AREQRFXZVABMNJ-HUUCEWRRSA-N 290.407 2.080 10 20 CECD CSC(C)(C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 831930863 JUODUAWOYCJCGF-VIFPVBQESA-N 283.393 2.287 10 20 CECD CCC[C@@H](C)C(=O)N(CC(=O)O)Cc1ccccc1O 911485352 YRAQQIHGPWUONP-LLVKDONJSA-N 279.336 2.242 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(F)CC1 914430712 JBFWAXCTUYSRSG-DUXPYHPUSA-N 265.284 2.072 10 20 CECD COc1cc(Cl)cc(CNCC[C@H]2CCNC2)c1O 841037411 SRDHUCKAUSYNGQ-SNVBAGLBSA-N 284.787 2.143 10 20 CECD CCc1cccc(CNC[C@@H](O)COCC(C)C)c1O 848893325 CDQKSYFKHQEZEH-OAHLLOKOSA-N 281.396 2.078 10 20 CECD CC[C@H](C)[C@@H](C)C(=O)NCc1ccc(O)cc1O 910948816 AXFBHRDVILEVEM-VHSXEESVSA-N 251.326 2.396 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCN1C1CC1 846474563 VDLFJDHAAJEAQE-CYBMUJFWSA-N 294.782 2.289 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)COC)cc1 752761454 PCLBDSOXDLZPFI-UHFFFAOYSA-N 264.369 2.138 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCCNCC2)c1O 841059128 YCLVAFOXBVQZRE-GFCCVEGCSA-N 284.787 2.286 10 20 CECD C[C@@H](NCCCC(=O)N(C)C)c1cc(F)cc(F)c1O 756478038 DNOWMIXLYZJVEZ-SECBINFHSA-N 286.322 2.189 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)CNC(C)C)cc1 852776699 ZREQEVSCGKQFDB-UHFFFAOYSA-N 291.439 2.489 10 20 CECD COC(=O)N(C)CCN[C@@H](C)c1cc(Cl)ccc1O 850547400 FRSVFFROXBSBIN-VIFPVBQESA-N 286.759 2.394 10 20 CECD Oc1ccccc1CN[C@H]1Cc2cccc(O)c2C1 758560557 MRPGFZHGPXUWLX-ZDUSSCGKSA-N 255.317 2.355 10 20 CECD CCO[C@@H](C(=O)NCc1cc(Cl)ccc1O)C1CC1 862130541 JSPPUZSEMIGKMH-CYBMUJFWSA-N 283.755 2.477 10 20 CECD CN(CCC1CC1)Cc1cc2c(cc1O)OC[C@@H]2O 768462156 KFPMGVCROBLNJH-AWEZNQCLSA-N 263.337 2.050 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCCOC1)c1ccccc1O 868123370 FRYGBKVPBZKFGN-NEPJUHHUSA-N 278.352 2.179 10 20 CECD CN(Cc1cn[nH]c1)Cc1ccc(N(C)C)c(F)c1 769425994 RKOHJHBZZXHJCF-UHFFFAOYSA-N 262.332 2.247 10 20 CECD Cc1cnc(CC(=O)NCc2ccc(N(C)C)cc2)s1 765465937 MSPWEPDLAQEVJD-UHFFFAOYSA-N 289.404 2.376 10 20 CECD CCOc1ccc(CN2CCc3c[nH]nc3C2)c(O)c1 769468148 AWJGKXZDUVOXIY-UHFFFAOYSA-N 273.336 2.072 10 20 CECD Cc1ccc(CN[C@]2(CO)CCOc3ccccc32)c(O)c1 877498325 BRWHXFITYFPUJQ-SFHVURJKSA-N 299.370 2.461 10 20 CECD CCCOc1ccc(CNC[C@@H](C)S(C)(=O)=O)cc1C 873096302 VXFGZMQBYAUAIP-CYBMUJFWSA-N 299.436 2.307 10 20 CECD C[C@H](N[C@@H]1C=C[C@H](CO)C1)c1c(O)cccc1F 886542939 ICCMCPZGAVQFPU-GARJFASQSA-N 251.301 2.119 10 20 CECD C[C@H](NCC(=O)NC1CCCC1)c1ccc(N(C)C)cc1 772980903 NAHQVCFIONRKGL-ZDUSSCGKSA-N 289.423 2.462 10 20 CECD Cc1ccc(CN(C)C(=O)c2cc(O)cs2)nc1 789919138 WNEKTUNUOBIYEA-UHFFFAOYSA-N 262.334 2.429 10 20 CECD Cc1cc(C)c([C@H](C)NCCCS(C)(=O)=O)c(O)c1 788643816 HKMNQQKRVPZFGX-LBPRGKRZSA-N 285.409 2.094 10 20 CECD CCOc1ccc(O)c(CNC[C@H]2CC(C)=NO2)c1 895311843 SFMRRQOGFHVQSK-CYBMUJFWSA-N 264.325 2.045 10 20 CECD COc1ccc(CNC[C@H]2CC[C@@H](C)O2)c(O)c1OC 894817472 QUTWODGHTLYCHW-ZYHUDNBSSA-N 281.352 2.067 10 20 CECD C[C@H](NCCSCCCO)c1cc(F)ccc1O 185379228 ZXDSVTDXSITUIY-JTQLQIEISA-N 273.373 2.298 10 20 CECD CCC[C@](C)(CO)NCc1cc(C)cc(OC)c1O 894259557 WTAUGJWTJQHJKR-OAHLLOKOSA-N 267.369 2.350 10 20 CECD OC[C@@H](NCc1c(O)ccc(Cl)c1F)C1CC1 790964864 PAFOYWZKOYZQSX-SNVBAGLBSA-N 259.708 2.045 10 20 CECD Oc1cccc(Br)c1CN[C@H]1CCOC1 706834360 ZRPQAGUESAFIJX-QMMMGPOBSA-N 272.142 2.033 10 20 CECD COc1cccc(O)c1CNCc1cnc2n1CCCC2 790637079 GWSUZERZFZSOGI-UHFFFAOYSA-N 287.363 2.223 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCC[C@@H]2C)c(O)c1 792916960 BZBJYQFJYMISMK-GXFFZTMASA-N 278.352 2.389 10 20 CECD CN(C)c1ccc(CNCc2cnc3n2CCC3)cc1 719153975 BLLKFRSYMRUYQT-UHFFFAOYSA-N 270.380 2.185 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(F)(F)F 70267083 ZJYQXMOVKXUHHE-UHFFFAOYSA-N 260.259 2.273 10 20 CECD CC(C)(C)NCC(=O)NCc1c(O)ccc2c1CCCC2 1319354737 MWWFOONFZZVRAP-UHFFFAOYSA-N 290.407 2.275 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2C[C@@H](O)C2(C)C)cc1F 1329389546 LYSCXYJPJAOBFC-UONOGXRCSA-N 284.350 2.280 10 20 CECD COC(=O)[C@]1(C)CCCN(Cc2ccc(N)cc2)C1 1336285206 JEAHXPUEWGVNAF-OAHLLOKOSA-N 262.353 2.044 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](CCO)C(C)C)c1O 162252955 GJEFMARVPLQSBM-AWEZNQCLSA-N 283.343 2.231 10 20 CECD CC[C@@H](NCc1cc2c(cc1O)OCO2)C(F)F 824508140 ANJCVFCAPZMOSP-MRVPVSSYSA-N 259.252 2.254 10 20 CECD COc1ccc(O)c(CNc2cccc(C(N)=O)c2)c1 20125093 PXIKHSLHYPPZRH-UHFFFAOYSA-N 272.304 2.112 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCCS(C)(=O)=O 38047276 NORQHIQQVBWVBM-NWDGAFQWSA-N 297.420 2.273 10 20 CECD COc1ccc(O)c([C@H](C)NCc2ncccn2)c1 192156498 XZWGFCQOQHYFIM-JTQLQIEISA-N 259.309 2.042 10 20 CECD Oc1c(F)cc(F)cc1CNCCOCC(F)(F)F 708556875 ZAPOMOIPPWTUHN-UHFFFAOYSA-N 285.212 2.339 10 20 CECD CC[C@@H](NCCOCCOC)c1ccc(N(C)C)cc1 178632511 CSEPVURLRWEBOY-MRXNPFEDSA-N 280.412 2.456 10 20 CECD CN(C)C[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1 179630687 LYPXFPAXZXZBBF-OAHLLOKOSA-N 261.413 2.136 10 20 CECD CC(=O)c1cc(C(=O)N(C)Cc2ccccc2O)n(C)c1 176014993 SBNOUHMZFFUUNU-UHFFFAOYSA-N 286.331 2.206 10 20 CECD C[C@@H]1CN=C(N2CCN(Cc3ccccc3O)CC2)S1 179579990 JHYRBPCEXMLIGX-GFCCVEGCSA-N 291.420 2.001 10 20 CECD CCN1CCN(Cc2cc(F)ccc2O)C[C@H]1C 300416274 NDDWUYBHINNCDS-LLVKDONJSA-N 252.333 2.057 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cc(C)cc(C)c2O)C1 178900506 NRGSMUZXPFSMJV-INIZCTEOSA-N 277.364 2.394 10 20 CECD CCc1noc(CC)c1CNC(=O)c1cccc(O)c1O 185825277 LOKPRSBEJGUJNI-UHFFFAOYSA-N 290.319 2.141 10 20 CECD CCCN(CC(=O)OC)Cc1ccc(N(C)C)cc1 194545931 WYKVSYOALLOFEN-UHFFFAOYSA-N 264.369 2.138 10 20 CECD CCN(CCCN)Cc1cc(Br)ccc1O 221636266 CPSUYXPRGRCFMV-UHFFFAOYSA-N 287.201 2.325 10 20 CECD Cc1nc(CCNC(=O)c2ccc(C)c(O)c2O)cs1 267549724 CMFLKEAXPNRQCE-UHFFFAOYSA-N 292.360 2.144 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)C1CCOCC1 268559694 ODSKSXYWAIUBHX-LLVKDONJSA-N 278.352 2.007 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCO[C@H](C2CC2)C1 274147932 DPFOTMVIRKEFJF-HIFRSBDPSA-N 290.363 2.149 10 20 CECD CCOC(=O)[C@H](C)[C@H](C)NCc1ccc(N(C)C)cc1 283068941 JXUCXVCVBKRJCT-OLZOCXBDSA-N 278.396 2.430 10 20 CECD C[C@@](O)(CCc1ccccc1)C(=O)NCc1ccccc1O 283064616 CPHZISDYOXUYQO-GOSISDBHSA-N 299.370 2.392 10 20 CECD CO[C@H]1CCN(C(=O)c2ccc(C)c(O)c2O)CC1(C)C 296956020 JUUGAKFMHSVRJZ-LBPRGKRZSA-N 293.363 2.293 10 20 CECD CCC(CC)(CCO)CNC(=O)c1c(F)ccc(O)c1O 294947336 MJQHJILYQFBQDL-UHFFFAOYSA-N 299.342 2.156 10 20 CECD Cc1ccc(C(=O)N2CC[C@H](O)CC(C)(C)C2)c(O)c1O 297128195 ZDERLNSJFAMHEZ-NSHDSACASA-N 293.363 2.029 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@@H]1O 293698150 CMOGHEJFSZYMMF-HOCLYGCPSA-N 262.397 2.264 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(C)(C)C)C2=O)cc1C 818112285 ZIOZWANPCQFKQB-CQSZACIVSA-N 290.407 2.493 10 20 CECD COc1cccc(CNC(=O)CCc2cncs2)c1O 815834773 YRALWNYIEZCADF-UHFFFAOYSA-N 292.360 2.106 10 20 CECD OCC(F)(F)CNCc1ccc2ccccc2c1O 816570680 CRPGGOULBOVZCY-UHFFFAOYSA-N 267.275 2.263 10 20 CECD CC(C)N1CC[C@H](N(C)Cc2cc3c(cc2O)OCO3)C1 825331792 NGYIBOXRNQDVJO-ZDUSSCGKSA-N 292.379 2.035 10 20 CECD C[C@H](NCc1ccc(-c2nn[nH]n2)cc1)c1ccccc1O 824612076 IQGZAGDCGDEOPV-NSHDSACASA-N 295.346 2.423 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](CN3CCCC3=O)C2)c1 827634537 SENTXEXYAUZMNQ-CQSZACIVSA-N 288.391 2.145 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NOCc1ccccc1 588403719 XIABVJRFGKXUKL-CLFYSBASSA-N 285.299 2.359 10 20 CECD CCOc1ccc(CNc2cc(OC)ncn2)c(O)c1 902181347 KKIXCRQGZCFYPZ-UHFFFAOYSA-N 275.308 2.202 10 20 CECD CCOc1ccc(CN[C@H](C)CCCCO)c(O)c1 824653791 IAXVZXSPIHHMAI-GFCCVEGCSA-N 267.369 2.432 10 20 CECD C[C@@H](NC[C@H]1CCCN1CCCO)c1ccc(F)cc1O 834850594 NLWBKYYSDSGBNY-TZMCWYRMSA-N 296.386 2.029 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H](C)CCN 841968432 XPYGAJQXWSNIMP-LBPRGKRZSA-N 279.384 2.051 10 20 CECD CCN(CC)c1ccc(CN(C)S(=O)(=O)CC)cc1 919724803 KHRVCQKVXHHOHR-UHFFFAOYSA-N 284.425 2.314 10 20 CECD C[C@@H]1CC[C@H](C(=O)O)N1Cc1ccc(N(C)C)cc1 844934483 NCTGOZVFCCRMOD-BXUZGUMPSA-N 262.353 2.190 10 20 CECD C[C@@H]1CC/C(=C/C(=O)NCc2ccc(O)cc2O)C1 910951261 QKTDIMFIOUAXFT-PAKSIRSJSA-N 261.321 2.460 10 20 CECD Cc1cc(CN(C)[C@@H]2CCC(=O)N(C)C2)ccc1N(C)C 846920103 FPOPTQYJVNNULJ-OAHLLOKOSA-N 289.423 2.114 10 20 CECD C[C@@H]1C[C@H](N)CCN1Cc1c(O)ccc(Cl)c1F 846703699 PMKYGZSFHNYCSY-RKDXNWHRSA-N 272.751 2.496 10 20 CECD CCNC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840256255 PLLZQXFMHBHPSQ-GFCCVEGCSA-N 263.385 2.311 10 20 CECD CC(C)n1cc(CNCCc2ccc(N)cc2)cn1 841037076 YETKEOHDGUVLSY-UHFFFAOYSA-N 258.369 2.379 10 20 CECD CNCCCN(C)Cc1cc(Cl)cc(F)c1O 841104432 RMNXSQAFINIZEU-UHFFFAOYSA-N 260.740 2.226 10 20 CECD Cc1ccc(O)c([C@H](C)NCCS(=O)(=O)CC2CC2)c1 756763137 UNFCDQBXJKPZOE-LBPRGKRZSA-N 297.420 2.176 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2ccc(C)nc2)c1 858146692 LLRDKCXDIYYJSV-UHFFFAOYSA-N 285.347 2.403 10 20 CECD CC[C@H](N[C@H](C)C(=O)N(C)OC)c1ccc(C)cc1O 858586553 FHVCGGWWPUGEFJ-YPMHNXCESA-N 280.368 2.150 10 20 CECD Oc1ccc([C@@H]2OCC[C@H]2NCc2ccccc2O)cn1 858288837 FFSZYFIUWZENFR-CJNGLKHVSA-N 286.331 2.113 10 20 CECD COCC1(NCc2cccc(OC)c2O)CCCC1 850345427 ZZNLELDNLIPWNU-UHFFFAOYSA-N 265.353 2.450 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](CC)NC 852799306 DAMPANLQZBYIGW-ZDUSSCGKSA-N 264.369 2.129 10 20 CECD Cc1oc(C(=O)NCc2ccc(N(C)C)cc2)cc1CO 864574729 FGVKWGPVNISWCN-UHFFFAOYSA-N 288.347 2.076 10 20 CECD CN(Cc1cc(F)c(N(C)C)cc1F)C[C@@H](O)C1CC1 862367652 QBQZWOHBKGNLSB-OAHLLOKOSA-N 284.350 2.234 10 20 CECD CC(=O)NC[C@H]1CCCCN1Cc1ccc(C)cc1O 877673384 FMFAHFUYPGCSLG-OAHLLOKOSA-N 276.380 2.191 10 20 CECD CCCOc1ccc(CNCCNC(=O)C2CC2)cc1C 873009209 ZDRYVTGEUTZMAW-UHFFFAOYSA-N 290.407 2.400 10 20 CECD Cc1ccc(CNC[C@H](CO)Cc2ccco2)c(O)c1 877092838 LCUVUBCWNJSDEI-CYBMUJFWSA-N 275.348 2.234 10 20 CECD O=C1N[C@@H](c2cccc(O)c2O)Nc2cc(F)c(F)cc21 877858672 KOGMNUWONHJSRR-ZDUSSCGKSA-N 292.241 2.230 10 20 CECD CSCC[C@H](O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 775409469 GGZSHESKMRLNTH-RISCZKNCSA-N 296.436 2.044 10 20 CECD C[C@H](CNCc1cc(F)cc(F)c1O)Cn1ccnc1 882934908 XSUXHWRDSKAWKM-SNVBAGLBSA-N 281.306 2.293 10 20 CECD CCCN(Cc1ccccc1O)[C@H](C)C(=O)N(C)C 76073963 SVOVDMBZBNUGOV-GFCCVEGCSA-N 264.369 2.081 10 20 CECD CCC(=O)N1C[C@H](C)[C@H](NCc2ccc(OC)c(C)c2)C1 1054307153 ICUCZZQKQGCKAY-DZGCQCFKSA-N 290.407 2.350 10 20 CECD COc1ccc(CN[C@H]2C[C@H](OC)C2(C)C)c(O)c1OC 893096530 MWPZUSAZIUTTFF-STQMWFEESA-N 295.379 2.313 10 20 CECD COCC1CN(Cc2cc(Cl)cc(F)c2O)C1 895970084 BUJOHAHJJFJUAP-UHFFFAOYSA-N 259.708 2.263 10 20 CECD COc1ccc(CN2CCC[C@H](CO)[C@H]2C)c(O)c1OC 894941072 YQQWYHKTMDFPPF-DGCLKSJQSA-N 295.379 2.002 10 20 CECD c1cc2c(cc1CNCc1ccc3nonc3c1)CCO2 897993460 DMBKECJEQSNOQE-UHFFFAOYSA-N 281.315 2.448 10 20 CECD COc1cccc(CN[C@H]2CCC[C@H](OC)C2)c1O 746755678 REMPLMHPTKGMGU-STQMWFEESA-N 265.353 2.448 10 20 CECD CC[C@H](O)CCCNCc1cc(F)cc(F)c1O 708480858 MYDQTHLJXRHHAW-NSHDSACASA-N 259.296 2.311 10 20 CECD CCC[C@@H]1C[C@H]1NC(=O)NCc1ccc(OC)cc1O 792969007 XUUJDFMEQZDFOM-ZWNOBZJWSA-N 278.352 2.389 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(F)cc1O 796829161 ZRDYUZLZQISILC-BXUZGUMPSA-N 292.354 2.335 10 20 CECD C[C@@H](NC(=O)CC(C)(C)O)c1ccc(N(C)C)cc1 792332165 GHGHISCEHWBVAP-LLVKDONJSA-N 264.369 2.091 10 20 CECD Nc1ccc(CNC(=O)NC2(C3CC3)CCOCC2)cc1 1262603359 GFIAIKPKNHOIAR-UHFFFAOYSA-N 289.379 2.027 10 20 CECD CCN(Cc1ccncc1)C(=O)NCc1ccc(N)cc1 1353540614 WNHOBJVJMAKGKW-UHFFFAOYSA-N 284.363 2.396 10 20 CECD CCOc1ccc(CN[C@H](CC2CC2)C(=O)O)c(O)c1 1610041838 FPDAASRVCAUGQN-CYBMUJFWSA-N 279.336 2.134 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1cc(C)cc(OC)c1O 1589441719 WCFAETCIGYXFCJ-NSHDSACASA-N 267.325 2.004 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@H]2C[C@H]2C(=O)O)c1 1599597998 DDYNSFHDXROPGT-INTNWOOBSA-N 279.336 2.161 10 20 CECD CN(C)c1ccc(CNCCC(=O)Nc2cccnc2)cc1 818941248 GOLARROCSPALFN-UHFFFAOYSA-N 298.390 2.266 10 20 CECD CC(C)N(C)CCNCc1ccc2c(c1)CCCO2 921649742 IKEPSGLWAHMETL-UHFFFAOYSA-N 262.397 2.441 10 20 CECD CC1(CCC(=O)NCCc2ccc(O)c(O)c2)CC1 934938415 BUPHECHDTDMQQN-UHFFFAOYSA-N 263.337 2.337 10 20 CECD Cc1ccc(CN2CCC(CN(C)C)CC2)c(O)c1 876577219 YGACUJWANPUKQI-UHFFFAOYSA-N 262.397 2.474 10 20 CECD OCC1(CNCc2cc(F)cc(F)c2O)CCCC1 708504656 SOTKMIRLQMDNDC-UHFFFAOYSA-N 271.307 2.313 10 20 CECD CC(C)(C)[C@H](CO)NCc1cc(F)cc(F)c1O 708501801 JFWMNSAXBWBYCT-NSHDSACASA-N 259.296 2.167 10 20 CECD COCC(COC)N[C@@H](C)c1cc(C)ccc1O 388402844 PPVQUOXLYGRNJE-NSHDSACASA-N 253.342 2.013 10 20 CECD C[C@@H]1C[C@@H](C(=O)O)CN(Cc2cc(F)ccc2O)C1 398830133 HEZBHUGZPMUYKJ-MWLCHTKSSA-N 267.300 2.074 10 20 CECD CS[C@@H](CO)[C@@H](C)NCc1cccc(Cl)c1O 224857218 YIZRZCDUJWIREW-KCJUWKMLSA-N 275.801 2.248 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(Cl)c[nH]2)c1 114541668 HOIPSJANXKMROB-UHFFFAOYSA-N 280.711 2.312 10 20 CECD CN(C)C(=O)NCc1ccc(N2CCSCC2)cc1 56328385 KZHJKBCQZVABFP-UHFFFAOYSA-N 279.409 2.011 10 20 CECD COc1ccc(N(C)CC(=O)N[C@@H](C)C(C)C)cc1OC 64517408 LEWRDHPFZVXGQV-LBPRGKRZSA-N 294.395 2.301 10 20 CECD CCn1cc(CNCc2ccc(N3CCCC3)cc2)nn1 404477941 UDHQENXVXFFZHT-UHFFFAOYSA-N 285.395 2.188 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](N)CC(C)C)c1 1341721856 OJCJSLFOIHVDEN-NEPJUHHUSA-N 294.395 2.342 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N2CC(O)C2)c1C 305147776 SJMPKONVDSIZNH-UHFFFAOYSA-N 284.359 2.219 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1CCOCC1 60678925 SBVUZOIWWBXZID-UHFFFAOYSA-N 276.380 2.138 10 20 CECD COc1cccc(CNCc2ncc(C)s2)c1O 230687120 LGUGRRFROSWVEW-UHFFFAOYSA-N 264.350 2.456 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNCC1CC1 37807434 LPPXLNSFSQMEOA-UHFFFAOYSA-N 289.423 2.101 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1c(F)ccc(F)c1F 184991078 ITEKPSLWBFXPDM-UHFFFAOYSA-N 297.232 2.445 10 20 CECD C[C@H](C[S@](C)=O)N(C)Cc1cccc(Cl)c1O 131041186 JUQJAQWLMOTIMH-VVVCHXIZSA-N 275.801 2.244 10 20 CECD CC1(C)CC(NC(=O)c2cccc(O)c2O)CC(C)(C)N1 192918013 KKXBLQQUDZIYEK-UHFFFAOYSA-N 292.379 2.137 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C\c2cccnc2)c1 255643866 QUAXYWYIIAERGE-DAXSKMNVSA-N 284.315 2.125 10 20 CECD CCOC[C@@H](NC(=O)c1c(F)ccc(O)c1O)C(C)C 295568527 YNFBWIUNTANBHS-SNVBAGLBSA-N 285.315 2.028 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)NC1CC1 295336817 ZWAPJEGEPDTEQF-GFCCVEGCSA-N 276.380 2.271 10 20 CECD Cc1ccc(C(=O)Nc2cc3ccccn3n2)c(O)c1O 804378258 JEBUOTMOIHFEED-UHFFFAOYSA-N 283.287 2.306 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2ccc(F)cc2O)n1 818347427 ZQKKYORZLQYPEX-VIFPVBQESA-N 278.331 2.302 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCCC[C@H]2N)c1 818614615 CWTUEICNTKVSLR-ZLKJLUDKSA-N 292.379 2.099 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CC[C@H](n2cncn2)C1 816574450 ICMKLEVMFKYMCG-JTQLQIEISA-N 296.733 2.223 10 20 CECD CCOC(=O)CN(CCCF)Cc1ccccc1O 823582124 YVUZRCYMRQDFGH-UHFFFAOYSA-N 269.316 2.117 10 20 CECD COc1ccc(N(C)C(=O)/C=C\c2cnccc2C)nc1 492638029 AGLJJUQIARWNDV-DAXSKMNVSA-N 283.331 2.470 10 20 CECD CN(Cc1ccccc1O)C(=O)CSC(F)F 825481568 NCDJUQRKTFRBHX-UHFFFAOYSA-N 261.293 2.306 10 20 CECD COCCN(CC(C)C)C(=O)c1cc(O)cs1 731868526 IGSSPWQZRVOWGX-UHFFFAOYSA-N 257.355 2.198 10 20 CECD CC[C@H](NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@H](C)O 838560007 SDZYIBXIPSWZFM-HUBLWGQQSA-N 293.411 2.272 10 20 CECD COc1cccc(CNC[C@@H](C)C(=O)OC(C)(C)C)c1O 848565745 LICGWNUYEIAWTP-LLVKDONJSA-N 295.379 2.468 10 20 CECD CC(C)[C@@H](C)N(C)C(=O)NCCc1ccc(N)cc1 841961154 AGMOERHQRHGZBK-GFCCVEGCSA-N 263.385 2.497 10 20 CECD CCOc1cccc(CN2CCC3(CCNC3)CC2)c1O 843125879 BKQWBMBXDDNWBF-UHFFFAOYSA-N 290.407 2.366 10 20 CECD COCC(C)(C)CNC[C@H](N)c1ccc(N(C)C)cc1 841043312 RETXYKBQVPNUFQ-HNNXBMFYSA-N 279.428 2.015 10 20 CECD CCC[C@H](O)[C@H](CO)NCc1ccc(N(CC)CC)cc1 842224704 FBXVXNGDBXAWHY-IRXDYDNUSA-N 294.439 2.144 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3CCC[C@]3(CN)C2)c1 844903244 VXSDVRMCNWMSPE-YOEHRIQHSA-N 290.407 2.352 10 20 CECD COc1cc2c(c(OC)c1)N(C[C@H]1CCC(=O)O1)CCC2 852171851 BEZKBMZCNCWJTK-GFCCVEGCSA-N 291.347 2.162 10 20 CECD COCCOCCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756462680 YPCKEVUJOZSPIO-JQWIXIFHSA-N 283.343 2.332 10 20 CECD Cc1ccc(N(C)Cc2ccc(N(C)C)cc2)nn1 853094062 XEUHDZKOPGDTDA-UHFFFAOYSA-N 256.353 2.487 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2ccc(C)nc2)c1 858209895 BWAYQPJWRZRCJH-UHFFFAOYSA-N 299.374 2.446 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H]2CCCC[C@@H]2O)c1 862756396 XBIHUWGCFZKDKL-OCCSQVGLSA-N 277.364 2.258 10 20 CECD Oc1cc2c(cc1CN1[C@H]3C=CC[C@H]1CC3)[C@@H](O)CO2 768461907 HLCCRVUUQAVYAX-HUBLWGQQSA-N 273.332 2.111 10 20 CECD CCc1cccc(CNCCN(C)CC(F)F)c1O 862549784 FBOHGJCBWBGWRT-UHFFFAOYSA-N 272.339 2.241 10 20 CECD C[C@H]1C(=O)N([C@H](C)c2ccc(N(C)C)cc2)C(=O)N1C 761578833 XIFKBWDHGAPXOK-MNOVXSKESA-N 275.352 2.096 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc3n(n2)CCCC3)c1 862754762 JBNMVWRGOJWMCY-UHFFFAOYSA-N 285.347 2.163 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1CSC1 864634978 VMOXSGAHBMKAKB-UHFFFAOYSA-N 264.394 2.074 10 20 CECD CCOC(=O)CN(Cc1c(O)cccc1OC)CC(C)C 768755852 ROSJQFZJCGOQEP-UHFFFAOYSA-N 295.379 2.422 10 20 CECD CC[C@H](CO)N(C)Cc1cc(F)c(N(C)C)cc1F 862382687 WRLUHDZOKLCPSY-LLVKDONJSA-N 272.339 2.234 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc(O)c(F)c2)c1 768296296 VPFXPOZFKSCOSQ-UHFFFAOYSA-N 291.278 2.176 10 20 CECD COc1cccc(O)c1CN1CCCC[C@@H]1C1OCCO1 769299535 XQXNROGJMZNXFO-CYBMUJFWSA-N 293.363 2.128 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)[C@H]1CCCOC1 764142665 KLANTIAXVOQPCM-KRWDZBQOSA-N 290.407 2.134 10 20 CECD CC(C)CCN(C)Cc1cc2c(cc1O)OC[C@H]2O 768439259 FEMGRIBFCYHKLC-CQSZACIVSA-N 265.353 2.296 10 20 CECD C[C@H](CCO)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776248396 ZMACGGOBHFAQPF-CHWSQXEVSA-N 293.411 2.131 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCS1 773743802 LHZGOXHMCDRZGW-RNCFNFMXSA-N 281.377 2.041 10 20 CECD CC[C@H](N[C@H]1CCC[C@H]1C(=O)NC)c1ccccc1O 775523918 BAWQNVOWYZOJAP-RDBSUJKOSA-N 276.380 2.348 10 20 CECD C[C@@H]1COC[C@H]1NCc1cc(Cl)cc(F)c1O 896735045 AOVMWJGDFCHQFL-RDDDGLTNSA-N 259.708 2.309 10 20 CECD Oc1ccccc1CN1CCn2nc(C3CC3)cc2C1 896939619 LBVAWRZTILTLLA-UHFFFAOYSA-N 269.348 2.482 10 20 CECD CC[C@]1(O)CCN(Cc2cc(F)cc(F)c2O)C1 894504603 PWGPPTOZJAVJRH-ZDUSSCGKSA-N 257.280 2.017 10 20 CECD CN(C)CCN(C)Cc1c(O)cccc1Br 707142991 QVAUWOOBELNOQV-UHFFFAOYSA-N 287.201 2.148 10 20 CECD CCC(C)(C)C(=O)NCc1ccc(OC)cc1O 794380273 XIKGBMOSDFTQMP-UHFFFAOYSA-N 251.326 2.453 10 20 CECD CO[C@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@H]1OC 1204323328 GYXXRUWAKBFPJS-CALCHBBNSA-N 290.407 2.132 10 20 CECD CCOc1ccc(N2CCN(CCF)CC2)cc1 1149356231 MTZDJANWGVKCAY-UHFFFAOYSA-N 252.333 2.177 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ccnc(N)n1 1337783611 UOBGPQSHRAHPNG-UHFFFAOYSA-N 257.341 2.045 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cccc(CC(=O)O)c2)c1 1600464372 AQFSRZYVBPVBDA-UHFFFAOYSA-N 299.326 2.258 10 20 CECD CCCC(=O)NCCCNCc1ccc(OC)c(C)c1 1154160851 PEKNCMHDZPJECE-UHFFFAOYSA-N 278.396 2.400 10 20 CECD CC[C@H](O)CNCc1cc(C)cc(Br)c1O 309965338 NDBOSXFJZLBDBC-JTQLQIEISA-N 288.185 2.324 10 20 CECD Cc1nscc1C(=O)NCc1ccc(N(C)C)cc1 179666105 JXPZEUDMTHHZMS-UHFFFAOYSA-N 275.377 2.448 10 20 CECD CC(C)[C@@H](CCO)NCc1ccc(N(C)C)cc1 230689166 GFYBHYHQIJTVKU-OAHLLOKOSA-N 250.386 2.249 10 20 CECD CO[C@H](C)CN(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 313749883 QDZSXNNLWPZLNO-ONRRBMGISA-N 294.307 2.164 10 20 CECD Oc1c(Cl)cccc1CN[C@@H]1CCN(C2CC2)C1 124806357 JEPWHSMMPZHSPY-LLVKDONJSA-N 266.772 2.372 10 20 CECD Cc1ccc(O)c(C(=O)NCc2ccc(O)c(O)c2)c1 182536982 LNIKQNWABGWHAW-UHFFFAOYSA-N 273.288 2.042 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(C)ccc2O)C[C@H]1C 188118404 MAGWYKDXVCDNSP-OCCSQVGLSA-N 277.364 2.332 10 20 CECD Cc1cc(C(=O)NC[C@H](C)N)c(C)n1-c1ccc(F)cc1 194914827 ITQUELQLBPBQOV-JTQLQIEISA-N 289.354 2.310 10 20 CECD CCC[C@@](C)(O)CNCc1ccc(N2CCOCC2)cc1 226250002 IARBDPZPZLVQOK-QGZVFWFLSA-N 292.423 2.164 10 20 CECD C[C@@](O)(CN[C@H]1CCc2cccc(O)c21)C(F)(F)F 296964112 RFYNVYBQGPFQQR-JOYOIKCWSA-N 275.270 2.282 10 20 CECD CC[C@@H](C(=O)NCc1ccc(N(C)C)cc1)N(CC)CC 265460176 XGINRYORPVLXQH-INIZCTEOSA-N 291.439 2.489 10 20 CECD CO[C@H](C)CCNCc1ccc(N(C)C)c(F)c1 264948785 JUKBUXOQIZPPRL-LLVKDONJSA-N 254.349 2.406 10 20 CECD Oc1c(Cl)cccc1CN[C@@H]1C[C@H]2CC[C@H]1NC2 530247028 VOVZHLPINXGRAA-OASPWFOLSA-N 266.772 2.276 10 20 CECD CN(C)c1ccc(CN2CCOC[C@H]2[C@@H]2CCCO2)cc1 367604468 UCEMKHZJARSYAQ-IRXDYDNUSA-N 290.407 2.132 10 20 CECD CCS(=O)(=O)CCN[C@@H](C)c1ccc(C)c(C)c1O 273563863 IYBFXULVKCSSMX-LBPRGKRZSA-N 285.409 2.094 10 20 CECD OC[C@@H](Cc1ccc(F)cc1)NCc1ccccc1O 271194166 HICVXOAMHWCAET-OAHLLOKOSA-N 275.323 2.225 10 20 CECD CCN1CC(=O)N(Cc2ccc(N3CCCC3)cc2)C1=O 272268816 MZJXGVGXDBUTEQ-UHFFFAOYSA-N 287.363 2.071 10 20 CECD C[C@H](N[C@H]1CCc2c[nH]nc2C1)c1ccc(F)cc1O 370399377 UCGWHZOQXRZIEW-CABZTGNLSA-N 275.327 2.463 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@@H](OC)C(C)C)c1O 278304514 DHFRDOJMLHNVQN-GFCCVEGCSA-N 298.339 2.070 10 20 CECD CN(CCC1OCCCO1)c1ccc2c(c1)OCO2 270359437 RKKKIEWUVNTFHJ-UHFFFAOYSA-N 265.309 2.005 10 20 CECD COC(=O)[C@]12CCC[C@H]1CN(Cc1ccccc1O)C2 374674043 AHRYVVHMKYSFJA-BBRMVZONSA-N 275.348 2.167 10 20 CECD COC(=O)CC1(CN(C)c2ccc3c(c2)OCO3)CC1 281680666 QTMORVNMCUDEOU-UHFFFAOYSA-N 277.320 2.195 10 20 CECD CNC(=O)[C@H](CCSC)N[C@@H](C)c1cc(C)ccc1O 806662244 AYVSNIBVADTKFL-AAEUAGOBSA-N 296.436 2.219 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1[C@@H]1CCCO1 807538432 DMJDUZZUIWKQMW-MNOVXSKESA-N 267.350 2.237 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H]2C[C@H](F)CN2)cc1 817976707 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Cc1cccc(O)c1CN1CCCN(CC(F)F)CC1 877529189 VPAZYJHMBKGQRP-UHFFFAOYSA-N 284.350 2.473 10 20 CECD C[C@@H]1C[C@@H](NC[C@H]2C[C@@H](N)C2)c2c(O)ccc(F)c21 873250445 HRGDXMLYXKFHRT-MWGHHZFTSA-N 264.344 2.407 10 20 CECD CCC[C@@]1(C)C(=O)NCCN1Cc1ccc(C)cc1O 877461728 GGBKCKRUCNNDPT-INIZCTEOSA-N 276.380 2.191 10 20 CECD CCOCCOCCCC(=O)N(C)c1ccc(N)cc1 877074168 AVVWVWVUIVCWBU-UHFFFAOYSA-N 280.368 2.065 10 20 CECD Cc1c[nH]cc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1=O 775412005 UAPFEWLNBOURKB-GFCCVEGCSA-N 299.374 2.240 10 20 CECD C[C@H](NC(=O)Nc1ccn(C)n1)c1ccc(N(C)C)cc1 775586515 RMLHCXSKIWYBMC-NSHDSACASA-N 287.367 2.369 10 20 CECD Cc1cc(C(=O)NCc2ccc(O)c(O)c2)c2n[nH]cc2c1 778928811 BZOCYMCHYZSVMO-UHFFFAOYSA-N 297.314 2.213 10 20 CECD COc1ccc(CNC(=O)NC[C@@H]2C=CCC2)c(O)c1 883782580 HMSWEYITXWEWPZ-LLVKDONJSA-N 276.336 2.166 10 20 CECD CC[C@@H](NC(=O)c1ccc(C)c(O)c1O)c1ncc[nH]1 785421431 OTAULQVMMPCQCO-SNVBAGLBSA-N 275.308 2.010 10 20 CECD CC[C@@]1(CO)CCCN1Cc1ccc(OC)c(OC)c1O 893909109 WPUTWJAJRCRNNC-INIZCTEOSA-N 295.379 2.146 10 20 CECD COc1ccc(CN2CCC(OC)CC2)c(O)c1OC 891536795 NSSHRHLCXJKPBN-UHFFFAOYSA-N 281.352 2.020 10 20 CECD C[C@@H](CCNCc1cc(F)c(N(C)C)cc1F)N(C)C 895293254 XCOUGXHFTZKPRW-NSHDSACASA-N 285.382 2.461 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCCSC1 749111213 YKVAQWLTWQAPEV-SNVBAGLBSA-N 253.367 2.386 10 20 CECD Cc1ccc(F)c(S(=O)(=O)NCc2ccccc2O)c1 751151008 NMFYUBKFEHWRIQ-UHFFFAOYSA-N 295.335 2.318 10 20 CECD Cc1noc([C@@H](C)NCc2cc(F)ccc2O)n1 792177100 RXFXBRREXPVTKZ-SSDOTTSWSA-N 251.261 2.074 10 20 CECD COc1ccc(CNCCCNC(=O)C2CCC2)cc1C 1154082453 DDRCFHPYFQJMST-UHFFFAOYSA-N 290.407 2.400 10 20 CECD Cc1cc(C)c([C@H](C)NCC(=O)NCC(C)C)c(O)c1 1324239891 LXXUWUBRZJSOBA-ZDUSSCGKSA-N 278.396 2.432 10 20 CECD CCn1cnc2c1CCN(Cc1ccc(N)cc1)C2 1334755091 VJTOFOJPYRQSOU-UHFFFAOYSA-N 256.353 2.044 10 20 CECD COC(=O)[C@H](C)CN(Cc1ccc(N)cc1)C1CC1 1345159274 DYDJCJBXZAJLEX-LLVKDONJSA-N 262.353 2.042 10 20 CECD CC(C)(C)C(=O)N1CCC(NCc2ccc(N)cc2)CC1 1356082665 BLIGIAISUWSOSA-UHFFFAOYSA-N 289.423 2.396 10 20 CECD Cc1cc(O)c(CN[C@@]2(CC(=O)O)CCCOC2)cc1C 1600285455 BXYVRKMWRKRMQW-MRXNPFEDSA-N 293.363 2.123 10 20 CECD Cc1ccc(O)c(CNCc2c[nH]c(C(=O)O)c2)c1 1600465172 QAMCGMKNIHQJPT-UHFFFAOYSA-N 260.293 2.017 10 20 CECD C[C@H](N[C@H](CO)C1CCCC1)c1cc(C(=O)O)ccc1O 1593207133 BARSPEJBTVBLIG-IINYFYTJSA-N 293.363 2.292 10 20 CECD Nc1ccc(NC(=O)NC[C@@H]2CCCS2)cc1 150025140 HIFFPEBRVRDEAG-NSHDSACASA-N 251.355 2.286 10 20 CECD COc1cccc(CNC(=O)C2=C(C)OCCC2)c1O 160290336 IVUPHADVDLUURS-UHFFFAOYSA-N 277.320 2.101 10 20 CECD C[C@H]1CCN(CCNCc2ccc3c(c2)CCCO3)C1 921805688 HQNSRACDWAQVHX-AWEZNQCLSA-N 274.408 2.443 10 20 CECD Cc1nccn1CCN[C@@H](C)c1ccc(F)cc1O 273468005 FEZIRDBPSLDXGN-JTQLQIEISA-N 263.316 2.387 10 20 CECD CCOC[C@H]1CN(Cc2cc(Cl)ccc2O)CCO1 529664263 CBJQHTZVNMZAEE-CYBMUJFWSA-N 285.771 2.283 10 20 CECD CCOc1cccc(CNC(=O)c2cccc(O)c2O)c1 186950682 HBUHMDMEEUSCHS-UHFFFAOYSA-N 287.315 2.427 10 20 CECD COc1cccc(CNc2ccc(CC(N)=O)cc2)c1O 37074931 YEFURJCAVCURDZ-UHFFFAOYSA-N 286.331 2.041 10 20 CECD CCN(CC)c1ccc(CNC[C@@]2(O)CCO[C@@H]2C)cc1 227975315 YQLWHSWYEOUZFQ-PBHICJAKSA-N 292.423 2.162 10 20 CECD CC[C@]1(C(=O)O)CCCN(Cc2ccccc2O)C1 86784434 YLWSWBARFSRVGK-HNNXBMFYSA-N 263.337 2.469 10 20 CECD COc1cc(Cl)cc(CN(C)CCN(C)C)c1O 229120898 ZJSPZCZGLSEEIL-UHFFFAOYSA-N 272.776 2.048 10 20 CECD CC(=O)OC1CCN(Cc2ccc(N(C)C)cc2)CC1 93453698 BBWZDYJBPGDWIJ-UHFFFAOYSA-N 276.380 2.280 10 20 CECD C[C@@H]1OCC[C@]12CN(Cc1c(O)cccc1Cl)CCO2 279745845 XZBIFOWSHVFIRA-NHYWBVRUSA-N 297.782 2.425 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCOCC2CC2)c1 273576829 LYKIETKQKLKYGE-NSHDSACASA-N 293.363 2.256 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@@H]1c1cccnc1 365559832 KIWYCEXORSLUQT-CYBMUJFWSA-N 284.315 2.470 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1CCO[C@@H](C2CC2)C1 274147931 DPFOTMVIRKEFJF-DZGCQCFKSA-N 290.363 2.149 10 20 CECD Cc1cc(O)c(CN2CC[S@](=O)C[C@@H](C)C2)cc1C 277442684 KEOYKJGADDLXAU-WLRWDXFRSA-N 281.421 2.209 10 20 CECD COCCN(Cc1cccnc1)Cc1ccccc1O 289445795 MNUNPNDGGPWCPH-UHFFFAOYSA-N 272.348 2.436 10 20 CECD COc1ccc(N(C)Cc2ccc(OC)nn2)c(OC)c1 283236986 UNRREYRBMVCBPQ-UHFFFAOYSA-N 289.335 2.139 10 20 CECD C[C@@H]1CSCCN(C(=O)c2c(F)ccc(O)c2O)C1 295617130 DQUZUXKOOUGTAR-QMMMGPOBSA-N 285.340 2.062 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1cc(OC)ccc1O 293808707 DYESNGWREZUUJP-GFCCVEGCSA-N 294.395 2.043 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)Cc1cnn(C)n1 290102214 WZWQKCGPZMZLQJ-UHFFFAOYSA-N 299.422 2.437 10 20 CECD Oc1cc(F)c(Cl)cc1CNCCNc1cnccn1 816556495 KVNQOUIUTYCBLV-UHFFFAOYSA-N 296.733 2.176 10 20 CECD CCCCOc1ccccc1NC[C@H](O)COC 819421045 ZYHSLZIIGIMVSN-LBPRGKRZSA-N 253.342 2.285 10 20 CECD COc1cc(CN2CC[C@H](O)C2)c(O)c(C(C)(C)C)c1 824567731 VELOZVSQRNVHTR-LBPRGKRZSA-N 279.380 2.265 10 20 CECD COCC(C)(C)N1CCN(Cc2cc(F)ccc2O)CC1 822497911 OBASTCIPGLZIJQ-UHFFFAOYSA-N 296.386 2.074 10 20 CECD Cc1ccc(O)c(CNC(=O)CN(C)CC(C)(C)C)c1 824903973 FZWPHXLWPYLCLB-UHFFFAOYSA-N 278.396 2.295 10 20 CECD CCCN(Cc1c(C)nnn1CC)c1ccc(CN)cc1 824292109 LOBVAKCHDQBYMR-UHFFFAOYSA-N 287.411 2.482 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@@H](F)C2)c1O 824571945 SMQHNQWIAHRGOD-SECBINFHSA-N 274.679 2.498 10 20 CECD COc1ccc(O)c(CNc2nc(C)cc(OC)n2)c1 735487058 ASJHJMUGEWILFM-UHFFFAOYSA-N 275.308 2.120 10 20 CECD Oc1ccc(Cl)cc1CNC[C@@H]1CCCNC1 841033380 SJSJLAYRHSZWBT-SNVBAGLBSA-N 254.761 2.135 10 20 CECD Nc1ccc(CCNC(=O)CCCc2nccs2)cc1 843342813 PBJIITALQBMJDI-UHFFFAOYSA-N 289.404 2.407 10 20 CECD C[C@@H]1C[C@@H](CN(C)c2ccc(OCC(=O)O)cc2)CCO1 846279873 OWZNDATWFSDCLT-OLZOCXBDSA-N 293.363 2.401 10 20 CECD CCc1cccc(CNC[C@H](C)CN2CCOCC2)c1O 848897079 MSYAWOPWGCQATN-AWEZNQCLSA-N 292.423 2.013 10 20 CECD COc1cc(O)c(CN2CCC[C@@H](CO)[C@@H]2C)cc1OC 840979895 VKSDWLJPABONDV-RYUDHWBXSA-N 295.379 2.002 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C(=O)O)[C@@H]2C)c1O 846283360 DQOBBXRMGJFGSQ-QPUJVOFHSA-N 295.310 2.029 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)Nc1ccc(N)cc1 841299172 VUDKAOLELHYZIY-CHWSQXEVSA-N 263.341 2.348 10 20 CECD CO[C@@H]1[C@@H](C)[C@@H](NC(=O)Nc2ccc(N)cc2)C1(C)C 841296843 ZTORSGNBAVXYGX-ZWKOPEQDSA-N 277.368 2.450 10 20 CECD CCOc1ccc(O)c(CNCC(N)(CC)CC)c1 841031443 UGPXMPLLXXZWJN-UHFFFAOYSA-N 266.385 2.398 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](C)c1cc(C)ccc1O 756775460 QPHDNDCCRQMSAI-SCRDCRAPSA-N 276.380 2.266 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1CC1=CCCC1 853086035 GBFRXZIJTZZPCT-UHFFFAOYSA-N 286.331 2.267 10 20 CECD CCOc1cccc(CN2C[C@H]3CCC[C@@]3(N)C2)c1O 857226154 GARGZGROZNAPFC-CZUORRHYSA-N 276.380 2.104 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H](C)c2csnn2)c1 858543767 WKVINDJMTUOMCV-SECBINFHSA-N 292.364 2.113 10 20 CECD CC[C@](C)(CC(=O)OC)NCc1cc(F)ccc1O 757919999 OEYPFFVGKIBKBU-CQSZACIVSA-N 269.316 2.353 10 20 CECD C[C@H](NC(=O)N[C@H](C)c1ccccc1O)[C@@H]1CCOC1 868314702 VVTNCRLILHJSNY-QJPTWQEYSA-N 278.352 2.177 10 20 CECD C[C@@H](CCN(C)C)NC(=O)N[C@H](C)c1ccccc1O 868366660 TZMTXBADJHSHBC-NWDGAFQWSA-N 279.384 2.093 10 20 CECD CCOc1ccc(N2CCN(C(=O)C(C)(C)F)CC2)cc1 1116442423 WGZYLGITUCOTGV-UHFFFAOYSA-N 294.370 2.482 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2nnc(C)c(C)n2)c1 775467334 GATUVUGIMWLEMQ-SNVBAGLBSA-N 274.324 2.376 10 20 CECD CC[C@@H](C)NC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 775830164 DXOPCCZSOYDGRT-CHWSQXEVSA-N 277.412 2.318 10 20 CECD OC1CCN(c2ccc(CNC3CC=CC3)cc2)CC1 877092912 AJHMXQOQWSQSKD-UHFFFAOYSA-N 272.392 2.456 10 20 CECD CCCN(Cc1ccccc1O)[C@H](C(=O)O)C1CC1 873640906 LHYPSPZJLYWUPR-AWEZNQCLSA-N 263.337 2.467 10 20 CECD CC(C)N1C[C@@H](N[C@H](C)c2c(O)cccc2F)CC1=O 886549066 BBASFAPGQLBFSH-MNOVXSKESA-N 280.343 2.191 10 20 CECD Cc1ccc(C(=O)N2CC[C@H](C(F)(F)F)C2)c(O)c1O 888015272 IAJBXGWRVXQTPG-QMMMGPOBSA-N 289.253 2.431 10 20 CECD C[C@@H](O)[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 780891917 CNROCUNZDTVTPT-HIFRSBDPSA-N 262.397 2.345 10 20 CECD COc1ccc(CNCCNC(=O)C2CCC2)cc1C 1122461836 KZXKLVOREZZPDR-UHFFFAOYSA-N 276.380 2.010 10 20 CECD C[C@@](O)(CC(=O)NCc1ccccc1O)c1ccccc1 780983001 ALPRKULXLDWBRY-QGZVFWFLSA-N 285.343 2.306 10 20 CECD CCOC(=O)N1CC[C@@H](N[C@H](C)c2c(O)cccc2F)C1 886594982 YFLNAKUOHLKVPZ-GHMZBOCLSA-N 296.342 2.413 10 20 CECD C[C@@H]1C[C@H](NC[C@@]2(O)CCO[C@@H]2C)c2c(O)ccc(F)c21 788623265 KNKPCVNYBWEDPA-ZEQKQHQNSA-N 295.354 2.209 10 20 CECD Cc1cc(O)c(CN2[C@@H](C)[C@@H](C)NC(=O)[C@H]2C)cc1C 895117744 WAYHFRCQWAUNNZ-FRRDWIJNSA-N 276.380 2.106 10 20 CECD COc1cc(C)cc(CNCc2cc(C)ncn2)c1O 894366036 KFDNAHKOYXYPEJ-UHFFFAOYSA-N 273.336 2.097 10 20 CECD COc1ccc(CNCc2cc(C)ccc2O)cn1 71406716 UIAZWULKKKPPSH-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1ccc(CNC(=O)NCCC2(C)CC2)c(O)c1 793093661 RBFBDAAOCJMUQO-UHFFFAOYSA-N 278.352 2.390 10 20 CECD C[C@@H]1C[C@H](NCc2c(O)cccc2Br)CO1 706835613 CEMZIDMGYNCVSM-BDAKNGLRSA-N 286.169 2.422 10 20 CECD CC[C@H](O)CCNCc1c(O)cccc1Br 706875072 MCFGTKOOHQYLHW-VIFPVBQESA-N 288.185 2.405 10 20 CECD CCc1nsc(NCc2ccc(OC)cc2O)n1 795285650 TVNKSEHSQNBGSU-UHFFFAOYSA-N 265.338 2.427 10 20 CECD CN(C(=O)c1n[nH]c2c1CCCC2)c1ccc(N)cc1 713783893 AOBLUHAIVJIDKH-UHFFFAOYSA-N 270.336 2.147 10 20 CECD CCC(CC)(CO)NCc1cc(C)cc(OC)c1O 1333706342 YSNSSNDEJLBHID-UHFFFAOYSA-N 267.369 2.350 10 20 CECD CC(C)Cn1cccc(C(=O)N(C)c2ccc(N)cc2)c1=O 1263168183 GFQSMBNWWWZPOU-UHFFFAOYSA-N 299.374 2.363 10 20 CECD COC1(CNC(=O)NCc2ccc(N)cc2)CCCCC1 1353388570 DWXBHFLIVRGSFH-UHFFFAOYSA-N 291.395 2.417 10 20 CECD CN(CC[C@@H]1CCCOC1)c1ccc(OCC(=O)O)cc1 1777056163 MELYDUJXGWWMTM-ZDUSSCGKSA-N 293.363 2.403 10 20 CECD CN1C(=O)c2ccccc2N[C@H]1c1cccc(O)c1O 15249445 BRKWLQUCFGRUCV-CQSZACIVSA-N 270.288 2.294 10 20 CECD CN(Cc1ccc(O)cc1)C(=O)c1cccc(O)c1O 126574000 FFQXHHJGXULQII-UHFFFAOYSA-N 273.288 2.076 10 20 CECD CCn1cnc(C(=O)N[C@H](C)c2ccccc2O)c1 827955719 DJKAGVVDCNPFIC-SNVBAGLBSA-N 259.309 2.100 10 20 CECD C[C@H](N[C@@H](C)[C@H](O)C(F)(F)F)c1ccc(F)cc1O 866463181 KQJQQKOABFKFSC-HFJPGXAFSA-N 281.249 2.494 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCCOCC1 708437712 SUZKZQVAUNVTGG-NSHDSACASA-N 257.280 2.329 10 20 CECD COc1ccc(CNCC2(OC)CCCC2)c(O)c1 382277303 QQDLWYANJOTXMJ-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Oc1c(Cl)cccc1CNCC1CC2(C1)OCCO2 896912467 WTMXIAYOYQRZLS-UHFFFAOYSA-N 283.755 2.288 10 20 CECD COCCCC(=O)N[C@@H](C)c1cc(OC)ccc1O 103529617 CUHCNECGEWLUTD-JTQLQIEISA-N 267.325 2.005 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccnc2S)cc1 10433416 QESWTGSWWXHXLZ-UHFFFAOYSA-N 287.388 2.366 10 20 CECD COc1ccc(O)c(CNC(=O)Cc2ccc(F)cc2)c1 114543221 ULQQZUXPBZIOMR-UHFFFAOYSA-N 289.306 2.399 10 20 CECD Cc1cccc(C(=O)NCc2ccc(N(C)C)cc2)n1 25476593 JKLSHUZAONNRKZ-UHFFFAOYSA-N 269.348 2.386 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(S(C)(=O)=O)CCC2)c1 281236568 VAVZKDVZAIVZLM-LBPRGKRZSA-N 297.420 2.319 10 20 CECD O=C(C[C@H]1C=CCCC1)NCc1ccc(O)c(O)c1 186898111 FHSRWYYNENNUKB-NSHDSACASA-N 261.321 2.460 10 20 CECD Cc1nn(C)c2ncc(NC(=O)Cc3ccc(N)cc3)cc12 237856320 CFLCXTSBDZOXCX-UHFFFAOYSA-N 295.346 2.040 10 20 CECD CCN(CC(F)(F)F)C(=O)c1ccc(C)c(O)c1O 272709384 CHPMFXRPWOFSTC-UHFFFAOYSA-N 277.242 2.431 10 20 CECD COc1cc(O)c(CN[C@H]2CCCSC2)cc1OC 271804221 JMPZCQYAYOUKEX-NSHDSACASA-N 283.393 2.395 10 20 CECD CNC(=O)CC[C@H]1CCCCN1Cc1ccccc1O 289518586 HBAYKDMENCZNLE-CQSZACIVSA-N 276.380 2.273 10 20 CECD COc1ccc(O)c(CN2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4OC)c1 289774518 RJILRDVHMCGJOU-JBAWGBACSA-N 289.375 2.256 10 20 CECD CO[C@@](C)(C(=O)NCc1ccc(N(C)C)cc1)C1CC1 290988459 RICAHDRIPIDQPD-MRXNPFEDSA-N 276.380 2.184 10 20 CECD Nc1ccc(Cc2nc(C(=O)OCCF)cs2)cc1 803429107 WDZIKHQJXLMKRV-UHFFFAOYSA-N 280.324 2.442 10 20 CECD CCCC(=O)CSc1ncc(C(=O)OC)s1 295334051 PHGWDXRGCLAABJ-UHFFFAOYSA-N 259.352 2.391 10 20 CECD CC1(CN[C@H]2CCc3cccc(O)c32)CCNCC1 817965252 RZDPPBZHABRWCW-ZDUSSCGKSA-N 260.381 2.359 10 20 CECD CCOc1cccc(CN2C[C@@H](C)C[C@H](CO)C2)c1O 817413146 USJZTTXQUZTGMT-STQMWFEESA-N 279.380 2.241 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)N(C)C 820877950 FTYVKLUFAHMGGW-GFCCVEGCSA-N 264.369 2.081 10 20 CECD CCOc1ccc(CN[C@@H]2CCC[C@@H]2CO)c(O)c1 825183407 MTOJXZPVGCJCNM-TZMCWYRMSA-N 265.353 2.042 10 20 CECD Cc1cc(O)c(CNC[C@@H](C)N(C)C)cc1Cl 825425549 BTFZGMROEJHVOG-SNVBAGLBSA-N 256.777 2.394 10 20 CECD CC[C@H](NCc1ccc2ccccc2c1O)C(=O)NC 825316241 MMXSLNVNMMRAPP-AWEZNQCLSA-N 272.348 2.160 10 20 CECD COCCOC[C@H](C)N[C@H]1CCc2cccc(O)c21 834667879 CPLIKRGHCCOIDC-AAEUAGOBSA-N 265.353 2.021 10 20 CECD CC[C@H](NC[C@H]1CCN1C)c1ccc(F)cc1O 903319418 ZABRAHWOOAGJOY-YPMHNXCESA-N 252.333 2.276 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@@H](C2CC2)[C@@H]1C1CC1 836884444 FWGULYOLKMTTJQ-JSGCOSHPSA-N 273.332 2.358 10 20 CECD Oc1cccc2c1[C@@H](N[C@H]1CCc3n[nH]cc3C1)CC2 834680701 GFKZBGWIPRITTR-JSGCOSHPSA-N 269.348 2.250 10 20 CECD CN(c1ccc(CNC(=O)CCO)cc1)C1CCCCC1 902825893 DQPYVYRUTKSBEE-UHFFFAOYSA-N 290.407 2.454 10 20 CECD O=C(O)CN(Cc1ccccc1O)C(=O)CCC1CCC1 911491937 WPCGMCFLXZEZAE-UHFFFAOYSA-N 291.347 2.386 10 20 CECD COc1ccc(N2CCCN(C[C@H]3CCOC3)CC2)cc1 917087832 JUYDXYGKPCEAJE-OAHLLOKOSA-N 290.407 2.244 10 20 CECD CCC(=O)N1CCC(NCc2cc(C)ccc2O)CC1 742218796 ILXQNSQVZCBZDK-UHFFFAOYSA-N 276.380 2.191 10 20 CECD COCC1(N[C@H](C)c2cccc(OC)c2O)CC1 846160516 PLVYQTFQGGWTOM-SNVBAGLBSA-N 251.326 2.230 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C)[C@H]1CO 840938480 GJRBAUYTKMJQGW-MLGOLLRUSA-N 262.397 2.264 10 20 CECD CC(C)c1nc([C@@H](C)NC(=O)Nc2ccc(N)cc2)n[nH]1 841297274 DJELUTQPNMMMJA-SECBINFHSA-N 288.355 2.393 10 20 CECD Cc1cccnc1CNC(=O)NCCc1ccc(N)cc1 841791115 NKYWIPRQGRAVEZ-UHFFFAOYSA-N 284.363 2.014 10 20 CECD COc1cc(CN2C[C@@H]3[C@H](C2)C3(F)F)c(O)cc1C 844758234 SXRKVHZPQYSMAF-PHIMTYICSA-N 269.291 2.406 10 20 CECD O=C(CC1CCOCC1)NCc1cc(Cl)ccc1O 846474720 AUXPMXPFPANRNB-UHFFFAOYSA-N 283.755 2.479 10 20 CECD CCN(C(=O)/C=C/c1scnc1C)c1cnn(C)c1 848343976 VSPVRRURGYEPBG-AATRIKPKSA-N 276.365 2.251 10 20 CECD CC[C@H](CCO)N[C@@H](C)c1cccc(OC)c1O 846145520 OGOXGPFQPBBZAZ-WDEREUQCSA-N 253.342 2.212 10 20 CECD CC[C@H](CN1CCOCC1)NCc1cc(C)c(C)cc1O 922590374 ROUGJXOFGLNDSD-MRXNPFEDSA-N 292.423 2.209 10 20 CECD C[C@@H]1C[C@@H](NCCN2CCC2)c2c(O)ccc(F)c21 756769928 RVRHNZKEOVTUJO-ZYHUDNBSSA-N 264.344 2.375 10 20 CECD Cc1cc(CN2CC[C@@H](N)C[C@@H]2C)ccc1N(C)C 923392224 ITRCPSYPQKBMEU-DZGCQCFKSA-N 261.413 2.373 10 20 CECD CCC1(C(=O)NCc2ccc3c(c2)CCCN3C)COC1 755249949 FQHURBWCZNVGFA-UHFFFAOYSA-N 288.391 2.112 10 20 CECD Cc1ccc(O)c(CNC(=O)CCc2ccncc2)c1 862760367 QGWBBKIEHGEAJX-UHFFFAOYSA-N 270.332 2.345 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CC12CCOCC2)c1ccccc1O 868677016 VYBBAMHMRCOFFE-BXUZGUMPSA-N 290.363 2.322 10 20 CECD CC1=C(C(=O)NCc2ccc(O)c(O)c2)CCN1C(C)C 934944171 PJXDIHFKFOZEMW-UHFFFAOYSA-N 290.363 2.102 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NCCc2cnc[nH]2)s1 1537963121 VIZFHVPLZUNDPQ-UHFFFAOYSA-N 276.325 2.254 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H]3CNC[C@H]3C2)cc1 770395626 TVYBNTLTEOGYHS-HOTGVXAUSA-N 273.424 2.184 10 20 CECD C[C@@H]1OCC[C@@H]1CN(C)c1ccc(OCC(=O)O)cc1 872161081 RVKZHYPEJKYRQY-NWDGAFQWSA-N 279.336 2.011 10 20 CECD Cc1ccc([C@@H](O)CNCc2c(C)cccc2O)o1 877060302 WTKAUKVAOKOWLS-AWEZNQCLSA-N 261.321 2.425 10 20 CECD Cc1ccc(CN2CCC(N3CCCC3=O)CC2)c(O)c1 876690887 UOOKBNSFZXJRHT-UHFFFAOYSA-N 288.391 2.287 10 20 CECD CN(Cc1cccc(O)c1)C(=O)/C=C/c1ccc(O)c(O)c1 779530860 IGBCJRGCZKJMCT-SOFGYWHQSA-N 299.326 2.475 10 20 CECD CC(C)NC(=O)CCN[C@H](C)c1c(O)cccc1F 886500067 DPOJMTACSBAWIL-SNVBAGLBSA-N 268.332 2.097 10 20 CECD Cc1cc(Br)cc([C@@H](C)N[C@H](C)CO)c1O 187049359 WSIIXGHUUHXWOV-RKDXNWHRSA-N 288.185 2.495 10 20 CECD C[S@](=O)C1(CNCc2c(O)ccc(Cl)c2F)CC1 799348787 PKMAPPSGSCJDPH-SFHVURJKSA-N 291.775 2.185 10 20 CECD Cc1cc(C)c(C(=O)O)cc1/C=C1\SC(=S)NC1=O 794928581 YDGGUVOYMKAMFJ-YHYXMXQVSA-N 293.369 2.490 10 20 CECD CCN1CCC[C@H]1CNCc1cc(F)cc(F)c1O 708504699 UILJPHKCGXGBGI-LBPRGKRZSA-N 270.323 2.244 10 20 CECD CN(CCO[C@H]1CCCCO1)Cc1ccccc1O 193071377 CZNNTZZRGNMYHN-HNNXBMFYSA-N 265.353 2.367 10 20 CECD Cc1cccc(CNc2ccc(-n3cncn3)cn2)c1O 792193275 UQMKXCOHKCCFQN-UHFFFAOYSA-N 281.319 2.288 10 20 CECD CN(Cc1nc(C(=O)O)cs1)Cc1ccccc1O 1606175922 ZBZCJSUNYQTCNM-UHFFFAOYSA-N 278.333 2.179 10 20 CECD Cc1noc([C@H]2CCCN(Cc3ccc(N)cc3)C2)n1 1335285486 ODQDWLZOMBDDTH-ZDUSSCGKSA-N 272.352 2.340 10 20 CECD Cc1ncc(C(=O)Nc2ccc(N)cc2)c(C2CC2)n1 1332394179 YOEIUGDGYUALHU-UHFFFAOYSA-N 268.320 2.497 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@H]1F 1346245385 DBLZGDFABAMUEC-CHWSQXEVSA-N 250.317 2.069 10 20 CECD CCCN(CC)CCNC(=O)Nc1ccc(N)cc1 220266621 QMYPKEWKLVDNHB-UHFFFAOYSA-N 264.373 2.122 10 20 CECD C[C@H](C(=O)O)N(Cc1cc(F)ccc1O)C1CCC1 1609641983 YURPIISLQZOYDK-SECBINFHSA-N 267.300 2.359 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2CCCN2C2CCCC2)cc1 1580443642 VFZQCSNBFOHSCR-INIZCTEOSA-N 287.407 2.292 10 20 CECD C[C@@H](CC(=O)O)NCc1c(O)cccc1Br 1776401764 ZMXYFFKBJYTTOU-ZETCQYMHSA-N 288.141 2.108 10 20 CECD Cc1cccc(OCC(=O)NCc2ccc(O)c(O)c2)c1 158934041 IINVYQYYVRMXIH-UHFFFAOYSA-N 287.315 2.101 10 20 CECD C[C@@H](CC[S@@](C)=O)NCc1ccc2c(c1)CCCO2 921831469 WIYVHAMWXUXNGI-HXPMCKFVSA-N 281.421 2.258 10 20 CECD COCCOCCCNCc1cc(Cl)ccc1O 20192298 PZRASRYRYZUDRN-UHFFFAOYSA-N 273.760 2.188 10 20 CECD C[C@@H](Nc1c([N+](=O)[O-])ncn1C)c1ccccc1O 26707268 OSDFERMMTGOUMV-MRVPVSSYSA-N 262.269 2.207 10 20 CECD CC(=O)c1cc(F)cc(CN2CCOCC23CC3)c1O 801980801 AXRJPPFXYOZIJA-UHFFFAOYSA-N 279.311 2.099 10 20 CECD CC(C)[C@@H](CC(=O)O)NCc1ccc(N(C)C)cc1 4636436 CIRVETXWOUOFLB-CQSZACIVSA-N 264.369 2.342 10 20 CECD c1cc(N2CCOCC2)ccc1CNC[C@@H]1CCCOC1 38044458 SIJHLOKGYHEZKR-INIZCTEOSA-N 290.407 2.039 10 20 CECD O=C1CN(C(=O)/C=C\c2cccnc2)c2ccccc2N1 214613946 WCMOBVSTHQXYGH-FPLPWBNLSA-N 279.299 2.080 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)c(O)c1 185318014 PXPFIGTYLHINSK-AAEUAGOBSA-N 286.379 2.266 10 20 CECD COCc1cccc(CNC(=O)c2cccc(O)c2O)c1 186946345 BAOVHRSOGMEFLF-UHFFFAOYSA-N 287.315 2.174 10 20 CECD CCCCN(CCO)Cc1cc(OC)c(OC)cc1O 183477083 DUVPGHXOLNVERI-UHFFFAOYSA-N 283.368 2.004 10 20 CECD CO[C@]1(C)C[C@@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 193131129 MNALCRXRBAJENH-MLGOLLRUSA-N 293.363 2.373 10 20 CECD C[C@H]1CN(C)CC[C@H]1N(C)Cc1cc(F)ccc1O 290599285 VUXCMXPXPHQSAF-SMDDNHRTSA-N 266.360 2.303 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(N)cc2)n[nH]1 236606851 PVUOIBWGPNDZRX-UHFFFAOYSA-N 272.352 2.088 10 20 CECD C[C@@H](CC(=O)Nc1ccc(N)cc1)[C@H]1CCCNC1 237596682 FKDRRVDWCAYFNR-RYUDHWBXSA-N 261.369 2.233 10 20 CECD COC(=O)CCN(Cc1cccc(OC)c1O)C(C)C 93384032 NDEKJQCWXBLKER-UHFFFAOYSA-N 281.352 2.174 10 20 CECD O=C(CSc1ccncc1)c1ccc(O)c(O)c1 94614592 KNRHTEQRNUCDMQ-UHFFFAOYSA-N 261.302 2.468 10 20 CECD Cc1noc(C)c1CCNC(=O)NCc1ccccc1O 264464221 SGINMBINUURHRG-UHFFFAOYSA-N 289.335 2.039 10 20 CECD COc1ccc(N(C)CCCc2nc(C)no2)c(OC)c1 269760223 AWGIRDGZFWXWRC-UHFFFAOYSA-N 291.351 2.464 10 20 CECD CN1CC[C@@H]2CCN(Cc3ccc(N(C)C)c(F)c3)[C@H]2C1 272661924 ROGNXQDOMWYEJP-PBHICJAKSA-N 291.414 2.418 10 20 CECD C[C@@H](N[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)cc1O 370399376 UCGWHZOQXRZIEW-BXKDBHETSA-N 275.327 2.463 10 20 CECD CN(Cc1ccccc1O)C(=O)OC[C@H]1CCCO1 288267410 UJSXYTADTJTBAR-GFCCVEGCSA-N 265.309 2.140 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C)O[C@@]3(CCOC3)C2)cc1C 280390745 WWBAUHFHDZTODN-PBHICJAKSA-N 291.391 2.389 10 20 CECD CCOC1CC(N(C)C(=O)/C=C/c2ccc(O)c(O)c2)C1 293628782 ZGZQPSSTHHVSGV-FNORWQNLSA-N 291.347 2.137 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1cccnc1 808094373 MFWOSQYSHUGJFO-UHFFFAOYSA-N 291.347 2.132 10 20 CECD COc1ccc(O)c(CNC(=O)c2occ3c2CCC3)c1 802783308 MYJGXGGVTHNFQX-UHFFFAOYSA-N 287.315 2.413 10 20 CECD Cc1cc(Br)cc([C@H](C)N[C@H]2CCNC2)c1O 817944989 QUYBGIWGOTXVMP-ONGXEEELSA-N 299.212 2.476 10 20 CECD CC[C@@H](NC[C@@H]1C[C@H](F)CN1)c1ccc(N(C)C)cc1 817976818 UZGZHTUFOKOKMT-OFQRWUPVSA-N 279.403 2.493 10 20 CECD CC(C)[C@H](NCc1ccccc1O)[C@H](O)C(F)(F)F 813328868 VDIOOMPNJONGAZ-RYUDHWBXSA-N 277.286 2.430 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1ccc(N(C)C)c(C)c1 815078192 QWTJRBLLZKYAOE-INIZCTEOSA-N 289.423 2.162 10 20 CECD CCOc1ccc(CN2CCC(C(=O)O)CC2)c(O)c1 820387006 JFZRMULETZOLCF-UHFFFAOYSA-N 279.336 2.088 10 20 CECD CC[C@@H](NCc1ccc2ccccc2c1O)C(=O)NC 825316242 MMXSLNVNMMRAPP-CQSZACIVSA-N 272.348 2.160 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CCS[C@@H]2C)c(O)c1 827649550 JJBSSMHJZYSWHG-SKDRFNHKSA-N 296.392 2.094 10 20 CECD COC(=O)Cc1ccc(NC(=O)c2cc(O)cs2)cc1 732266377 AHMMACSBRGAMAL-UHFFFAOYSA-N 291.328 2.422 10 20 CECD COc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 588403514 MPOZJLPXPAHUAA-UTCJRWHESA-N 286.287 2.153 10 20 CECD CC[C@@](C)(CNC(=O)N(C)Cc1ccccc1O)OC 838661177 KHCPWJKMQIDBHT-HNNXBMFYSA-N 280.368 2.349 10 20 CECD CC[C@H](C[C@@H](C)CO)NCc1cc([N+](=O)[O-])ccc1O 743500352 XZRLHXGUFNIEQD-ZYHUDNBSSA-N 282.340 2.187 10 20 CECD CCOc1cccc(CNC[C@@H]2CCCCN2)c1O 841033373 SESBBQDESRCZGS-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD CCOc1ccc(CN2CC[C@H](C)[C@@H](CN)C2)c(O)c1 841101048 NHOSMKBNFDUDST-JSGCOSHPSA-N 278.396 2.208 10 20 CECD COCC1(CC(=O)NCc2ccc(N(C)C)cc2C)CC1 843550414 KHSKWQYDMKOTRD-UHFFFAOYSA-N 290.407 2.494 10 20 CECD CN(C)c1ccc([C@H]2NC3(CCCC3)C(=O)N2C)cc1F 742439834 OLVQFCRAROWXKW-AWEZNQCLSA-N 291.370 2.265 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H]2[C@H](C)NCC[C@H]2C)c1O 842476089 GHKPCWVEZFYJPI-HFBDOXOYSA-N 294.370 2.210 10 20 CECD CN(C)c1ccc(CN2[C@H]3CCNC[C@H]2CC3)cc1 843057968 JDIJIKPRQMSKDR-HZPDHXFCSA-N 259.397 2.079 10 20 CECD CCc1cccc(CN2CC(OC(=O)NC(C)C)C2)c1O 848915934 BVAOMSXKHCTQJW-UHFFFAOYSA-N 292.379 2.273 10 20 CECD COC(=O)[C@H](CNC(=O)Nc1ccc(N)cc1)CC(C)C 841300871 VAILNTJTYZFSDZ-NSHDSACASA-N 293.367 2.226 10 20 CECD CC[C@@H](COC)NCc1ccc(N2CCC(O)CC2)cc1 850566914 UEHFWTYCYCUFSX-HNNXBMFYSA-N 292.423 2.162 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)[C@H]2CN(C)CCO2)c(O)c1 756762278 XEOOAAULNHJHKS-HEHGZKQESA-N 278.396 2.070 10 20 CECD CCOc1ccc(CN[C@@H](CO)CC2CC2)c(O)c1 754833855 LYTIUGOKDKTNHX-CYBMUJFWSA-N 265.353 2.042 10 20 CECD CC[C@H](N[C@H](C)C(=O)N(C)OC)c1ccc(N(C)C)cc1 858586725 JTOREOPWOQPTOA-DOMZBBRYSA-N 293.411 2.202 10 20 CECD CN(C)c1cc(F)c(CNCc2cnn(C)c2)cc1F 858106626 NCFUGRTZHDPXID-UHFFFAOYSA-N 280.322 2.054 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H]2C[C@H](N)C2)cc1 852857308 OXFGNSAVCBWMOI-SHTZXODSSA-N 289.423 2.229 10 20 CECD C[C@H](N[C@H](CCO)C1CC1)c1cc([N+](=O)[O-])ccc1O 756740786 UHRQBLJSJVFNQQ-TVQRCGJNSA-N 280.324 2.112 10 20 CECD CN(C)c1cc(F)c(CN2CC3(CCOC3)C2)cc1F 862380215 CDCFLZRPAGGEGJ-UHFFFAOYSA-N 282.334 2.253 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccc3[nH]ncc23)c1 769540255 IWEXWQYWAGUKNA-UHFFFAOYSA-N 297.314 2.207 10 20 CECD CC(C)OCCCN(C)Cc1cc2c(cc1O)OC[C@@H]2O 768449504 ZWJZDNIZUXQDBP-HNNXBMFYSA-N 295.379 2.065 10 20 CECD C[C@H](NC(=O)NCCC(C)(C)C(=O)O)c1ccccc1O 874405573 RBLMYXXXGPJCFX-JTQLQIEISA-N 294.351 2.253 10 20 CECD Cc1nnc(NCc2ccc(N3CC=CC3)cc2)nc1C 775479860 KDVQLKAYTVHZFH-UHFFFAOYSA-N 281.363 2.477 10 20 CECD C[C@H]1C[C@@H](C)CN1C(=O)/C=C\c1ccc(O)c(O)c1 779521825 UZWPBZHNUJUPHH-FPNIURKZSA-N 261.321 2.368 10 20 CECD COc1cccc([C@@H](C)N[C@H](CCO)C(F)(F)F)c1O 886803703 MFFQJJNFKSHLPG-LDYMZIIASA-N 293.285 2.365 10 20 CECD COCCOC(=O)NCc1ccc(N2CCCC2)cc1 884933364 YNZCDMJIPGWKJI-UHFFFAOYSA-N 278.352 2.159 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@H](C)c1c(O)cccc1F 886627149 UTAPDQWLLBVQIM-NXEZZACHSA-N 268.332 2.095 10 20 CECD C[C@H](N[C@H]1CC[C@H](O)CC1)c1c(O)cccc1F 886554717 AURVVORFDSDSRN-DCAQKATOSA-N 253.317 2.485 10 20 CECD Oc1cc2c(cc1O)NCC2 92278760 ULSCUQBZBSXFBT-GFCCVEGCSA-N 151.165 1.066 10 20 CECD C[C@H]1C[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)CO1 784441299 DSBLHVWCISLOGP-AAEUAGOBSA-N 289.375 2.312 10 20 CECD COc1cccc(O)c1CNCc1nc(C(F)F)no1 895727901 VKGHZSUOFLSEGL-UHFFFAOYSA-N 285.250 2.011 10 20 CECD COc1ccc(CN[C@@H](C)COCC2CC2)c(O)c1OC 895168685 ARSHHQJHPPHJNT-NSHDSACASA-N 295.379 2.314 10 20 CECD COCC1(C)CN(Cc2cc(F)cc(F)c2O)C1 894980730 YWFSFPAKOBQIPW-UHFFFAOYSA-N 257.280 2.139 10 20 CECD CCN1CCC[C@@H](NCc2cc(Cl)ccc2O)C1=O 722351312 AXKFSXVRVWJJQH-GFCCVEGCSA-N 282.771 2.146 10 20 CECD Cc1cccc(F)c1CNC(=O)c1cccc(O)c1O 790793719 HODJLOVZZFKXME-UHFFFAOYSA-N 275.279 2.475 10 20 CECD COC[C@@H](C)NCc1c(O)cccc1Br 706830376 TZEVZJMSQQRTLI-MRVPVSSYSA-N 274.158 2.279 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](CC(=O)O)C2)c1 86757531 PSDSHORCEUBJEU-LLVKDONJSA-N 279.336 2.088 10 20 CECD C[C@@H]1CC(F)(F)CCN1C(=O)Cc1ccc(N)cc1 697154604 GMDTZDVJJJVHAI-SNVBAGLBSA-N 268.307 2.458 10 20 CECD Cc1ccc(N2CC=C(CCNC(=O)C(C)C)CC2)nn1 1089807878 YLVJHUFRIROPJO-UHFFFAOYSA-N 288.395 2.084 10 20 CECD COc1ccc(CN[C@@H]2CC[C@H](CNC(C)=O)C2)cc1C 1086628661 RWMSPJOIIFMCJF-JKSUJKDBSA-N 290.407 2.398 10 20 CECD Cc1ccc(CN2C[C@@H](C(=O)O)CC[C@H]2C)c(O)c1 1605273134 JBRPNHLRZIBQOJ-YPMHNXCESA-N 263.337 2.386 10 20 CECD CCc1csc(CC(=O)NCc2ccc(N)cc2)n1 1342700542 SIUCWXZUVJHOKN-UHFFFAOYSA-N 275.377 2.147 10 20 CECD Cc1cccc(CNCc2ccc(C(=O)O)o2)c1O 1600532423 OZFYHYFDVNKTJG-UHFFFAOYSA-N 261.277 2.282 10 20 CECD O=C(O)c1ccc(CNC(=O)c2cc(O)cs2)c(F)c1 1602342152 VFDBHVNOVSTUSD-UHFFFAOYSA-N 295.291 2.221 10 20 CECD CC(C)c1ccc(O)c(CN2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)c1 1604002925 SQYKUMDBEUNFFT-NHAGDIPZSA-N 275.348 2.278 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 228929777 ILNVPJBTZVLAEC-OLZOCXBDSA-N 277.412 2.316 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccc3n2CCN[C@H]3C)c1 1579723883 UARPHJRUTFXFSX-LBPRGKRZSA-N 299.374 2.096 10 20 CECD COc1cc(C)c(CN2CCC[C@H](CC(=O)O)C2)c(O)c1 1594054032 ADXNXBDMMLARMW-GFCCVEGCSA-N 293.363 2.396 10 20 CECD CC[C@@H](N[C@H](C)CN1CCN(C)CC1)c1ccccc1O 155740165 JECCOCMWKMKBRY-GDBMZVCRSA-N 291.439 2.069 10 20 CECD Cc1ccc(CN2CCCN3CCC[C@H]3C2)c(O)c1 1119295170 DWIGSWFOXGZBPR-HNNXBMFYSA-N 260.381 2.371 10 20 CECD CCOCCCNC(=O)N[C@H](C)c1ccccc1O 867982723 VDBDHDCJMGQOFY-LLVKDONJSA-N 266.341 2.179 10 20 CECD O=C(CSc1nccs1)NOCc1ccccc1 45061484 NHRCAHDKDGNQLI-UHFFFAOYSA-N 280.374 2.483 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(CO)CCOCC2)c1 186149553 IKWLLMFMQSMMAC-CYBMUJFWSA-N 279.380 2.140 10 20 CECD CO[C@](C)(CNC(=O)Nc1ccc(N)cc1)C1CC1 311787226 ZPAVAIWEFFYDRJ-CQSZACIVSA-N 263.341 2.205 10 20 CECD Cc1cc(NS(=O)(=O)c2ccco2)ccc1O 783529578 KYDWGDISBSBTPY-UHFFFAOYSA-N 253.279 2.094 10 20 CECD CN1CCCc2cc(CNC(=O)c3ccc[nH]3)ccc21 57550122 OFQNIQHURVEKRY-UHFFFAOYSA-N 269.348 2.327 10 20 CECD COC[C@H](C)NC(=O)c1cc(C)n(-c2ccccn2)c1C 78585515 VZBUJWVSNUJFEY-NSHDSACASA-N 287.363 2.254 10 20 CECD CO[C@@H](C)CN(C)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 313749885 QDZSXNNLWPZLNO-STUBTGCMSA-N 294.307 2.164 10 20 CECD CCCOc1ccc(CN2CCN(C3CC3)CC2)c(O)c1 127934877 STKVCNREMRBSHA-UHFFFAOYSA-N 290.407 2.461 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccco1 180580505 VWNDLWMCOCJXIC-GQCTYLIASA-N 259.261 2.020 10 20 CECD CCOC(=O)CN(C)Cc1cc(Cl)cc(OC)c1O 184678324 YIAQEYJOEWSIAC-UHFFFAOYSA-N 287.743 2.049 10 20 CECD CCOc1cncc(NCc2cccc(OC)c2O)n1 91479379 ZWRZTMALVAYGLT-UHFFFAOYSA-N 275.308 2.202 10 20 CECD COc1cc(N2CCC[C@@H](OC)C2)c([N+](=O)[O-])cc1OC 91688615 HXCYLZWDZKSSFN-SNVBAGLBSA-N 296.323 2.227 10 20 CECD C[C@@H]1CN(C(=O)/C=C\c2cncc(F)c2)c2cccnc2O1 255438944 LYUSTINKYLALIX-DOGVGXBMSA-N 299.305 2.443 10 20 CECD C[C@@H](CNC(=O)NCc1ccccc1O)c1nccs1 273518171 QDKZMAQTOWTVPE-JTQLQIEISA-N 291.376 2.452 10 20 CECD CO[C@H]1CCC[C@H](CC(=O)NCc2ccc(O)c(O)c2)C1 279940743 OMYPOIMPFLCWAF-AAEUAGOBSA-N 293.363 2.309 10 20 CECD COc1ccc(CNC(=O)[C@@H]2COc3ccccc32)c(O)c1 373670200 QXJOZMYRAATOMG-CQSZACIVSA-N 299.326 2.193 10 20 CECD COC1(CNC(=O)c2ccc(C)c(O)c2O)CCCC1 295540338 KOBDEUNDIWWWIC-UHFFFAOYSA-N 279.336 2.095 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H]2CCCC[C@@H]2N)cc1 296698307 IBELCDYCLAHTBA-HOCLYGCPSA-N 289.423 2.276 10 20 CECD COC(=O)c1cnc(SCC(=O)OCC(C)C)s1 295432027 ZFQHPITXGOKYQI-UHFFFAOYSA-N 289.378 2.221 10 20 CECD CCOC[C@H](O)CNc1ccccc1OCC(F)F 819460618 STIKSUMGJQFLPV-SNVBAGLBSA-N 275.295 2.140 10 20 CECD C[C@@H](NC[C@H]1CC[C@H](C(N)=O)CC1)c1ccccc1O 817586206 LZCVUKMHHXWQND-JHJVBQTASA-N 276.380 2.335 10 20 CECD C[C@H](NC[C@@H]1C[C@H](F)CN1)c1cc(F)cc(F)c1O 817976502 MGNRRARZKYMJHA-HGNGGELXSA-N 274.286 2.021 10 20 CECD Cc1cccc(CN2CCC[C@@H](CC(=O)O)C2)c1O 821112200 JCHPQBXFPBKWLQ-LBPRGKRZSA-N 263.337 2.387 10 20 CECD Oc1c(CN2CCc3nn[nH]c3C2)ccc2ccccc12 827877586 QDHSHUMPGGUOMK-UHFFFAOYSA-N 280.331 2.222 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2c(O)cccc2Cl)C1 827812577 QOJMJVVESJHVGW-KYZUINATSA-N 269.728 2.087 10 20 CECD CC(C)OC1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 825765342 WIBDSGRDVCYLRG-UHFFFAOYSA-N 297.326 2.267 10 20 CECD CC1=NO[C@@](C)(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 904684407 ZVOAXAOHGMJUSE-MLGOLLRUSA-N 289.379 2.485 10 20 CECD O=C(OCc1noc(C2CC2)n1)c1cc(O)cs1 732353136 LVJYHHMMJCZDKN-UHFFFAOYSA-N 266.278 2.071 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cnsn2)c1 839113379 UHWYPZINRWSLGE-ZETCQYMHSA-N 294.336 2.135 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC(CC(N)=O)CC1 840910696 PXJHDZYIEQWTAT-UHFFFAOYSA-N 289.423 2.148 10 20 CECD CC[C@H](COC)N[C@H](C)c1cccc(OC)c1O 846147487 VUZDTHZVUJAPIQ-GHMZBOCLSA-N 253.342 2.476 10 20 CECD C[C@H](NCCNC(=O)C1CC1)c1ccc(Cl)cc1O 841744196 MUCVHFIUBMGQPD-VIFPVBQESA-N 282.771 2.222 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1ccc(N(C)C)cc1C 840910040 DOMGKQDOLHJHOG-CYBMUJFWSA-N 278.396 2.302 10 20 CECD CC(=O)c1cc(Cl)cc(CNCC2(N)CCC2)c1O 843368017 KQRWHSYXBXMNFP-UHFFFAOYSA-N 282.771 2.219 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)[C@H](C)OC)c1O 846162863 CWNGTJZJWXWUBK-DCAQKATOSA-N 253.342 2.475 10 20 CECD Nc1ccc(CC(=O)NCCOc2ccc(F)cc2)cc1 746316809 AHCDDPLLJCETDQ-UHFFFAOYSA-N 288.322 2.146 10 20 CECD CCN(CC)c1ccc(CN(C)CCNC)cc1F 843057133 CUGNWNYSYRGZMD-UHFFFAOYSA-N 267.392 2.323 10 20 CECD CN(C)c1ccc(CNC(=O)c2cncs2)cc1F 746798657 MJMAQQGPWLOTPT-UHFFFAOYSA-N 279.340 2.278 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1c(O)ccc(Cl)c1F 844936549 IKMADYTVNVKDDV-SECBINFHSA-N 275.707 2.480 10 20 CECD C[C@@]1(NC(=O)Nc2ccc(N)cc2)CCO[C@@H]1C1CC1 841295571 BLTIKVFVMHCVSZ-UKRRQHHQSA-N 275.352 2.348 10 20 CECD COc1ccc(N(C)CC(=O)NCC2CCC2)cc1 844353486 PMUMGPFXHXONET-UHFFFAOYSA-N 262.353 2.048 10 20 CECD C[C@@H](NCCN(C)CC(F)F)c1ccc(F)cc1O 858596101 AZQSCNUGBBTCBA-SECBINFHSA-N 276.302 2.379 10 20 CECD CCN(CC)C[C@H](C)NC(=O)N(C)Cc1ccccc1O 921117925 GDCBTQUKGRSXMZ-ZDUSSCGKSA-N 293.411 2.264 10 20 CECD Cc1ccc(O)c(CNC(=O)NCC[C@H]2CCCCO2)c1 858353244 JIWKQDGYSBUSJZ-CQSZACIVSA-N 292.379 2.459 10 20 CECD Cc1cc(C(=O)N[C@@H]2COC[C@H]2C)c(C)n1-c1ccccn1 928891261 FMDNBNKOEQLCOY-IAQYHMDHSA-N 299.374 2.254 10 20 CECD COc1ccc(O)c(CN(C)Cc2ccc(OC)nc2)c1 757918195 XLXQRBJSVRQKRU-UHFFFAOYSA-N 288.347 2.436 10 20 CECD COc1cccc2c1N(C(=O)/C=C/c1cn(C)cn1)CCC2 931514369 PUTCSXRGQFMRFO-CMDGGOBGSA-N 297.358 2.421 10 20 CECD C/C=C/C(=O)NCc1cccc(Br)c1O 765754281 UOYYBXPRQGTGQR-DUXPYHPUSA-N 270.126 2.347 10 20 CECD O=C(NCCc1ccc(Cl)nc1)c1cc(O)cs1 761592411 WXZGHHOKSNFAQD-UHFFFAOYSA-N 282.752 2.475 10 20 CECD CCCNC(=O)CN(CCC)Cc1c(C)cccc1O 876625586 ZEASUPWBWPUZMN-UHFFFAOYSA-N 278.396 2.439 10 20 CECD Cc1ccc(CNC[C@H]2CC(=O)N(C(C)(C)C)C2)c(O)c1 877636497 YTQZSIBNMSYXRO-CYBMUJFWSA-N 290.407 2.437 10 20 CECD CN(CC1(N(C)C)CCC1)C(=O)c1cc(O)cs1 783960243 HXEXPABFPXTWSL-UHFFFAOYSA-N 268.382 2.010 10 20 CECD Cc1cccc(O)c1CN[C@H]1CN(C2CC2)C[C@@H]1C 877094193 IAGQRVDSDZSGDE-WFASDCNBSA-N 260.381 2.273 10 20 CECD CC[C@H](C[C@H](C)CO)NCc1cc(OC)c(OC)cc1O 776220342 VTGZXYWWXGZJKT-WCQYABFASA-N 297.395 2.296 10 20 CECD CCN(C)S(=O)(=O)Nc1ccc(O)c(C(C)C)c1 882798798 DQVIXVKPXUUUFF-UHFFFAOYSA-N 272.370 2.124 10 20 CECD CSCC(C)(C)NC(=O)Cc1ccc(N)cc1 1122407822 PCVFBANFVRAXNE-UHFFFAOYSA-N 252.383 2.069 10 20 CECD CCOc1ccc(CN[C@@H](C)C[C@H](C)O)c(O)c1 782977135 BYRIHBZSDVLKOB-QWRGUYRKSA-N 253.342 2.040 10 20 CECD CN1CCN(c2ccc(CNC/C=C\Cl)cc2)CC1 898434002 REFIRKJOBKXZLL-UQCOIBPSSA-N 279.815 2.281 10 20 CECD C[C@@H](NCc1ccc(-n2cncn2)nc1)c1ccccc1O 783502608 NRJXZCMQABJGEF-GFCCVEGCSA-N 295.346 2.219 10 20 CECD COc1cc(C)cc(CNCC2(OC)CCC2)c1O 894431122 NFPBSFPXKOBXSX-UHFFFAOYSA-N 265.353 2.368 10 20 CECD Cc1cc(N(C)C)ccc1CNCC[C@@H](O)C1CC1 898197639 ICTZYVUPJLBKNH-MRXNPFEDSA-N 262.397 2.312 10 20 CECD C[C@H](NCCCCS(C)(=O)=O)c1cc(F)ccc1O 818350957 NUDJRLHRUVZRGF-JTQLQIEISA-N 289.372 2.007 10 20 CECD CN1C(=O)Cc2cc(NC(=O)c3cc(O)cs3)ccc21 791012155 LAVGUFJZJLAJBA-UHFFFAOYSA-N 288.328 2.225 10 20 CECD CCc1cccc(CN(C)[C@@H](C)C[S@](C)=O)c1O 709309431 UXZMZKNDDCWIPR-VOJFVSQTSA-N 269.410 2.153 10 20 CECD C[C@@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)n1ccnc1 1324138657 IZVNQTPYFVOMFA-OLZOCXBDSA-N 286.379 2.388 10 20 CECD C[C@]1(C(=O)NCc2cccc(O)c2O)CC=CCC1 1348047119 LVZSDMIDMROTOB-HNNXBMFYSA-N 261.321 2.460 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C1CCNCC1 1349314764 YEQCYRSEQIWQLI-UHFFFAOYSA-N 273.424 2.471 10 20 CECD COc1cc(C)cc(CNC(C)(C)CCC(=O)O)c1O 1607149245 CVYVCMGWZWLUHU-UHFFFAOYSA-N 281.352 2.442 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCC[C@H]2C(=O)O)cc1C 1610475635 HDSAJACYDADZRF-CHWSQXEVSA-N 263.337 2.352 10 20 CECD CCOc1cccc(CN[C@@H]2CCO[C@H]2C2CC2)c1O 230315199 BNADWILIVRETDL-CJNGLKHVSA-N 277.364 2.448 10 20 CECD CC[C@@]1(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CCCN1 1577195978 OOPWVIVEDKICKV-GUYCJALGSA-N 289.423 2.462 10 20 CECD CC1CC(CN[C@@H](C)c2cccc(-c3nn[nH]n3)c2O)C1 1590194176 QGXHOCRVWJNFPF-YVNMAJEFSA-N 287.367 2.269 10 20 CECD Cc1cccc(CNCCCc2cn[nH]c2C)c1O 124695892 FMAAJOPDQWPZGJ-UHFFFAOYSA-N 259.353 2.455 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC(C)(O)CC2)c1O 161196580 UQRUVAKGMKHLID-UHFFFAOYSA-N 281.327 2.081 10 20 CECD C[C@@H]1CC[C@@H](C)N1[C@H](C)C(=O)NCc1ccccc1O 263696155 NLOMJAQNUFAERQ-JHJVBQTASA-N 276.380 2.270 10 20 CECD CN1CC[C@H]1CNCc1cc(Cl)cc(Cl)c1O 712609157 OLFHSHKVTBHSPD-JTQLQIEISA-N 275.179 2.493 10 20 CECD COC[C@@]1(C)CCN(C(=O)Nc2ccc(N)cc2)C1 381729440 KUHCBHTVMMKZOF-AWEZNQCLSA-N 263.341 2.159 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](CO)C[C@@H]2CCCO2)c1 886670011 HVWFQMRGPXTXHC-MJBXVCDLSA-N 279.380 2.281 10 20 CECD Cn1cc(/C=C2\SC(NC3CCCCC3)=NC2=O)cn1 7988269 HCTBINJCSAUXPH-GHXNOFRVSA-N 290.392 2.313 10 20 CECD Cc1[nH]ncc1C(=O)NCc1ccc(N2CCCC2)cc1 63783636 JCJIHTGLHHWMFB-UHFFFAOYSA-N 284.363 2.248 10 20 CECD CO[C@@H]1CCCN(C(=O)NCc2ccc(N(C)C)cc2)C1 76406596 MUBNVQOCQYABEU-OAHLLOKOSA-N 291.395 2.073 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1C=CCCC1 180859902 AYMYFSCYLVNGQS-CRALRDPISA-N 259.305 2.336 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(Cl)n1 156655131 ZAHHORIMAHDOLC-UHFFFAOYSA-N 292.722 2.119 10 20 CECD C[C@@H](NCCCO[C@@H]1CCOC1)c1cc(F)ccc1O 185705595 QWDDTBJWKLMDEW-DGCLKSJQSA-N 283.343 2.378 10 20 CECD C[C@H]1CCCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 137192309 LQQLAGHUTSJXAB-AWEZNQCLSA-N 289.423 2.101 10 20 CECD CCC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 49180136 QGEYPIXZKRNAGK-LBPRGKRZSA-N 262.353 2.110 10 20 CECD CCOc1cccc(CN2CC[C@@](C)(C(=O)OC)C2)c1O 93813689 VEIVACDPDXOABM-MRXNPFEDSA-N 293.363 2.176 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCC1 264449301 OOWVLSNAYOSCKL-UHFFFAOYSA-N 261.369 2.447 10 20 CECD O=C1CN(Cc2c(O)cccc2Cl)CN1CC1CC1 279443473 PKAUGHVRGQPOPL-UHFFFAOYSA-N 280.755 2.057 10 20 CECD COc1cccc(CN[C@]2(C)CCO[C@H]2C2CC2)c1O 273090085 KUWKAAOCLHJROT-JKSUJKDBSA-N 277.364 2.448 10 20 CECD Oc1cc2c(cc1CN1CCC=C(F)C1)OCO2 274478632 LYXAOAVBJWZOJX-UHFFFAOYSA-N 251.257 2.180 10 20 CECD COCC1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CCC1 282360268 XIDVFVSGGOTWMB-GQCTYLIASA-N 291.347 2.044 10 20 CECD CCCOc1ccc(CN(CC)[C@H](C)CO)c(O)c1 292847084 SUCWVVFRKDKOJU-GFCCVEGCSA-N 267.369 2.384 10 20 CECD CCOc1ccc(O)c(CN(C)[C@@H](CO)COC(C)C)c1 809768773 WOOWJMOPJZLJAM-AWEZNQCLSA-N 297.395 2.009 10 20 CECD C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(O)cs1 807694563 MUTWFBFRGYSXIJ-GHMZBOCLSA-N 280.393 2.153 10 20 CECD CCNC(=O)CN1C[C@H](C(C)C)Cc2cc(OC)ccc21 817298003 DTARITTVWGLHNW-CQSZACIVSA-N 290.407 2.466 10 20 CECD Cc1cc(O)c(CNC[C@@H](O)C(F)(F)F)cc1Cl 825130957 HNNDTXGYMDRNQK-SNVBAGLBSA-N 283.677 2.367 10 20 CECD COc1cc(CN(C)Cc2cccc(O)n2)c(O)cc1C 902569021 GGRPDBVIJFZAOE-UHFFFAOYSA-N 288.347 2.442 10 20 CECD C[C@H](NC(=O)CNc1ccccn1)c1ccc(N(C)C)cc1 907493794 SVCAEHWHJSIWRT-ZDUSSCGKSA-N 298.390 2.437 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@H](O)C1CCC1 825244999 CLVYYGXFILCUGR-ZDUSSCGKSA-N 273.735 2.435 10 20 CECD Cc1cc(C)c2c(N)c(C(=O)OCCCCO)sc2n1 733418366 OUDCERRNHIXEGQ-UHFFFAOYSA-N 294.376 2.425 10 20 CECD CC[C@H](CSC)NC(=O)/C=C\c1ccc(O)c(O)c1 588407253 MEMGOGNAYBXPPR-JPVGGKMYSA-N 281.377 2.369 10 20 CECD CC1=NO[C@H](C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 832431451 PJHVJUYZMXNQIK-FZMZJTMJSA-N 275.352 2.095 10 20 CECD CCC[C@@]1(CO)CCCN1C(=O)c1cc(O)cs1 834539064 JFZITIKFIHNCJN-ZDUSSCGKSA-N 269.366 2.221 10 20 CECD CC[C@H](OC)C(=O)NCCCSc1nccs1 733973623 SBPSFXOMBADZQM-VIFPVBQESA-N 274.411 2.167 10 20 CECD Cc1ccc(CN(C)c2ccc3c(c2)OCO3)nn1 840935896 BUOWNKSADRXKJT-UHFFFAOYSA-N 257.293 2.150 10 20 CECD CCc1cccc(CN2CCN(CC3CC3)CC2)c1O 848881881 JEAPLHHPPYMHFP-UHFFFAOYSA-N 274.408 2.482 10 20 CECD O=C(O)CCCC(=O)NCc1c(O)ccc2c1CCCC2 843330351 WCUIKLMXHYLJAT-UHFFFAOYSA-N 291.347 2.142 10 20 CECD COc1ccc2c(c1)CCCN2CCCN1CCOCC1 919880277 AFEYIKGSTXMINN-UHFFFAOYSA-N 290.407 2.170 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1n[nH]c(C)c1O 747659201 NIDNAQVPRZOGMT-UHFFFAOYSA-N 289.335 2.182 10 20 CECD Cn1cc(C(=O)NCc2ccccc2O)c(C2CCC2)n1 840400294 WWICWIWXKGPADW-UHFFFAOYSA-N 285.347 2.323 10 20 CECD Nc1ccc(Cc2noc([C@H]3CCCCO3)n2)cc1 843158702 HIBXDZIBVXHWIZ-GFCCVEGCSA-N 259.309 2.484 10 20 CECD CCn1cnnc1NCc1ccc(N(C)C)c(F)c1 922660124 LRMMUIWHZYJFKM-UHFFFAOYSA-N 263.320 2.115 10 20 CECD Cc1ccc(C(=O)N[C@H]2Cc3cccc(O)c3C2)c(O)c1O 760607327 MUKCTMJBVKDHQN-NSHDSACASA-N 299.326 2.009 10 20 CECD COc1cccc(O)c1CN1CCOC2(CCC2)C1 769485128 YTSALUNLYWUUBT-UHFFFAOYSA-N 263.337 2.156 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)N1CC=CC1 875099490 RCFVPAYEYRQXFT-UHFFFAOYSA-N 271.364 2.368 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CCC1 779541809 KJOCRSQBMYDXCZ-PCGIRMHASA-N 261.321 2.416 10 20 CECD CC[C@H]1C(=O)N(CC)CCN1Cc1ccc(N(C)C)cc1 779218839 UZPNTSLFFLTUKT-INIZCTEOSA-N 289.423 2.195 10 20 CECD CC(C)CO[C@@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773762911 LRTYQRMWPDBNBI-NEPJUHHUSA-N 295.379 2.206 10 20 CECD Cc1cccc(O)c1CN1CC[C@@H](C)[S@@](=O)CC1 877476272 AALRMHOFMHEIFO-XIKOKIGWSA-N 267.394 2.044 10 20 CECD CC(C)N(C)C(=O)[C@@H](C)N[C@H](C)c1ccccc1O 879648593 VHFIKXJMSCHBCZ-VXGBXAGGSA-N 264.369 2.298 10 20 CECD Nc1ccc(CN(CCO)[C@@H]2C[C@H]3CC[C@H]2C3)cc1 1120269358 QVLAPHOYGASXNA-OFQRWUPVSA-N 260.381 2.252 10 20 CECD C[C@H](N[C@H](C)c1ncn(C)n1)c1c(O)cccc1F 886596354 COPKXEFIGDJZKL-DTWKUNHWSA-N 264.304 2.072 10 20 CECD Cc1nnc([C@H](C)OC(=O)c2ccc(C)c(O)c2O)s1 783344273 KYEFTLHTAIFGPP-ZETCQYMHSA-N 294.332 2.484 10 20 CECD COc1cccc(CNC(=O)C2(SC)CCC2)c1O 787446026 NPEWDOGMRZIYFM-UHFFFAOYSA-N 281.377 2.303 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H](C)[S@]1=O 792191971 GYAJGRXKHQECDZ-LCKNKQDLSA-N 287.812 2.387 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H](OC)CC1 783602132 APJYNYVCFUYQKI-GFCCVEGCSA-N 265.353 2.402 10 20 CECD COc1ccc(CNCCCNC(=O)CCCF)cc1C 1164072137 PXAYAYVWYCNFEA-UHFFFAOYSA-N 296.386 2.349 10 20 CECD CN(C)[C@H]1CCCC[C@H]1NCc1cc(F)ccc1O 1320161967 ULOFAQRLEYEJHJ-KGLIPLIRSA-N 266.360 2.494 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1C[C@@]12CCOC2 1329520787 XXHHUPFZDUENTC-WPPNPWJKSA-N 293.710 2.241 10 20 CECD CCC[C@]1(CO)CCCN1C(=O)NCc1ccc(N)cc1 1337070361 OAJUPOZVLYNMMF-MRXNPFEDSA-N 291.395 2.105 10 20 CECD O=C(O)[C@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 1608634241 CPNJYFZBVCSIHE-ZETCQYMHSA-N 273.691 2.091 10 20 CECD C[C@@H](N[C@H]1CC=C(C(=O)O)C1)c1cc(F)ccc1O 1604330562 RBJBWWTWLZXBIH-KCJUWKMLSA-N 265.284 2.355 10 20 CECD O=C(NCc1ccccc1O)Nc1ccc(C(=O)O)s1 1608472636 BLVCDZGMZLESEI-UHFFFAOYSA-N 292.316 2.474 10 20 CECD CCc1nc(CN[C@@H](C)c2cc(C(=O)O)ccc2O)co1 1610071980 VCCYTWMYGIQPIM-VIFPVBQESA-N 290.319 2.492 10 20 CECD Nc1ccc(CNC(=O)CCOc2ccccc2F)cc1 1580443445 GECRYABGSWPQIS-UHFFFAOYSA-N 288.322 2.493 10 20 CECD C[C@@H]1CC[C@@H](CN2CCCc3cc(CN)ccc32)O1 232007578 ZTHJXHXSWHMBOA-DOMZBBRYSA-N 260.381 2.465 10 20 CECD CO[C@H](C(=O)NCc1ccc(O)c(O)c1)c1ccccc1 158964374 PYRXEYZXJDTGLT-HNNXBMFYSA-N 287.315 2.102 10 20 CECD C[C@H](CNCc1ccc2c(c1)CCCO2)CC(=O)O 258989984 ZBJUHBYUFOGPQO-NSHDSACASA-N 263.337 2.212 10 20 CECD CCOc1cccc(CN[C@H](C)CCN(C)C)c1O 49553122 JDZWTMXNRZPTNK-GFCCVEGCSA-N 266.385 2.221 10 20 CECD Cc1csc([C@@H](C)NC(=O)Cc2ccc(N)cc2)n1 80255483 XZHRNJLIXTUCIC-SNVBAGLBSA-N 275.377 2.454 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)N1CCC(C)CC1 80357775 HDOURVVQFANKMS-UHFFFAOYSA-N 284.381 2.089 10 20 CECD CCN1CCCC[C@@H]1C(=O)N(C)Cc1ccccc1O 104853219 IPBBBWZWOJVYLB-CQSZACIVSA-N 276.380 2.225 10 20 CECD C[C@H](NC(=O)Nc1ccnnc1)c1ccc(N(C)C)cc1 1348075457 RJTHBCBGRZRWNY-NSHDSACASA-N 285.351 2.425 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)CC[C@@H](C)O)c1O 135822020 XCTPEGDQZXIWKF-SECBINFHSA-N 285.771 2.451 10 20 CECD Cc1ccc(O)c(CNc2nnc(-c3nccn3C)o2)c1 195028168 RTYMUBPIUHEJDA-UHFFFAOYSA-N 285.307 2.096 10 20 CECD Nc1ccc(CCNC(=O)COCCc2ccccc2)cc1 238126092 YUBCQSXZKUQRRD-UHFFFAOYSA-N 298.386 2.187 10 20 CECD Cc1nc(C(=O)N(C)Cc2ccccc2O)c(C)o1 293217651 COKNEWHJEBSDBQ-UHFFFAOYSA-N 260.293 2.269 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](OC)C2)c1O 234888725 UPPHUEBXTJWRNH-NSHDSACASA-N 271.744 2.275 10 20 CECD Cc1ccc(O)c(CN(C)[C@@H](C)C(=O)OC(C)C)c1 93773278 UKSKAGRCWYVHDM-LBPRGKRZSA-N 265.353 2.473 10 20 CECD CC(C)OCCS(=O)(=O)Nc1ccc(O)cc1Cl 93666489 DSJGHJCMLMCSBX-UHFFFAOYSA-N 293.772 2.212 10 20 CECD Cc1cc(O)c(CN2CCO[C@H]([C@H]3CCCO3)C2)cc1C 246303796 VOVXDVVKZDKCGS-SJORKVTESA-N 291.391 2.389 10 20 CECD CN(C)c1ccc(CN(Cc2ncnn2C)C2CC2)cc1 267546110 WSRFXSRJKQQAJH-UHFFFAOYSA-N 285.395 2.046 10 20 CECD Cc1ccc([C@H](C)NCC(F)(F)CO)c(O)c1C 274455383 ZNUDKAJLHWVTDP-JTQLQIEISA-N 259.296 2.287 10 20 CECD COc1cccc(CNCc2cnc3n2CCCC3)c1O 368493997 DMIYJYIKYYDDJI-UHFFFAOYSA-N 287.363 2.223 10 20 CECD C[C@H](NCC(C)(C)CCO)c1cc([N+](=O)[O-])ccc1O 273596424 QTPFRDXGYPIVEJ-JTQLQIEISA-N 282.340 2.360 10 20 CECD Cc1ccc(C(=O)NCCCc2nccs2)c(O)c1O 272740410 IJCKWPYWJMZGPQ-UHFFFAOYSA-N 292.360 2.225 10 20 CECD C[C@H](C[S@@](C)=O)N(C)Cc1ccc(N(C)C)c(F)c1 275321158 SIQHJYGTSMJPQV-NSPYISDASA-N 286.416 2.091 10 20 CECD CCCC(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 272059112 ADUFUIWCOAZCSV-UHFFFAOYSA-N 299.754 2.347 10 20 CECD C[C@H](NC[C@H](N)C1CC1)c1cc(Cl)ccc1O 817964921 JGSLEFWURCMBGK-UFBFGSQYSA-N 254.761 2.434 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCc2cccnc21 816888930 FAZBNQJIMCKQPP-CQSZACIVSA-N 282.343 2.476 10 20 CECD C[C@H](NC1CNC1)c1ccc(Cl)c(Cl)c1O 817956308 WGJAWZSBMQYLBH-LURJTMIESA-N 261.152 2.321 10 20 CECD Cc1noc([C@H](C)OC(=O)c2ccc(C)c(O)c2O)n1 727005719 VUACGNGSWHCTHC-ZETCQYMHSA-N 278.264 2.016 10 20 CECD CC(C)[C@@H]1C[C@@H](C(=O)NCc2ccc(O)cc2O)CCO1 822971202 AEICIUGWNYSZNL-NHYWBVRUSA-N 293.363 2.165 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCNC[C@@H]3C2)cc1C 904421306 XOXYJFXDZJILEX-DZGCQCFKSA-N 260.381 2.050 10 20 CECD O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)c1c(F)ccc(O)c1O 825679603 WVENYTCKNPJCBN-GUBZILKMSA-N 279.311 2.403 10 20 CECD CCN(CC)c1ccc(CNC(COC)COC)cc1F 824921401 KZITZVLSAMEVAM-UHFFFAOYSA-N 298.402 2.423 10 20 CECD CC1CCN(C(=O)[C@H](C)OC(=O)c2cc(O)cs2)CC1 732353790 VPTFOHDLFRJFQN-JTQLQIEISA-N 297.376 2.258 10 20 CECD Cc1noc([C@@H](C)OC(=O)c2cc(O)cs2)n1 732354262 IQSRCBWELIPSDE-RXMQYKEDSA-N 254.267 2.063 10 20 CECD C[C@H]1COC(C)(C)CN1C(=O)NCCc1ccc(N)cc1 841959703 PBTQIPNOFNYLLG-LBPRGKRZSA-N 291.395 2.020 10 20 CECD CCOc1ccc(O)c(CN2CCN[C@@H](C(C)C)C2)c1 843105195 QBVROVALJSKNFB-OAHLLOKOSA-N 278.396 2.221 10 20 CECD CCOCCOC1CN(Cc2cccc(CC)c2O)C1 848900060 AIVCKHKPXPOVTR-UHFFFAOYSA-N 279.380 2.192 10 20 CECD COc1cc(N(C)CC[C@H]2CCNC2)cc(OC)c1OC 842473206 QUHQFYOZTBUEAQ-GFCCVEGCSA-N 294.395 2.148 10 20 CECD CCCCN1CC(=O)N[C@H]1c1ccc(N(C)C)cc1C 840806355 XZFLMUKXDLWICD-MRXNPFEDSA-N 275.396 2.292 10 20 CECD CCOCc1cc(CN[C@H]2CCN[C@@H](C)C2)ccc1OC 841062078 SKESUYVWEXOPMS-BBRMVZONSA-N 292.423 2.462 10 20 CECD CCN(C)C(=O)N(C)CCN(C)c1ccc(OC)cc1 845986815 CMGFRVCYUMXXNM-UHFFFAOYSA-N 279.384 2.135 10 20 CECD CCOc1ccc(CNCCCCCCN)c(O)c1 843126162 BHRBSKPIEKETDO-UHFFFAOYSA-N 266.385 2.400 10 20 CECD CCC1(C(=O)NCc2cc(Cl)ccc2O)COC1 846477333 SBKWZGKIAAKVFJ-UHFFFAOYSA-N 269.728 2.088 10 20 CECD C[C@H]1C[C@@H](CN)CN1Cc1cc(Cl)cc(F)c1O 843056880 BIJRZTCMVKMMQT-IUCAKERBSA-N 272.751 2.354 10 20 CECD C[C@@H](NCCn1ccnc1)c1cc(F)cc(F)c1O 756371625 MDKZOSJXZGITFM-SECBINFHSA-N 267.279 2.218 10 20 CECD COc1ccc(CN(C)Cc2cccc(OC)c2O)cn1 757917823 QATYPEMYUNPIIW-UHFFFAOYSA-N 288.347 2.436 10 20 CECD CC[C@H](NC(=O)NCc1ccccc1O)[C@@H]1CCCO1 756104918 DNHFOWFOTUKRRD-JSGCOSHPSA-N 278.352 2.149 10 20 CECD C[C@@H](NCc1nccn1C)c1cc(F)cc(F)c1O 756539716 SIKLBMXVPVUUFF-MRVPVSSYSA-N 267.279 2.255 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C(=O)N(C)OC)cc1 858325880 QBPYZACOWRCCQI-CYBMUJFWSA-N 293.411 2.031 10 20 CECD CC[C@@H]1C(=O)NCCCN1Cc1ccc(N(C)C)c(C)c1 933215271 AZBLZOFPSAKLBU-OAHLLOKOSA-N 289.423 2.162 10 20 CECD CCCCN(Cc1ccccc1O)C[C@@H]1CNC(=O)C1 852019101 UQCAPUNSJDOBLW-ZDUSSCGKSA-N 276.380 2.130 10 20 CECD CN(C)CCCN(C)Cc1cc(F)c(N(C)C)cc1F 862366472 JAKPAZLZWGKCBH-UHFFFAOYSA-N 285.382 2.414 10 20 CECD O=C(NCc1cccc(Br)c1O)c1cocn1 765736096 LINQFMDFLFQFRZ-UHFFFAOYSA-N 297.108 2.073 10 20 CECD CCn1cc(CN(C)Cc2cccc(OC)c2O)cn1 769426708 GZHYTGPQXLWOEZ-UHFFFAOYSA-N 275.352 2.249 10 20 CECD COc1ccc(O)c(CN2C[C@H](C)OC(C)(C)C2)c1 133110929 PEESGMKIUUGAGP-NSHDSACASA-N 265.353 2.400 10 20 CECD C[C@H](NC(=O)c1ccc(C=O)[nH]1)c1ccc(N(C)C)cc1 775403692 KEXUUPCFZDVPDX-NSHDSACASA-N 285.347 2.384 10 20 CECD Cc1ccc(C(=O)N(C)CCOC(C)(C)C)c(O)c1O 780985644 TXYYMWJPVMZZMI-UHFFFAOYSA-N 281.352 2.293 10 20 CECD CCC[C@@H](CNCc1ccc(OC)c(OC)c1O)OC 894664608 VDUGNCPAOKATBC-LBPRGKRZSA-N 283.368 2.314 10 20 CECD COc1cc(C)cc(CNC2C[C@@H]3CC[C@H](C2)N3C)c1O 894911671 JIZAUKSTJCAURF-GOOCMWNKSA-N 290.407 2.424 10 20 CECD CCCN(Cc1ccccc1O)C[C@H]1CCS(=O)(=O)C1 280053561 PEHSPRIVDMYXOR-CYBMUJFWSA-N 297.420 2.039 10 20 CECD Oc1c(F)cc(F)cc1CNCCN1CC=CCC1 708555926 QDLDATGEHTYHQO-UHFFFAOYSA-N 268.307 2.022 10 20 CECD CN1C[C@H]2CN(Cc3cc(Cl)ccc3O)C[C@H]2C1 194536520 ZGGDMSBDONNTJE-TXEJJXNPSA-N 266.772 2.039 10 20 CECD CC[C@@H](NCCN(C)C(=O)OC)c1ccccc1O 689585800 RWTPTEBXTHOIMF-GFCCVEGCSA-N 266.341 2.131 10 20 CECD CC[C@H](C)N1CCN(Cc2cccc(OC)c2O)CC1 133826181 APVMPGXOSINVBY-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD CCOC(=O)[C@H](NCc1ccc(N(C)C)c(C)c1)C1CC1 1326388755 UGIRUOIBYJFIAE-MRXNPFEDSA-N 290.407 2.492 10 20 CECD Cc1cc(NCc2c(O)ccc3c2CCCC3)nc(CO)n1 1326407549 HNOWHHYXKYXBDJ-UHFFFAOYSA-N 299.374 2.474 10 20 CECD CS(=O)(=O)N(Cc1ccccc1O)C1CCCC1 151326484 IHQPLNSRAAJFBS-UHFFFAOYSA-N 269.366 2.096 10 20 CECD CC[C@H](N[C@H]1CCc2nc(C)nn2C1)c1ccccc1O 155587231 VHMMPXHOLIFALG-JSGCOSHPSA-N 286.379 2.348 10 20 CECD CN(C)c1ccc(CNCc2ccc(C(N)=O)cc2)cc1 34992529 HCSNADUHMZBYSD-UHFFFAOYSA-N 283.375 2.141 10 20 CECD CN1CCC(CNCc2ccc3c(c2)CCCO3)CC1 921689544 STGOFVCPEAQIRQ-UHFFFAOYSA-N 274.408 2.443 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)[C@H]1OC 252782674 NMMGHTBSGUQCKX-ARFHVFGLSA-N 278.396 2.035 10 20 CECD CCN(CC)C[C@H](C)NCc1ccc2c(c1)CCO2 45693394 HXXHBKYQXVTORK-ZDUSSCGKSA-N 262.397 2.441 10 20 CECD CC[C@H](CN[C@H](C)c1cc(OC)ccc1O)OC 290036185 DFJISMDBSDWOHG-GHMZBOCLSA-N 253.342 2.476 10 20 CECD CC[C@H](C)C[C@H](N)C(=O)NCc1ccc(N(C)C)cc1 401001292 KMAWTVBIMPIKCE-WFASDCNBSA-N 277.412 2.132 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@H]2NCC[C@H]2C1 311210129 KZKNJEBSCHJXAB-GXFFZTMASA-N 266.772 2.229 10 20 CECD O=C(NCc1ccccc1O)c1cc(F)ccc1O 80022590 WPGUTOOEVDVDJV-UHFFFAOYSA-N 261.252 2.167 10 20 CECD Cc1ccc([C@@H](C)NCCCn2cncn2)c(O)c1 381677123 IVUCKRVKTQPJHE-GFCCVEGCSA-N 260.341 2.033 10 20 CECD CC(C)[C@@H](CO)CN[C@@H](C)c1cc(F)ccc1O 394073299 RTLVYMFYGKOFGO-WDEREUQCSA-N 255.333 2.446 10 20 CECD C[C@@H](N[C@H](CCO)C(F)(F)F)c1ccc(F)cc1O 886800671 ANRXUXOXKKDKTJ-RDDDGLTNSA-N 281.249 2.495 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccnc2C)c1 114541861 WZOPYPAOXRALAN-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COC1(CNCc2ccc(N3CCOCC3)cc2)CCC1 181085967 CAHGEQWLHXFNMH-UHFFFAOYSA-N 290.407 2.182 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCC[C@H]2CCO)c1 189958908 RBFISSNDQXNUTJ-WFASDCNBSA-N 279.380 2.432 10 20 CECD Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(F)cc1O)CC2 185317454 URHQJFJUSGPJAL-JOYOIKCWSA-N 290.342 2.097 10 20 CECD CCCOc1ccc(CNc2nnc(C)o2)c(O)c1 181497152 JGXUQNOGVWRCMJ-UHFFFAOYSA-N 263.297 2.485 10 20 CECD CO[C@H](C)CC(=O)NCc1ccc2c(c1)CCCN2C 195389063 AVUNFNNXAHZHFI-GFCCVEGCSA-N 276.380 2.110 10 20 CECD CC(C)[C@H]1OCCC[C@H]1CNC(=O)Cc1ccc(N)cc1 236616007 LMTVWYHHXJJYDA-WMLDXEAASA-N 290.407 2.379 10 20 CECD COC(=O)[C@H]1CCCCN1Cc1ccc(N(C)C)cc1 93440886 JQSJQIQFDAVLMN-OAHLLOKOSA-N 276.380 2.280 10 20 CECD COCCCN(CCOC)Cc1ccc(N(C)C)cc1 92220915 OJNCLCVJRVQAII-UHFFFAOYSA-N 280.412 2.238 10 20 CECD COC[C@H](CN[C@@H](C)c1cc(Cl)ccc1O)OC 273478237 TXKLIWMSBLXKRB-ONGXEEELSA-N 273.760 2.358 10 20 CECD Cn1ncc(CN2CCCc3cc(OC(F)F)ccc32)n1 368584992 PHKVJXRYXXFSIZ-UHFFFAOYSA-N 294.305 2.369 10 20 CECD CCCOc1ccc(CNCCC(C)(C)O)c(O)c1 274772374 SDVMADGJMMTSHP-UHFFFAOYSA-N 267.369 2.432 10 20 CECD Oc1ccc(F)cc1CNC[C@H]1COC2(CCCC2)O1 272513071 XGQDJFSQQDMZLH-ZDUSSCGKSA-N 281.327 2.307 10 20 CECD CN(C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2Cc1ccccc1O 374890897 FEXGDYVJEXMTIW-BFYDXBDKSA-N 290.407 2.076 10 20 CECD CNC(=O)OC[C@H]1CCCCN1Cc1cc(F)ccc1O 290065261 FNYQUFIJCPBRIG-CYBMUJFWSA-N 296.342 2.242 10 20 CECD CC(=O)C(=O)CSc1nnc2sc3ccccc3n12 808013205 QZLHZTRRVHANEG-UHFFFAOYSA-N 291.357 2.194 10 20 CECD COc1cccc(CN[C@H](C2CC2)C(C)(C)CO)c1O 290814713 GKIMURTYVZKWTJ-OAHLLOKOSA-N 279.380 2.288 10 20 CECD CC(C)(CNCc1ccc2ccccc2c1O)OCCO 816613596 ZASPBCANRRCZBN-UHFFFAOYSA-N 289.375 2.423 10 20 CECD CCOc1ccc(O)c(CN2CCC(C(=O)O)CC2)c1 820387549 SKXNUJXJYSHEQU-UHFFFAOYSA-N 279.336 2.088 10 20 CECD COc1ccc(O)c(CN[C@@H](C2CC2)[C@H](CO)C2CC2)c1 824845566 MEFKMEALFXPVGP-WBVHZDCISA-N 291.391 2.288 10 20 CECD CCOCc1cc(CNC[C@@](C)(O)C2CC2)ccc1OC 732669687 REQJWFAIPGAEKZ-QGZVFWFLSA-N 293.407 2.482 10 20 CECD C[C@H](N[C@H]1COC[C@H]1C)c1ccc(N2CCOCC2)cc1 903400232 NJSRZTPBDVTWIP-KEYYUXOJSA-N 290.407 2.209 10 20 CECD CCC[C@@](C)(O)CNCc1ccc(OCC)cc1O 732821018 UDPLPNPRUQIOJJ-OAHLLOKOSA-N 267.369 2.432 10 20 CECD CCOCc1cc(CN[C@H](C)[C@@H](C)C(=O)O)ccc1OC 901448778 MTPSANCVQYIDAK-VXGBXAGGSA-N 295.379 2.431 10 20 CECD O=C(O)C(F)(F)CNCc1ccc(N2CCCCC2)cc1 904030277 IXHNHDBZDTVGHW-UHFFFAOYSA-N 298.333 2.486 10 20 CECD Cc1ccc([C@H](O)CNC(=O)c2cc(O)cs2)cc1 732271507 ZUKDLOALSONIET-GFCCVEGCSA-N 277.345 2.226 10 20 CECD N[C@@H]1CCC[C@H](NCc2c(O)cccc2Cl)C1 841056925 FYUXGIGPEDWXGT-ZJUUUORDSA-N 254.761 2.405 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cc(Cl)cc(F)c1O 844935973 GJCNCDBYWKALCX-SNVBAGLBSA-N 275.707 2.480 10 20 CECD CCN(C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)C(C)C 842786345 YFHXGOQAPPCHJP-OAHLLOKOSA-N 292.427 2.192 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC[C@H]1N 843053029 XXVOGGGRBZAOAD-LDYMZIIASA-N 299.758 2.123 10 20 CECD C[C@H]1CCCC[C@H]1OCC(=O)NCc1ccc(O)cc1O 910951946 ZCIDQTCJEGANSX-XHDPSFHLSA-N 293.363 2.309 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)O[C@H]1CCOC1 913860025 FRXRIZZOTTWJMY-AWEZNQCLSA-N 278.352 2.110 10 20 CECD Cc1noc(CN(C)Cc2ccc(N(C)C)cc2C)n1 848927611 JCCWTEVLFZJNKM-UHFFFAOYSA-N 274.368 2.384 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@H]2[C@H]2CCCOC2)cc1 843502227 BFKMAIDORBNZGN-HOCLYGCPSA-N 288.391 2.229 10 20 CECD CCCCCOC1CN(C(=O)c2cc(O)cs2)C1 748405410 KEBLSNPEYXSDHR-UHFFFAOYSA-N 269.366 2.485 10 20 CECD Nc1ccc(CCNC(=O)NC(C2CC2)C2CC2)cc1 841675041 LZJKKYIVMIYAFJ-UHFFFAOYSA-N 273.380 2.299 10 20 CECD Cn1cc(C(C)(C)NCc2cc([N+](=O)[O-])ccc2O)cn1 742374367 WCKGCHBTHNVSFY-UHFFFAOYSA-N 290.323 2.059 10 20 CECD O=C(NCCCF)NCc1cc(Cl)ccc1O 846711881 RAHYSCQZINXIOW-UHFFFAOYSA-N 260.696 2.204 10 20 CECD CC(C)(C)c1n[nH]c(CNC(=O)Nc2ccc(N)cc2)n1 841298897 TUNBHVPPJMOUNL-UHFFFAOYSA-N 288.355 2.006 10 20 CECD COc1ccc(CNCc2nc(C(=O)O)cs2)cc1C 841792764 FJDLPEVOAMBADH-UHFFFAOYSA-N 292.360 2.448 10 20 CECD CC(C)OCCNCc1ccc(N2CCOCC2)c(F)c1 757979195 VXGVUFKRMJDSLG-UHFFFAOYSA-N 296.386 2.177 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)OCCF)c1 859007330 ZXBMVGXHPXLWKM-QMMMGPOBSA-N 257.261 2.158 10 20 CECD O=C(NC1(C(F)(F)F)CC1)c1cc(O)cs1 854783981 HSJUIABWNZJKQZ-UHFFFAOYSA-N 251.229 2.278 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@](C)(O)CC 930905894 TYRJFTKABPUXJP-INIZCTEOSA-N 278.396 2.262 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCC=CO1)c1ccccc1O 868522294 DNIICKZIKCBPSJ-NEPJUHHUSA-N 276.336 2.445 10 20 CECD O=C(NCC1CCN(C2CC2)CC1)c1cc(O)cs1 774864526 QWCBZVQZINSTCP-UHFFFAOYSA-N 280.393 2.058 10 20 CECD CCN(Cc1ccc(C)cc1O)C[C@H](O)C(F)(F)F 877429419 XYJBBKLTLLPQFT-LBPRGKRZSA-N 277.286 2.446 10 20 CECD COc1ccc(CNC[C@H]2CN(C(C)=O)C[C@@H]2C)cc1C 1048092522 PHKJCIMWJQVKCJ-BBRMVZONSA-N 290.407 2.208 10 20 CECD Cc1ccc(CNCC2(C(=O)N(C)C)CCCC2)c(O)c1 877029791 NKBVICOXKWNFOP-UHFFFAOYSA-N 290.407 2.439 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1Cc2ccccc21 773747653 CMHOTJRETPMEHT-XHDPSFHLSA-N 297.354 2.485 10 20 CECD CC(C)OC(=O)CCN[C@H](C)c1ccccc1O 879648703 ZUGQQZMMWSGZDG-LLVKDONJSA-N 251.326 2.385 10 20 CECD CO[C@@H]1CCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1C 1120605281 RKRYEKFFZTZZEW-HZPDHXFCSA-N 290.407 2.492 10 20 CECD COCCN1CCC(N[C@H](C)c2c(O)cccc2F)CC1 886513075 SRYBWJSNTSJWAM-GFCCVEGCSA-N 296.386 2.293 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3CC[C@H]2[C@H](O)C3)cc1 887040578 GRHGMAHSSIQNOM-BHYGNILZSA-N 274.408 2.488 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)c(C)cc2O)[C@@H]1C 787237371 FURWTULQBKIRED-TZMCWYRMSA-N 277.364 2.392 10 20 CECD COc1ccc(CN[C@@H](CO)C2CCCC2)c(O)c1OC 894556818 LOCOERXSDSSKAQ-ZDUSSCGKSA-N 295.379 2.050 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)C[C@]1(C)CO 895345504 VDRRZYLFNUUWDA-LKFCYVNXSA-N 271.307 2.121 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1CCC[C@H](O)C1 795491572 SQVZEXDICREPHH-JOVKLMRISA-N 292.331 2.205 10 20 CECD CCC1(C(=O)NCc2ccc(OC)cc2O)CCOCC1 794376443 GZUWRCOEBYZQBJ-UHFFFAOYSA-N 293.363 2.224 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1C[C@]12CCOC2 1329520784 XXHHUPFZDUENTC-CPFSXVBKSA-N 293.710 2.241 10 20 CECD Nc1ccc(CN2CCC(NCC3CC3)CC2)cc1 1337834911 YMBHSYVTLYMBEH-UHFFFAOYSA-N 259.397 2.233 10 20 CECD CON(C)c1nnc(-c2sccc2O)n1CC(C)C 1342943438 UDMXOEGXJZGQTJ-UHFFFAOYSA-N 282.369 2.366 10 20 CECD CC(C)CN1CCC[C@@H]1C(=O)N(C)c1ccc(N)cc1 1357944428 ISEMQLLXQYUNQP-OAHLLOKOSA-N 275.396 2.352 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1C[C@@H]1C(=O)O 1593297846 ARTPTRXPRLCVAX-WCQGTBRESA-N 280.343 2.091 10 20 CECD C[C@@H]1CCC[C@]1(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776636392 LNRQZWGRQVDBNC-YMTOWFKASA-N 294.307 2.033 10 20 CECD CC1=C(C(=O)NCc2ccc(N(C)C)cc2)CCCO1 159732380 HMEVFFOEIDPRLM-UHFFFAOYSA-N 274.364 2.453 10 20 CECD CCOCCOCCN[C@@H](C)c1cc(C)ccc1O 927087891 QHTMLBWFEQUFAI-ZDUSSCGKSA-N 267.369 2.404 10 20 CECD CC(C)[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N(C)C 106460897 JIIXIUHFSUGNSF-OAHLLOKOSA-N 295.402 2.094 10 20 CECD Cc1ccc(C(=O)NC[C@@]2(C)CCCC[C@@H]2O)c(O)c1O 179535770 XAMGGNAJOYEBEW-BLLLJJGKSA-N 293.363 2.077 10 20 CECD Cc1nccn1C[C@@H](C)CNCc1ccccc1O 105442918 BVLHDPZTYGPMNQ-LBPRGKRZSA-N 259.353 2.323 10 20 CECD Cc1cc(O)c(CN(C)[C@H]2CCCCNC2=O)cc1C 123883955 YJTHOYKWNHHCPF-AWEZNQCLSA-N 276.380 2.110 10 20 CECD COc1ccc(N(C)CC(=O)N2CCCCC2)cc1F 121730342 LHLHKIXMYOQRPX-UHFFFAOYSA-N 280.343 2.283 10 20 CECD COc1cc(Cl)cc(CN(C)CCn2cccn2)c1O 184693278 OLPMWKZJTDTQEB-UHFFFAOYSA-N 295.770 2.383 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2ccc3c(c2)CCO3)C1 193498497 RXGLIZNBEBLNSF-UONOGXRCSA-N 275.348 2.053 10 20 CECD CN(C)CC[C@H](NC(=O)Cc1ccc(N)cc1)C(C)(C)C 236986498 NHHSEVBXNZSYPK-HNNXBMFYSA-N 291.439 2.294 10 20 CECD C[C@H](CNCc1c(O)cccc1Cl)CN(C)C 291683443 IAXIETKFOAIWNJ-SNVBAGLBSA-N 256.777 2.333 10 20 CECD CN(C)c1ccc(CN2CCS[C@H]3COCC[C@@H]32)cc1 91855630 QHLHAPBHPGJOGN-HOTGVXAUSA-N 292.448 2.459 10 20 CECD CO[C@H](C)[C@H](C)NCc1ccc(N(C)C)c(F)c1 269057623 WYMMUZPULDSVRQ-WDEREUQCSA-N 254.349 2.405 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@]3(CCCOC3)C2)c1O 366489496 POGFJUPFLHSUOD-WMLDXEAASA-N 291.391 2.471 10 20 CECD Cc1cnc(N(C)Cc2ccc(N3CCOCC3)cc2)nc1 270198700 FGKYQHRMJPGLOI-UHFFFAOYSA-N 298.390 2.258 10 20 CECD C[C@H](CNC(=O)NCc1ccccc1O)c1nccs1 273518176 QDKZMAQTOWTVPE-SNVBAGLBSA-N 291.376 2.452 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2c(O)cccc2Cl)C1 279443450 PJSKUCGHJHIFAU-VHSXEESVSA-N 283.755 2.477 10 20 CECD COc1cccc(CN2CC[C@@H](N3CCCC3)[C@H]2C)c1O 289727602 HPEIWSOYMUHCJM-UKRRQHHQSA-N 290.407 2.459 10 20 CECD Cc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)n(C)n1 284281519 JUWOBELYKLAJHC-SNVBAGLBSA-N 290.323 2.193 10 20 CECD COc1ccc(O)c(CNC(=O)[C@]2(C)CC2(F)F)c1 817548510 ARIFJBMITBTOAG-LBPRGKRZSA-N 271.263 2.062 10 20 CECD Cc1cc(Br)cc([C@@H](C)NC[C@H](C)N)c1O 817972965 QOSBBBDICBZVED-DTWKUNHWSA-N 287.201 2.461 10 20 CECD CC(C)[C@@H](O)CNCc1cc(Cl)c(F)cc1O 816550083 HZNLQVOULUIEMU-LBPRGKRZSA-N 261.724 2.291 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccccn2)c1 728980501 IBTMXHQZFSJLTG-SNVBAGLBSA-N 272.304 2.287 10 20 CECD Cc1cccc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1O 824838050 KUYHBKPILYBXAG-LXTVHRRPSA-N 257.333 2.086 10 20 CECD CO[C@H](C1CC1)[C@H](C)NCc1cc([N+](=O)[O-])ccc1O 825099098 UPJITDFXJMKOAR-XPTSAGLGSA-N 280.324 2.204 10 20 CECD CCC(=O)C1(C(=O)N(C)Cc2ccccc2O)CC1 825480954 DHTFYSUPISCHFL-UHFFFAOYSA-N 261.321 2.110 10 20 CECD CN(C)c1ccc(/C=C/CN[C@H](CC(F)F)C(=O)O)cc1 901811774 HKEBFYOLRDTGIX-ITDFMYJTSA-N 298.333 2.464 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC=C(C(=O)O)C1 901734157 XBXHUXVOQQWXIG-CQSZACIVSA-N 274.364 2.324 10 20 CECD CCN(CC)c1ccc(CNc2cncc(CO)n2)cc1 902107868 JYLSIGRYSWLMON-UHFFFAOYSA-N 286.379 2.427 10 20 CECD Cc1cc(O)c(CN(C)C(C)(C)C(=O)O)cc1C 833747223 TYBOQLCSUYFJOJ-UHFFFAOYSA-N 251.326 2.304 10 20 CECD NCCN(Cc1ccccc1)Cc1cccc(F)c1O 843060239 YWKGOHUHCZANGA-UHFFFAOYSA-N 274.339 2.492 10 20 CECD C[C@H]1C[C@H](NCc2cc(Cl)c(F)cc2O)CO1 843432933 RMLDUNKOSBUZKV-CBAPKCEASA-N 259.708 2.452 10 20 CECD CN(C)c1ccc(CNCC2(N)CCCC2)cc1F 849350078 OYOUTPJYQVUMMR-UHFFFAOYSA-N 265.376 2.253 10 20 CECD CCc1ncc(CNCc2cc(OC)ccc2O)cn1 840899412 WVIJXDIGEQWBAX-UHFFFAOYSA-N 273.336 2.043 10 20 CECD COc1cccc([C@@H](C)NCCc2ccn(C)n2)c1O 846162036 FVYTVDZEHXYRKX-LLVKDONJSA-N 275.352 2.028 10 20 CECD Cc1cc(C(=O)N[C@@H]2CO[C@@H](C)C2)c(C)n1-c1ccccn1 844108327 VCDNPVAYJMPQLL-JSGCOSHPSA-N 299.374 2.396 10 20 CECD O=C(Cc1ccc2c(c1)OCCO2)NCc1ccccc1O 748354956 QSZLXBVEPVVQRJ-UHFFFAOYSA-N 299.326 2.022 10 20 CECD C[C@@H](N[C@H]1CCN(C)C1)c1cc(Cl)ccc1O 756533543 IOMJWCFLJDVCFQ-KOLCDFICSA-N 254.761 2.400 10 20 CECD CCOCCNC(=S)N(C)Cc1ccc(N(C)C)cc1 750980617 JTOLBQFFXMCMNZ-UHFFFAOYSA-N 295.452 2.095 10 20 CECD C[C@H](NC[C@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 850544535 HKIJRRQOEUQIBV-CMPLNLGQSA-N 294.351 2.360 10 20 CECD C[C@H]1[C@@H](N(C)C)CCN1Cc1ccc(N(C)C)cc1 931041060 GILQFVXMMBUDJS-BBRMVZONSA-N 261.413 2.277 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H]2C2OCCO2)cc1 933899186 MNDSORJXRDNCDD-MRXNPFEDSA-N 290.407 2.480 10 20 CECD C[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1csnn1 868708871 MFIBMOYIRLEOKV-RKDXNWHRSA-N 292.364 2.365 10 20 CECD CCN1C[C@H](C)N(Cc2cccc(OC)c2O)C[C@H]1C 769465543 HEBSJBBSLMAZPI-OLZOCXBDSA-N 278.396 2.315 10 20 CECD O=C(c1cc(O)cs1)N1CCOC2(CCCC2)C1 768264232 MLOVRLIUWOAZBT-UHFFFAOYSA-N 267.350 2.239 10 20 CECD CNC(=O)[C@@H]1CCCCN1Cc1cc(Cl)ccc1O 133039689 CBNLYSPDFNLOFJ-LBPRGKRZSA-N 282.771 2.146 10 20 CECD COc1cccc(O)c1CN1CC[C@H](N2CCCCC2)C1 769331618 UPONPLIZQGLIKD-AWEZNQCLSA-N 290.407 2.461 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NCc2ccncc2)o1 1537963115 UWTKJWYJLFCGMP-UHFFFAOYSA-N 257.253 2.415 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCO[C@@]2(CCOC2)C1 877132957 SBUOCHRJQMMWKE-BBRMVZONSA-N 277.364 2.128 10 20 CECD Cc1cc(C)c2c(N)c(C(=O)OC[C@H](C)O)sc2n1 787608895 YQCMGCPCGYOOJV-QMMMGPOBSA-N 280.349 2.033 10 20 CECD COc1ccc(CN[C@@]2(C)CCCOC2)c(O)c1OC 893392445 HSAWPINVKKHWAJ-HNNXBMFYSA-N 281.352 2.068 10 20 CECD Cc1nc([C@H]2CCN(Cc3c(O)cccc3Cl)C2)n[nH]1 895008331 WCWBIKWMJMDNAL-JTQLQIEISA-N 292.770 2.462 10 20 CECD COc1ccc(CNC[C@@H](C)SC)c(O)c1OC 893183213 TZEQOAYYLOZOIB-SECBINFHSA-N 271.382 2.251 10 20 CECD COCC1(NCc2ccc(Br)cc2O)CC1 691430990 VKSPQRDJFCIJMZ-UHFFFAOYSA-N 286.169 2.423 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCOC[C@@H]1C 796497694 ODAOFKPHYRACIQ-NWDGAFQWSA-N 265.353 2.163 10 20 CECD O=C(OC[C@H]1CCC[C@H](O)C1)c1cc(O)cs1 795401744 INWUMYSEGAVAKE-IUCAKERBSA-N 256.323 2.162 10 20 CECD C[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccccc1O 777725557 URGYJYUCXKWVKR-RWMBFGLXSA-N 297.420 2.399 10 20 CECD CCOC(=O)[C@@H](CC)N[C@H](C)c1ccccc1O 879648270 HVPRPEQDYVEUCG-ZYHUDNBSSA-N 251.326 2.385 10 20 CECD CCC[C@](C)(NCc1cc(C)cc(OC)c1O)C(=O)O 1605198631 DRVHWZHSCPECIN-HNNXBMFYSA-N 281.352 2.442 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC(C(=O)O)C2)cc1 1600391365 BTZNCSIJKWATBH-UHFFFAOYSA-N 298.342 2.251 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cccc(C(=O)O)c1 1601239108 SJCZNPWFHDFXOO-FNORWQNLSA-N 299.282 2.448 10 20 CECD C[C@]1(N)CCCC[C@@H]1C(=O)N1Cc2cccc(O)c2C1 1576531296 SVBUVCWZMRWRDZ-CJNGLKHVSA-N 274.364 2.142 10 20 CECD COc1ccc(O)c([C@H](C)NCCC[C@H](C)CO)c1 230669734 FCCDDBYQABVROY-RYUDHWBXSA-N 267.369 2.460 10 20 CECD CC[C@H](CNCc1ccc2c(c1)CCN2CC)C(=O)O 1776714835 FUHLLDPXSDGVGL-CYBMUJFWSA-N 276.380 2.269 10 20 CECD CCOC(=O)[C@](C)(O)CN(CC)c1ccc(OCC)cc1 274595328 LDPCUJLZVLZTEO-MRXNPFEDSA-N 295.379 2.226 10 20 CECD COc1ccc(O)c(CNCCc2ccccn2)c1 20089323 BICLKDFBCLOHBS-UHFFFAOYSA-N 258.321 2.128 10 20 CECD CCCN(CC[C@@H]1CCNC1=O)Cc1ccccc1O 846807303 BYFQMJQNXXRBBQ-ZDUSSCGKSA-N 276.380 2.130 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2[C@H]3CCCC[C@H]32)cc1 250236869 FEUPAWWKXFSJKT-FICVDOATSA-N 258.365 2.364 10 20 CECD CC(C)C[C@H]1COCCN1C(=O)Cc1ccc(N)cc1 157519941 JALKMPJYMDHZJX-HNNXBMFYSA-N 276.380 2.085 10 20 CECD Cn1c(Cl)cnc1CN1CCCc2cc(CN)ccc21 700829563 IJHHFDWEKJAUGZ-UHFFFAOYSA-N 290.798 2.485 10 20 CECD COc1ccc(CN[C@@H](CCO)C(F)(F)F)cc1C 821206435 DBZHPMNOAPFRCL-LBPRGKRZSA-N 277.286 2.407 10 20 CECD C[C@@H](NCCCO)c1cc(Br)ccc1O 134903688 XTWPUYIDDDCEKJ-MRVPVSSYSA-N 274.158 2.188 10 20 CECD CCN1CC[C@@H]2CC[C@@H](C1)N2Cc1ccccc1O 179585529 OYYXGZIGBVBSKV-GJZGRUSLSA-N 260.381 2.451 10 20 CECD CCCNC(=O)C1CCN(Cc2cc(F)ccc2O)CC1 179907022 DLDNUYFJAZQYTN-UHFFFAOYSA-N 294.370 2.270 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(O)nc1 115281926 PQHXLIRZBOLJDL-UHFFFAOYSA-N 285.347 2.092 10 20 CECD COc1ccc(O)c([C@H](C)Nc2ncnc3[nH]ncc23)c1 301193982 MVSPBHOZPLSZCR-QMMMGPOBSA-N 285.307 2.240 10 20 CECD C[C@@H]1CCCCN1C(=O)CN(C)c1ccc2c(c1)OCO2 121336100 ZTHLNBARMGXYNW-GFCCVEGCSA-N 290.363 2.253 10 20 CECD CC(C)OCCN1CCN(Cc2cc(F)ccc2O)CC1 180185252 CYLLGHBENIEDLD-UHFFFAOYSA-N 296.386 2.074 10 20 CECD COc1ccc(N(C)CC[C@@H]2CCOC2=O)cc1F 121685997 BUFDQQOCVGNHIH-SNVBAGLBSA-N 267.300 2.224 10 20 CECD CC[C@H](NCC(C)(C)C(N)=O)c1ccc(N(C)C)cc1 183205574 BGQGPAXHSKACEQ-AWEZNQCLSA-N 277.412 2.305 10 20 CECD CC[C@H](NC1CN(C(=O)OC)C1)c1ccc(N(C)C)cc1 181468497 MPQZYTYMYRISPW-HNNXBMFYSA-N 291.395 2.244 10 20 CECD CC[C@H]1COCCN1Cc1cccc(OC)c1O 132342845 SJRLKXPZAMBADJ-LBPRGKRZSA-N 251.326 2.012 10 20 CECD Cc1cnc(SCC(=O)c2ccc(O)c(O)c2)nc1 48353397 BYWNRFAAILOIAP-UHFFFAOYSA-N 276.317 2.171 10 20 CECD C[C@@H]1CN(Cc2cccc(Br)c2O)CCO1 132476389 HQZPVZDCZQGXSZ-SECBINFHSA-N 286.169 2.375 10 20 CECD CC(=O)c1cc(F)cc(CN2CCO[C@@H]3CCC[C@H]32)c1O 227156252 HEHKYMDNPCEWQI-HUUCEWRRSA-N 293.338 2.487 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H]2CCCCO2)cc1F 87209989 OUFBATQYJJPUMO-ZDUSSCGKSA-N 294.370 2.467 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(N)cn1 132920530 RWSKNEPDXZUEIT-UHFFFAOYSA-N 284.363 2.002 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](CO)C(C)(C)C)c1O 193102473 PUCYGXWKTMTJKJ-CYBMUJFWSA-N 283.343 2.231 10 20 CECD CCO[C@H](CCNC(=O)Cc1ccc(N)cc1)C(C)C 236941484 NLBKXYQDHDUPNL-OAHLLOKOSA-N 278.396 2.379 10 20 CECD Oc1cc2c(cc1CN1CCC3(CCOCC3)C1)OCO2 266476390 UGYZUGVIJRQMFR-UHFFFAOYSA-N 291.347 2.123 10 20 CECD CN1CCN(C(=O)Cc2ccc(N)cc2)Cc2ccccc21 262636367 HVDNFGSLOWXZJE-UHFFFAOYSA-N 295.386 2.290 10 20 CECD CC(C)[C@@H](CO)N[C@H](C)c1ccc(F)c(F)c1O 276869364 DOHPLEDVFPOVPL-LDYMZIIASA-N 259.296 2.338 10 20 CECD COc1ccc(N2CCC(NCCC(C)(C)O)CC2)cc1 364365051 QZCWDHSHVDLTOQ-UHFFFAOYSA-N 292.423 2.415 10 20 CECD CC[C@@H](NCc1cccc(C)c1O)[C@H](O)C(F)(F)F 271767597 ATHKFBSDFUCPKD-PWSUYJOCSA-N 277.286 2.492 10 20 CECD C[C@H](NC[C@H]1CC[C@H](O)C1)c1cc([N+](=O)[O-])ccc1O 276669346 RPKHMXWHNJLOAA-NHCYSSNCSA-N 280.324 2.112 10 20 CECD CO[C@@H](C)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273598072 RCWQRPOJENPYDL-UWVGGRQHSA-N 268.313 2.376 10 20 CECD C[C@H](NC[C@@H]1CCCOC1)c1cc([N+](=O)[O-])ccc1O 273414020 QLTGTAGSWGBOOP-QWRGUYRKSA-N 280.324 2.378 10 20 CECD CC[C@H](NC[C@H](CO)[C@@H]1CCOC1)c1ccccc1O 280782327 GYJRYSCZWOUNOD-NFAWXSAZSA-N 279.380 2.078 10 20 CECD Cc1cnn(C)c1CNCc1ccc2c(c1)CCCN2C 285594706 XUNNQXUSGATAAZ-UHFFFAOYSA-N 284.407 2.401 10 20 CECD C[C@H](Oc1ccc(C=O)cc1)C(=O)NCc1ccccc1O 802777985 UYDPBMJQKQTOFX-LBPRGKRZSA-N 299.326 2.288 10 20 CECD Cc1noc(CCCN[C@H]2CCc3cccc(O)c32)n1 296671946 FVSPLUMFGNGKMU-LBPRGKRZSA-N 273.336 2.293 10 20 CECD CC(C)(O)CNCc1cc(Br)cc(F)c1O 715745040 NFNAEAUTORUATE-UHFFFAOYSA-N 292.148 2.154 10 20 CECD C[C@H](CN)N[C@H](C)c1cc(Br)cc(F)c1O 817966723 UKCZTBLQOQDLFS-RNFRBKRXSA-N 291.164 2.292 10 20 CECD Cc1cc(CN(C)CCN2CCCC2=O)ccc1N(C)C 815047477 ITLMHKXAWQXBCI-UHFFFAOYSA-N 289.423 2.115 10 20 CECD CCCN1C[C@H](CNCc2c(O)cccc2Cl)CC1=O 817411776 YXQLAASCZSQDGR-NSHDSACASA-N 296.798 2.394 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ncccc1N(C)C 901054391 XCRLYKKEHXVWKQ-UHFFFAOYSA-N 285.347 2.125 10 20 CECD CCN1CC[C@@H](NCc2ccc3c(c2)CCO3)[C@@H](C)C1 742207088 OXKYVENEXZNXQK-XJKSGUPXSA-N 274.408 2.441 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)N2CCC2)cc1 915361522 ZLXMZJSMYPUUMM-UHFFFAOYSA-N 289.423 2.197 10 20 CECD Oc1ccc(Cl)c(F)c1CNCC[C@H]1CCNC1 841036484 OXSZYXKHBBPLOY-SECBINFHSA-N 272.751 2.274 10 20 CECD Cc1ccc(O)c(CNC[C@H](C(=O)O)C(C)C)c1 848640661 UCIBTSJUCOEJEP-LBPRGKRZSA-N 251.326 2.147 10 20 CECD C[C@H]1OCC[C@H]1c1nc(Cc2ccc(N)cc2)no1 843159171 MAUCRHJDINIUNS-BXKDBHETSA-N 259.309 2.135 10 20 CECD C[C@H](COCC1CC1)NC(=O)/C=C/c1ccc(O)c(O)c1 846528599 NTWQIZLRDDEGAN-OKPNEXGHSA-N 291.347 2.042 10 20 CECD CCN(CCSC)Cc1cc2c(cc1O)OCO2 842644298 LPTXVMMAMRERLS-UHFFFAOYSA-N 269.366 2.306 10 20 CECD CC(C)N(CC1CCC1)C(=O)C(=O)Nc1ccc(N)cc1 841122136 XRDAQSCKNAMPQJ-UHFFFAOYSA-N 289.379 2.244 10 20 CECD Cc1cc(C)c([C@H](C)NCCO[C@H]2CCOC2)c(O)c1 927081304 OKJBVEKZYQSUDJ-KBPBESRZSA-N 279.380 2.465 10 20 CECD C[C@@H](CO)[C@H]1CCCCN1C(=O)c1cc(O)cs1 855468108 ZFNBMVVCEZKIRI-GXSJLCMTSA-N 269.366 2.077 10 20 CECD CN1CCN(c2ccc(CNCCc3ccoc3)cc2)CC1 850376684 KBBKQTXPGPAQAV-UHFFFAOYSA-N 299.418 2.364 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NN2CCOC2=O)cc1 862696579 OFMLAMCMANMBHR-UHFFFAOYSA-N 299.330 2.191 10 20 CECD C/C=C\C[C@@H](CO)NCc1ccc(N(C)C)c(F)c1 769935728 PZVCAEINNFBMQK-ZFDPJTLLSA-N 266.360 2.308 10 20 CECD Cc1ccc(CNC[C@@H](O)COc2ccccc2)c(O)c1 876918357 IYTRWKJMNVDXRP-OAHLLOKOSA-N 287.359 2.230 10 20 CECD CCCN(C[C@H](OC)[C@H]1CCOC1)c1ccc(CN)cc1 877477386 CEGRBYHTPHHUMF-RDJZCZTQSA-N 292.423 2.413 10 20 CECD COc1cc(O)c(CNCC(C)(C)CCCO)cc1OC 776257619 ZDBKNOHKSMSUSM-UHFFFAOYSA-N 297.395 2.298 10 20 CECD Cc1nn[nH]c1C(=O)NCc1ccc(N2CCCCC2)cc1 789917273 NQMPBOPLTQBRQB-UHFFFAOYSA-N 299.378 2.033 10 20 CECD CCOc1cccc(NC(=O)c2ccc(C)c(O)c2O)n1 780957221 XAUSASZQRGCHDL-UHFFFAOYSA-N 288.303 2.452 10 20 CECD CO[C@@H]1CCOC[C@H]1NCc1cc(Cl)c(F)cc1O 897890767 XVTJQIJABCBAOZ-DGCLKSJQSA-N 289.734 2.078 10 20 CECD COc1ccc(CNC[C@H]2CCSC2)c(O)c1OC 894120683 RSDHIPDMHHKPRP-SNVBAGLBSA-N 283.393 2.252 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1cc(F)ccc1O 83513812 BMIJAMJPPRRHIC-LBPRGKRZSA-N 269.316 2.209 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 893867255 TWRFHKGCBDTIIE-JTQLQIEISA-N 299.317 2.446 10 20 CECD CN1CC[C@@]2(CCN(Cc3c(O)ccc4ccncc34)C2)C1 793748885 VGJAOYRQLLBXCI-GOSISDBHSA-N 297.402 2.468 10 20 CECD CCc1cccc(CN(CCCOC)CCOC)c1O 692091829 HFTXMCITNGKIGQ-UHFFFAOYSA-N 281.396 2.440 10 20 CECD CC1([C@H](NCc2ccc3c(c2)CCCO3)C(=O)O)CC1 1776514466 KYORMBIMXDAVHB-CQSZACIVSA-N 275.348 2.355 10 20 CECD O=C([C@@H]1C[C@H]1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 1349356108 SONZDSBBLQQPGL-BFHYXJOUSA-N 293.338 2.258 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1ccc(N)cc1 1356083705 YIBHSABNMFMOBS-RISCZKNCSA-N 262.353 2.042 10 20 CECD O=C(NC[C@H](CC1CCCC1)C(=O)O)c1cc(O)cs1 1608421270 PGVDYUKXLJKMRN-JTQLQIEISA-N 297.376 2.465 10 20 CECD CC[C@@H](CN[C@H](C)c1cccc(OC)c1O)C(=O)O 1603567879 KYJDPMJZHMGDKE-ZJUUUORDSA-N 267.325 2.162 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC[C@@H](C(=O)O)C1 1600236308 RWZNYGPJLSVTPV-OCCSQVGLSA-N 276.380 2.404 10 20 CECD O=C(O)c1ccccc1C(=O)NCc1c(O)cccc1F 1608944781 SARDALLSCCDESI-UHFFFAOYSA-N 289.262 2.160 10 20 CECD COc1cccc(CNCC2(C)CCN(C)CC2)c1O 227328865 BVBBOKNPGMHUPE-UHFFFAOYSA-N 278.396 2.222 10 20 CECD CN(C)c1cc(F)c(CN2C[C@@H]3CCC[C@@]3(N)C2)cc1F 1578423117 PNSRNHBTQBLIEJ-BLLLJJGKSA-N 295.377 2.344 10 20 CECD COc1cc(C)cc(CN[C@@H]2CC[C@H](C(=O)O)C2)c1O 1594054480 NBRGCIFAEXCTMX-CMPLNLGQSA-N 279.336 2.052 10 20 CECD CC(C)NCCC(=O)NCc1ccc2c(c1)CCCN2C 166474732 YHTZTRARSUQVAR-UHFFFAOYSA-N 289.423 2.073 10 20 CECD CN(C)c1ccc(CNC[C@H]2CCN(C3CC3)C2)cc1 37408223 SLPSOCJEXKAUMG-OAHLLOKOSA-N 273.424 2.327 10 20 CECD C[C@H]1C[C@@H](NCc2cc(Br)ccc2O)CO1 402293429 NPXQYYQPOLRZJZ-GZMMTYOYSA-N 286.169 2.422 10 20 CECD CCNCC1CCN(Cc2cc(F)cc(F)c2O)CC1 708495243 VJLJIJLOQDVLQK-UHFFFAOYSA-N 284.350 2.492 10 20 CECD Oc1cc2c(cc1CN(CC(F)F)C1CC1)OCO2 106857112 VSKGOCULONYGRE-UHFFFAOYSA-N 271.263 2.350 10 20 CECD COc1ccc(N(C)Cc2cnn(C)c2)c(OC)c1 179002376 XKLWHQFDOISBMY-UHFFFAOYSA-N 261.325 2.074 10 20 CECD CN(Cc1ccco1)Cc1cc2c(cc1O)OCO2 162177243 OOJFMWSPCVUTTJ-UHFFFAOYSA-N 261.277 2.346 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1c[nH]cn1 188882245 WEQSRNYBKKBGDU-UHFFFAOYSA-N 286.379 2.067 10 20 CECD CC(C)N1CCN(Cc2cc(F)ccc2O)CC1 179914995 LRMNXDYMASHSJV-UHFFFAOYSA-N 252.333 2.057 10 20 CECD Cc1cccc(CN2C[C@@H](C)O[C@@]3(CCCOC3)C2)c1O 366489494 POGFJUPFLHSUOD-PBHICJAKSA-N 291.391 2.471 10 20 CECD Cc1cc(C(=O)NC[C@@H]2CCNC2)c(C)n1-c1ccccc1 272988722 FDBXEIPWFAKLIB-OAHLLOKOSA-N 297.402 2.433 10 20 CECD CCC[C@@]1(NCc2cc([N+](=O)[O-])ccc2O)CCOC1 285406784 CWCPIEIKOOKUMH-CQSZACIVSA-N 280.324 2.349 10 20 CECD Fc1cc(CNc2cnccn2)ccc1N1CCOCC1 298739479 PXRWDKPDGKHHEA-UHFFFAOYSA-N 288.326 2.064 10 20 CECD Cc1cc(CN2CCC[C@@](C)(O)C2)ccc1N(C)C 293704760 DDDAYHVHNSVJME-MRXNPFEDSA-N 262.397 2.408 10 20 CECD CCCNC(=O)CCCN(C)Cc1ccccc1O 298399781 HFABBPMQCPPPBU-UHFFFAOYSA-N 264.369 2.130 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)OC2CCOCC2)c1 810050915 SUHHDVUBSWZRPJ-JTQLQIEISA-N 295.335 2.367 10 20 CECD CCOCc1cc(CN[C@@H]2CCN(C)C2)ccc1OC 729681805 JQTINDQEKWUMHQ-OAHLLOKOSA-N 278.396 2.025 10 20 CECD C[C@@H](O)c1ncc(C(=O)N[C@H](C)c2ccccc2O)s1 827946432 HWWRAVHGBCULMN-RKDXNWHRSA-N 292.360 2.393 10 20 CECD CCC(CC)(CC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 828800386 VCEWAZKQVNRIFT-UHFFFAOYSA-N 296.323 2.424 10 20 CECD Cc1nc[nH]c1C(=O)NCc1c(O)ccc2c1CCCC2 821071214 XZLQEAUAVOLAPX-UHFFFAOYSA-N 285.347 2.233 10 20 CECD C[C@@H](NC(=O)c1nn(C)c2c1CCCC2)c1ccccc1O 827952601 YHGKWFWEVIPZEI-LLVKDONJSA-N 299.374 2.496 10 20 CECD CCn1ncc(C)c1NC(=O)NCc1ccccc1O 825168482 YQKFALQPBKPMMJ-UHFFFAOYSA-N 274.324 2.239 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](C(=O)O)C2)cc1C 738464035 XRBAXAITTVTPRO-LBPRGKRZSA-N 263.337 2.306 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1ccc(N(C)C)c(F)c1 840956887 GJTVXIPGFXCYRE-CQSZACIVSA-N 294.370 2.323 10 20 CECD C[C@H]1C[C@H](CN)CN1Cc1cc(Cl)cc(F)c1O 843056879 BIJRZTCMVKMMQT-DTWKUNHWSA-N 272.751 2.354 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN[C@@H](C)[C@H]2C)c1O 843376859 FGAJQTWYHRFXRO-VHSXEESVSA-N 296.798 2.430 10 20 CECD C[C@@H](NCCCOCCO)c1ccc(Cl)cc1O 841751693 BTZGGBUSGZMJRR-SNVBAGLBSA-N 273.760 2.095 10 20 CECD NC[C@@H]1CCCN(Cc2cccc(Br)c2O)C1 843047496 PZVMNTMZORIINX-JTQLQIEISA-N 299.212 2.325 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CNCC[C@H]1C 841059735 WIWRZHAOFBMBNS-WBMJQRKESA-N 261.413 2.149 10 20 CECD CN(C)c1ccc(CN[C@@H](CN)C2CCCC2)cc1 841086011 FORZJTXALUHKMS-INIZCTEOSA-N 261.413 2.360 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2ccoc2)c1 858613925 XUMLHBUYXGDLRK-UHFFFAOYSA-N 274.320 2.336 10 20 CECD COC[C@@H](NCc1ccc2c(c1)CCCO2)[C@H]1CCCO1 922078724 GUXAQOKWMQQZTK-NVXWUHKLSA-N 291.391 2.295 10 20 CECD CC[C@H](CO)N(C)Cc1ccc(N2CCCC2)cc1 1117788947 CLGGFJGTVHEITI-OAHLLOKOSA-N 262.397 2.490 10 20 CECD OC[C@H]1CSCCN1Cc1c(O)ccc(Cl)c1F 877779872 GUTXJNXJHQMXEY-QMMMGPOBSA-N 291.775 2.094 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCC(=O)N1 771791291 LZIKGGAUOXQBDW-HNNXBMFYSA-N 289.423 2.242 10 20 CECD CC(C)CNCC(=O)NCc1ccc(N2CCCC2)cc1 1118218240 DQSSCHZZBOXMBS-UHFFFAOYSA-N 289.423 2.149 10 20 CECD C[C@@H](NCc1cccc(F)c1O)C1CCNCC1 873221550 WSRHAQHQIYXSPQ-SNVBAGLBSA-N 252.333 2.009 10 20 CECD O=C(N[C@@H]1CCc2cc(O)ccc2C1)c1cc(O)cs1 774357163 ZDTGYEUSNJLGDB-LLVKDONJSA-N 289.356 2.447 10 20 CECD CCOc1ccc(CN[C@H]2CCC[C@@H]2CCO)c(O)c1 778216190 KDVLONQKLHPRFG-DOMZBBRYSA-N 279.380 2.432 10 20 CECD C[C@H](N[C@H]1CCCC[C@@H]1O)c1c(O)cccc1F 886594772 UHMSQVZWKSZHBM-DLOVCJGASA-N 253.317 2.485 10 20 CECD Cn1cnnc1[C@H]1CCCN1Cc1cc(F)cc(F)c1O 894077177 YPAJOJLQFDUDTL-GFCCVEGCSA-N 294.305 2.136 10 20 CECD CCCN1CC(=O)N[C@@H]1c1ccc(N2CCCC2)cc1 1331382944 WYUQVQCTPAIGBK-INIZCTEOSA-N 273.380 2.127 10 20 CECD CC(C)[C@@]1(C)C[C@@H]1C(=O)NCc1cccc(O)c1O 1520508490 CSSWIXNVNPRGPE-IAQYHMDHSA-N 263.337 2.396 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cc(OC)c(C)cc1O 1603498677 UHJUACQFZJXLQU-LLVKDONJSA-N 267.325 2.004 10 20 CECD NCC1(CC(=O)NCc2ccccc2O)CCCCC1 228424068 HROWVJLIXLHFNT-UHFFFAOYSA-N 276.380 2.308 10 20 CECD CC[C@]1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCCN1 1577195976 OOPWVIVEDKICKV-CXAGYDPISA-N 289.423 2.462 10 20 CECD Oc1c(CN(C2CCNCC2)C2CC2)ccc(F)c1F 1580885586 GAXKDAOIQNRORH-UHFFFAOYSA-N 282.334 2.387 10 20 CECD Oc1ccccc1CNCc1cc2c(cc1O)OCO2 134235752 KWUJBQGCZYUZSB-UHFFFAOYSA-N 273.288 2.116 10 20 CECD O=C(O)[C@]1(NCc2ccc3c(c2)CCO3)CCC[C@H]2C[C@@H]21 1777600227 XLJCRYNNIASPCO-JDFRZJQESA-N 287.359 2.355 10 20 CECD CC(C)C[C@H](CC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1776337257 VACFKMUZXWOVKT-LLVKDONJSA-N 296.323 2.279 10 20 CECD CCN(CC)c1ccc(CN2CCN(C)CC2)cc1F 154407065 ZIRLAKZUYWOWAG-UHFFFAOYSA-N 279.403 2.419 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)[C@@H](O)C(F)(F)F)c1 865711139 JAAGJNLRVDRPNT-GZMMTYOYSA-N 263.259 2.102 10 20 CECD CCOc1cccc(CN[C@@H](C)Cn2cccn2)c1O 37155468 LBTXUTDYONWZAA-LBPRGKRZSA-N 275.352 2.166 10 20 CECD Oc1cc(Br)ccc1CNCC12CC(CO1)C2 529661797 HOKYJOOLRJYXEP-UHFFFAOYSA-N 298.180 2.423 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H]2CCCCNC2=O)cc1 177873349 UNBXNIPOCAXVJD-XJKSGUPXSA-N 289.423 2.462 10 20 CECD CC[C@@H](C)[C@](C)(O)CNCc1cc([N+](=O)[O-])ccc1O 304067299 UJMLVCGSWBHBAF-QMTHXVAHSA-N 282.340 2.187 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CC[C@H](N)C2)cc1 178711674 LWBUNWZDHPBQRW-CABCVRRESA-N 289.423 2.276 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](CCC(N)=O)C2)cc1C 66080671 JTSQYPFAAJYQKF-CQSZACIVSA-N 290.407 2.487 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cnc(C2CC2)nc1 180751682 NODGUXSVLYWLNT-QHHAFSJGSA-N 297.314 2.417 10 20 CECD CCc1onc(C)c1NC(=O)c1cccc(O)c1O 189540794 MBOYMIIIVVDSTH-UHFFFAOYSA-N 262.265 2.209 10 20 CECD COc1ccc([C@H](O)CNCc2ccccc2O)cc1 134226123 PXSFACZTKYFICQ-MRXNPFEDSA-N 273.332 2.224 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nn2cnnc2)c1 181434290 SLPNXNHFNLYYLQ-UHFFFAOYSA-N 295.346 2.378 10 20 CECD CCCOc1ccc(CN(CC(N)=O)CC(C)C)c(O)c1 132907436 QQZIGKJHNGMOJN-UHFFFAOYSA-N 294.395 2.124 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](N(C)C)C2)c1O 91393745 UTPRFSNSCVJAAN-CQSZACIVSA-N 294.370 2.260 10 20 CECD C[C@@H](N[C@H]1CC[C@H](O)CC1)c1ccc(F)cc1O 252815254 UXQAPUIUUMQTJH-YUSALJHKSA-N 253.317 2.485 10 20 CECD CCNC(=O)[C@H](C)N[C@H](CC)c1ccc(N(C)C)cc1 268709159 FUEDKQBBZUJGPD-SWLSCSKDSA-N 277.412 2.318 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 271162735 AZWSDDHJRVSYFH-ZDUSSCGKSA-N 294.370 2.419 10 20 CECD C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H]1CCCCO1 272639770 LLDYRDKHMDVZGH-LPIAKDFXSA-N 291.347 2.185 10 20 CECD CC(C)C[C@@H]1NC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 272136746 SITZGEDZYLDVCN-AWEZNQCLSA-N 289.379 2.219 10 20 CECD Cc1cc(O)c(CN2CCO[C@]3(CCO[C@@H]3C)C2)cc1C 377272319 BLQAYBTWSHZDKF-RHSMWYFYSA-N 291.391 2.389 10 20 CECD C[C@@H]1C[C@@H](C)[C@@H](C(=O)NCc2ccc(N(C)C)cc2)O1 282353154 AGRROSAABFUZLP-JMSVASOKSA-N 276.380 2.182 10 20 CECD CC(=O)C(=O)COC(=O)C1(c2ccccc2F)CCCC1 808487476 AJCMYFZKVRDPKA-UHFFFAOYSA-N 292.306 2.339 10 20 CECD Cc1ccc(O)c(CNc2nc(C)cc(N(C)C)n2)c1 800723916 WBGOMDFLMMYYGF-UHFFFAOYSA-N 272.352 2.477 10 20 CECD C[C@@H](C(=O)NCc1ccc(O)c(O)c1)C(C)(F)F 293677260 KODKKQNAGPPEIV-ZETCQYMHSA-N 259.252 2.005 10 20 CECD CC(=O)C(=O)CSc1nncn1-c1ccc(C)cc1C 808014307 DDQZLKUOQWNAGX-UHFFFAOYSA-N 289.360 2.134 10 20 CECD CC(=O)C(=O)COC(=O)Cc1ccc(Cl)cc1Cl 808487707 GMEURMWPVDCWIM-UHFFFAOYSA-N 289.114 2.237 10 20 CECD CCN(C)c1ccc(CN(CCO)CC(F)F)cc1 815108185 HGHIVDOGSPJNMK-UHFFFAOYSA-N 272.339 2.202 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@H](O)C1CCC1 825240649 PQSWAFLWUWHXDC-LBPRGKRZSA-N 273.735 2.435 10 20 CECD Cc1ccncc1/C=C\C(=O)N1CCOc2ncccc21 492463952 WVNGXOFNJBEHNK-PLNGDYQASA-N 281.315 2.224 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](O)C2)cc1Cl 824491845 XMJGZJGIWOROFA-NSHDSACASA-N 255.745 2.311 10 20 CECD C[C@]1(CNCc2ccc3c(c2)CCCO3)CCCNC1 904354997 JHGWOXUPZWHMGL-KRWDZBQOSA-N 274.408 2.491 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)Cc1cnc[nH]1 908044310 ANLQMWOSVHSUGI-UHFFFAOYSA-N 287.363 2.487 10 20 CECD CCCCNC(=O)CCN[C@@H](C)c1cc(OC)ccc1O 839538401 CGEDMJVDSYLZED-LBPRGKRZSA-N 294.395 2.358 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@H]2CC[C@H]1O2 734407270 KVYOBTARKGBLHD-BZUAXINKSA-N 288.391 2.245 10 20 CECD COC1CCC(NC(=O)NCc2ccccc2O)CC1 838060833 KZUCRMOJEAHOLR-UHFFFAOYSA-N 278.352 2.149 10 20 CECD Cc1nc(C)c(CNC(=O)c2cc(O)cs2)s1 743674425 KXWQCZOJANZISF-UHFFFAOYSA-N 268.363 2.457 10 20 CECD COc1cccc(O)c1CNCc1ccc(CN)cc1 843127297 DTMUJOPZMKUKNS-UHFFFAOYSA-N 272.348 2.149 10 20 CECD Cc1cc(Br)cc(CN(C)[C@@H]2CCNC2)c1O 843049054 FDFFMOHNUTZIIV-GFCCVEGCSA-N 299.212 2.257 10 20 CECD CCc1cccc(CN(C)C(C)(C)C(=O)OC)c1O 848885774 RRSNGGQOLZRFCA-UHFFFAOYSA-N 265.353 2.338 10 20 CECD CN(C)c1ccc(CN2CC[C@H]3CC[C@@H](C2)N3)cc1F 843054522 QDDSUXHDJUVOMV-KGLIPLIRSA-N 277.387 2.218 10 20 CECD COc1ccc(O)c(CNCc2ccc(CN)cc2)c1 843129456 UKVVGCBVFUTPBQ-UHFFFAOYSA-N 272.348 2.149 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CC(=O)O)cc1 840995589 XPHGKUISFWVRPM-LBPRGKRZSA-N 264.369 2.486 10 20 CECD C/C=C/C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753742674 WHHGFZUUAYKYFH-ONEGZZNKSA-N 278.327 2.059 10 20 CECD Cc1ccc([C@@H](C)NCCO[C@H]2CCOC2)c(O)c1C 927081854 XOPCSSJYZOCAIP-KGLIPLIRSA-N 279.380 2.465 10 20 CECD CO[C@@H](C)CNC(=O)NCc1c(O)ccc2c1CCCC2 852531185 YAFCZYPLPVBOCQ-NSHDSACASA-N 292.379 2.105 10 20 CECD COC(=O)CCC(=O)CSc1ncc(Cl)s1 850000352 RSJIMFQURLELOC-UHFFFAOYSA-N 279.770 2.411 10 20 CECD C[C@H]1CN(C2CC2)C[C@@H]1NCc1ccc(N(C)C)cc1 757708300 XIFJWPXWXXECMG-GUYCJALGSA-N 273.424 2.325 10 20 CECD Cc1cc(CN2CC[C@@](C)(CN)C2)ccc1N(C)C 923356837 VBOYIOGMZJXBEH-INIZCTEOSA-N 261.413 2.232 10 20 CECD Fc1cc(CN2C[C@@H]3C[C@H]3C2)ccc1N1CCOCC1 862442186 YQHANTXNWFSECW-KBPBESRZSA-N 276.355 2.114 10 20 CECD Cc1ccc(O)c(CNC(=O)Cn2cc(C3CC3)cn2)c1 862754080 QGXYKSLYVIIBFL-UHFFFAOYSA-N 285.347 2.091 10 20 CECD COC/C=C\C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 864786655 VVINTJTWVFXYOL-PLNGDYQASA-N 288.391 2.446 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@@H]2CCCCO2)c1 862758211 SPJIEFLHOVKSTJ-ZDUSSCGKSA-N 263.337 2.276 10 20 CECD C[C@H](NCCN1CCOC[C@H]1C)c1ccc(N(C)C)cc1 765728637 NOFQTORRCMGKMH-CABCVRRESA-N 291.439 2.124 10 20 CECD O=C(O)[C@H](CC1CCC1)NCc1cc(F)cc(F)c1O 1119612215 XFQVEEHTJYOFFG-LBPRGKRZSA-N 285.290 2.403 10 20 CECD CC(C)(C)c1[nH]cnc1C(=O)NCc1ccc(O)c(O)c1 866768423 ALYVZJZWNVEAAR-UHFFFAOYSA-N 289.335 2.048 10 20 CECD Cn1cc(/C=C/C(=O)N2CCCc3cccc(O)c32)cn1 778951439 LZHRAUKXSAOPBS-BQYQJAHWSA-N 283.331 2.118 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@H]1C(=O)Nc1ccc(N)cc1 884009131 MXEHBNGJSHNKIY-OTYXRUKQSA-N 270.336 2.297 10 20 CECD CC(C)OC(=O)[C@H](C)N(C)Cc1cc(F)cc(F)c1O 894075747 JCHRHDFMYHMOTI-VIFPVBQESA-N 287.306 2.442 10 20 CECD C[C@@H](CCCCN)NC(=O)N[C@H](C)c1ccccc1O 892134963 PIXULAZMYAKCOJ-NWDGAFQWSA-N 279.384 2.270 10 20 CECD CC[C@H](C(=O)NCc1ccc(N2CCCC2)cc1)[C@@H](C)O 791207421 AKRNABVGPRZSGJ-CJNGLKHVSA-N 290.407 2.310 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2ccccc2O)C1=O 722344735 CXZBUSSCMZOZGW-AAEUAGOBSA-N 262.353 2.054 10 20 CECD CCc1cccc(CNCC[C@@H](C)N(C)C)c1O 697849248 QCWOBSNYUCQQSQ-GFCCVEGCSA-N 250.386 2.384 10 20 CECD C[C@H](O)CCN(Cc1ccccc1O)C[C@@H]1CCCO1 798195253 DMIRFVZAVIGFBK-ZFWWWQNUSA-N 279.380 2.144 10 20 CECD Cc1nc(NCc2ccc(N3CCCC3)cc2)n[nH]1 1324601333 JEDXYHNLSGXQCT-UHFFFAOYSA-N 257.341 2.325 10 20 CECD Nc1ccc(CNC(=O)N2CCCC[C@H]2c2cc[nH]n2)cc1 1337018380 KKUXRKWYAFFRID-HNNXBMFYSA-N 299.378 2.429 10 20 CECD Nc1ccc(CN2CCC(OC[C@@H]3CCCO3)CC2)cc1 1335284389 BGMNZGVQSQZDBZ-KRWDZBQOSA-N 290.407 2.429 10 20 CECD C[C@@H](NC(=O)[C@@H](C)n1ccnc1)c1ccccc1O 1336880742 KERPBNNXPPLECH-GHMZBOCLSA-N 259.309 2.027 10 20 CECD Cc1ccc(O)c(CN[C@H](CC(F)(F)F)C(=O)O)c1 1600465186 QWFFNFFLOFKLGM-SECBINFHSA-N 277.242 2.196 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@H]1[C@@H](C(=O)O)C1(F)F 1610122366 QRRZRMZQPGTWHV-STQMWFEESA-N 298.333 2.150 10 20 CECD Nc1ccc(CNC(=O)Nc2cnc3c(c2)COCC3)cc1 1580445551 JXOIJGWJOYMEGP-UHFFFAOYSA-N 298.346 2.058 10 20 CECD CO[C@@]1(C(=O)O)CCN(Cc2cc(C(C)C)ccc2O)C1 1599079641 VGEKPQHBKQRBDV-INIZCTEOSA-N 293.363 2.191 10 20 CECD COc1ccc(O)c(CNC[C@@H](O)c2ccccc2)c1 35601136 AUAJZHVJQISIPW-MRXNPFEDSA-N 273.332 2.224 10 20 CECD CS(=O)(=O)c1ccc(CNCc2ccccc2O)cc1 45172955 AFDMZQOOPQESHM-UHFFFAOYSA-N 291.372 2.086 10 20 CECD COc1ccc(O)c(CNC[C@H](OC)C(C)C)c1 381921625 PBTJUGPZUXKRGF-AWEZNQCLSA-N 253.342 2.161 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CCO)C(F)(F)F)c1 886802035 XSTBHZCPVLUKEE-QPUJVOFHSA-N 293.285 2.365 10 20 CECD CC(C)CN(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 65960956 LUVPTVABGWTNCO-UHFFFAOYSA-N 291.439 2.299 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C1(C)CC1 188906823 PELHAXJIMCGDGR-UHFFFAOYSA-N 260.337 2.278 10 20 CECD C[C@H]1CCN[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 126568147 QJQUTXNVHFJQCX-XJKSGUPXSA-N 289.423 2.099 10 20 CECD CC[C@@H](CCO)NCc1cc(Br)ccc1O 77453244 HMMXWRFJZHFLSK-NSHDSACASA-N 288.185 2.405 10 20 CECD CCN(C)C(=O)CN[C@@H](C)c1ccc(N(C)CC)cc1 186817137 RKZTUJLKPLMATQ-ZDUSSCGKSA-N 277.412 2.272 10 20 CECD CC(C)NC(=O)CN[C@@H](C)c1cc(Cl)ccc1O 184895968 SARQKSUMVLJXGC-VIFPVBQESA-N 270.760 2.221 10 20 CECD O=C(CSc1nccs1)NC(=O)NC1CCCCC1 48874569 DESJXTOECBAGOE-UHFFFAOYSA-N 299.421 2.394 10 20 CECD O=C1OCC[C@]12CCCN2Cc1cccc(Cl)c1O 190039611 DTAKSZSLEMWLJK-CQSZACIVSA-N 281.739 2.327 10 20 CECD CCOc1ccc(O)c(CN(CC(=O)OC)C(C)C)c1 93287366 ZRLFRVUOVMVWTA-UHFFFAOYSA-N 281.352 2.174 10 20 CECD C[C@H](NC[C@@H]1CN2CCC[C@@H]2CO1)c1cc(F)ccc1O 94618484 VZBKCRZSEROYNE-IACUBPJLSA-N 294.370 2.045 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NCC(=O)O)c2C)c1 237730275 KTPFJOGUSIDTNI-UHFFFAOYSA-N 286.331 2.217 10 20 CECD CN(C)c1ccc(CN2CC[C@@]3(CCCN3)C2)cc1 257721791 VRDRNBNXKXDOGN-INIZCTEOSA-N 259.397 2.081 10 20 CECD CCOc1ccc(N(CC)CCCS(C)(=O)=O)cc1 264034349 BJMNHMYPFDGAAQ-UHFFFAOYSA-N 285.409 2.346 10 20 CECD CCOc1ccc(O)c(CN(C)Cc2ccon2)c1 271208867 SVAFJBHRDUPJII-UHFFFAOYSA-N 262.309 2.411 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2c[nH]nc2C)c1 273539510 XZUXJPIYJLBESL-SNVBAGLBSA-N 289.335 2.061 10 20 CECD CC(=O)N1CCC[C@H](CNCc2cccc(C)c2O)C1 279915819 WZVNKNIILPWZPG-CQSZACIVSA-N 276.380 2.049 10 20 CECD C[C@H]1OCC[C@]12CN(Cc1ccc(N(C)C)cc1)CCO2 280404248 LBLTXDBKEHUNTL-PBHICJAKSA-N 290.407 2.132 10 20 CECD CC[C@H](N[C@H](CO)CCOC)c1ccc(N(C)C)cc1 281614520 NHVGZGCTHAPXMN-HOCLYGCPSA-N 280.412 2.191 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@]2(CCOC2)O1 280363180 UOMJYSWZOWSSSE-IAQYHMDHSA-N 297.782 2.425 10 20 CECD Cc1cc(C)c([C@H](C)NCCS(=O)(=O)C(C)C)c(O)c1 294295169 MZPJSJXNCPPPPY-ZDUSSCGKSA-N 299.436 2.483 10 20 CECD COCCOCCN(C)Cc1ccc(N(C)C)c(C)c1 293641220 RSGXMBHWVPNQRA-UHFFFAOYSA-N 280.412 2.156 10 20 CECD COCC1(CNC(=O)c2cc(O)cs2)CCC1 800696177 HNYINMUQSICBSL-UHFFFAOYSA-N 255.339 2.000 10 20 CECD Cc1cc(CN[C@@H]2CCCC[C@@H]2C(N)=O)ccc1N(C)C 815089362 DARCBXKLVLQAAC-LSDHHAIUSA-N 289.423 2.195 10 20 CECD C[C@H]1CC2(CCNCC2)CN1Cc1cc(F)ccc1O 818431373 KALVTDDDZMJWTD-LBPRGKRZSA-N 278.371 2.495 10 20 CECD COc1cc(C)cc(CN(C)C[C@@H]2CCCN2C)c1O 817374679 URPJJYOHWUXNQH-AWEZNQCLSA-N 278.396 2.235 10 20 CECD CCn1nc(C)c(CNCc2c(O)cccc2Cl)n1 818221677 SAXHQBCBIFRIKX-UHFFFAOYSA-N 280.759 2.255 10 20 CECD CC(=O)N[C@@H]1CCN(Cc2ccc3ccccc3c2O)C1 817415709 XBYWZJIOELJOEF-OAHLLOKOSA-N 284.359 2.256 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C1(CO)CC1 826991243 XGCXEVDCOVXETG-ZDUSSCGKSA-N 262.397 2.312 10 20 CECD CO[C@H]1COCC[C@H]1CNCc1ccc(N(C)C)c(F)c1 824709726 SHVIXFFWFMRXIU-BBRMVZONSA-N 296.386 2.033 10 20 CECD COC/C(C)=C/CN(C)c1ccc(OCC(=O)O)cc1 903903297 BOEWXUNPLZGTQH-XYOKQWHBSA-N 279.336 2.179 10 20 CECD Cc1cc(C(=O)OCCCCO)c(C)n1-c1ccccn1 733436042 RCZYPRPCXZGXBS-UHFFFAOYSA-N 288.347 2.418 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)CC(C)(C)O 839922492 WCWLRSWUYAHGAK-CYBMUJFWSA-N 292.423 2.269 10 20 CECD CC[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C)O1 732301704 GTDGNVRAKDBQDW-PSASIEDQSA-N 255.339 2.093 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2OC(C)(C)C)c1 830543922 INZBCFUNIPINLF-TZMCWYRMSA-N 293.363 2.221 10 20 CECD CCO[C@@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 841956797 IPMRQHZYMBFKMH-OAHLLOKOSA-N 291.395 2.022 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)cc1F 843059940 VQTPVOWWXPWHGM-LZWOXQAQSA-N 291.414 2.451 10 20 CECD CN(C)c1ccc([C@H](N)CNC[C@@H]2CCSC2)cc1 841046260 YQKPPYSBDZGIAR-SWLSCSKDSA-N 279.453 2.095 10 20 CECD Cc1cc(CNCCCSc2nccs2)nn1C 840899421 MMMVRJXUGLMTQE-UHFFFAOYSA-N 282.438 2.457 10 20 CECD O=C(Cc1ccsc1)OCC(=O)c1ccc(O)c(O)c1 916590023 YREHTOKWGYRSMJ-UHFFFAOYSA-N 292.312 2.128 10 20 CECD CN(C)c1ccc(OCc2nnn(C(C)(C)C)n2)cc1 848512245 JCSMPDVMBZBVOF-UHFFFAOYSA-N 275.356 2.073 10 20 CECD C[C@@H](NCC[C@@]1(O)CCCOC1)c1cc(F)ccc1O 846214131 SKEUTHVDMOFDAV-ABAIWWIYSA-N 283.343 2.114 10 20 CECD Cc1nn(C)c(C)c1C(=O)NCc1cc(Cl)ccc1O 846478850 FUHHBGRFQYSSBG-UHFFFAOYSA-N 293.754 2.326 10 20 CECD CCN(CC)c1ccc(CN(C)CCN)cc1F 841100922 OKBKWDQIAYKCEV-UHFFFAOYSA-N 253.365 2.062 10 20 CECD Cc1ccc2c(c1)N(C(=O)/C=C/c1cnn(C)c1)CC2 746819278 RZKXXFULQAAXFI-GQCTYLIASA-N 267.332 2.331 10 20 CECD COc1cccc([C@H](C)NCC[C@H](C)OC)c1O 846143645 FKXQNPBCDNNDFM-QWRGUYRKSA-N 253.342 2.476 10 20 CECD CCCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1018412513 KGXMPTLTJRPXSR-HNNXBMFYSA-N 290.407 2.494 10 20 CECD Cc1noc(C)c1CCOC(=O)c1cccc(O)c1O 758563494 VJZKDJJWSDSGLM-UHFFFAOYSA-N 277.276 2.102 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](O)COCC2CC2)c(O)c1 756509358 AWSMBKFZKCYSCE-OCCSQVGLSA-N 279.380 2.139 10 20 CECD C[C@@H](N[C@H]1C[C@H](CO)C1)c1ccc(Cl)cc1O 927142600 CNIKDMUZUWQNKB-FXPVBKGRSA-N 255.745 2.467 10 20 CECD CN(C)c1ccc(CNCc2cccnc2O)cc1F 858304017 CEHRDRCPYXPWPT-UHFFFAOYSA-N 275.327 2.282 10 20 CECD C[C@H]1C[C@H](NCC(F)(F)CO)c2c(O)ccc(F)c21 768285117 DVKWCTYIDNOBGG-CBAPKCEASA-N 275.270 2.297 10 20 CECD CCCOc1ccc(CN[C@@H]2CCCN(C)C2=O)cc1C 873071102 JEWNUYPNBRVLQO-OAHLLOKOSA-N 290.407 2.494 10 20 CECD Cc1cccc(O)c1CNc1ccc(CCO)nc1 877531895 DEIWTRKHCNCUSW-UHFFFAOYSA-N 258.321 2.243 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)[C@H](C)CN1C 775986255 QOUNBRDGGGNPSG-ZIAGYGMSSA-N 261.413 2.277 10 20 CECD Cc1cc(O)c(CN[C@H]2CCn3ccnc3C2)cc1C 778187967 OXYVPCSNFBAWFB-AWEZNQCLSA-N 271.364 2.310 10 20 CECD C[C@H](NCCOC[C@@H]1CCCO1)c1c(O)cccc1F 886528802 ROZCEKXEGWRFDU-RYUDHWBXSA-N 283.343 2.378 10 20 CECD CCCCNC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 775829940 BEJRNYZDOUJQTN-CYBMUJFWSA-N 277.412 2.320 10 20 CECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)c1cnccn1 784287931 WGDNORPEQJRZSP-TZGMSPROSA-N 286.287 2.205 10 20 CECD CCn1cc(CN2CCCc3cc(OC)ccc32)nn1 883992793 HFIOHYVXVFHKBM-UHFFFAOYSA-N 272.352 2.259 10 20 CECD COc1cc(C)cc(CN[C@@H](C)[C@@H](O)C(F)(F)F)c1O 895445708 VVFGARGLGGIPIC-QPUJVOFHSA-N 293.285 2.111 10 20 CECD COc1cccc(CN[C@@]2(C)CCCOC2)c1O 221362381 JNBLRGLOUZJPJE-AWEZNQCLSA-N 251.326 2.060 10 20 CECD CCO[C@H]1C[C@@H](NCc2cc(C)cc(OC)c2O)C1 894983903 TYCYUKKXQHAXJQ-BETUJISGSA-N 265.353 2.366 10 20 CECD Oc1cccc(Br)c1CNC[C@H](O)C1CC1 706863357 FBBOGPKNPUCPRR-LBPRGKRZSA-N 286.169 2.015 10 20 CECD COc1cccc(O)c1CN1C[C@H](C)O[C@H](C2CC2)C1 793215941 YPQWQWZQVATBHI-ZBEGNZNMSA-N 277.364 2.400 10 20 CECD Cc1cc(CNCc2c(O)cccc2Cl)n[nH]1 716465504 YLALOJGJLFKCEW-UHFFFAOYSA-N 251.717 2.367 10 20 CECD CCCCCS(=O)(=O)NCc1ccc(OC)cc1O 795357043 KPYZYUPZCLCNCT-UHFFFAOYSA-N 287.381 2.010 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(Cl)cn1 95977206 XELJXWRKDMDCRX-UHFFFAOYSA-N 292.722 2.119 10 20 CECD Cc1cccc(O)c1CN1CCC[C@](C)(C(=O)O)C1 1600542947 CCLZXUVJFYIMMA-HNNXBMFYSA-N 263.337 2.387 10 20 CECD CSC[C@H](CCO)N[C@H](C)c1cc(F)cc(F)c1O 1342407763 SDLBZPHKPRRJSJ-SCZZXKLOSA-N 291.363 2.435 10 20 CECD CN(C)c1ccc(/C=C\c2ccc(-c3nn[nH]n3)cn2)cc1 1609270771 XYEIARUMZGBKJY-CLTKARDFSA-N 292.346 2.498 10 20 CECD O=C(NCc1ccccc1O)Nc1cccc(C(=O)O)c1 1601543901 HLNNCHTWCVKJBW-UHFFFAOYSA-N 286.287 2.412 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CC=C(C(=O)O)C2)c1O 1607166655 FIQNZCMNZQWWHC-LLVKDONJSA-N 297.738 2.317 10 20 CECD CC(C)[C@H](N[C@H](C)c1cc(F)cc(F)c1O)C(=O)O 1589135640 AEDKFOMEBIDXPI-HQJQHLMTSA-N 273.279 2.430 10 20 CECD Nc1ccc(NC(=O)NN2C[C@@H]3CCC[C@H]3C2)cc1 1580449895 XDESQRGEVHGWNW-QWRGUYRKSA-N 260.341 2.037 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@@H](C(=O)O)C2)cc1Cl 1594327083 QMHHKIHZGZETBJ-WAAGHKOSSA-N 269.728 2.307 10 20 CECD COc1ccc(CN[C@@H](CN)CC(C)C)cc1C 841037649 BXUNBNFGLCRBRH-CQSZACIVSA-N 250.386 2.467 10 20 CECD CC[C@H](CN[C@@H](C)c1cc(OC)ccc1O)OC 290036190 DFJISMDBSDWOHG-WDEREUQCSA-N 253.342 2.476 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H](C)[C@H]2CO)c1O 189698698 VBZBHVZEULKVDE-LKFCYVNXSA-N 297.782 2.451 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@H]3CNC[C@H]3C2)cc1 401022541 RSGJKRMLGVWNQH-BZUAXINKSA-N 273.424 2.230 10 20 CECD CCN1CC[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 708678822 BOVLLJOATXZOBR-WFASDCNBSA-N 275.396 2.024 10 20 CECD CC1([C@H]2CCCN(Cc3ccc(N)cc3)C2)OCCO1 1120269581 USYOUZYLRSERAS-AWEZNQCLSA-N 276.380 2.244 10 20 CECD COc1ccccc1CN(CCO)Cc1ccccc1O 305743453 JYKHITJEFIQROP-UHFFFAOYSA-N 287.359 2.395 10 20 CECD CCCCOC(=O)CN(C)c1ccc(OC)c(OC)c1 64517257 RPVYRENGXVCCIN-UHFFFAOYSA-N 281.352 2.483 10 20 CECD COc1ccc(CNC[C@@H]2CCC[C@@H](O)C2)c(O)c1OC 1342959650 HEMAAUJMLSPEIH-DGCLKSJQSA-N 295.379 2.050 10 20 CECD CSC[C@H](C)C(=O)NCc1ccc(N(C)C)cc1 66756716 CYGUWKBSQWLLKT-NSHDSACASA-N 266.410 2.368 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)c(O)c1 185317960 PXPFIGTYLHINSK-DGCLKSJQSA-N 286.379 2.266 10 20 CECD CC(C)(CNCc1ccc(N2CCCC2)cc1)OCCO 313778626 ABJSAZDBDQQIAS-UHFFFAOYSA-N 292.423 2.164 10 20 CECD COc1ccc(N(C)Cc2nncn2C)cc1Cl 121868332 DYXYBNMKYJPEMQ-UHFFFAOYSA-N 266.732 2.114 10 20 CECD CN(CCn1cccn1)Cc1cccc(Cl)c1O 180222558 NDTOIUFZNXRDDD-UHFFFAOYSA-N 265.744 2.374 10 20 CECD COc1ccncc1CN(C)Cc1ccccc1O 287566238 BMAKDLKCTJCJKP-UHFFFAOYSA-N 258.321 2.428 10 20 CECD CCCCOC(=O)CN(C)c1ccc(OC)cc1OC 131677971 RUQWFXKOFUYMMQ-UHFFFAOYSA-N 281.352 2.483 10 20 CECD Cc1cccc(CN2CCC(NC(=O)C(C)C)CC2)c1O 271760712 YMGKUWYHXGYVCX-UHFFFAOYSA-N 290.407 2.437 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CCc2c[nH]nc2C1 376856312 NWAYWALZNCRGGT-NSHDSACASA-N 277.755 2.416 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@@]2(CCOC2)O1 280331017 RELRTFUZPIUTKB-XHDPSFHLSA-N 297.782 2.425 10 20 CECD CCCCN(CC(=O)NC1CC1)Cc1ccccc1O 282497292 QNPHYLGJAYGMQN-UHFFFAOYSA-N 276.380 2.273 10 20 CECD CCC[C@@H](O)CN1CCN(c2ccc(OC)c(F)c2)CC1 296815671 QJLITNLPHZNVJJ-CQSZACIVSA-N 296.386 2.117 10 20 CECD CC(C)Cc1nnc(N(C)Cc2ccccc2O)n1C 290578001 XCNGACXNDCTHPJ-UHFFFAOYSA-N 274.368 2.356 10 20 CECD COc1ccc2c(c1)CCCN2Cc1ccc(OC)nn1 801510044 FHUHQDBONITFTN-UHFFFAOYSA-N 285.347 2.447 10 20 CECD COc1ccc(N2CCC(NC(=O)C(C)(F)F)CC2)cc1 808460603 HQQQDOQJHCXCGY-UHFFFAOYSA-N 298.333 2.435 10 20 CECD CC(C)c1nnc(CNCc2ccc(N(C)C)cc2)[nH]1 294804094 NFACQBFNUDRNTD-UHFFFAOYSA-N 273.384 2.284 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H](O)C2CC2)cc1 819975233 ZTEWDSIEVDMBJJ-INIZCTEOSA-N 290.407 2.262 10 20 CECD CN(Cc1cc(Cl)c(F)cc1O)C[C@H](O)C1CC1 816611458 QKXNVJVHQISOMG-ZDUSSCGKSA-N 273.735 2.387 10 20 CECD C[C@@H](NC[C@@H]1CCCNC1)c1cc(F)cc(F)c1O 817946279 VEIUSOQIPROIJD-NXEZZACHSA-N 270.323 2.321 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CCC[C@@H](OC)C2)c1 815835608 ZBNDYSZBMKRQDU-WCQYABFASA-N 293.363 2.222 10 20 CECD CCOCC[C@@H](O)CNCc1c(C)c2ccccc2n1C 571396321 AISSZJBWQVEQRW-CQSZACIVSA-N 290.407 2.364 10 20 CECD Cc1cc(CN2C[C@@H](F)C[C@H]2C(=O)O)ccc1N(C)C 903614874 LLVTXRJNNOJMEJ-JSGCOSHPSA-N 280.343 2.058 10 20 CECD CC[C@@H](CNCc1cccc(Cl)c1O)C(=O)O 903704763 DHICFQDSPZGDIK-QMMMGPOBSA-N 257.717 2.246 10 20 CECD COC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 839101405 BRYYXQHJEJYPMT-UHFFFAOYSA-N 286.715 2.175 10 20 CECD CCc1ccc(CC(=O)NCc2ccccc2O)nc1 830527284 YEOYVKUXFRWINX-UHFFFAOYSA-N 270.332 2.209 10 20 CECD COCC1(CNC(=O)c2cc(O)cs2)CCCC1 839790097 MUHDYVPEOQBPCY-UHFFFAOYSA-N 269.366 2.390 10 20 CECD CNC[C@@H]1CCN(Cc2cccc(Br)c2O)C1 843053496 ZDVIJOWRXPKDEU-JTQLQIEISA-N 299.212 2.196 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)CC(C)(C)N 849350139 KZLHJYSOQJOQOR-UHFFFAOYSA-N 253.365 2.061 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)CCCN)CC2)cc1 841079616 KNRFUTCFDIUHNA-AWEZNQCLSA-N 291.439 2.381 10 20 CECD CCOC[C@@H](C)N[C@H](C)c1cc(OC)ccc1O 44689082 NOQXCZSXLZUKSU-GHMZBOCLSA-N 253.342 2.476 10 20 CECD Nc1ccc(NC(=O)NCc2noc3c2CCCC3)cc1 841300637 YIYUURFGHCYICD-UHFFFAOYSA-N 286.335 2.457 10 20 CECD CSCCCNC(=O)NCc1cc(C)ccc1O 858231395 RCEQNUWSTHCJCM-UHFFFAOYSA-N 268.382 2.253 10 20 CECD COc1cccc(C(=O)N(C)Cc2ccc(N(C)C)cc2)n1 752397436 ZGGYQPPOURLLAF-UHFFFAOYSA-N 299.374 2.428 10 20 CECD CC[C@H](CCO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756603713 JYODCPKKSJTVHD-VHSXEESVSA-N 268.313 2.112 10 20 CECD C[C@@H](N[C@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 756770117 RTKOJPYYWDOGSD-KOLCDFICSA-N 280.324 2.112 10 20 CECD Cc1cc(CN2CCC[C@@H](CN)C2)ccc1N(C)C 923281602 QEBBIOFLTTWMGO-HNNXBMFYSA-N 261.413 2.232 10 20 CECD CCO[C@H](CC(=O)NCc1cc(OC)ccc1O)C(C)C 761576243 SFDGYBGSLXPFCM-OAHLLOKOSA-N 295.379 2.468 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)O[C@@]2(CCO[C@@H]2C)C1 877487086 UQZVMEZTZKNZEF-VBQJREDUSA-N 291.391 2.469 10 20 CECD CCN(C)c1ccc(CN2CCC[C@]2(C)CO)cc1 773847683 OZZBDIZAWSBAAJ-MRXNPFEDSA-N 262.397 2.490 10 20 CECD CN(C(=O)CCCOc1cccnc1)c1ccc(N)cc1 877077351 DYGMYXVZIDJCRM-UHFFFAOYSA-N 285.347 2.486 10 20 CECD CC1(F)CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 872692015 VAQXYZYQGDINHH-ZDUSSCGKSA-N 281.327 2.142 10 20 CECD C[C@@H](O)CN(Cc1cc(F)cc(F)c1O)C1CC1 895193111 TYQHVSLWNKPLBV-MRVPVSSYSA-N 257.280 2.016 10 20 CECD CC1(N)CCN(Cc2cc(Cl)ccc2O)CC1 704594056 CLGUQLGOTQLLOR-UHFFFAOYSA-N 254.761 2.359 10 20 CECD CO[C@@]1(C)C[C@H]1NCc1c(O)cccc1Br 706812879 GEXQFNPSWSPAGU-NEPJUHHUSA-N 286.169 2.422 10 20 CECD COc1ccc(O)c(CNC[C@@H]2C[C@@H](C)O[C@H]2C)c1 686511673 HBJLKSIBUQRNDP-WOPDTQHZSA-N 265.353 2.304 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](N3CCCC3)C2)c1 133943018 XEKIGIOASHTNML-HNNXBMFYSA-N 260.381 2.371 10 20 CECD CC[C@@H](N[C@H]1CCCN(C)C1=O)c1ccc(C)cc1O 794800018 BFEMEYPHCDPTPZ-KGLIPLIRSA-N 276.380 2.362 10 20 CECD COc1cccc(S(=O)(=O)Nc2ccc(O)cc2F)c1 758169317 NYXWAMQAISMTJD-UHFFFAOYSA-N 297.307 2.341 10 20 CECD COC(=O)N1CCC(NCc2cc(Cl)ccc2O)CC1 237254087 BFTLGNCHKQKMLW-UHFFFAOYSA-N 298.770 2.366 10 20 CECD C[C@@H](NCCc1cnn(C)c1)c1c(O)cccc1F 1331255073 SHMTYSYAIMYQEE-SNVBAGLBSA-N 263.316 2.158 10 20 CECD C[C@H](O)C[C@H]1CCCCN1C(=O)NCc1ccc(N)cc1 1262603511 KZPZQGXEOFPUSY-SWLSCSKDSA-N 291.395 2.104 10 20 CECD COc1ccc(O)c([C@H](C)NCC2CCOCC2)c1 104190170 QDWOWQOPYJDJCA-NSHDSACASA-N 265.353 2.478 10 20 CECD O=C(O)[C@@H](CC(F)F)NCc1cc(Cl)cc(F)c1O 1601639435 ULOZZUPYQVCWNW-MRVPVSSYSA-N 297.660 2.383 10 20 CECD CC[C@H](CCO)CN[C@H](C)c1cc(C(=O)O)ccc1O 1605022658 XLYNQWATQOJRMO-GHMZBOCLSA-N 281.352 2.150 10 20 CECD CCN(C)c1ccc(CN[C@@H]2CCC[C@@H]2C(=O)O)cc1 1609991115 JTBDWYDGBPPSGM-LSDHHAIUSA-N 276.380 2.486 10 20 CECD CC1(C)OC[C@@H](CCSc2ncc(C(=O)O)s2)O1 1604559397 FZNAWBRDACYQAI-SSDOTTSWSA-N 289.378 2.475 10 20 CECD CN(C(=O)C1=CC[C@@H](N)C1)c1nsc2ccccc12 1578368779 UQXPVRDVQMPTPT-SNVBAGLBSA-N 273.361 2.307 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCC(F)(F)CO 231792598 VLDLOIBUXAVEFF-UWVGGRQHSA-N 271.307 2.466 10 20 CECD C[C@@H]1CCCN(Cc2cc(F)ccc2O)[C@@H]1C(=O)O 818631659 MHQDYYGGBCFASS-RNCFNFMXSA-N 267.300 2.216 10 20 CECD Cc1cccc(O)c1CN1CCO[C@H]([C@H]2CCCO2)C1 876805656 DSHRYPBTZZAKPL-CVEARBPZSA-N 277.364 2.080 10 20 CECD CCOc1cccc(CN2CC[C@H](C(=O)O)[C@H]2C)c1O 252605698 PVMOALMNGRYNOU-PWSUYJOCSA-N 279.336 2.086 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@](C)(O)C(F)(F)F)c1 273450701 FYTNCGNWXBFCRK-PRHODGIISA-N 293.285 2.365 10 20 CECD Oc1c(Cl)cccc1CNCC1=CCCOC1 290183530 NWYABQGSLFUUAV-UHFFFAOYSA-N 253.729 2.482 10 20 CECD CCOC(=O)CCCN[C@H](C)c1cc(OC)ccc1O 81545279 WZZFXROHUOCTOG-LLVKDONJSA-N 281.352 2.395 10 20 CECD COc1ccc(O)c(CN2C[C@H](CN)[C@@H](C)C[C@@H]2C)c1 397429070 ZGPBRDAQVYQUNI-OBJOEFQTSA-N 278.396 2.206 10 20 CECD C=CCNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 68549075 UECKKBLVSFCMSI-ZDUSSCGKSA-N 289.379 2.069 10 20 CECD CCC[C@@H](N)C(=O)NCc1ccc(N(CC)CC)cc1 178711635 FCLPFQBKTOSLFB-OAHLLOKOSA-N 277.412 2.276 10 20 CECD Cc1ccc(C(=O)NCc2cccs2)c(O)c1O 177660843 MZCKUBYPSWABBT-UHFFFAOYSA-N 263.318 2.398 10 20 CECD CO[C@@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 300101219 VQKYPDCQZGSHNW-GFCCVEGCSA-N 283.755 2.469 10 20 CECD CCOC(=O)N1CC[C@H](N[C@@H](C)c2cc(F)ccc2O)C1 186456390 NRAYLTUKMVDDST-JQWIXIFHSA-N 296.342 2.413 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1=CCCOC1 127347909 NZCIWLCVDLUIQU-UHFFFAOYSA-N 260.381 2.497 10 20 CECD C[C@H](NCc1ccc(C(N)=O)cc1)c1cc(F)ccc1O 184862462 ISMMNCLGXAIKJL-JTQLQIEISA-N 288.322 2.481 10 20 CECD CCOC(=O)N1CCC(NCc2cc(C)ccc2O)CC1 71406285 OUPMBDSXTBFBOD-UHFFFAOYSA-N 292.379 2.411 10 20 CECD N#Cc1ccc(O)c(NC(=O)/C=C/c2ccc(O)c(O)c2)c1 181266282 CJFOBCJINZZJAU-ZZXKWVIFSA-N 296.282 2.327 10 20 CECD C[C@H](N[C@H](C)CN1CCCC1=O)c1ccc(F)c(F)c1O 191215186 QDYJKTWPJSHELR-ZJUUUORDSA-N 298.333 2.332 10 20 CECD COC(=O)CCCSc1ncc([N+](=O)[O-])s1 192484059 JLSGFCLKEAPUEG-UHFFFAOYSA-N 262.312 2.097 10 20 CECD OCCO[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 271171231 IXCGPEPTUKRXMK-LLVKDONJSA-N 285.771 2.019 10 20 CECD Cc1ccc([C@@H](C)NCC(=O)NCC(F)F)c(O)c1C 280427608 BOJHVLDBPJKCGK-SNVBAGLBSA-N 286.322 2.041 10 20 CECD CCCCN(CCN1CCOCC1)Cc1ccccc1O 282548911 WWMOBZZFYRQCJC-UHFFFAOYSA-N 292.423 2.327 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@@H](C)C(=O)N(C)C)c1O 808716094 JBIHUBGZZQGNTN-UWVGGRQHSA-N 284.787 2.481 10 20 CECD O=C(NCC1CCSCC1)c1c(F)ccc(O)c1O 295371412 WSODNBVPXWIAJP-UHFFFAOYSA-N 285.340 2.110 10 20 CECD CCOC(=O)CN(C)Cc1cc(Cl)c(F)cc1O 294793476 CRZBDQFMYFCKFD-UHFFFAOYSA-N 275.707 2.180 10 20 CECD Oc1cc(Br)ccc1CNC1CSC1 706453445 YXPDNFRWQFDHJQ-UHFFFAOYSA-N 274.183 2.360 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCC[C@H](N)C2)c1 817970446 VQKVHVNDHREJHG-WCFLWFBJSA-N 292.379 2.099 10 20 CECD C[C@H](NC[C@H]1CNCCCO1)c1cc(Cl)ccc1O 817981695 MSAISSXMQUJVDJ-CMPLNLGQSA-N 284.787 2.075 10 20 CECD FC(F)Cn1cc(CNCc2ccc3c(c2)CCO3)cn1 814292073 MAWWZHVLFQCKBC-UHFFFAOYSA-N 293.317 2.373 10 20 CECD CCC[C@@]1(CO)CCN(C(=O)c2cc(O)cs2)C1 811566099 OFNADEQFLHRYGW-CYBMUJFWSA-N 269.366 2.078 10 20 CECD Cc1cc(O)c(CNC[C@H](CO)[C@@H]2CCOC2)cc1Cl 825752396 ACFBIEJEBMZSRV-DGCLKSJQSA-N 299.798 2.089 10 20 CECD Cc1nc[nH]c1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 822082710 OGCKLZRFVPTCTO-SNVBAGLBSA-N 272.352 2.275 10 20 CECD COCC(COC)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 834894087 YYJMFGCWXPDMHJ-SKDRFNHKSA-N 283.343 2.331 10 20 CECD CCC(F)(F)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 831925605 ZPLSPEKSZRDTHU-MRVPVSSYSA-N 273.279 2.190 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCCN1C 734557537 HKPDNIURJGNALO-MRXNPFEDSA-N 289.423 2.162 10 20 CECD O=C(Nc1ccc2nc(O)[nH]c2c1)c1cc(O)cs1 732264141 AUELLALVAVRRJK-UHFFFAOYSA-N 275.289 2.288 10 20 CECD CCn1ccnc1[C@H](C)NC(=O)NCc1ccccc1O 836628644 UECSIOYZAWDGIE-NSHDSACASA-N 288.351 2.169 10 20 CECD COc1ccc(CNC[C@H]2CC(=O)N(C3CC3)C2)cc1C 846075212 MIZFZTJRSFEEAX-CQSZACIVSA-N 288.391 2.104 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C)C[C@H]1C(N)=O 840939076 KFBUKRQVGVKLLK-WBMJQRKESA-N 289.423 2.147 10 20 CECD CC[C@@H](NC[C@H]1CNC(=O)C1)c1cc(Cl)ccc1O 840833750 PJKRJVYMUUFRQM-JOYOIKCWSA-N 282.771 2.222 10 20 CECD C[C@H]1CN[C@H](C)CN1Cc1cccc(Br)c1O 843120057 SSFVMXNXGJWLQX-ZJUUUORDSA-N 299.212 2.337 10 20 CECD CC[C@H](NCc1cccc(Br)c1O)C(=O)O 843037948 CLSLNWGDJSZVQZ-VIFPVBQESA-N 288.141 2.108 10 20 CECD C[C@@H](N[C@H](C)c1ccc(Cl)cc1O)C(=O)N(C)C 841752951 WJSQPVHHQYUYLR-RKDXNWHRSA-N 270.760 2.173 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 910942600 FZCZUSFRBSZFDG-BHYGNILZSA-N 295.338 2.300 10 20 CECD CCCC[C@H](CN)NCc1cccc(OCC)c1O 841029772 RXTAJJBQILUQEU-CYBMUJFWSA-N 266.385 2.398 10 20 CECD CC[C@@H](C)[C@@H](CNC(=O)NCCc1ccc(N)cc1)OC 841907600 DFBRGAWTRXSXPS-IUODEOHRSA-N 293.411 2.172 10 20 CECD CCC[C@@H](CNC(=O)NCc1cc(C)ccc1O)OC 858500339 BMBFYXWZHBCHLC-ZDUSSCGKSA-N 280.368 2.315 10 20 CECD CCOCc1cc(CN[C@@H]2COC[C@H]2C)ccc1OC 922643500 QQXBAHNJZYLDGS-IUODEOHRSA-N 279.380 2.356 10 20 CECD CCN(Cc1cc(F)cc(C(C)=O)c1O)[C@@H](C)C(=O)O 852736578 QYWVWEZGDBZZDD-QMMMGPOBSA-N 283.299 2.029 10 20 CECD CO[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)C1(C)C 753558368 REFGGVJRJVNEGC-UONOGXRCSA-N 292.379 2.347 10 20 CECD CC[C@@](C)(CN(C)c1ccc(OCC(=O)OC)cc1)OC 877315083 JYFCYFGWVHURRI-INIZCTEOSA-N 295.379 2.490 10 20 CECD Nc1ccc(CCNC(=O)c2cc3c([nH]2)CCCC3)cc1 876527546 IOSBQHRCEDCHKD-UHFFFAOYSA-N 283.375 2.448 10 20 CECD CCN1C[C@H](C)N(Cc2cc(OC)ccc2O)C[C@H]1C 775711878 JOPFFTROXUFGCX-OLZOCXBDSA-N 278.396 2.315 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H](CCO)C2CC2)c1O 771796249 PQJZFKWDTIAMTO-CQSZACIVSA-N 297.782 2.499 10 20 CECD O=C1CN(Cc2ccccc2)[C@@H](c2cccc(F)c2O)N1 778523757 DDZJVRAJFKJRBQ-INIZCTEOSA-N 286.306 2.162 10 20 CECD COCC1CN(Cc2cc(Cl)c(F)cc2O)C1 895970423 XPROOKAJFDGUEK-UHFFFAOYSA-N 259.708 2.263 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(C)cc(OC)c2O)[C@H]1C 787243380 WJXUJEUAIYUQSH-AAEUAGOBSA-N 293.363 2.093 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)c2ncnn2C)c(O)c1 276696575 VJSYLONPISXSBX-MNOVXSKESA-N 260.341 2.241 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCO[C@H](C)C2)c1O 894359416 ODYRMWLOQDKZJW-DGCLKSJQSA-N 265.353 2.366 10 20 CECD COc1ccc(CN2CC[C@@H](OC)C[C@@H]2C)c(O)c1OC 894254763 UWGSYEBTOWEWKG-WCQYABFASA-N 295.379 2.409 10 20 CECD COC[C@@H](NCc1ccc(OC)c(OC)c1O)C(C)C 892966126 QWDBLFWMIQYFSE-GFCCVEGCSA-N 283.368 2.170 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1ccc(N(C)C)cc1 686595601 GKJNLRWMOJATMI-JKSUJKDBSA-N 278.396 2.036 10 20 CECD COc1cc(CNCc2cccc(OC)c2O)ccn1 60942033 BYPKTIQHBKIATR-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](C)S(=O)[C@H](C)C2)c1 792192393 NSNZZGXENNLVQK-VXGBXAGGSA-N 297.420 2.132 10 20 CECD O=C(N[C@@H]1C[C@H]1Cc1ccccc1)c1cccc(O)c1O 790785845 YYEGTFPKXNHGOG-TZMCWYRMSA-N 283.327 2.459 10 20 CECD Nc1ccc(Cc2nc(C3CCOCC3)no2)cc1 87810516 WETRGZUKLJXGPI-UHFFFAOYSA-N 259.309 2.137 10 20 CECD O=C(O)c1coc(CNCc2cccc(F)c2O)c1 1602556702 RSODVHXUNYVLKA-UHFFFAOYSA-N 265.240 2.112 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H](C(=O)O)C(C)C)c1O 1589268535 TUGAWUNNADZRPG-GFCCVEGCSA-N 299.754 2.447 10 20 CECD COc1ccc(N2CCC(N[C@H](C)CCCO)CC2)cc1 168272059 YWIDMQKSZCQAMB-CQSZACIVSA-N 292.423 2.415 10 20 CECD Cc1ccc(O)c(CNCc2cnn(CC(F)F)c2)c1 858239402 NDSGUFQEELAYIY-UHFFFAOYSA-N 281.306 2.452 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@H]1CCc2cccc(O)c21 296666484 FPJAABBICDOWBD-GDAOTKPNSA-N 267.394 2.126 10 20 CECD C[C@@H](NC(=O)[C@H]1CCSC1)c1ccccc1O 827937396 VFIKLUGPECWQMC-ZJUUUORDSA-N 251.351 2.323 10 20 CECD COCCCCC(=O)N[C@@H](C)c1cc(OC)ccc1O 103529043 RNLSZTANIVKLAI-NSHDSACASA-N 281.352 2.395 10 20 CECD COc1cccc(CNC(=O)N[C@H](C)C2CCC2)c1O 127876591 LSPNLGTYFNMMRM-SNVBAGLBSA-N 278.352 2.389 10 20 CECD CN1CCCc2cc(CNC(=O)NCCCF)ccc21 123788789 RIPMZYDJSSCEOP-UHFFFAOYSA-N 279.359 2.228 10 20 CECD CNC(=O)c1ccc(NCc2cc(OC)ccc2O)cc1 36957566 VYQIBTPULRRKTN-UHFFFAOYSA-N 286.331 2.373 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1ccncc1 123669080 TZZDQFPRTJMJMC-UHFFFAOYSA-N 271.320 2.129 10 20 CECD CC(C)[C@@]1(C)C[C@H]1C(=O)NCc1ccc(O)c(O)c1 186462363 QDMQKKZOUBTZCQ-XHDPSFHLSA-N 263.337 2.396 10 20 CECD CC[C@H](COC)N[C@H](C)c1cc(OC)ccc1O 79735697 LUYKQNIJVVZYDG-GHMZBOCLSA-N 253.342 2.476 10 20 CECD CCO[C@H]1C[C@](CO)(NCc2ccccc2O)C1(C)C 186597739 JFUAXCZFDKHORA-GOEBONIOSA-N 279.380 2.048 10 20 CECD CCOc1cccc(CN2CCN(CC)C[C@@H]2C)c1O 289747133 QLOJIVKIGBKBJM-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](Cn3ccnn3)C2)c1 92070683 UBQRKQRMMBYKTN-AWEZNQCLSA-N 286.379 2.204 10 20 CECD CCOc1cccc(CN[C@@H]2CCc3c[nH]nc3C2)c1O 363935500 BPMCGOJUKIXVLT-CYBMUJFWSA-N 287.363 2.161 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@@H]1CCC[C@H]1O 271243657 GOKUTTBQEJZCTI-GOEBONIOSA-N 262.397 2.345 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC2(C)CCC2)c1O 278538369 WWCJYANEDMUQJW-UHFFFAOYSA-N 266.297 2.341 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H](CO)CCOC)cc1 281553930 JKHHXIMKZVLEJF-ZFWWWQNUSA-N 280.412 2.191 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1cc(OC)ccc1O 281225382 KPPHWRNGWUAIGK-LLVKDONJSA-N 281.352 2.174 10 20 CECD CCN(CC(=O)NCc1ccco1)c1ccc(OC)cc1 299325227 ALQDJMYFCJSQGY-UHFFFAOYSA-N 288.347 2.431 10 20 CECD CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(N(C)C)c(C)c1 815102166 MJSNFNOUTZPBOO-GJZGRUSLSA-N 289.423 2.065 10 20 CECD Oc1cc(F)c(Cl)cc1CNCc1cc[nH]n1 816531918 KNWHCWWFJLPAPP-UHFFFAOYSA-N 255.680 2.198 10 20 CECD CN(C)c1ccc(CNCCO[C@@H]2CCCCO2)cc1 813333211 KQZMAMHVADILOY-MRXNPFEDSA-N 278.396 2.385 10 20 CECD Cc1cc(CN2CCOCC23CC3)ccc1N(C)C 815112314 OFDJBSSBLDHFKG-UHFFFAOYSA-N 260.381 2.426 10 20 CECD CCO[C@@H](C(=O)N[C@H](C)c1ccccc1O)C1CC1 827957292 SMJDIBJMEPTRJW-QMTHXVAHSA-N 263.337 2.385 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(OC)c(C)cc2O)C1 902419001 GZBTYXAEIXQDEB-LBPRGKRZSA-N 293.363 2.094 10 20 CECD O=C(c1cc(O)cs1)N1CCC(n2cccn2)CC1 732272907 RUYBDJLAJNVXKH-UHFFFAOYSA-N 277.349 2.128 10 20 CECD C[C@@H](CC(=O)N[C@H](C)c1ccccc1O)n1cccn1 827952356 PEIUZGNOWDOONH-NWDGAFQWSA-N 273.336 2.417 10 20 CECD O=C(O)[C@@H]1CCC[C@@H]1NCc1c(O)cccc1Cl 904269274 ZNWIVSZWURKQGV-KCJUWKMLSA-N 269.728 2.389 10 20 CECD NC(=O)Nc1ccc(NC(=O)c2cc(O)cs2)cc1 732265680 FSKDZULYLCEREQ-UHFFFAOYSA-N 277.305 2.197 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@@H]1CCOC1 840892575 BIMUBWNUZBFRMX-DZGCQCFKSA-N 262.397 2.371 10 20 CECD CC[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841040305 NZGHHXKUAGMAGS-GFCCVEGCSA-N 289.379 2.246 10 20 CECD C[C@@H](CN)N(C)Cc1ccc(N2CCCCC2)cc1 843051471 JBGAYRSSMIOGGC-AWEZNQCLSA-N 261.413 2.456 10 20 CECD CO[C@H]1COCC[C@@H]1CNCc1ccc(N(C)C)cc1C 840949950 DEIVAEOBTKNVSL-WBVHZDCISA-N 292.423 2.202 10 20 CECD NC[C@H]1CC[C@H](NCc2c(O)cccc2Cl)C1 841084973 RCQLMGGVADRJTK-UWVGGRQHSA-N 254.761 2.263 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CO[C@H](C)C2)c1 842926699 AZPJHMXIDSULDZ-SCVCMEIPSA-N 279.336 2.007 10 20 CECD COc1ccc(N(C)CCN(C)CCC2(O)CCC2)cc1 844401368 KEVDWGAGDMVMRQ-UHFFFAOYSA-N 292.423 2.368 10 20 CECD CC(C)[C@H](C)C(=O)N(CC(=O)O)Cc1ccccc1O 911486496 OLEAGRYFWQHHCD-NSHDSACASA-N 279.336 2.098 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CCCN2)cc1 844166549 DRZZGBQYLBYHDW-MRXNPFEDSA-N 289.423 2.243 10 20 CECD O=C(OCCOCC1CCC1)c1cccc(O)c1O 842094637 YKNBUHXOTBJKQJ-UHFFFAOYSA-N 266.293 2.071 10 20 CECD CCOCCOCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 927087617 OMPUMWOVECKLMH-LLVKDONJSA-N 298.339 2.004 10 20 CECD CCOC(=O)/C=C/CN(C)c1ccc(OC)c(OC)c1 929347339 HJORWLKKYQEIAE-VOTSOKGWSA-N 279.336 2.259 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](N)[C@H](CC)C2)c1 843053621 OXNQUOXCSBFAHT-DOMZBBRYSA-N 278.396 2.350 10 20 CECD CC[C@@H](O)CCN[C@H](C)c1cc(F)cc(F)c1O 756657201 BGPXOWIDUJLTRN-PSASIEDQSA-N 259.296 2.482 10 20 CECD O=S1(=O)CC[C@@H](CSc2ncc(Cl)s2)C1 850000207 MELGCQNANYNTPT-LURJTMIESA-N 283.827 2.323 10 20 CECD O=C(OCCF)N(Cc1ccccc1O)C[C@H]1CCCO1 859001695 WXPFWPWSEORUMH-CYBMUJFWSA-N 297.326 2.479 10 20 CECD CCn1cnnc1CCN[C@@H](C)c1ccc(F)cc1O 756733543 PRJUMGCAFXKCJK-JTQLQIEISA-N 278.331 2.036 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cnco2)cc1 758504879 BUHUYZKJRDNPTI-UHFFFAOYSA-N 273.336 2.451 10 20 CECD CC(C)N1CC[C@H](N[C@H](C)c2cc(F)cc(F)c2O)C1=O 756708260 BFPVFCMPDCKRGZ-RNCFNFMXSA-N 298.333 2.330 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H]1CCCOC1 935945999 SJOXTIXUURKBFE-LBPRGKRZSA-N 298.379 2.311 10 20 CECD COc1cccc(CNCc2nc(C)c(C)[nH]2)c1O 862367135 XBKJRAUTIYTVJC-UHFFFAOYSA-N 261.325 2.031 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccnn2C(C)C)c1 862758156 QUIJRVXXVQIRSF-UHFFFAOYSA-N 273.336 2.408 10 20 CECD COC[C@@H](C)[C@H](C)C(=O)NCc1cc(C)ccc1O 862755906 NBGZUAUKYGTAOG-NEPJUHHUSA-N 265.353 2.235 10 20 CECD CCN1C[C@H](C)N(Cc2cc3c(cc2O)OCO3)C[C@@H]1C 769467830 ZRGINNBMGHMFGP-RYUDHWBXSA-N 292.379 2.035 10 20 CECD COc1ccc(N(C)CCN(C)C[C@H]2CCO[C@@H]2C)cc1 878805377 KTVIJBHXZOJCJC-HUUCEWRRSA-N 292.423 2.488 10 20 CECD C[C@@H](N[C@H]1CCN(C2CC2)C1=O)c1ccc(N(C)C)cc1 1116673985 QICMWGHIJBCKBL-WBMJQRKESA-N 287.407 2.167 10 20 CECD CN(Cc1ccc(N2CCC(O)CC2)cc1)C1CC1 876579875 ARBUEDPAODPNHC-UHFFFAOYSA-N 260.381 2.242 10 20 CECD COC(=O)[C@H](C)CN(Cc1ccc(C)cc1O)C1CC1 877171085 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BDUWRMMCUWBIIL-AAEUAGOBSA-N 295.379 2.266 10 20 CECD CC[C@H](NCc1cc(C)cc(OC)c1O)C(C)(C)O 894863762 REOFEBUIPAXUJT-ZDUSSCGKSA-N 267.369 2.348 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@H]2CCC(=O)[C@@H]2C)c1 793688150 CWFRAQNNDNGWDK-GHMZBOCLSA-N 291.347 2.022 10 20 CECD CC[C@H](NC[C@@](C)(O)COC)c1ccc(C)cc1O 794811349 WZQHTSCGJKKEGB-DZGCQCFKSA-N 267.369 2.139 10 20 CECD CCN(CC(=O)O)Cc1c(O)cccc1Br 706673941 NZMXSNAUAZZZSK-UHFFFAOYSA-N 288.141 2.061 10 20 CECD O=C(N[C@H]1C[C@@H]1Cc1ccccc1)c1cccc(O)c1O 790785843 YYEGTFPKXNHGOG-JSGCOSHPSA-N 283.327 2.459 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)c1cnccn1 765608071 HVLVTBITXBIAQS-LLVKDONJSA-N 255.321 2.262 10 20 CECD COC[C@@H]1CCCN(Cc2c(O)cccc2OC)C1 769402127 BGVQWBDAAMRXCY-GFCCVEGCSA-N 265.353 2.259 10 20 CECD CCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)[C@@H]1C 985839875 UZRQXQKYSIEXPQ-ZFWWWQNUSA-N 290.407 2.493 10 20 CECD CN1CCCc2cc(CN[C@@H]3CC[C@H](C(=O)O)C3)ccc21 1606230091 PWGGUBGKEJPCJK-LSDHHAIUSA-N 288.391 2.412 10 20 CECD COc1cc(C)cc(CN[C@H]2C[C@@H]3C[C@]3(C(=O)O)C2)c1O 1607149503 RMXFYGDUWLGZKI-WQGACYEGSA-N 291.347 2.052 10 20 CECD CCc1oc(/C=C2/SC(=S)NC2=O)cc1C(=O)O 1610079751 NFXWNOSEDSVHIA-XBXARRHUSA-N 283.330 2.029 10 20 CECD COc1cc(Cl)cc(CNCCc2cnn(C)c2)c1O 228671645 ZBPHDVWKHHCTBW-UHFFFAOYSA-N 295.770 2.120 10 20 CECD CN(C)c1cncc(NC(=O)N(C)c2ccc(N)cc2)c1 1578429310 SOXJZDLNZQXWCS-UHFFFAOYSA-N 285.351 2.398 10 20 CECD CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)C[C@H](C)O1 160176367 AVRRQJKRJARSRE-AAEUAGOBSA-N 295.379 2.409 10 20 CECD CC[C@H](NCc1cnnn1CC)c1ccccc1O 838913706 WQGBWLIOMOVIMN-ZDUSSCGKSA-N 260.341 2.245 10 20 CECD C[C@@H]1OCC[C@H]1CN1CCCc2cc(CN)ccc21 866659937 YGJPNOWMWWNNAY-WFASDCNBSA-N 260.381 2.323 10 20 CECD CC(C)NCc1ccc(N2CCN(C)CC2)c(F)c1 34823177 PYAUFRVXCZEOJQ-UHFFFAOYSA-N 265.376 2.076 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)CN 164824778 JGVQJXIOCBTCMH-UHFFFAOYSA-N 277.412 2.086 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)c2ncn(C)n2)c(O)c1 275745781 REHAIFVPOQNDRA-QWRGUYRKSA-N 260.341 2.241 10 20 CECD C[C@@H]1CCCN(Cc2cc(F)ccc2O)[C@H]1CCN 404516898 SXKKIGBRJHYPRT-RISCZKNCSA-N 266.360 2.481 10 20 CECD Oc1cccc(Cl)c1CNC[C@@H](O)C1CCC1 316674864 YKSRNCKHDAGFHT-CYBMUJFWSA-N 255.745 2.296 10 20 CECD CC1(C)COCCN1Cc1cc(F)cc(F)c1O 708424694 ZTIAUVBTOYHVJB-UHFFFAOYSA-N 257.280 2.281 10 20 CECD COc1cccc(CN[C@H]2CS[C@H](C)C2)c1O 397976657 PIJHWWZXFHOLGM-MWLCHTKSSA-N 253.367 2.384 10 20 CECD COCc1cccc(/C=C2\SC(=S)NC2=O)c1 174052154 PLLSBPKYSUSMKU-POHAHGRESA-N 265.359 2.322 10 20 CECD CCCOc1ccc(CNC[C@]2(O)CCSC2)c(O)c1 176758315 ZFAWXEVXOKLUIR-OAHLLOKOSA-N 297.420 2.139 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@@H]2CCOC2)cc1F 176959426 CXCFBOIAFQLLJC-GFCCVEGCSA-N 294.370 2.325 10 20 CECD CCN(CC)c1ccc(CNC(=O)NCC[C@H](C)O)cc1 172225633 XADDMPPVLPVRME-ZDUSSCGKSA-N 293.411 2.103 10 20 CECD COc1ccc(O)c(CN2CCC([C@H]3CCCN3)CC2)c1 63197476 VYTCUOUQHJCDSW-MRXNPFEDSA-N 290.407 2.365 10 20 CECD CC[C@@H](OC)C(=O)NCc1ccc2c(c1)CCCN2C 69960607 JYDNXLQHBMEOIN-OAHLLOKOSA-N 276.380 2.110 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCCO2)cc1 79389926 GBWBSMLAANUPDR-OAHLLOKOSA-N 276.380 2.328 10 20 CECD COc1cccc(CN2CCOC(C)(C)C2)c1O 132308913 KJFUVEQORWCBDP-UHFFFAOYSA-N 251.326 2.012 10 20 CECD CCCCN(C)C(=O)CSc1ncc([N+](=O)[O-])s1 192531952 DRWVRVVJYXPCOI-UHFFFAOYSA-N 289.382 2.402 10 20 CECD COCC(=O)N(Cc1ccco1)Cc1ccccc1O 247832836 LQLROENWUHDAJH-UHFFFAOYSA-N 275.304 2.160 10 20 CECD CN(C)c1ccc(CNC[C@@](C)(O)c2ccco2)cc1 266162941 OHGROBSDCFOARB-MRXNPFEDSA-N 274.364 2.343 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCCC2CC2)c1O 278292735 BVWGVUZSXYYHTJ-UHFFFAOYSA-N 266.297 2.199 10 20 CECD Cc1ccc(O)c(CN2CCCC[C@@H](S(C)(=O)=O)C2)c1 278634152 IJGGHNXSJSICPO-CQSZACIVSA-N 297.420 2.100 10 20 CECD CC(C)C[C@H](CO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273300370 BFMPBNBTIPLCHI-WDEREUQCSA-N 282.340 2.358 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H]1[C@H]1CCCO1)OCO2 284025510 IFRGIFZBKWDIBU-GXTWGEPZSA-N 291.347 2.264 10 20 CECD COCC1(C(=O)NCc2ccc(N(C)C)c(F)c2)CCC1 283843964 HMVZZFOECASGOG-UHFFFAOYSA-N 294.370 2.325 10 20 CECD Cc1ccc(O)c(CN(C)C[C@@H](O)C(F)(F)F)c1 809751313 QQHALNBTAUDJBU-LLVKDONJSA-N 263.259 2.056 10 20 CECD CC1(CCN2C(=O)CN(Cc3ccccc3O)C2=O)CC1 819168747 CKNSYEOTNSTOKA-UHFFFAOYSA-N 288.347 2.347 10 20 CECD CNC(=O)[C@@H](C)CN(C)Cc1ccc2ccccc2c1O 816520460 PYMGELPYOUMPCH-LBPRGKRZSA-N 286.375 2.359 10 20 CECD COc1ncc(/C=C/C(=O)N(C)c2ccccc2F)cn1 492741711 UAPORZIGIIEEOT-BQYQJAHWSA-N 287.294 2.301 10 20 CECD COc1ccc(CN[C@H]2C[C@@H](C(=O)OC)C2)cc1C 827501125 REHXVFQJPZHTDI-BETUJISGSA-N 263.337 2.045 10 20 CECD CCOCc1cc(CN[C@@H](C(=O)O)C2CC2)ccc1OC 901475948 ATUGWYAFNOYIEP-OAHLLOKOSA-N 293.363 2.185 10 20 CECD CCC1(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CCC1 832266846 JQBYGJLSAJDZDR-OAHLLOKOSA-N 289.423 2.449 10 20 CECD Cc1cc(C(=O)NCC2(N)CCC2)c(C)n1-c1ccccn1 831549461 BFIHEEJDIOPCIQ-UHFFFAOYSA-N 298.390 2.100 10 20 CECD O=C(O[C@@H]1C[C@@H]2CCCC[C@@H]2NC1=O)c1cc(O)cs1 837516504 YOBUZSQZYYDSIC-INTQDDNPSA-N 295.360 2.058 10 20 CECD Nc1ccc(CNC(=O)CCC2CCOCC2)cc1 837303096 UPOWKEGFKNLXAH-UHFFFAOYSA-N 262.353 2.092 10 20 CECD COc1cccc(O)c1CNCc1nc(C(C)(C)C)n[nH]1 839170752 PYXHTLAYJVLCPC-UHFFFAOYSA-N 290.367 2.106 10 20 CECD CC(C(=O)OCC(=O)c1ccc(O)c(O)c1)=C1CCC1 838236489 SQOPSTFZEMHYHH-UHFFFAOYSA-N 276.288 2.324 10 20 CECD O=C(NCc1ccc(O)cc1O)C1CCC=CCC1 910957019 NNXILYHNZPCWBK-UHFFFAOYSA-N 261.321 2.460 10 20 CECD COc1cccc([C@H](C)NC[C@H](O)CC(C)C)c1O 846142315 RIJVZYVHZXWDKX-NWDGAFQWSA-N 267.369 2.458 10 20 CECD COc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)o1 847695788 IDPBJAORLIJHBH-VIFPVBQESA-N 291.303 2.060 10 20 CECD COc1ccc(CC(=O)NCCc2ccc(N)cc2)c(C)c1 911782785 NFGFJESVYBRDCN-UHFFFAOYSA-N 298.386 2.487 10 20 CECD COc1cc(O)c(CNCc2cccc(N)c2)cc1OC 849350764 VKWPIYZIFNUILX-UHFFFAOYSA-N 288.347 2.281 10 20 CECD CCOc1ccc([C@@H]2NC3(CCCC3)C(=O)N2C)c(O)c1 742441889 LYVZUJDHXIFHOL-CQSZACIVSA-N 290.363 2.164 10 20 CECD C[C@H](NCC[C@@]1(O)CCCOC1)c1ccc(N(C)C)cc1 846214256 LJEDTOAZYSDCRG-YOEHRIQHSA-N 292.423 2.335 10 20 CECD CN(C[C@H]1CCCC[C@@H]1O)C(=O)Nc1ccc(N)cc1 841295774 GDNQOHFXDUKFAW-RISCZKNCSA-N 277.368 2.284 10 20 CECD NCc1ccc2c(c1)CCCN2CCC1CCNCC1 843350131 JWXAPBHUHGLPMV-UHFFFAOYSA-N 273.424 2.288 10 20 CECD CN(C)c1nccc(CNCc2ccc3c(c2)CCCO3)n1 921968364 NKXFXNVKIRUYDR-UHFFFAOYSA-N 298.390 2.157 10 20 CECD N[C@H]1CCC[C@@H](NCc2c(O)cccc2Cl)C1 841056923 FYUXGIGPEDWXGT-VHSXEESVSA-N 254.761 2.405 10 20 CECD CCN(C(=O)/C=C\c1cnc(C)s1)c1cnn(C)c1 848342975 WUKARQBTYBQRRH-WAYWQWQTSA-N 276.365 2.251 10 20 CECD CCN(CCN1CCCC1=O)c1ccc(OC)c(OC)c1 921062510 ZPRYWMSZRSZYHM-UHFFFAOYSA-N 292.379 2.153 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCOC[C@@H]2C)c(O)c1 756533050 HOOHVXKISUMQMM-UONOGXRCSA-N 278.396 2.072 10 20 CECD CON(C)CCN[C@@H](C)c1ccc(Cl)cc1O 850478731 XAXUBIWWQOWOLO-VIFPVBQESA-N 258.749 2.189 10 20 CECD CON(C)CCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 850479280 PFJZLCZNAVNXKB-GXSJLCMTSA-N 268.332 2.162 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)C(F)(F)F)c1 858460403 ALCWEZUAGFHFLL-QMMMGPOBSA-N 276.258 2.451 10 20 CECD CC[C@@H]1C[C@@H](C)CN1Cc1cc2c(cc1O)OC[C@@H]2O 768464964 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ODLDMVFUABIEDL-NEPJUHHUSA-N 275.396 2.070 10 20 CECD C[C@@H](NCCCC1(O)CCC1)c1cc(C(=O)O)ccc1O 1593264585 KRHZIMUSPZSHFK-LLVKDONJSA-N 293.363 2.436 10 20 CECD CC[C@H](N[C@@H]1CC12CC2)c1cccc(-c2nn[nH]n2)c1O 1590467769 TZPWMCIHWUBLFE-NWDGAFQWSA-N 285.351 2.166 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@](F)(C(=O)O)C2)cc1 1777039994 UKKHNFUTUUHMBG-DOMZBBRYSA-N 280.343 2.188 10 20 CECD Cn1nc(CNCc2ccccc2O)cc1C1CC1 922953619 CZNYQTBLRJSTKF-UHFFFAOYSA-N 257.337 2.293 10 20 CECD CCc1cccc(CN[C@H](C)Cc2cnn(C)c2)c1O 848913887 AUCRPYSCNCQVHI-GFCCVEGCSA-N 273.380 2.409 10 20 CECD CC(C)[C@H]1CN(C(=O)Cc2ccc(N)cc2)CCS1 236620493 OAZSDWYNRNGUKR-CQSZACIVSA-N 278.421 2.411 10 20 CECD COc1ccc(CN[C@H](C)[C@H]2CCCO2)c(O)c1 40906053 KVIHTKYZBCPCHP-QMTHXVAHSA-N 251.326 2.058 10 20 CECD Nc1ccc(CN2CC[C@@H](N3CCCCC3)C2)cc1 62977628 SCTDMGQKSBIYPH-MRXNPFEDSA-N 259.397 2.329 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](C)[C@H]2CCN)c1 404415929 GATCFBRPGRAQID-IUODEOHRSA-N 278.396 2.350 10 20 CECD C[C@H](N[C@H](CO)C[C@H]1CCCO1)c1cc(F)ccc1O 886670144 JXYCBWNVPKLFNO-WCFLWFBJSA-N 283.343 2.112 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)/C=C/c1cnn(C)c1 115280419 KLTZGDAPWUBAHC-VMPITWQZSA-N 298.390 2.124 10 20 CECD CC(C)C[C@@H](CNCc1ccccc1O)N(C)C 20201263 UEFTWVDFTSWMPN-AWEZNQCLSA-N 250.386 2.458 10 20 CECD CCN(CC)CCN(CCOC)Cc1ccccc1O 179570678 XXDAFSBUQDCBIG-UHFFFAOYSA-N 280.412 2.182 10 20 CECD C[C@@H](NCc1ccccc1O)c1ccc2[nH]c(=O)[nH]c2c1 37163201 CNXJONOWSYQJEV-SNVBAGLBSA-N 283.331 2.413 10 20 CECD CCC[C@@](C)(NCc1ccccc1O)C(=O)OC 184047313 YGWILXRFXOJXCL-CQSZACIVSA-N 251.326 2.214 10 20 CECD CC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCS1 181140865 VDVWGSFCWCKYBL-FUEXJSSKSA-N 293.388 2.465 10 20 CECD Oc1cccc(Cl)c1CN1C[C@@H]2CCCN[C@@H]2C1 219803436 ZXRQOEYLIVQYCS-GXFFZTMASA-N 266.772 2.229 10 20 CECD CO[C@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 234888618 VQKYPDCQZGSHNW-LBPRGKRZSA-N 283.755 2.469 10 20 CECD O=C(Cn1ccnc1C1CC1)c1ccc(O)c(O)c1 530131863 PKQBZTVDEOJLLG-UHFFFAOYSA-N 258.277 2.055 10 20 CECD Cn1nncc1CNCc1ccc(N2CCCCC2)cc1 267529967 RQNUPJJFQVVBRV-UHFFFAOYSA-N 285.395 2.095 10 20 CECD COCC[C@H](C)N[C@@H](C)c1cc(C(=O)OC)ccc1O 273604649 SVGAFULAYKMZBN-QWRGUYRKSA-N 281.352 2.254 10 20 CECD Cc1cccc(CN[C@@]2(CO)CCOc3ccccc32)c1O 282159753 DHPUYOUMVWKVTC-GOSISDBHSA-N 299.370 2.461 10 20 CECD O=S1(=O)CCC[C@H](CSc2nccs2)C1 284399278 ZLYPEUTUJQKGPY-MRVPVSSYSA-N 263.409 2.060 10 20 CECD C[C@](O)(C(=O)NCc1c(O)ccc2c1CCCC2)C1CC1 287390604 RPOMPVDBYAMNNN-QGZVFWFLSA-N 289.375 2.048 10 20 CECD CC[C@H](NCC(C)(C)C(=O)NC)c1ccc(F)cc1O 285938766 DHBPZZODRACYIW-LBPRGKRZSA-N 282.359 2.344 10 20 CECD CCCc1nc(C)c(CNC(=O)c2cccc(O)c2O)o1 293890722 MTSPCCYSUOPZAD-UHFFFAOYSA-N 290.319 2.277 10 20 CECD CCn1nc(C)c(C(=O)NCc2ccc(N)cc2)c1Cl 297323999 XCGQMYYMIUCEMY-UHFFFAOYSA-N 292.770 2.377 10 20 CECD CCOc1cccc(CN2CCCc3n[nH]cc32)c1O 291707860 ZPXQCNYMKLCZPZ-UHFFFAOYSA-N 273.336 2.467 10 20 CECD Cc1cc(Cl)cc([C@H](C)NC[C@H]2COCCO2)c1O 808677837 FJSGHTMVBSNPPA-JQWIXIFHSA-N 285.771 2.420 10 20 CECD Cc1cc(C)c([C@H](C)NCC2(CO)CCOCC2)c(O)c1 294802328 PAYXVUBVCFKENQ-AWEZNQCLSA-N 293.407 2.449 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C2CNC2)cc1 817890049 WHKIFQLLQCRDDY-CYBMUJFWSA-N 261.413 2.230 10 20 CECD CN(C)c1ccc(OC[C@@H]2CC3(CC3)C(=O)O2)cc1 810001015 UBXRWECPIFPQEQ-ZDUSSCGKSA-N 261.321 2.227 10 20 CECD C[C@@H](N[C@@H](CN)C1CCCC1)c1cc([N+](=O)[O-])ccc1O 817981753 NJXWYSWGRFYAGG-YGRLFVJLSA-N 293.367 2.469 10 20 CECD CN(C)c1ccc(CNCCC(C)(C)CO)cc1F 824602928 HTULABDZHONPBR-UHFFFAOYSA-N 268.376 2.390 10 20 CECD COc1ccc(N(C)C(=O)/C=C\c2cnccc2C)cn1 492542232 ZBDHDCNJGRXZPO-DAXSKMNVSA-N 283.331 2.470 10 20 CECD Cc1cc(O)c(CNCc2cncn2C)cc1Cl 825944328 UKFSWTYKCPGNSG-UHFFFAOYSA-N 265.744 2.377 10 20 CECD CN(C[C@]1(C)CCCNC1)c1ccc2c(c1)OCO2 904331414 HEQZNMPIFPYNGV-OAHLLOKOSA-N 262.353 2.241 10 20 CECD CCOCCOC1CN(Cc2ccc(OCC)cc2O)C1 838991180 JVISWSUAWVDOJH-UHFFFAOYSA-N 295.379 2.028 10 20 CECD COc1cccc([C@H](C)N[C@@H](CO)CC(F)(F)F)c1O 846157898 PFOWYRPGLCWBLQ-DTWKUNHWSA-N 293.285 2.365 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C(=O)O)C2)cc1 846227235 KKLOJHRXGQJYKP-ZDUSSCGKSA-N 262.353 2.049 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1=COCC1 840558451 YKLAGYLEZPGULE-ZDUSSCGKSA-N 288.391 2.412 10 20 CECD CCOc1ccc(CN2CC[C@H](C)[C@H](CN)C2)c(O)c1 841101046 NHOSMKBNFDUDST-GXTWGEPZSA-N 278.396 2.208 10 20 CECD CO[C@@H](CS(=O)(=O)Nc1ccc(O)cc1C)C(C)C 842584696 IGNJIRRQTHRIHI-ZDUSSCGKSA-N 287.381 2.113 10 20 CECD C[C@H]1C[C@H](C)CC[C@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841038312 UQMTXVHGHNVUIA-UHIISALHSA-N 289.379 2.148 10 20 CECD CC[C@H]1CN(C)CCCN1C(=O)c1cc(O)cs1 846987767 IIDKWRVSOSJABK-JTQLQIEISA-N 268.382 2.010 10 20 CECD CC[C@H](NC[C@@H]1CCCNC1=O)c1ccc(C)cc1O 840825806 MOTWYCXWAWUPDL-JSGCOSHPSA-N 276.380 2.268 10 20 CECD C[C@H](OC(=O)c1cccc(O)c1O)c1ccncc1 758555982 AWCVLQDZHWRKNQ-VIFPVBQESA-N 259.261 2.411 10 20 CECD C[C@H](NC(=O)COC(F)(F)F)c1ccc(N(C)C)cc1 935464958 OGPLEWDEOONDMC-VIFPVBQESA-N 290.285 2.466 10 20 CECD COCC1(O)CCN(Cc2c(O)cccc2Cl)CC1 769452172 QXFXMZYXHVTUST-UHFFFAOYSA-N 285.771 2.019 10 20 CECD COc1ccc(N2CCCN(Cc3cn[nH]c3)CC2)cc1 768997843 IFSYTPLPGTZQQT-UHFFFAOYSA-N 286.379 2.131 10 20 CECD C[C@H](C[C@@H]1CCOC1)NC(=O)N(C)Cc1ccccc1O 760192793 ISJQSFZOTDLTGG-OLZOCXBDSA-N 292.379 2.349 10 20 CECD CC(C)(O)[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1 877796605 KGBJZLGXKPOUPV-LBPRGKRZSA-N 293.363 2.104 10 20 CECD CCCOc1ccc(CNCC2(O)CCOCC2)cc1C 873041355 GVBCUTXRPHNNEC-UHFFFAOYSA-N 293.407 2.415 10 20 CECD CCS(=O)(=O)C1CCN(Cc2c(C)cccc2O)CC1 877480877 MQSKAFIBFCJEEV-UHFFFAOYSA-N 297.420 2.100 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCC[C@H]1CCO)c1ccccc1O 875516386 VUQSRZCKHTWHSX-MBNYWOFBSA-N 292.379 2.304 10 20 CECD CCN(C)c1ccc(CN2CC[S@@](=O)C[C@H](C)C2)cc1 773889518 WNXFRKSTYPLHRQ-JLTOFOAXSA-N 294.464 2.343 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H]2CCO)c1O 779202588 PBEGHHVZVUNCBO-GFCCVEGCSA-N 285.771 2.401 10 20 CECD CCN(C)c1ccc(CN2CCCC[C@@H]2C(=O)NC)cc1 773748660 QDAWLROWQPDCNA-MRXNPFEDSA-N 289.423 2.243 10 20 CECD COc1ncc(/C=C\C(=O)N(C)c2ccc(C)cc2)cn1 775828444 YGYMIPOPVHMDOT-TWGQIWQCSA-N 283.331 2.470 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)NCc1cc(F)cc(F)c1O 882941028 GGZIDBBMDNDDGN-IUCAKERBSA-N 286.322 2.063 10 20 CECD CSCc1cn(Cc2ccc(N(C)C)cc2)nn1 881272518 YKZSNDRXHLOMIY-UHFFFAOYSA-N 262.382 2.255 10 20 CECD Oc1ccc(F)cc1CN1CCC2(CC1)C[C@@H](O)CCO2 897261089 WFHHDZXMNFVENU-AWEZNQCLSA-N 295.354 2.037 10 20 CECD CCOC(=O)c1cnc(S[C@@H]2CCOC2)s1 703029687 RXNYICNMRLHGJW-SSDOTTSWSA-N 259.352 2.201 10 20 CECD C[C@]1(O)CCCN(Cc2cc(F)cc(F)c2O)C1 894044662 WJRXVKSIILZZCJ-ZDUSSCGKSA-N 257.280 2.017 10 20 CECD COc1cccc(O)c1CNc1ccc(C(N)=O)cc1 750720325 NMMOSSYERCIHOC-UHFFFAOYSA-N 272.304 2.112 10 20 CECD C[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C2CC2)O1 792670379 QSICSTFMQRHVTE-KCJUWKMLSA-N 267.350 2.093 10 20 CECD Oc1cc(Br)ccc1CNC[C@H](O)C1CC1 691428618 MSNDMRMSKVLMFM-LBPRGKRZSA-N 286.169 2.015 10 20 CECD OCCN(Cc1ccccc1O)[C@H]1C[C@H]2CC[C@H]1C2 793329534 UYGUKZPBZMHAJZ-YDHLFZDLSA-N 261.365 2.375 10 20 CECD CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc(O)cs1 791058216 BRXJZHZVYPFAHJ-LBPRGKRZSA-N 282.409 2.304 10 20 CECD CN(C)c1ccc(CN[C@](C)(C(=O)O)C2CC2)cc1 1777039577 RIQQUWVOLOFADV-HNNXBMFYSA-N 262.353 2.096 10 20 CECD CC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C(F)F 1330676645 JRTWTBGDHPJIDA-RNEXMXFGSA-N 271.263 2.271 10 20 CECD COC(=O)CC1CC(N[C@H](C)c2ccccc2O)C1 1336757638 JPUZMKKJHFTSFT-VOMCLLRMSA-N 263.337 2.385 10 20 CECD CC(C)[C@@H](NCc1cc(F)c(N(C)C)cc1F)C(=O)O 1331846158 MJJDWVZVEZQZQX-CYBMUJFWSA-N 286.322 2.230 10 20 CECD CC[C@@H](F)C(=O)NCCCSc1nccs1 1337075394 CRQLVSXRJWUDPE-MRVPVSSYSA-N 262.375 2.490 10 20 CECD CN(C)c1cc(F)c(CN[C@@H](C(=O)O)C2CCC2)cc1F 1262163752 FPISKGLDKNMUPA-CQSZACIVSA-N 298.333 2.374 10 20 CECD CC1(C)CNCCN1Cc1cc(Br)ccc1O 220291651 JKJJQTAXMAGQQZ-UHFFFAOYSA-N 299.212 2.339 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccc(F)cc1 158895631 DTGMACYIFABWAG-UHFFFAOYSA-N 261.252 2.167 10 20 CECD O=C(O)c1cc2ccccc2c(CN2CCO[C@@H]3C[C@H]32)c1O 1608866058 URCLPXYJYMWADY-HUUCEWRRSA-N 299.326 2.217 10 20 CECD N[C@@H]1C[C@H]1C1CCN(Cc2cc(F)c(F)cc2O)CC1 1574268874 JKQWRYDZTMANOH-SMDDNHRTSA-N 282.334 2.230 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCc2ccc(Cl)cc2O)C1 1574761926 WGGWYPSEPBJFSH-KCJUWKMLSA-N 269.728 2.389 10 20 CECD CCc1cccc(CN(C)C[C@@H](C)C(=O)O)c1O 1573960723 NOMMHNVRYNICNI-SNVBAGLBSA-N 251.326 2.107 10 20 CECD C[C@H](N[C@H]1CCC[C@H]1C)c1cccc(-c2nn[nH]n2)c1O 1589952990 BLUCPYFSAXQHPG-NRUUGDAUSA-N 287.367 2.412 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)Sc1ncc(C(=O)O)s1 1594988076 WQLKYICXQWGNGK-BQBZGAKWSA-N 288.394 2.237 10 20 CECD CN(C)c1ccc(CNC2CC3(C2)C[C@H]3C(=O)O)cc1 1777040017 ZUQMWHZSORHGPT-UGWHAMFMSA-N 274.364 2.096 10 20 CECD C[C@@H](N)[C@H]1CCCCN1Cc1ccc(N(C)C)cc1 63191473 SRSSVXUOTVFAAC-CZUORRHYSA-N 261.413 2.454 10 20 CECD C[C@H](CNCc1ccc2c(c1)CCO2)Cn1ccnc1 67500434 NWRUFRYXZCJJFC-CYBMUJFWSA-N 271.364 2.244 10 20 CECD CCc1cccc(CN[C@@H](CO)CC(F)(F)F)c1O 717734856 IEASBAUTZFAHCG-LLVKDONJSA-N 277.286 2.358 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cc[nH]c2)c1 111608345 BUKXNJYYCAGFJS-VIFPVBQESA-N 260.293 2.220 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc[nH]n1 66096356 KAZXTVARKDUGDD-UHFFFAOYSA-N 259.309 2.168 10 20 CECD CNCCCN(C)Cc1cc(Cl)cc(C(C)=O)c1O 124716463 XKBCOKOOJWOBSO-UHFFFAOYSA-N 284.787 2.290 10 20 CECD OCC1(NCc2cccc(Cl)c2O)CCCC1 127878653 NGKUFNCXEAAFSS-UHFFFAOYSA-N 255.745 2.440 10 20 CECD c1cc(N2CCCCC2)ccc1CNC[C@@H]1COCCO1 37998058 GTKIMALVPJTYMD-QGZVFWFLSA-N 290.407 2.182 10 20 CECD C[C@H](N[C@@H]1CCCn2ncnc21)c1ccc(F)c(F)c1O 187751540 RYRWCURNASOQKY-GZMMTYOYSA-N 294.305 2.448 10 20 CECD C[C@H](NCCCN1CCC(O)CC1)c1cc(F)ccc1O 185116528 JNCSEHMUZLCEKX-LBPRGKRZSA-N 296.386 2.029 10 20 CECD CCc1ncc(C(=O)NCCc2ccc(N)cc2)s1 237068102 QMKWFVWJLSMRHT-UHFFFAOYSA-N 275.377 2.260 10 20 CECD Cc1cc(C(=O)N2CCC(N)CC2)c(C)n1-c1ccccn1 237678852 AAWIDLZVZZQQDD-UHFFFAOYSA-N 298.390 2.052 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCCC[C@@H]2N)cc1 94752514 HOYPRJDYUUZGIE-CVEARBPZSA-N 289.423 2.276 10 20 CECD Cc1c(CNC(=O)c2ccnnc2)n(C)c2ccccc12 352133837 GFRZLGYURSEEJB-UHFFFAOYSA-N 280.331 2.207 10 20 CECD 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ZWGMVYZZFFAIFI-LBPRGKRZSA-N 293.367 2.264 10 20 CECD Cc1ccc(CNC(=O)Cc2ccc(N)cc2)s1 50225102 PCJVOGWKIHZHPY-UHFFFAOYSA-N 260.362 2.498 10 20 CECD C[C@H]1CCCN1C(=O)NCc1ccc(N(C)C)cc1 173321511 ZGPMDONJUJMXKY-LBPRGKRZSA-N 261.369 2.447 10 20 CECD C[C@H](Oc1cccnc1)C(=O)N(C)Cc1ccccc1O 117971129 OTCGNOKLGAWYLJ-LBPRGKRZSA-N 286.331 2.213 10 20 CECD CC[C@@H](N[C@@H]1CCCCNC1=O)c1ccc(N(C)C)cc1 177874419 XQXTVNCGSRXIQD-HZPDHXFCSA-N 289.423 2.462 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccco1 183481137 KZUNTMACJZYSNS-ZRQQLDRUSA-N 287.315 2.451 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)Cc1ccoc1 187488783 KPEHQYPMRHUSHN-UHFFFAOYSA-N 286.331 2.314 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCN2CCCC2=O)c1 182346034 KYDMPVGVCOTKHC-GFCCVEGCSA-N 292.379 2.064 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@@H](C)c1ccc(N(C)C)cc1 37782523 ZMYGQYWRJQJOJR-KBPBESRZSA-N 289.423 2.414 10 20 CECD CCN1CC[C@@H]2CC[C@@H](C1)N2Cc1cc(OC)ccc1O 180697485 QLPBGIJCLVPZIF-GJZGRUSLSA-N 290.407 2.459 10 20 CECD C[C@@H]1CCCCN1C(=O)CN(C)Cc1ccccc1O 174854028 KLJMFVKLFPRRSM-CYBMUJFWSA-N 276.380 2.225 10 20 CECD COc1cc(Cl)cc(CNCc2ccon2)c1O 228675855 QUEUHHHXOXMCBH-UHFFFAOYSA-N 268.700 2.332 10 20 CECD CO[C@]1(C)C[C@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 193131144 MNALCRXRBAJENH-BLLLJJGKSA-N 293.363 2.373 10 20 CECD O=C(NCc1ccccc1O)c1cc(Cl)ccn1 133761103 MQIVAAUFHUBBHV-UHFFFAOYSA-N 262.696 2.371 10 20 CECD C[C@@H]1[C@H](C(=O)NCCc2ccc(O)c(O)c2)[C@H]1C1CC1 528856504 AXSFQUUGGHQLLD-AMFBXLIHSA-N 275.348 2.049 10 20 CECD C[C@H](NCCS(=O)(=O)C(C)(C)C)c1ccccc1O 183602761 FBXJBYUWLHHKHH-NSHDSACASA-N 285.409 2.256 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](N)C(C)C)cc1F 269267215 PXVSETRGMDFFGZ-OAHLLOKOSA-N 295.402 2.271 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2cccnc2)c1 273429175 VCUDDFZGKFYGSM-LLVKDONJSA-N 286.331 2.425 10 20 CECD CCOCCN(CC)Cc1ccc([N+](=O)[O-])c(OC)c1O 278151521 CJSSNNPPRGEEGQ-UHFFFAOYSA-N 298.339 2.167 10 20 CECD CN(C)c1ccc(CN(C)S(=O)(=O)CCC2CC2)cc1 271233112 AYXGRYIEWSCGTB-UHFFFAOYSA-N 296.436 2.314 10 20 CECD C[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)CCO1 271422479 ZSLGNTLBOAWIBT-WCQYABFASA-N 278.352 2.101 10 20 CECD C[C@H]1C(=O)N(c2cc(Cl)c(N)c(Cl)c2)C(=O)N1C 278252291 XATMJIHLAMZYHX-YFKPBYRVSA-N 288.134 2.363 10 20 CECD COc1ccc(O)c(CN2CCc3ccccc3[C@@H]2CO)c1 271780385 HQNCEQJOCRLJAK-KRWDZBQOSA-N 299.370 2.493 10 20 CECD COc1cc(O)c(CN[C@@H](CO)CC2CCC2)cc1OC 279953010 ZSGYJGCZTHALFE-CYBMUJFWSA-N 295.379 2.050 10 20 CECD CNC(=O)CCCN[C@@H](C)c1ccc(C)c(C)c1O 273465207 DPEZBKKJZYDLGX-LBPRGKRZSA-N 264.369 2.186 10 20 CECD Cc1ccc(C(=O)NCCC(C)(F)F)c(O)c1O 295916406 IMSUISNVTYOARV-UHFFFAOYSA-N 259.252 2.181 10 20 CECD COc1cccc(CNC(=O)[C@H](C)C(C)(F)F)c1O 293597099 DLEAAQXISULLPA-QMMMGPOBSA-N 273.279 2.308 10 20 CECD CC(C)(C(=O)OCC(=O)c1ccc(O)c(O)c1)C1CC1 805702839 DJYLJESXJPNIOB-UHFFFAOYSA-N 278.304 2.260 10 20 CECD CC(=O)C(=O)COC(=O)Cc1ccc(Cl)c(Cl)c1 808488918 VJQGWXZQVZWAEK-UHFFFAOYSA-N 289.114 2.237 10 20 CECD C[C@H](NCCNC1CC1)c1cc(Cl)ccc1O 817954556 YQGRBIPXGUKOKJ-VIFPVBQESA-N 254.761 2.448 10 20 CECD CNCCCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 817939656 HTAMBKMENKUJCX-KOLCDFICSA-N 252.333 2.279 10 20 CECD C[C@H]1C[C@@H]1CNCc1ccc(N2CCC(O)CC2)cc1 827662395 QISXTXJJFXGONV-DZGCQCFKSA-N 274.408 2.393 10 20 CECD CCN(CCC(=O)O)Cc1ccc(N(C)C)c(F)c1 901602708 UBDJTPHNCYVGBD-UHFFFAOYSA-N 268.332 2.188 10 20 CECD O=C(O)C[C@@H]1CC[C@H](NCc2ccc3c(c2)CCO3)C1 905814552 LWHPKATWHTWNEN-RISCZKNCSA-N 275.348 2.355 10 20 CECD NCCCN(CC1CCCC1)C(=O)Cc1ccc(N)cc1 841851683 UEUFTAXFHFYOGG-UHFFFAOYSA-N 289.423 2.179 10 20 CECD C[C@H]1C[C@H](N)CCN1Cc1cccc(Cl)c1O 846705011 WZOWGWHRAWIQKN-GXSJLCMTSA-N 254.761 2.357 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)CN2CCCC2=O)c1O 846145048 OHBXYXSHOMLUOK-NWDGAFQWSA-N 292.379 2.062 10 20 CECD CC[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 841955441 CCSFFPLXKIAQGO-IUODEOHRSA-N 291.395 2.020 10 20 CECD CCc1cccc(CNCCCNC(=O)C2CCC2)c1O 848898239 REWNKOIJMYDYPQ-UHFFFAOYSA-N 290.407 2.351 10 20 CECD CN1CCCN=C1NCc1ccc(N2CCCC2)cc1 848993160 BGDIMRLUMITZID-UHFFFAOYSA-N 272.396 2.068 10 20 CECD O=C(OCc1ccc2c(c1)COC2)c1cccc(O)c1O 758574020 YDVWAMYOBACAKZ-UHFFFAOYSA-N 286.283 2.485 10 20 CECD C[C@H](N[C@@H]1CCN(C)C1)c1cc(F)cc(F)c1O 756534702 NAEKDOUHCWCKMU-WCBMZHEXSA-N 256.296 2.025 10 20 CECD COc1cc(CN[C@@H](C)CO)c(O)c(C(C)(C)C)c1 850161199 CYXGMLKZGXNLMD-JTQLQIEISA-N 267.369 2.169 10 20 CECD C/C=C(/C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210986 DXERUKXVTJWHPT-DXNYSGJVSA-N 288.391 2.230 10 20 CECD CN(CC(=O)NCC(C)(C)C)c1ccc2c(c1)OCO2 859206848 PAVGHOAMXFYJES-UHFFFAOYSA-N 278.352 2.014 10 20 CECD Cc1cc(O)c(CN(C)[C@H]2CCC(=O)N(C)C2)cc1Cl 862428426 QBVDVKXPMSSFAO-LBPRGKRZSA-N 296.798 2.407 10 20 CECD COc1cccc(CN(C)Cc2nnc3ccccn23)c1O 769202173 FSBJLZRTKJGOLM-UHFFFAOYSA-N 298.346 2.076 10 20 CECD COc1cccc(CN2CCC(CN(C)C)CC2)c1O 132799475 SSFXBIOQBQYTTE-UHFFFAOYSA-N 278.396 2.174 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@H](C)[C@@H](C)O 1118090650 NHPFTURLSGYTCR-BFHYXJOUSA-N 264.413 2.351 10 20 CECD CCC1(CO)CCN(C(=O)c2cc(O)cs2)CC1 765420567 HXBUVJVTIZZNGI-UHFFFAOYSA-N 269.366 2.078 10 20 CECD OC1CCN(c2ccc(CN3CCSCC3)cc2)CC1 876560750 LLXWCVQULHPGCW-UHFFFAOYSA-N 292.448 2.197 10 20 CECD O=C(O)CC1(CNCc2cc(F)cc(F)c2O)CC1 1119612123 UTXZPKAEADHYCA-UHFFFAOYSA-N 271.263 2.015 10 20 CECD OCC[C@H]1CCCN1Cc1cc(Cl)ccc1O 779202618 QKGTZLWIVGHWNU-GFCCVEGCSA-N 255.745 2.392 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@H](C2CC2)C1 779540980 VIAFGBUVPOVHQX-XYRDXQRHSA-N 273.332 2.370 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)N[C@H]2CC[C@H](O)CC2)o1 1537962829 ZTTGENPLUJWWRR-KYZUINATSA-N 264.285 2.123 10 20 CECD C[C@@H](NC(=O)[C@@H]1Cc2ccccc2CN1)c1ccccc1O 877256316 RZRFSGNXWJHJDE-WBMJQRKESA-N 296.370 2.284 10 20 CECD Cc1ccc(C(=O)OCC[C@H]2CCCO2)c(O)c1O 787679941 ATKFELMFODTAAM-SNVBAGLBSA-N 266.293 2.132 10 20 CECD C[C@@H](NCCC(=O)NC(C)(C)C)c1c(O)cccc1F 886546019 XBTREKJMOUEYPS-SNVBAGLBSA-N 282.359 2.487 10 20 CECD COc1cc(C)cc(CNC[C@](C)(O)c2ccco2)c1O 894315078 HJBNWFUYZFOAFA-INIZCTEOSA-N 291.347 2.300 10 20 CECD COc1ccc(CN2CC[C@@H](OC)[C@H](C)C2)c(O)c1OC 894716738 BDUWRMMCUWBIIL-DGCLKSJQSA-N 295.379 2.266 10 20 CECD CN1CCN(c2ccc(CN3CCC(F)CC3)cc2)CC1 895547291 SSBFNBQROIZHHD-UHFFFAOYSA-N 291.414 2.372 10 20 CECD OC[C@@H]1Cc2ccccc2N1Cc1cc(F)ccc1O 895244065 YJUQJTBOUWUKMX-AWEZNQCLSA-N 273.307 2.455 10 20 CECD CO[C@H]1C[C@H](NCc2c(O)cccc2Br)C1 706809513 CSOQWCJMFFURHI-KYZUINATSA-N 286.169 2.422 10 20 CECD CC[C@]1(C)CN(Cc2cc3c(cc2O)OCO3)CCO1 190330288 AFUXYMHLDNGSSE-OAHLLOKOSA-N 279.336 2.122 10 20 CECD O=C(NCc1ccccc1O)c1[nH]nnc1-c1ccccc1 797744468 QNRDFUJOZHPOPN-UHFFFAOYSA-N 294.314 2.107 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](N3CCCC3=O)C2)c1 790457633 FOIAXUMDISATTI-OAHLLOKOSA-N 288.391 2.206 10 20 CECD CCCN(Cc1ccccc1O)C(=O)/C=C/COC 791383447 AXHNSAGLELVPEC-RMKNXTFCSA-N 263.337 2.333 10 20 CECD C[C@@H](NS(=O)(=O)CC1CCC1)c1ccccc1O 867834662 UOJHYFDPZICBGV-SNVBAGLBSA-N 269.366 2.173 10 20 CECD C[C@@H]1CC[C@@H](NCCc2ccc(N)cc2)[C@@H](n2cncn2)C1 1327841092 VDQTUYZGLUFUKF-XYPHTWIQSA-N 299.422 2.422 10 20 CECD CCN(CCNCc1ccc2c(c1)CCO2)C1CC1 101931705 CUONXEFXXFUYDT-UHFFFAOYSA-N 260.381 2.195 10 20 CECD C[C@@H](Cc1cccnc1)NC(=O)NCc1ccc(N)cc1 1335692338 PLOYQJSBEURPBD-LBPRGKRZSA-N 284.363 2.094 10 20 CECD COc1cc(CN2C[C@H]3CC[C@H]2[C@H](O)C3)c(O)cc1C 1331061946 OBGIWBATBJOBPO-CORIIIEPSA-N 277.364 2.054 10 20 CECD O=C(NC[C@@H](CC1CCCC1)C(=O)O)c1cc(O)cs1 1608421271 PGVDYUKXLJKMRN-SNVBAGLBSA-N 297.376 2.465 10 20 CECD C[C@@H](N[C@H](C)c1nccn1C)c1cc(C(=O)O)ccc1O 1593202746 BCQQZMFZJPVMOD-NXEZZACHSA-N 289.335 2.236 10 20 CECD CC[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 1595281508 POLUIEBGNXAGSU-MFKMUULPSA-N 250.342 2.266 10 20 CECD CCc1cccc(CN(CC)[C@@H](C)CS(C)(=O)=O)c1O 848887396 VKKLRYAXBAIFNG-LBPRGKRZSA-N 299.436 2.210 10 20 CECD C[C@@H](NC(=O)C1(CN)CCCC1)c1ccccc1O 870987717 BENSKHHPQRKLNC-LLVKDONJSA-N 262.353 2.089 10 20 CECD Cc1ccc(CN[C@H]2CCN3CCCC[C@@H]23)c(O)c1 876933829 AEFUQLUUDCYPBR-GJZGRUSLSA-N 260.381 2.417 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)C(=O)NC(C)(C)C 135761279 IMGHVVWGPISACA-VIFPVBQESA-N 284.787 2.438 10 20 CECD C[C@H]1C[C@H](CNCc2cc3c(cc2O)OCO3)CCO1 271363234 ISJIDIQYSHVHII-WDEREUQCSA-N 279.336 2.026 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCN2CCC[C@H]2C1 708480837 MMVBBCIELRXWNJ-STQMWFEESA-N 282.334 2.387 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1cnnn1C 394940358 BXHZQADGECTUBV-JQWIXIFHSA-N 272.352 2.167 10 20 CECD CCOC(=O)c1cnc(S[C@@H](C)CC(=O)O)s1 1596739950 LIGSLTWPBPICFW-LURJTMIESA-N 275.351 2.275 10 20 CECD CN1CCCc2cc(CNC(=O)c3ccccn3)ccc21 58768483 RHJYWDGNELFDSS-UHFFFAOYSA-N 281.359 2.394 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2C[C@@H]2C2CC2)cc1 176564085 CNNRQLBCBPYNHS-HUUCEWRRSA-N 258.365 2.415 10 20 CECD COc1ccc(O)c(CNC(=O)CC[C@H]2CC[C@@H](C)O2)c1 173579382 PCESSTIRBWTKBV-DGCLKSJQSA-N 293.363 2.365 10 20 CECD NC1CCC(NCc2c(O)cccc2Cl)CC1 127320267 AHCCCLAYKBUCEI-UHFFFAOYSA-N 254.761 2.405 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ccncc2)cc1F 121578065 JWTKMWCUFSDQEV-UHFFFAOYSA-N 287.338 2.146 10 20 CECD C[C@@H]1C[C@H](NCc2ccc(N3CCOCC3)cc2)CCO1 219887684 QVRPSKLSRLVJNF-GDBMZVCRSA-N 290.407 2.180 10 20 CECD CCO[C@@H]1C[C@@H](NC(=O)c2cccc(O)c2O)C12CCC2 187129826 KNTVIICLYNTGCU-CHWSQXEVSA-N 291.347 2.175 10 20 CECD CC[C@H](O)CCN[C@H](C)c1ccc(F)c(F)c1O 187762192 BDOQAQKOLXGGRJ-BDAKNGLRSA-N 259.296 2.482 10 20 CECD CCn1cc(NCc2ccc(N3CCOCC3)cc2)cn1 35780103 COYAZIRHVWAGAI-UHFFFAOYSA-N 286.379 2.352 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H](N)C(C)(C)C 136866545 CJEXZFHVDJHNFX-OAHLLOKOSA-N 291.439 2.475 10 20 CECD CCOC(=O)CCN[C@H](C)c1ccc(N(C)C)cc1 45687956 PPTUCAKGDAHMKD-GFCCVEGCSA-N 264.369 2.356 10 20 CECD Cc1noc(NCc2cccc(Br)c2O)n1 134431763 PCYAYXODIWKJDC-UHFFFAOYSA-N 284.113 2.458 10 20 CECD CCOc1ccc(O)c(CN2CCOC[C@H]2C)c1 91815063 MTBLJCLLTYIRBY-LLVKDONJSA-N 251.326 2.012 10 20 CECD Nc1ccc(NC(=O)c2cn(-c3ccccc3)nn2)cc1 238036977 VEYQNJNVOYJLJG-UHFFFAOYSA-N 279.303 2.102 10 20 CECD Cc1ncc(NC(=O)NCc2ccc(N(C)C)cc2)cn1 264067620 HSCDGSXZYYFLDV-UHFFFAOYSA-N 285.351 2.173 10 20 CECD COc1ccc(N(C)CCc2cnn(C)c2)cc1F 268218941 VVRYIHFMVWNQBJ-UHFFFAOYSA-N 263.316 2.247 10 20 CECD C[C@@H]1C[C@H](CCNC(=O)NCc2ccccc2O)CCO1 273104691 PGIYJSQOJDJWQB-CHWSQXEVSA-N 292.379 2.397 10 20 CECD CN(C)c1ccc(CNC(=O)CSc2ncco2)cc1 277948723 JMMXYYSJQPYRKR-UHFFFAOYSA-N 291.376 2.149 10 20 CECD CCOc1ccc(O)c(CNCCC[C@H](C)O)c1 278626074 KDQJFSPXLZBXCP-NSHDSACASA-N 253.342 2.042 10 20 CECD OC[C@@]1(F)CCCN(Cc2cccc(Cl)c2O)C1 289775470 KWBAMRBJINLMGZ-CYBMUJFWSA-N 273.735 2.342 10 20 CECD CN(C)C1(CNC(=O)NCc2ccccc2O)CCCC1 299481721 HCCCCCUPRRCQAH-UHFFFAOYSA-N 291.395 2.066 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCc2ncn(C)n2)c1O 808709101 BUPMDPKCYGONHE-VIFPVBQESA-N 280.759 2.333 10 20 CECD CCN(C)c1ccc(CN2C[C@@H](F)C[C@H]2C(=O)OC)cc1 815105786 LEVHADLWVLFFJL-ZFWWWQNUSA-N 294.370 2.228 10 20 CECD C[C@H]1OCC[C@@]1(O)CNCc1ccc2ccccc2c1O 816593871 HEYKCSKSDSIXEY-SJKOYZFVSA-N 287.359 2.175 10 20 CECD CCOc1ccc(CN2C[C@@H](C(=O)O)CC[C@H]2C)c(O)c1 817881189 PXPYQAUBFOOFLS-YPMHNXCESA-N 293.363 2.476 10 20 CECD CC[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)[C@@H]1CCOC1 817940361 GEWXFPVDAFAPBK-OIISXLGYSA-N 291.439 2.157 10 20 CECD CC[C@@H]1C[C@H]1CNCc1ccc([N+](=O)[O-])c(OC)c1O 824783723 UJVCLXVJRAMOGS-KOLCDFICSA-N 280.324 2.445 10 20 CECD Cc1cc(O)c(CN(CC(=O)O)C(C)C)cc1C 821045993 NQMOEMAIZMNLRS-UHFFFAOYSA-N 251.326 2.304 10 20 CECD Cc1ccc(O)c(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1 824839350 XDOVWHHZVGHEEY-OCVGTWLNSA-N 257.333 2.086 10 20 CECD CC[C@H](NCCCON)c1ccc(N(C)C)cc1 902419909 VMSMKYJXZOVLCC-AWEZNQCLSA-N 251.374 2.074 10 20 CECD CCO[C@H]1CCN(Cc2cc(OC)c(C)cc2O)C1 902526912 CNNLPLVQSPJVQP-ZDUSSCGKSA-N 265.353 2.320 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C(=O)O)C1CC1 901476484 HCMCUINDFDOTEO-CQSZACIVSA-N 262.353 2.014 10 20 CECD CC[C@H](N[C@@H]1CC(=O)N(CC)C1)c1ccc(F)cc1O 834888611 BHFMROHXCXVTSH-YPMHNXCESA-N 280.343 2.193 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCO[C@H]2CC)c1 839191872 LKQKNENASNJXFG-HIFRSBDPSA-N 265.353 2.448 10 20 CECD Cc1ccoc1CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 831924654 KPHXXXPXPXJSTB-NSHDSACASA-N 289.331 2.289 10 20 CECD C[C@@]1(CNC(=O)NCc2cc(Cl)ccc2O)CCOC1 844971336 GLKQGLJUZUCRQV-AWEZNQCLSA-N 298.770 2.271 10 20 CECD CCc1cccc(CNCc2ccnc(N(C)C)n2)c1O 848900608 OJRMKPZIDYRQIJ-UHFFFAOYSA-N 286.379 2.100 10 20 CECD C[C@@H]1C[C@@H](N)CCN1Cc1cccc(Br)c1O 846698333 FULPRVFFAUMJLL-KOLCDFICSA-N 299.212 2.466 10 20 CECD COc1ccc(N(C)CCN(C)CC[C@H]2CCNC2)cc1 846225759 UIAFMHOXEFACDB-OAHLLOKOSA-N 291.439 2.063 10 20 CECD CN(C)c1ccc([C@H](N)CNCc2ccccc2O)cc1 841044851 ZEDVMYBIUXFPQZ-MRXNPFEDSA-N 285.391 2.248 10 20 CECD COc1cccc([C@H](C)NC2CCN(OC)CC2)c1O 846171830 IDNHXBHIVIJLHC-NSHDSACASA-N 280.368 2.077 10 20 CECD CC(C)CC[C@H](CO)NCc1cc2c(cc1O)OCO2 858241711 YQZCPOSHLKQSLT-GFCCVEGCSA-N 281.352 2.008 10 20 CECD CN(CCc1nccs1)C(=O)c1cc(O)cs1 753848167 AJUDCYQQCIOMNE-UHFFFAOYSA-N 268.363 2.225 10 20 CECD Cc1ccc(O)c(CNC(=O)CC[C@@H]2CCOC2)c1 862758113 OXSZGCLDLNHKTR-GFCCVEGCSA-N 263.337 2.134 10 20 CECD CCOc1ccc(CN2CCOC[C@H](C)C2)c(O)c1 769455679 ICVUNVIXDZYSHF-GFCCVEGCSA-N 265.353 2.259 10 20 CECD CCO[C@H](C(=O)NCc1cc(Cl)ccc1O)C1CC1 862130543 JSPPUZSEMIGKMH-ZDUSSCGKSA-N 283.755 2.477 10 20 CECD CC[C@H]1C(=O)N(CC)CCN1Cc1cc(C)ccc1O 779218213 PDWAOBZVQIJAAN-AWEZNQCLSA-N 276.380 2.143 10 20 CECD Cc1cccc(O)c1CNCc1nc(C(C)C)n[nH]1 877560150 IOEALNGXYANTBD-UHFFFAOYSA-N 260.341 2.232 10 20 CECD Cc1ccc(O)c(CN2CCN(CC(C)C)C(=O)[C@H]2C)c1 779201086 AFDSVTOPULFBEY-CQSZACIVSA-N 290.407 2.389 10 20 CECD COc1ccc(/C=C\C(=O)NCc2ccc(O)c(O)c2)cc1 778929783 NTIOGFPYCPKVGQ-UITAMQMPSA-N 299.326 2.436 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1ccc(F)cn1 787748283 QBWNZVNXTFVSCW-QHHAFSJGSA-N 289.262 2.389 10 20 CECD Cc1cc(CN[C@@H](C)c2c(O)cccc2F)ncn1 886557271 XHGCOROGUWKZOX-JTQLQIEISA-N 261.300 2.481 10 20 CECD C[C@H](NCC1(CO)CCC1)c1cc(F)ccc1O 186547650 ZBCCZGOZJKHBCX-JTQLQIEISA-N 253.317 2.345 10 20 CECD CC[C@H](N[C@H](C)[C@@H]1CN(C)CCO1)c1ccc(C)cc1O 794819429 WQBKLVZLNWDXLY-KMFMINBZSA-N 292.423 2.460 10 20 CECD COc1ccc(CNC(=O)c2ncoc2C(C)C)c(O)c1 794374903 YRLWVPDEQLHXSG-UHFFFAOYSA-N 290.319 2.442 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1C[C@H]2C=C[C@H]1C2 1334816022 PBYSJNNZGJFKSE-GKODAQOPSA-N 285.343 2.439 10 20 CECD COc1ccc(CNC(=O)c2nc(C)cs2)c(O)c1 1339659396 OZUQSDOAPPWVPB-UHFFFAOYSA-N 278.333 2.096 10 20 CECD O=C(O)[C@H](NCc1ccccc1O)c1cccc(O)c1 1601676285 MSOQGSCCAXSCOL-CQSZACIVSA-N 273.288 2.013 10 20 CECD COCC[C@H](N)CN(C)c1ccc(OC)c(Cl)c1 1578999768 HUBBLORDWJHUOI-JTQLQIEISA-N 272.776 2.149 10 20 CECD C[C@@H](N[C@H]1CC[C@H](O)CC1)c1cc(C(=O)O)ccc1O 1593359315 BAKPSMXRRABEJC-YUSALJHKSA-N 279.336 2.045 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(C(=O)O)CCOCC2)c1 1594373381 XLTMPOMLBSALOX-GFCCVEGCSA-N 293.363 2.233 10 20 CECD COc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(O)c1 159469355 WYIZEZQXRSZDFZ-IMJJTQAJSA-N 289.375 2.448 10 20 CECD COCCO[C@@H]1CCCN(Cc2c(C)cccc2O)C1 877502315 FOQNWRHQSJMTMP-CQSZACIVSA-N 279.380 2.328 10 20 CECD COc1ccc(O)c(CNCC2(N(C)C)CCCC2)c1 160704641 ULSBYTBSTQJNSP-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CN(C)c1ccc(CNC(=O)C(F)(F)F)cc1F 263666563 HZCDLBJSCMEGGP-UHFFFAOYSA-N 264.222 2.070 10 20 CECD CCOc1cccc(CNCCC2(O)CCC2)c1O 283910219 IHKATKNUXSQWSM-UHFFFAOYSA-N 265.353 2.186 10 20 CECD CC[C@@H](NCc1cccc(OC)c1O)C(C)(C)O 292929975 GWSSZZGIZBJFCD-GFCCVEGCSA-N 253.342 2.040 10 20 CECD CCOc1cccc(CNC[C@H](O)C2CCC2)c1O 316011529 SAOZZYSGJYXAKM-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD COc1cccc(CN2CC[S@](=O)C(C)(C)CC2)c1O 322092370 HSGZWOBYHLZVQO-FQEVSTJZSA-N 297.420 2.134 10 20 CECD CCCN1CC[C@@H](CNCc2cc(F)cc(F)c2O)C1 708516473 IRYOSBRJIBZBLR-NSHDSACASA-N 284.350 2.492 10 20 CECD CCSC1(CNC(=O)Cc2ccc(N)cc2)CC1 691820000 RDWPEDZYYUGQAB-UHFFFAOYSA-N 264.394 2.213 10 20 CECD C[C@@H]1SCC[C@@H]1NC(=O)Nc1ccc(N)cc1 383932239 CBTSKUIBNQHGTR-KWQFWETISA-N 251.355 2.284 10 20 CECD CCOc1cccc(CN[C@H](CO)CC(F)(F)F)c1O 717812321 TXQAGAISPURQAB-JTQLQIEISA-N 293.285 2.194 10 20 CECD CNC(=O)CCCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 398351640 JWROKTNPLDPBEZ-NWDGAFQWSA-N 276.380 2.365 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc3[nH]cnc3c2)c1 114543796 VEJFNWFRDRFHMK-UHFFFAOYSA-N 297.314 2.207 10 20 CECD Cc1cccc(CN2CCC(c3nncn3C)CC2)c1O 179753254 ADVUKZZDTARPAH-UHFFFAOYSA-N 286.379 2.209 10 20 CECD COc1ccc(N2CCCN(c3cnccn3)CC2)cc1 301055866 APSAERCPZTVUKG-UHFFFAOYSA-N 284.363 2.202 10 20 CECD Cc1nnc([C@@H](C)N2CCOc3cc(N(C)C)ccc32)o1 181128128 CFHGLQZTNYBQHV-SNVBAGLBSA-N 288.351 2.404 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCc2cnn(C)c2)c1 182372224 NZVMPQUDMHMMTC-GFCCVEGCSA-N 289.379 2.418 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@@H]1CCCOC1 193536406 COUDNKSJPGLQFU-LBPRGKRZSA-N 263.337 2.167 10 20 CECD COc1cc(Cl)cc(CN2C[C@H](C)N[C@@H](C)C2)c1O 229103677 MBSIPGWCCVEZFG-UWVGGRQHSA-N 284.787 2.236 10 20 CECD CCOC[C@H](O)CN(C)c1ccc(OC(C)C)cc1 191591207 MPWZWFSMZPIUBZ-CQSZACIVSA-N 267.369 2.307 10 20 CECD COC[C@H](O)CCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 230670046 XBRIDKZAXZKGGY-UPJWGTAASA-N 279.380 2.236 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1cnc(N(C)C)nc1 269339300 FQYRIIJRFFEPNW-UHFFFAOYSA-N 299.422 2.241 10 20 CECD CN1CC[C@H]2CCN(Cc3ccc(N(C)C)cc3)[C@@H]2C1 272267699 BHWSAPQRFQTZKG-DOTOQJQBSA-N 273.424 2.279 10 20 CECD CCc1cncc(C(=O)NCCc2ccc(O)c(O)c2)c1 279468188 NGYXVNSTWIPMAF-UHFFFAOYSA-N 286.331 2.028 10 20 CECD CC1CCN(c2ccc(CNCc3cnn(C)n3)cc2)CC1 293516170 IJQQDHYMGNFZCH-UHFFFAOYSA-N 299.422 2.341 10 20 CECD CCCc1cc(C(=O)NCCc2ccc(O)c(O)c2)no1 295249901 GTNHHHUVMJCRCP-UHFFFAOYSA-N 290.319 2.011 10 20 CECD CC[C@@H](NCc1cnnn1C)c1cc(Cl)ccc1O 806660111 QMUHEJVMKZFUPQ-GFCCVEGCSA-N 280.759 2.415 10 20 CECD COc1ccc(O)c(CNC(=O)C(C)(C)C2CC2)c1 806858490 PRMKOZJLTKBBJS-UHFFFAOYSA-N 263.337 2.453 10 20 CECD Cc1ccc([C@H](C)NCCCc2cnn(C)n2)c(O)c1 293035565 ALXITERKXUUQCD-LBPRGKRZSA-N 274.368 2.113 10 20 CECD COc1ccc(N2CC[C@H](CNCC3(O)CCC3)C2)cc1 819379010 BVMNTODKZRMXNY-CQSZACIVSA-N 290.407 2.026 10 20 CECD COc1ccc(CNc2nnc(C(F)F)o2)c(O)c1 814368392 RZEMFOJSYZPHIE-UHFFFAOYSA-N 271.223 2.334 10 20 CECD C[C@@H](NC(=O)[C@H]1CCc2c[nH]nc2C1)c1ccccc1O 827937263 QCTGUXMGVVNBNX-MNOVXSKESA-N 285.347 2.098 10 20 CECD O=C(NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12)c1c(F)ccc(O)c1O 826947826 WLVBHHAKJAOHAX-JRPBRRGXSA-N 277.295 2.011 10 20 CECD CCOCc1cc(CN[C@H](CO)C2CC2)ccc1OC 734165439 ZVKYTEBYMFBJPC-OAHLLOKOSA-N 279.380 2.092 10 20 CECD CN(C)c1nccc(CN[C@@H]2CCc3cccc(O)c32)n1 834702703 STSXEVJOEPHPFN-CYBMUJFWSA-N 284.363 2.025 10 20 CECD COc1ccc(N(Cc2cnnn2C)CC2CC2)cc1 831588297 XDQNLZVYYDQQQF-UHFFFAOYSA-N 272.352 2.240 10 20 CECD CO[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)C12CCC2 838062622 WBUYDFVWFDDQPI-KGLIPLIRSA-N 290.363 2.149 10 20 CECD COc1cccc([C@H](C)NCC[C@H](O)C2CC2)c1O 903410186 DPFKPQNIAVOLFT-GWCFXTLKSA-N 265.353 2.212 10 20 CECD COC(=O)[C@H]1CCCCCN1C(=O)c1cc(O)cs1 831931611 RWTBIIVVAHQBCL-SNVBAGLBSA-N 283.349 2.012 10 20 CECD CC[C@@H](OC1CCCC1)C(=O)NCc1ccc(O)cc1O 910951566 UECXVBYSQQOBAC-OAHLLOKOSA-N 293.363 2.452 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1CCC=CO1 846473255 KYPNBLQHCBJVGG-GFCCVEGCSA-N 267.712 2.355 10 20 CECD COc1cccc2c1CCN(C(=O)Cc1ccc(N)cc1)C2 843489893 MMCVCBZCRWDAIL-UHFFFAOYSA-N 296.370 2.405 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCNC[C@@H]2C)c1O 843347782 MAPIIWXVTWOKLE-VIFPVBQESA-N 282.771 2.042 10 20 CECD CCCCCCN(C)CC(=O)NCc1ccc(O)cc1O 910955817 UZAMXDONWAUGNG-UHFFFAOYSA-N 294.395 2.226 10 20 CECD COc1ccc2c(c1)CCCN2CC[C@@H]1CCNC1 842471653 OWFVGRSDHKONET-ZDUSSCGKSA-N 260.381 2.447 10 20 CECD CCc1cccc(CN[C@H](C)c2nc(C)no2)c1O 848906959 YULAQOBAEWVMMY-SECBINFHSA-N 261.325 2.497 10 20 CECD CC[C@H](N)CNCc1cc(C)cc(Br)c1O 841072546 PLHBNAUNKWKPHF-JTQLQIEISA-N 287.201 2.290 10 20 CECD Nc1ccc(CCNC(=O)CCCCN2CCCC2)cc1 844164397 GETSPEFFUIGXKV-UHFFFAOYSA-N 289.423 2.194 10 20 CECD C[C@@H](C[C@@H](C)N)NCc1c(O)ccc(Cl)c1F 843127573 DZBQPCRNYCRSFR-SFYZADRCSA-N 260.740 2.400 10 20 CECD CC[C@@H](NCC[C@]1(O)CCCOC1)c1ccccc1O 846108708 QTYGKMRMFNQUKM-GDBMZVCRSA-N 279.380 2.365 10 20 CECD COC[C@](C)(O)CN[C@H](C)c1ccc(C)c(C)c1O 756578586 WXZYXXLMUYNJBH-IUODEOHRSA-N 267.369 2.057 10 20 CECD C[C@H](NCCN1CCOC[C@H]1C)c1cc(Cl)ccc1O 756535697 PUYJDHVVGCDDSJ-NEPJUHHUSA-N 298.814 2.417 10 20 CECD COC(=O)CCCCN[C@@H](C)c1cc(OC)ccc1O 859233284 PZDPUOTUFBTSFW-NSHDSACASA-N 281.352 2.395 10 20 CECD CCc1nn(C)c(OC)c1CNCc1c(C)cccc1O 877135108 PXZRRSRIRFLILY-UHFFFAOYSA-N 289.379 2.295 10 20 CECD C[C@H](O)[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862308450 ARXJEYNXINPZKO-QWRGUYRKSA-N 284.350 2.234 10 20 CECD Cc1cccc(O)c1CN1CCS[C@@H]2COCC[C@@H]21 876798148 FHHQRIOSJPFQPR-DZGCQCFKSA-N 279.405 2.407 10 20 CECD COCC[C@]1(NCc2ccc(OC)c(C)c2)CCOC1 775032209 GOQXBAHHMWUMFK-INIZCTEOSA-N 279.380 2.289 10 20 CECD CC[C@H](C)[C@](C)(O)CNCc1cc(F)ccc1O 779078595 SVECVRIDTXGOKN-IINYFYTJSA-N 255.333 2.418 10 20 CECD C[C@@H]1C[C@H](NCCOCCN(C)C)c2c(O)ccc(F)c21 774375634 DETWSCQTBCWJOE-YPMHNXCESA-N 296.386 2.247 10 20 CECD Cc1cccc(CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)n1 779520768 RMSJXUGCUVYGHR-CLFYSBASSA-N 298.342 2.473 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CCO)cc1 96811586 USLCISWXLXYHIT-ZDUSSCGKSA-N 250.386 2.393 10 20 CECD COc1ccc(CNCCc2ccccn2)c(O)c1OC 892422983 LOPPEGNCEUAVGR-UHFFFAOYSA-N 288.347 2.137 10 20 CECD CC1=NO[C@H](CNCc2c(O)cccc2Br)C1 895299413 CTALVIAJOXIQKF-VIFPVBQESA-N 299.168 2.409 10 20 CECD CC[C@H](NC(=O)c1cc(O)cs1)c1ncc[nH]1 781990865 KUHGKPLGANKYIZ-QMMMGPOBSA-N 251.311 2.058 10 20 CECD CCOC[C@@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898450368 QMRPDDLFGSVJRP-RHSMWYFYSA-N 293.455 2.370 10 20 CECD COC[C@@H](NCc1cc(OC)ccc1O)C(C)C 86682629 POHDSBCCBHGHTN-CYBMUJFWSA-N 253.342 2.161 10 20 CECD CCC[C@@H](NCc1cccc(CC)c1O)C(=O)OC 897834471 PXUXJMYZPNEADR-CYBMUJFWSA-N 265.353 2.386 10 20 CECD COc1cccc(CC(=O)NCc2ccccc2O)c1 133778259 SSKZNFMVHIGEEH-UHFFFAOYSA-N 271.316 2.260 10 20 CECD CCOC(C)(C)CNC(=O)NCc1ccc(OC)cc1O 793064736 FMVQEWCNRLKBJV-UHFFFAOYSA-N 296.367 2.015 10 20 CECD C[C@@H](CCCO)NCc1cc(F)c(N(C)C)cc1F 1331517665 FAUZVXXXSVZQEO-JTQLQIEISA-N 272.339 2.281 10 20 CECD Cc1cc(C(=O)NCc2cccc(O)c2O)nn1C(C)C 1348047492 NQGPVPHYEGWTNP-UHFFFAOYSA-N 289.335 2.114 10 20 CECD C[C@H](NCCCCN(C)C)c1cc(C(=O)O)ccc1O 1609780455 RZMOMDAYZUYDFW-NSHDSACASA-N 280.368 2.083 10 20 CECD O=C(O)c1cnc(SCC2(O)CCSCC2)s1 1608978737 PHMKNJOTPZAMHM-UHFFFAOYSA-N 291.419 2.192 10 20 CECD O=C(CCOc1ccccc1)NCc1ccc(O)c(O)c1 159114447 GNOGVGHFMIDAJR-UHFFFAOYSA-N 287.315 2.183 10 20 CECD CN(C(=O)c1cnn(C2CC2)c1)c1ccc(N)cc1 877074504 MKEBIOVTZAYKDX-UHFFFAOYSA-N 256.309 2.077 10 20 CECD Nc1ccc(CN2CC[C@H](N3CCCCC3)C2)cc1 62977627 SCTDMGQKSBIYPH-INIZCTEOSA-N 259.397 2.329 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CCOC1 108929387 MYOIGVLARLUVFN-ZDUSSCGKSA-N 292.379 2.350 10 20 CECD CCCC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)OC 135198154 SBQAIQNPCWIOHX-CQSZACIVSA-N 277.364 2.443 10 20 CECD COc1ccc(O)c(CNC(=O)NCCC(C)C)c1 114581923 MOSAKEFYQRKOSH-UHFFFAOYSA-N 266.341 2.246 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)NCC1CC1 174763334 URLJVPRNZZAVHK-UHFFFAOYSA-N 274.364 2.480 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCOC)cc1F 66841524 MWKBKIGKTMIWGQ-UHFFFAOYSA-N 282.359 2.325 10 20 CECD COC1(CNC(=O)N(C)Cc2ccccc2O)CCC1 181789332 FYKSKJOEJDSOGJ-UHFFFAOYSA-N 278.352 2.103 10 20 CECD CN(C)c1ccc(CN2CCSCC2)cc1F 126186927 IEXQDIAOWDXPSH-UHFFFAOYSA-N 254.374 2.441 10 20 CECD CN(C(=O)/C=C/c1cnn(C)c1)c1ccc(F)c(F)c1 48974082 XEYXZLGURKDJBF-ZZXKWVIFSA-N 277.274 2.375 10 20 CECD C[C@@H](CN[C@@H](C)c1ccccc1O)CN1CCOCC1 183522681 PFXKCNJYRUBJLJ-KBPBESRZSA-N 278.396 2.011 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1[C@H]2CCC[C@H]12 183431979 MZONBJUEBUWWNN-USWWRNFRSA-N 275.348 2.191 10 20 CECD C[C@@H]1C[C@H](CN)CN1Cc1cc(Br)ccc1O 220336568 DBAQHJKAGAFGRK-NXEZZACHSA-N 299.212 2.324 10 20 CECD CN1CCCN(Cc2ccc(N(C)C)c(F)c2)CC1 269373471 UUTLXKKDJJKMEW-UHFFFAOYSA-N 265.376 2.029 10 20 CECD C[C@@H]1CC[C@H](CCC(=O)NCc2ccccc2O)O1 266641173 YIIOQHRUXGCTLH-DGCLKSJQSA-N 263.337 2.356 10 20 CECD Cc1ccc([C@H](C)NCC2(O)CCN(C)CC2)c(O)c1C 273609166 VGDNNWCFXMDJKU-AWEZNQCLSA-N 292.423 2.116 10 20 CECD CCCCN(Cc1ccccc1O)C[C@@H](O)COCC 282519609 SZBKLJVGBGJNOY-OAHLLOKOSA-N 281.396 2.392 10 20 CECD COc1ccc(N2CCCN(c3nnc(C)o3)CC2)cc1 376116549 PXIPPJJVRCPQRR-UHFFFAOYSA-N 288.351 2.103 10 20 CECD Oc1c(Cl)cccc1CN1CCOC[C@H]1c1ncon1 374837189 QBDFUEQCYIMKRC-NSHDSACASA-N 295.726 2.002 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c(C)ccn1C 808094371 MDJIGHQZXMKGDQ-UHFFFAOYSA-N 293.363 2.455 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCc2cn(C)nn2)c1O 808712085 ATRTXYQOUKVYEU-VIFPVBQESA-N 280.759 2.333 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC[C@H]2CF)cc1 296674888 WPTQWVMONBKKSR-AWEZNQCLSA-N 279.359 2.396 10 20 CECD CC[C@H](C)[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)OC 296170961 SJWDRQXXCCZODV-SMBUJGDBSA-N 293.363 2.288 10 20 CECD C[C@H](CNCc1c(O)ccc(Cl)c1F)CN(C)C 813785624 FLJPFYBTZCHMQP-SECBINFHSA-N 274.767 2.472 10 20 CECD Cc1cc(O)c(CN2CCNC(=O)C[C@H]2C)cc1Cl 825935166 NZZGDKQIIMBVBE-SNVBAGLBSA-N 282.771 2.064 10 20 CECD C[C@@H]1C[C@H]1c1cc(NC(=O)Cc2ccc(N)cc2)n[nH]1 827930174 HQXADVXCQXGAPE-BXKDBHETSA-N 270.336 2.297 10 20 CECD CCOc1nc(C(=O)N[C@H](C)c2ccccc2O)co1 827941170 OMYBNJYRESHLEE-SECBINFHSA-N 276.292 2.270 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1ccc(C(N)=O)cc1 734509160 HXMCNEDUEYLELE-UHFFFAOYSA-N 297.402 2.450 10 20 CECD CN(Cc1nccn1C(F)F)C(=O)c1cc(O)cs1 732267936 CMZVZWHKQZBUGH-UHFFFAOYSA-N 287.291 2.318 10 20 CECD CSC[C@H](CCO)N[C@@H]1CCc2cccc(O)c21 834597490 GGLLTAGXFZHHQO-NWDGAFQWSA-N 267.394 2.083 10 20 CECD C[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)[C@H]1C 841959291 WPMOAKBCLGYWQL-RYUDHWBXSA-N 261.369 2.251 10 20 CECD CCOc1cccc(CNCCc2ccc(N)cc2)n1 841035832 PDTWBMZZXGHBLT-UHFFFAOYSA-N 271.364 2.395 10 20 CECD COCCC(C)(C)CNC(=O)NCCc1ccc(N)cc1 841878526 YVWCKCQIAGIUBE-UHFFFAOYSA-N 293.411 2.173 10 20 CECD C[C@@H](N[C@@H](CO)CCF)c1ccc(Cl)cc1O 846209982 VEPJRASIVAFROI-PSASIEDQSA-N 261.724 2.417 10 20 CECD CCCCS(=O)(=O)NCc1cc(Cl)ccc1O 845996723 SJGRMSZUESMYNT-UHFFFAOYSA-N 277.773 2.265 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](C)CC(N)=O)cc1 743524680 ZQSIONQMXLZDKC-LLVKDONJSA-N 299.374 2.088 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2cccc(C)c2O)C1 840975172 MDISRAXANGTZHT-INIZCTEOSA-N 277.364 2.476 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H]2[C@@H](C)CCN[C@H]2C)c1O 842476087 GHKPCWVEZFYJPI-AMJWSMQMSA-N 294.370 2.210 10 20 CECD COc1cccc([C@@H](C)NC[C@@](C)(O)C(F)(F)F)c1O 846156546 FYDOUQYCNLUUFC-PRHODGIISA-N 293.285 2.365 10 20 CECD COC1(CNC(=O)NCc2cc(Cl)ccc2O)CCC1 845099020 LDVAWXMTCFUABT-UHFFFAOYSA-N 298.770 2.414 10 20 CECD COCCOC[C@@H](C)N[C@H](C)c1cc(C)ccc1O 756731953 DTKNRUWXINVLMI-CHWSQXEVSA-N 267.369 2.403 10 20 CECD CCC(=O)[C@@H](C)OC(=O)/C=C/c1ccc(O)c(O)c1 759596202 OBNDEUPVSOUBOW-VPIOIWJLSA-N 264.277 2.022 10 20 CECD COc1cccc(CN[C@H]2Cc3cccc(O)c3C2)c1O 758563514 VYMQGBMQWNCQIN-ZDUSSCGKSA-N 285.343 2.363 10 20 CECD CN(C)c1ccc(CNc2nncn2C2CC2)cc1F 922659273 VRXIQVQRLRLFMW-UHFFFAOYSA-N 275.331 2.430 10 20 CECD C[C@@H](NC(=O)NCCc1ccccn1)c1ccccc1O 864424053 IAAXTMYGCOTKBW-GFCCVEGCSA-N 285.347 2.390 10 20 CECD O=C(Nc1cccc(-n2ccnn2)c1)c1cc(O)cs1 768387476 WMBQXXQIAIZTOW-UHFFFAOYSA-N 286.316 2.287 10 20 CECD CN(C)c1ccc(CN(CCO)CC2CC2)cc1F 769108951 ONJWFPHWSBJHKL-UHFFFAOYSA-N 266.360 2.096 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CC23CCC3)c1O 876428916 QPLBODJGNAEUFI-GFCCVEGCSA-N 276.336 2.143 10 20 CECD CCCn1cc(CN(C)Cc2ccc(N(C)C)cc2)nn1 876511257 CHAXEQHJCUIWPU-UHFFFAOYSA-N 287.411 2.386 10 20 CECD CCOC(=O)[C@H](NCc1cccc(CC)c1O)C1CC1 1118399509 FOWCDMLXBZRHKR-CQSZACIVSA-N 277.364 2.386 10 20 CECD CSCC[C@H](O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775409468 GGZSHESKMRLNTH-FZMZJTMJSA-N 296.436 2.044 10 20 CECD Oc1cc2c(cc1CN1CC[C@H](n3cncn3)C1)CCCC2 776779192 ZTGCAVCRZLMOOA-INIZCTEOSA-N 298.390 2.310 10 20 CECD O=C(NCc1ccc(O)c(O)c1)N1CCCCCC1 883093376 SPWLXNFCZCBCKE-UHFFFAOYSA-N 264.325 2.183 10 20 CECD COc1cc(C)cc([C@@H]2NC3(CCCC3)C(=O)N2C)c1O 887328392 WJFXWDMJFZHVQC-CQSZACIVSA-N 290.363 2.082 10 20 CECD N[C@H](CC1CC1)C(=O)NCc1c(O)ccc2c1CCCC2 884315052 FBCFXGWDPSXPRK-OAHLLOKOSA-N 288.391 2.015 10 20 CECD O=C(NC[C@H]1Cc2ccccc21)c1c(F)ccc(O)c1O 789959101 OSRSTBDCSWIXCS-SNVBAGLBSA-N 287.290 2.307 10 20 CECD C[C@@H](NCCCCS(C)(=O)=O)c1c(O)cccc1F 886627980 BWAOCBJOHAFWOC-SNVBAGLBSA-N 289.372 2.007 10 20 CECD COc1cccc(CNC(=O)c2c(F)ccc(O)c2O)c1 789938457 BZDZKDJLNPXWBK-UHFFFAOYSA-N 291.278 2.176 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H](OC)C2CC2)c(O)c1OC 894755451 QVDUTJUORPTRKY-ZUZCIYMTSA-N 295.379 2.313 10 20 CECD CCN1CCC[C@H](NCc2ccc(OC)c(C)c2)C1=O 722361599 NOZNCTGDUCIWIV-AWEZNQCLSA-N 276.380 2.104 10 20 CECD CC[C@H](NCC(C)(C)C(=O)NC)c1ccccc1O 185214231 OMPOOZVQDMZWLC-LBPRGKRZSA-N 264.369 2.205 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(N)nc(Cl)c1 170893356 SANUJSDAHHEXNB-UHFFFAOYSA-N 291.738 2.295 10 20 CECD Oc1ccc(Cl)c(F)c1CNCCc1cnccn1 790990582 OSSBHZFUIGMAKD-UHFFFAOYSA-N 281.718 2.307 10 20 CECD Cc1nc2cc(C(=O)NCc3ccc(O)c(O)c3)ccc2o1 792238643 USEQUUBUYIKVSH-UHFFFAOYSA-N 298.298 2.477 10 20 CECD CCC(=O)N1CCC[C@H](NCc2ccc(OC)c(C)c2)C1 998322802 LSUMEYUWUPGIGA-HNNXBMFYSA-N 290.407 2.494 10 20 CECD Cc1[nH]c(C(=O)NCc2ccc(N(C)C)cc2)c(C)c1C=O 1329732163 VBIXKXZUPCDCBJ-UHFFFAOYSA-N 299.374 2.440 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCCCN2)c1 1326319152 VPUVAEYYDKTPCH-SMDDNHRTSA-N 292.379 2.110 10 20 CECD Nc1ccc(CNC(=O)NC[C@H]2CC=CCC2)cc1 1335424725 AKZCDSAKXNOPDQ-LBPRGKRZSA-N 259.353 2.424 10 20 CECD CCN(CCC(=O)O)Cc1c(O)ccc(Cl)c1F 1609999687 LRVOLBVOYMIKHZ-UHFFFAOYSA-N 275.707 2.481 10 20 CECD CC(C)[C@H](N)CCNC(=O)NCc1cccc(Cl)c1O 1575839297 XLCHTXNOJCRBJG-GFCCVEGCSA-N 299.802 2.218 10 20 CECD COc1cc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c(O)cc1C 1599406587 GVDCOXIIPAUOOR-XQQFMLRXSA-N 291.347 2.147 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@](F)(C(=O)O)C2)cc1 1777039995 UKKHNFUTUUHMBG-IUODEOHRSA-N 280.343 2.188 10 20 CECD CC(C)[C@@H](O)CNCc1ccc(N2CCCC2)cc1 134694814 RFNPDBPYUFGOMK-INIZCTEOSA-N 262.397 2.393 10 20 CECD Oc1ccccc1CNCc1cnn(CC(F)F)c1 292930235 HUFQCJYKCXIEJB-UHFFFAOYSA-N 267.279 2.144 10 20 CECD Oc1ccc(F)cc1CN[C@H]1c2ccccc2C[C@@H]1O 848925975 IZVJCSQOVKHQIM-HOTGVXAUSA-N 273.307 2.279 10 20 CECD Cc1cc(C)c(O)c(CN2CCN(c3cnccn3)CC2)c1 119619617 KJILQGJASKYBCH-UHFFFAOYSA-N 298.390 2.121 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc3c(c2)CCO3)c1 114542125 WCMOZEUUZOHAJF-UHFFFAOYSA-N 299.326 2.266 10 20 CECD CN(C)c1ccc(CN[C@H](CO)Cc2ccccc2)cc1 63218008 MWQHSIVSLBKSGA-KRWDZBQOSA-N 284.403 2.446 10 20 CECD C[C@@H]1CCCN(C(=O)CN(C)c2ccc3c(c2)OCO3)C1 121250807 LHUAZOVUAOORHB-GFCCVEGCSA-N 290.363 2.110 10 20 CECD CCOCCCCNC(=O)/C=C/c1ccc(O)c(O)c1 180948911 XPPZCWVMAUEXIU-SOFGYWHQSA-N 279.336 2.044 10 20 CECD CC(C)NC(=O)NCc1c(O)ccc2c1CCCC2 80612717 QNDRJBAEKOEPBN-UHFFFAOYSA-N 262.353 2.479 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCC[C@@H]1N 85368066 OODVWDRXWMMMDS-CVEARBPZSA-N 289.423 2.229 10 20 CECD C[C@H]1OCCN(Cc2ccc(N3CCOCC3)cc2)[C@@H]1C 93418095 YSJKWDJUNDSTDW-HUUCEWRRSA-N 290.407 2.132 10 20 CECD COc1cccc(CN[C@@H](C)c2nnc3ccccn23)c1O 237408359 MAUGGFQVKOSSEN-NSHDSACASA-N 298.346 2.294 10 20 CECD CCc1nc(CN(CC)c2ccc(OC)cc2)n[nH]1 274667401 RIZCNEXFZSKAME-UHFFFAOYSA-N 260.341 2.402 10 20 CECD COC(=O)[C@H]1CCCCCN1Cc1ccccc1O 360020602 VBBUSTCZADCLRS-CYBMUJFWSA-N 263.337 2.310 10 20 CECD C[C@H](C[S@](C)=O)NCc1ccc2ccccc2c1O 816568056 VDBVPBNUKLQHIZ-WYRIXSBYSA-N 277.389 2.402 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CC23CCNCC3)c1 817976699 RQBNJOAEQIJQCW-SWLSCSKDSA-N 260.381 2.493 10 20 CECD Oc1c(CNCc2nnnn2C2CC2)ccc2ccccc12 816554944 NYOUKUCUKZFZMH-UHFFFAOYSA-N 295.346 2.157 10 20 CECD Cc1cc(O)c(CN[C@H](C(=O)O)C(C)C)cc1C 821045848 IRIVLLRPYJKXBY-ZDUSSCGKSA-N 251.326 2.208 10 20 CECD O=C1OCCN1[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 826995681 ZDVGYYNVRXUWFK-LBPRGKRZSA-N 296.754 2.072 10 20 CECD C[C@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(N(C)C)cc1 828863146 ZSORPYJDYFLUJN-LBPRGKRZSA-N 298.390 2.386 10 20 CECD CCOc1cccc(CN2[C@H]3CC[C@H]2CC(=O)C3)c1O 839131816 PHCGPEVKJJGSBR-STQMWFEESA-N 275.348 2.487 10 20 CECD CCOC[C@H]1CCCCN1C(=O)c1cc(O)cs1 839797859 KFMIUDSQFSPLSW-SNVBAGLBSA-N 269.366 2.485 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@H](C)c1ccc(N(C)C)cc1 834881015 JONYWMNGCZLFMP-FRFSOERESA-N 292.423 2.455 10 20 CECD CN(C[C@H](O)Cc1ccccc1)C(=O)c1cc(O)cs1 832833816 FXKWPGTXCHFRIX-GFCCVEGCSA-N 291.372 2.129 10 20 CECD Cc1noc(C2CN(Cc3ccc(N(C)C)c(F)c3)C2)n1 839130824 IEDBCVRYGYIUQL-UHFFFAOYSA-N 290.342 2.183 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@@H](C2CC2)[C@H]1C1CC1 836884314 FWGULYOLKMTTJQ-GXTWGEPZSA-N 273.332 2.358 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCCC[C@H]2F)c(O)c1 840441959 IIZBPEBOZBROSW-CHWSQXEVSA-N 296.342 2.481 10 20 CECD COc1cccc([C@H](C)NCCN2CC[C@@H](C)C2)c1O 846149465 ZRCFISXTTIBQJW-OLZOCXBDSA-N 278.396 2.393 10 20 CECD CN(C)c1ccc(CNC2[C@H]3CC[C@H]2CC(N)C3)cc1F 841075394 IRKWNBBEOMUIDH-YRFCHQJDSA-N 291.414 2.497 10 20 CECD CC1(C)CNCC[C@@H]1NCc1cc(F)ccc1O 841071794 BNVAHEAMWCZNME-ZDUSSCGKSA-N 252.333 2.009 10 20 CECD CN(C)C1(CNCc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 841890466 BFDKKOIQTWYUAL-UHFFFAOYSA-N 299.758 2.138 10 20 CECD CC[C@H](C)C[C@H](CO)NCc1cc(OC)c(OC)cc1O 843426821 BKEJVTOAEPWHCS-WCQYABFASA-N 297.395 2.296 10 20 CECD NC[C@H](NCc1cc(Cl)cc(F)c1O)C1CC1 841027623 DGPMKHHQMHWDGU-NSHDSACASA-N 258.724 2.012 10 20 CECD Nc1ccc(NC(=O)Nc2cc([C@H]3CCCO3)[nH]n2)cc1 841297496 RMOISVHNUXEHSM-GFCCVEGCSA-N 287.323 2.487 10 20 CECD Oc1ccc(F)cc1CN[C@H]1CCCC(F)(F)[C@@H]1O 840971041 FHGORQIYYBQBGH-CMPLNLGQSA-N 275.270 2.170 10 20 CECD CO[C@@]1(C)C[C@H]1N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 850571924 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FAVXPUMEOYNLNS-ZDUSSCGKSA-N 267.394 2.000 10 20 CECD CC[C@H](NCC[C@@H](O)COC)c1cc(Cl)ccc1O 775526558 RXOAFLGXKSPJOM-YPMHNXCESA-N 287.787 2.484 10 20 CECD COc1ccc(N2CCN(C[C@H]3CCO[C@H]3C)CC2)cc1 877912516 XOHOGNZRXYZMAC-LSDHHAIUSA-N 290.407 2.242 10 20 CECD C[C@@H]1CCN(S(=O)(=O)Nc2ccc(O)c(Cl)c2)C1 777939237 KIPOQCPIGWANLS-MRVPVSSYSA-N 290.772 2.044 10 20 CECD C[C@@H](NC(=O)NC1(CO)CCC1)c1ccc(N(C)C)cc1 776250907 YHTXRYGJMZBGJV-GFCCVEGCSA-N 291.395 2.028 10 20 CECD O=C(C=C1CCSCC1)NCc1ccc(O)c(O)c1 778929073 FFGKXAVIENOIAD-UHFFFAOYSA-N 279.361 2.167 10 20 CECD COc1cccc([C@@H](C)N[C@@H](CCO)C(F)(F)F)c1O 886803701 MFFQJJNFKSHLPG-KCJUWKMLSA-N 293.285 2.365 10 20 CECD CC[C@H](C)[C@H](NCc1ccc(N(C)CC)cc1)C(N)=O 887055700 GZLNHBJQRKRQEQ-WFASDCNBSA-N 277.412 2.132 10 20 CECD COc1ccc(CN[C@@H](C)CN(C)C(C)C)c(O)c1OC 894534736 TZGQHMYFXDDGLF-LBPRGKRZSA-N 296.411 2.228 10 20 CECD C[C@@H](NC(=O)NCCC1=CCNCC1)c1ccccc1O 892100771 MABPYDCWLOHGOY-GFCCVEGCSA-N 289.379 2.062 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H](CCO)C2)c1O 894004706 XKKRCSDTQGWNFL-ZDUSSCGKSA-N 279.380 2.304 10 20 CECD COc1ccc(CN2CCC[C@@H]([C@H](C)O)C2)c(O)c1OC 893417118 BXUKMIXLOXYDRK-NWDGAFQWSA-N 295.379 2.002 10 20 CECD Oc1c(F)cc(F)cc1CN1C[C@@H]2[C@@H](C1)C2(F)F 895149604 MCRBGJPGZZZVRF-RKDXNWHRSA-N 261.218 2.367 10 20 CECD CCc1cccc(CN2CCCNC(=O)[C@H]2CC)c1O 898547953 NTPVUOKVDKRRFJ-CQSZACIVSA-N 276.380 2.055 10 20 CECD C[C@@H](CN(C)Cc1ccc(Cl)cc1O)C(=O)O 1604158643 IPZMXBOVSZFYBO-QMMMGPOBSA-N 257.717 2.198 10 20 CECD CC1(C(=O)NCc2cccc(O)c2O)CC(F)(F)C1 1520510225 XIVXVXUCUALHRM-UHFFFAOYSA-N 271.263 2.149 10 20 CECD O=C(O)c1cnc(SCc2ccnc(O)c2)s1 1602536637 CIERARTUUHGSAG-UHFFFAOYSA-N 268.319 2.234 10 20 CECD CC[C@H](CN[C@H](C)c1cc(C(=O)O)ccc1O)OC 1595166543 UVYFIMWVHHWLTP-MWLCHTKSSA-N 267.325 2.166 10 20 CECD C[C@H](N[C@H](C)c1cnn(C)c1)c1cc(C(=O)O)ccc1O 1593196799 IPGAZKVFDOPMDT-ZJUUUORDSA-N 289.335 2.236 10 20 CECD CN(CCCCC(=O)O)c1ccc2c(c1)OCCO2 258984262 YKRWYIOMSRNJOD-UHFFFAOYSA-N 265.309 2.149 10 20 CECD C[C@@H](Cn1cccn1)NCc1ccc2c(c1)CCCN2C 50286641 TZDUPSKFJOUGPS-AWEZNQCLSA-N 284.407 2.444 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](C(C)C)N(C)C)c1 106917594 UBQCQLYNWOCAHQ-IAQYHMDHSA-N 294.395 2.164 10 20 CECD CCOc1ccc(N(C)C[C@@H](O)COC(C)C)cc1 304305326 PJJKABSFDMUNGA-CQSZACIVSA-N 267.369 2.307 10 20 CECD COC(=O)COc1ccc(N(C)CCOCC2CC2)cc1 183792921 CJMJLVRNUNMPII-UHFFFAOYSA-N 293.363 2.101 10 20 CECD CC[C@@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183475121 QHKJBYSKLSFAPZ-NXEZZACHSA-N 251.326 2.191 10 20 CECD C[C@H](O)C[C@H]1CCCN1Cc1cc(F)ccc1O 180170883 MZHHCRRAQOXSQF-GXFFZTMASA-N 253.317 2.267 10 20 CECD CN(Cc1cccs1)C(=O)c1cccc(O)c1O 126255214 KOUCYPBXXNDIDC-UHFFFAOYSA-N 263.318 2.432 10 20 CECD Cc1nn(C)cc1CN(C)Cc1ccc(N(C)C)cc1 156469509 HBCGAAUKUFTEJB-UHFFFAOYSA-N 272.396 2.427 10 20 CECD Cc1cn(C)nc1C(=O)NCc1c(C)c2ccccc2n1C 412317695 ZUVHTCFVVHELOD-UHFFFAOYSA-N 296.374 2.459 10 20 CECD C[C@@H](NCc1cc2c(cc1O)OCO2)C(F)(F)F 288349794 BXJLBIOFZPAYRF-ZCFIWIBFSA-N 263.215 2.161 10 20 CECD CCC[C@@]1(CO)CCCN1Cc1cc2c(cc1O)OCO2 278797427 XGJSYFLQOUQKRR-INIZCTEOSA-N 293.363 2.248 10 20 CECD COC[C@H](CCO)N[C@@H](C)c1cc(Cl)ccc1O 273561428 IHHXLFPNGYJTGG-ONGXEEELSA-N 273.760 2.094 10 20 CECD COC(=O)C1=C(C)O[C@@H](CSc2nccs2)C1 270387675 FSFZNEUYEGMVNK-MRVPVSSYSA-N 271.363 2.471 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnc2n1CCCC2 371019648 TUYHRDMIUQUZCL-UHFFFAOYSA-N 285.347 2.197 10 20 CECD CC(C)OC[C@@H]1CN(Cc2cc(F)ccc2O)CCO1 372123956 GRCJXIBKOMHWRU-AWEZNQCLSA-N 283.343 2.157 10 20 CECD CCOc1cccc(CN2CC[C@@]3(CCN(C)C3)C2)c1O 292781232 LKSCHSQOEVRPJK-QGZVFWFLSA-N 290.407 2.319 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCCC[C@@H]2N(C)C)c1 1341800913 BQQZKELCQUKMBX-CABCVRRESA-N 278.396 2.363 10 20 CECD Cc1c(C(=O)NCc2ccccc2O)[nH]c2c1C(=O)CCC2 299605476 WLZROIGZAYHPMZ-UHFFFAOYSA-N 298.342 2.478 10 20 CECD N[C@@H]1CCCC[C@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 818431939 XDOIRELNTVISIG-GHMZBOCLSA-N 299.758 2.313 10 20 CECD COC1([C@@H](C)NCc2cc(F)ccc2O)CCOCC1 817419261 FCQKFVIDKSBUNV-LLVKDONJSA-N 283.343 2.205 10 20 CECD C[C@@H](NCCCNC1CC1)c1ccc(F)cc1O 817984712 XQOWHCZFXPNMJZ-SNVBAGLBSA-N 252.333 2.324 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NCC1(O)CCC1 819377731 UELDRMSFBXFWSC-AWEZNQCLSA-N 276.424 2.497 10 20 CECD C[C@H](NCC1(CC(N)=O)CC1)c1ccc(N(C)C)cc1 817585827 IUGQJTZWIOMHQG-LBPRGKRZSA-N 275.396 2.059 10 20 CECD CC[C@@H](NCc1cc(Br)ccc1O)C(=O)O 818316699 FPDCOXZVVSNROD-SECBINFHSA-N 288.141 2.108 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)C2CC2)cc1Cl 825291202 GQXCDKLGMSJRFI-LBPRGKRZSA-N 255.745 2.215 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)/C=C/[C@H]2CCOC2)c1 827303198 CBCBSDWJRTZIOD-NDYVEPOPSA-N 291.347 2.171 10 20 CECD Cc1cc(O)c(CNCC(F)(F)CO)cc1Cl 825529831 HLCDLCOMVSABTL-UHFFFAOYSA-N 265.687 2.071 10 20 CECD COC(=O)c1cnc(Sc2cc(C)nc(OC)n2)s1 828428988 QDCMJQOGWNMEPD-UHFFFAOYSA-N 297.361 2.188 10 20 CECD Cc1c(C)n(C)c2ccc(OC[C@@H]3CNC(=O)O3)cc12 496813990 IPDXKRVFQHVVJE-LBPRGKRZSA-N 274.320 2.282 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc3ccncc23)C[C@@H]1C(=O)O 828457426 UODJTDWLUAUPRG-MFKMUULPSA-N 286.331 2.093 10 20 CECD Cc1cc(O)c(CNCCOC[C@H]2CCOC2)cc1Cl 825214564 HWYBKAONMLQDOV-LBPRGKRZSA-N 299.798 2.497 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)CC(C)(C)O1 731871460 LRYOJMBSPQCVCY-QMMMGPOBSA-N 255.339 2.093 10 20 CECD CCc1ncc(CN(C)c2ccc(OCC(=O)O)cc2)o1 903904938 QMAIUJAMAOYHEB-UHFFFAOYSA-N 290.319 2.337 10 20 CECD CC(C)(C)C[C@H](NCc1ccccc1O)C(=O)O 901804890 DLWJSNHSDSMTBE-NSHDSACASA-N 251.326 2.371 10 20 CECD COc1ccc(O)c(CNC(=O)c2scnc2Cl)c1 734015106 ZQJXPQAUJOHFDH-UHFFFAOYSA-N 298.751 2.441 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC1[C@H]2[C@H]3CC[C@@H](C3)[C@@H]12 588407485 WOUPWVZQJRJQQT-GXUCVMDVSA-N 285.343 2.272 10 20 CECD C[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)CCN1 841062127 GIHQKSQVCCJPBI-DTWKUNHWSA-N 272.751 2.415 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)[C@H](C)CO1 844733764 XKZOQMQLTPQQKZ-DGCLKSJQSA-N 295.379 2.409 10 20 CECD CCN1CC[C@H](CN[C@H](C)c2cccc(OC)c2O)C1 846142284 ZVKIHDFJTONYLT-CHWSQXEVSA-N 278.396 2.393 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C\c1cnn(C)c1 917524990 VGGIQKOBZMAUPL-YFHOEESVSA-N 298.390 2.158 10 20 CECD CC(C)[C@H](C(=O)NCc1cc(Cl)ccc1O)N(C)C 846474771 BGJKVRBVJKKSIP-CYBMUJFWSA-N 284.787 2.248 10 20 CECD O=C1CCCN1CCNCc1ccc2ccccc2c1O 846087294 QLIUSDAFQRIXDM-UHFFFAOYSA-N 284.359 2.257 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1CC1(F)F 846477697 VJIVGNXTELEGND-QMMMGPOBSA-N 261.655 2.317 10 20 CECD COCC1(CC(=O)N[C@@H](C)c2cc(OC)ccc2O)CC1 843832259 VLZMRLLQEVZLJS-NSHDSACASA-N 293.363 2.395 10 20 CECD C[C@H](C[C@H]1CCC(=O)N1)NCc1ccc(N(C)C)c(F)c1 924861659 KROYXFNNOVMPET-DGCLKSJQSA-N 293.386 2.039 10 20 CECD O=C(c1cc(O)cs1)N1CCC2(CCCC2=O)CC1 856016233 AIOVKJFFXBHXET-UHFFFAOYSA-N 279.361 2.429 10 20 CECD Cc1cnc(CNCc2ccc(N(C)C)cc2C)[nH]1 850138463 FRNLMEUTKUJBFG-UHFFFAOYSA-N 258.369 2.382 10 20 CECD O=C(OCC(=O)[C@H]1C[C@H]2CC[C@H]1C2)c1cccc(O)c1O 758562274 SJNCBUFAAUYSRN-NHCYSSNCSA-N 290.315 2.260 10 20 CECD C[C@@H]1C[C@H](N[C@H]2CCCCNC2=O)c2c(O)ccc(F)c21 756395816 JJNSDZCZXRILHF-USWWRNFRSA-N 292.354 2.338 10 20 CECD COc1cc(O)c(CN[C@@]2(C)CCO[C@@H]2C)cc1OC 753575201 GRSVXSHKGBNXKK-BMIGLBTASA-N 281.352 2.067 10 20 CECD CCOc1cccc(CN(C)Cc2cn[nH]c2)c1O 769428077 ZYAHSKLAQJQLBJ-UHFFFAOYSA-N 261.325 2.146 10 20 CECD CN(C(=O)C1C[C@@H]2CCC[C@H](C1)C2N)c1ccc(N)cc1 877077991 YHPODEOINGPJSK-ZAQWFSBCSA-N 287.407 2.385 10 20 CECD CCOCCNCc1ccc(OC)c(Cn2cccn2)c1 873013989 KLAOAIGYQOHHFH-UHFFFAOYSA-N 289.379 2.066 10 20 CECD CC(C)CC[C@@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 876873238 ZKLYLDWEJOCPPB-MRXNPFEDSA-N 291.439 2.475 10 20 CECD CC[C@@H](NC[C@H](O)CN(C)C)c1cc(Cl)ccc1O 775501299 GCMIVIQYMFUXGC-WCQYABFASA-N 286.803 2.009 10 20 CECD CC[C@@H]1[C@@H](C)CCN1Cc1cc2c(cc1O)OC[C@H]2O 774618129 JTMYCPUDRLTBPU-PSOPSSQASA-N 277.364 2.438 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@H]1C1CCNCC1)c1ccccc1O 870988671 WKCSNMFZBVQOSR-TUKIKUTGSA-N 288.391 2.205 10 20 CECD Cc1ccc(CN2CC[C@H](Cc3cnn(C)c3)C2)c(O)c1 876796664 HPORZRNHJOESFF-CQSZACIVSA-N 285.391 2.499 10 20 CECD CCN(CC)c1ccc(CN2C[C@H]3CNC[C@@H]3C2)cc1 770395630 TVYBNTLTEOGYHS-HZPDHXFCSA-N 273.424 2.184 10 20 CECD CC[C@]1(O)CCN(Cc2cccc(Cl)c2O)C1 779219807 WDXWIOPGLOTDBJ-ZDUSSCGKSA-N 255.745 2.392 10 20 CECD CCn1nccc1NC(=O)N(C)Cc1ccccc1O 776022586 CSQKPLKBRJUQQA-UHFFFAOYSA-N 274.324 2.273 10 20 CECD CSC[C@@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 778149018 BVXJPWFCYWSGNH-RISCZKNCSA-N 268.426 2.127 10 20 CECD C[C@H](NCc1ccc(N2CCN(C)CC2)cc1)c1ncc[nH]1 883290201 NWZCPBSUWYIATI-AWEZNQCLSA-N 299.422 2.012 10 20 CECD C[C@@H](NCCOCCN(C)C)c1cc(Cl)ccc1O 774380644 JTLJDLRPUBXBMH-LLVKDONJSA-N 286.803 2.274 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCO[C@@]2(CCOC2)C1 883081889 QSZNTXKTOKOVGA-WFASDCNBSA-N 299.317 2.098 10 20 CECD CCOc1cccc(CN2CC[C@@H](C(=O)OC)[C@@H]2C)c1O 787420298 GFAYYFAZOWNGHQ-WCQYABFASA-N 293.363 2.174 10 20 CECD CCN1C(=O)/C(=C/c2ccc(OC)nc2)SC1=S 780149190 UPBJCLQPOBXBLF-TWGQIWQCSA-N 280.374 2.311 10 20 CECD COc1ccc(CN2CCC=C(F)C2)c(O)c1OC 893437044 OGCIHXZXQFPYNJ-UHFFFAOYSA-N 267.300 2.469 10 20 CECD O=C(COC(=O)c1ccoc1Cl)c1ccc(O)c(O)c1 784989822 PUMVZDDQWMPYDE-UHFFFAOYSA-N 296.662 2.384 10 20 CECD COc1ccc(CNC[C@]2(O)CCC[C@H]2C)c(O)c1OC 894642037 KJYALJKKHLIIHL-BDJLRTHQSA-N 295.379 2.050 10 20 CECD COCc1cccc(C(=O)NCc2ccccc2O)c1 701179497 DAMUJONLEXNAKR-UHFFFAOYSA-N 271.316 2.469 10 20 CECD CC[C@@]1(NCc2cc(OC)c(OC)cc2O)CCOC1 792193253 SNFSWFJRRMNIOW-OAHLLOKOSA-N 281.352 2.068 10 20 CECD COCCCNCc1c(O)cccc1Br 706829122 LQCLQXUWQXZNCG-UHFFFAOYSA-N 274.158 2.281 10 20 CECD CN(CCN(C)C1CC1)Cc1ccc(N(C)C)cc1 193561211 RLNMMTHAPIODMU-UHFFFAOYSA-N 261.413 2.279 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@H](CF)C2)cc1 711430088 MVXVRELPONLMRG-SNVBAGLBSA-N 251.305 2.482 10 20 CECD C[C@H]1C(=O)CC[C@@H]1CC(=O)NCc1ccc(N(C)C)cc1 792846858 CBXGPIKMEZRCHX-TZMCWYRMSA-N 288.391 2.374 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)NCc1ccc(N)cc1)OC 1336974643 CABXBJXJAWQAIX-SMDDNHRTSA-N 279.384 2.129 10 20 CECD Nc1ccc(CN2CCC[C@H]2[C@@H](O)C(F)(F)F)cc1 1345159115 BXOYBCAIRBOXEU-NWDGAFQWSA-N 274.286 2.156 10 20 CECD CCN(C)c1ccc(CN[C@](C)(CCF)C(=O)O)cc1 1605410923 PPVOZEGSHBUDDA-OAHLLOKOSA-N 282.359 2.435 10 20 CECD CNC1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCC1 1578591852 SPDBSFQQJQNMBN-GFCCVEGCSA-N 275.396 2.072 10 20 CECD CC(C)(NCc1cc(F)ccc1O)c1cc(C(=O)O)on1 1590871372 PECBFYJIFMBISB-UHFFFAOYSA-N 294.282 2.242 10 20 CECD CCOc1ccc(CNCc2cc(C(=O)O)co2)c(O)c1 1597105870 VRBVZFQEDUIMCR-UHFFFAOYSA-N 291.303 2.372 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C[S@](C)=O)cc1 168215785 GLUYKHMCAPUWFL-BFUOFWGJSA-N 282.453 2.389 10 20 CECD C1=CCC(NCc2ccc(N3CCOCC3)cc2)C1 125244555 VRFUTNURBILVEQ-UHFFFAOYSA-N 258.365 2.331 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCO2)[C@@H](O)C(F)(F)F 922310711 ZPAVCBPBPSBJJA-TVQRCGJNSA-N 289.297 2.413 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCN2CCC[C@H]2C1 876940794 XTQMKNTZOYPKSY-KGLIPLIRSA-N 260.381 2.417 10 20 CECD Cc1ccc(CNCCCOC[C@H]2CCCO2)c(O)c1 876900778 QVQMNVWXVJTOIY-OAHLLOKOSA-N 279.380 2.376 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@H]1COCCO1 252387868 ZEAXJRXYVSOXSG-AGIUHOORSA-N 277.364 2.254 10 20 CECD COc1ccc(O)c(CNCc2cccnc2OC)c1 37650341 BUMMKNGZLORULI-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CN(C)C[C@H]1CCN(Cc2cccc(Cl)c2O)C1 180230750 IFXMRMOHTBOBFZ-LLVKDONJSA-N 268.788 2.429 10 20 CECD CC(C)N1CC[C@H](N[C@@H](C)c2cc(F)ccc2O)C1=O 186048788 DXLLWGGYJQNATR-GWCFXTLKSA-N 280.343 2.191 10 20 CECD CC[C@@H](NCCN1CCCC1=O)c1ccccc1O 405399372 PLGMARNNGAJCAS-CYBMUJFWSA-N 262.353 2.055 10 20 CECD COc1cccc(CN[C@@H](C)[C@H](OC)C2CC2)c1O 388240156 QJRJWVJHONMUFP-BONVTDFDSA-N 265.353 2.304 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1C[C@H]2CC[C@@H]1O2 883158242 ZFNKTTFFYXBVLJ-JLLWLGSASA-N 255.264 2.080 10 20 CECD O=C(NC1CC1)[C@@H]1CCCN1Cc1cccc(Cl)c1O 179726646 NYWSJKUWHNEKEG-ZDUSSCGKSA-N 294.782 2.289 10 20 CECD Cc1ccc(C(=O)NC2C[C@@H](C)O[C@H](C)C2)c(O)c1O 182968769 WUJPMZBNQUZJHP-NXEZZACHSA-N 279.336 2.092 10 20 CECD C[C@H]1OCC[C@H]1NCc1ccc2c(c1)CCCN2C 120712569 RAEMXINPJMEBBT-IUODEOHRSA-N 260.381 2.336 10 20 CECD Cc1cccc(CN2CCC[C@@H](C3OCCO3)C2)c1O 180014458 HOBVENBPDNTZPG-CQSZACIVSA-N 277.364 2.286 10 20 CECD CC(C)SCCNCc1cc2c(cc1O)OCO2 290036632 FMACIEXHEFTBJU-UHFFFAOYSA-N 269.366 2.352 10 20 CECD COCCC1(C(=O)NCCc2ccc(N)cc2)CCC1 237160271 NOZWNGREOUJHHR-UHFFFAOYSA-N 276.380 2.134 10 20 CECD COc1cccc(CNC(=O)c2ccc(C)c(O)c2O)c1 146223097 ZFJXXTKLVFPXDU-UHFFFAOYSA-N 287.315 2.345 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)c1 246708503 LDFOFRFSNSWOAZ-COPLHBTASA-N 275.348 2.453 10 20 CECD CN(Cc1ccon1)C(=O)NCc1ccc(N(C)C)cc1 265824660 YQPASUWICBUFRU-UHFFFAOYSA-N 288.351 2.082 10 20 CECD CN1CCN(Cc2ccc3ccccc3c2O)CC1 261305291 JHIDIJNZWSFOAD-UHFFFAOYSA-N 256.349 2.293 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2cccnc2)cc1F 264637630 DYQNMHXVARPWJA-UHFFFAOYSA-N 287.338 2.146 10 20 CECD O=S1(=O)CC[C@@H](COc2ccc(N3CCCC3)cc2)C1 278668250 NWWWPQUJEPHKFT-ZDUSSCGKSA-N 295.404 2.100 10 20 CECD C[C@]1(CNC(=O)c2cccc(O)c2O)CCO[C@H]1C1CC1 370497085 AGYDRXSWERKPNB-GOEBONIOSA-N 291.347 2.033 10 20 CECD Cc1ccc(O)c(CN[C@@]2(CO)CCOc3ccccc32)c1 282212434 DKSDBHDODHECIM-GOSISDBHSA-N 299.370 2.461 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@@H](O)C(F)(F)F 294294098 POKKCTLURDYMIV-SECBINFHSA-N 287.640 2.198 10 20 CECD CC(=O)C(=O)COC(=O)C1(c2ccc(F)cc2)CCCC1 808488219 PPJTZYSXWKCJPX-UHFFFAOYSA-N 292.306 2.339 10 20 CECD CN[C@@H](CC(C)(C)C)C(=O)NCc1ccc(N(C)C)cc1 395774480 SPLFCSCTUYBRQJ-HNNXBMFYSA-N 291.439 2.393 10 20 CECD Cc1cccc(CN2CCC[C@H](OC(=O)N(C)C)C2)c1O 294733257 GLZZBZFWCRWEAK-AWEZNQCLSA-N 292.379 2.363 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CC[C@H]1O 819683747 ALZUUNSNDDIIDL-DGCLKSJQSA-N 290.388 2.409 10 20 CECD CCN(CC(=O)N(C)C)Cc1ccc2ccccc2c1O 816485984 JAVVYXWCIVKXFW-UHFFFAOYSA-N 286.375 2.456 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C[C@@H]1COCCO1 827140090 HRGZVZMZLOMLEG-SECBINFHSA-N 289.734 2.032 10 20 CECD O=C(O)[C@H]1CCCN1Cc1cc(Cl)cc(F)c1O 821509834 XXJIJKBEWUCKNW-SNVBAGLBSA-N 273.691 2.234 10 20 CECD C[C@H](NCc1cc(Cl)c(F)cc1O)C1(CO)CC1 826991266 XTPVRRDNZFZNKF-QMMMGPOBSA-N 273.735 2.435 10 20 CECD Cc1ccc(C(=O)NC[C@H]2CCOC(C)(C)C2)c(O)c1O 837220111 HJMZYPXQPKHJEE-NSHDSACASA-N 293.363 2.341 10 20 CECD CCC1(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)COC1 834900906 TVEFPFQPJDCKAD-JTQLQIEISA-N 280.324 2.378 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@@H]1CCCNCC1 841057880 LSRCMYOUNPDCSI-SECBINFHSA-N 272.751 2.416 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@](C)(CN)C1 843113992 FFWARKBJCWQSNK-INIZCTEOSA-N 261.413 2.232 10 20 CECD C[C@@H](Cc1ccncc1)NC(=O)NCc1ccccc1O 749559816 UWYIMWUIOOLJMB-LBPRGKRZSA-N 285.347 2.218 10 20 CECD CCn1cnnc1CCN[C@H](C)c1cc(F)cc(F)c1O 756731807 DCFKUPKZGCZNJC-SECBINFHSA-N 296.321 2.175 10 20 CECD COc1ccc(N(C)C[C@@H]2CCOC2)c(OC)c1 752113334 RPLZANRSXHZLGQ-NSHDSACASA-N 251.326 2.177 10 20 CECD CCCC[C@@H](OC(=O)c1cc(O)cs1)C(=O)OC 762821064 DXFRENPTUABICT-SECBINFHSA-N 272.322 2.342 10 20 CECD C[C@H]1[C@H](C)CCN1Cc1cc2c(cc1O)OC[C@H]2O 768465200 YNNSFAYHGUBEGW-ISTVAULSSA-N 263.337 2.048 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CC3(CC3)C(=O)O2)c1 763728019 CSJPBDWZCJZSBX-CMPLNLGQSA-N 291.347 2.147 10 20 CECD COc1cc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)on1 775411050 NTZKQSVJBYOMIM-SNVBAGLBSA-N 289.335 2.240 10 20 CECD CCN(CC)CCOCCNCc1ccc(C)cc1O 877333391 UJGCNRRPYFPWIM-UHFFFAOYSA-N 280.412 2.149 10 20 CECD CSCC[C@H](NCc1ccc(C)cc1O)C(=O)N(C)C 877535969 VWXCDUCQXJBZSG-ZDUSSCGKSA-N 296.436 2.000 10 20 CECD CC(C)Cn1cc(C(=O)N(C)c2ccc(N)cc2)cn1 877075274 BUVYUIUIHFHKFZ-UHFFFAOYSA-N 272.352 2.398 10 20 CECD Cc1cc(COC(=O)c2ccc(C)c(O)c2O)nc(C)n1 1118388040 XSGPASKUDKDHCC-UHFFFAOYSA-N 288.303 2.170 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@@H]1F 1121112389 XYMWXVQIXMEYBN-STQMWFEESA-N 250.317 2.035 10 20 CECD CNCCCCC(=O)NCc1ccc(N2CCCC2)cc1 1121990151 BPGKAMKMQSWCRD-UHFFFAOYSA-N 289.423 2.293 10 20 CECD COc1ccc(CN2C[C@H](C)OC[C@@H]2C)c(O)c1OC 891669263 AYMPPWBRQYMKEY-QWRGUYRKSA-N 281.352 2.019 10 20 CECD Cc1ccc(O)c(CN[C@H](Cc2ccccc2)C(=O)O)c1 84854120 POOZVCKAJXMXSA-OAHLLOKOSA-N 285.343 2.486 10 20 CECD O=C(N[C@H](CCO)Cc1ccccc1)c1cc(O)cs1 799853856 KXRMRPOTHTUGPW-GFCCVEGCSA-N 291.372 2.177 10 20 CECD Cc1ccc(C(=O)N2CC[C@H](c3ccccn3)C2)c(O)c1O 799068048 MSMVXZAARSTCDQ-LBPRGKRZSA-N 298.342 2.431 10 20 CECD CCOc1cccc(CN[C@@H]2CCC[C@H]2CCO)c1O 189974880 HFRRMVPZTWZJHW-GXTWGEPZSA-N 279.380 2.432 10 20 CECD CC(C)O[C@@H]1C[C@H](NC(=O)c2cccc(O)c2O)C1(C)C 790934203 HULBFKDSXQGKJV-QWHCGFSZSA-N 293.363 2.420 10 20 CECD CCc1nn(C)cc1CNCc1cc(C)ccc1O 93112926 HMSJCTBDHITXGB-UHFFFAOYSA-N 259.353 2.286 10 20 CECD CCCN(Cc1ccccc1O)[C@H](CC)C(=O)O 191414327 NYDNPOMZOHZKCO-GFCCVEGCSA-N 251.326 2.467 10 20 CECD COc1cc(/C=C2/SC(=S)NC2=O)ccc1F 1319479199 PWTRCEWGYSOOFB-WEVVVXLNSA-N 269.322 2.323 10 20 CECD O=C1CCCCC[C@H](C(=O)NCc2cccc(O)c2O)C1 1263894431 GLWFJGQOHSGATF-NSHDSACASA-N 291.347 2.254 10 20 CECD Cc1cc(O)c(CN2C[C@H]3[C@@H](C2)[C@@H]3C(=O)O)c(Cl)c1 1600286877 YQQGGYFMZHTULF-WOFXILAISA-N 281.739 2.116 10 20 CECD CCN(C)c1ccc(CN[C@H](CC(=O)O)C2CC2)cc1 1609991000 CEHAYBJEZCTVOT-OAHLLOKOSA-N 276.380 2.486 10 20 CECD C[C@H](NC[C@H]1CCOC[C@@H]1C)c1cc(C(=O)O)ccc1O 1604337652 HZOBFGBPFVFTOU-GMXVVIOVSA-N 293.363 2.414 10 20 CECD O=C(O)[C@@H]1[C@H]2CN(Cc3c(O)ccc4ccccc34)C[C@H]21 1610803607 GVXMBAGXTFOEBU-FOLVSLTJSA-N 283.327 2.308 10 20 CECD C[C@H](NC[C@@H](C)C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589958813 LSTUQJAUMCBHEC-ZJUUUORDSA-N 287.367 2.269 10 20 CECD COc1ccc(O)c(CNCc2ccsc2C(=O)O)c1 1599598133 FKEXTMSFDVDQTP-UHFFFAOYSA-N 293.344 2.450 10 20 CECD C[C@H](N[C@H](C)CC[S@](C)=O)c1ccccc1O 167467315 MTLSXTRHMBKFLG-VGTOOOLASA-N 255.383 2.200 10 20 CECD CCN1C(=O)/C(=C\c2cnn(CC)c2)SC1=S 2798002 KKPRKUAVHKFPLL-WEVVVXLNSA-N 267.379 2.124 10 20 CECD COc1ccc(O)c(CN[C@H]2CCOC(C)(C)C2)c1 159951138 AEBVMJATUNGZEW-LBPRGKRZSA-N 265.353 2.448 10 20 CECD COc1cccc(CN2CC[S@@](=O)C(C)(C)CC2)c1O 322092372 HSGZWOBYHLZVQO-HXUWFJFHSA-N 297.420 2.134 10 20 CECD N[C@H](CC1CCCCC1)C(=O)NCc1ccccc1O 380297558 TWWQBGBIILMLDG-CQSZACIVSA-N 276.380 2.306 10 20 CECD CCCN1CCN(Cc2cccc(CC)c2O)CC1 692129347 KMHQDQCKRAURHB-UHFFFAOYSA-N 262.397 2.482 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCOC(C)C)c1 103529918 BXQUEFYIDATAOT-NSHDSACASA-N 281.352 2.393 10 20 CECD CCOCc1cc(CNC(C)(C)CCO)ccc1OC 174577890 AGMPEBIBXOYNHF-UHFFFAOYSA-N 281.396 2.482 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@]1(O)CCO[C@H]1C 300423511 GCXKZVFSGFFWTJ-ZOPJHEKZSA-N 291.391 2.378 10 20 CECD CCCc1noc(CN(C)c2ccc3c(c2)OCO3)n1 121414109 TWWBQLDTPUYMLE-UHFFFAOYSA-N 275.308 2.387 10 20 CECD Cc1cnccc1CNC(=O)c1ccc(C)c(O)c1O 187455801 RMOWHSWKUPDWPS-UHFFFAOYSA-N 272.304 2.040 10 20 CECD CSCC[C@H](C)NCc1cc2c(cc1O)OCO2 130768364 MKUSECKVMMBCDB-VIFPVBQESA-N 269.366 2.352 10 20 CECD COc1ccc(N(C)CC(=O)NC2CCCC2)c(OC)c1 132300688 ZZRHYVXIKVTXFT-UHFFFAOYSA-N 292.379 2.199 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cn[nH]c2C)cc1 194877670 WVKRBHYRXUJNKU-UHFFFAOYSA-N 286.379 2.494 10 20 CECD CC(C)(C)OC(=O)CSc1ncc(C(=O)O)s1 383400530 OEIGVURFCWGXFP-UHFFFAOYSA-N 275.351 2.275 10 20 CECD C[C@@]1(CNC(=O)c2c(F)ccc(O)c2O)CCCS1 276617636 UDBVZBSCUWTWBI-ZDUSSCGKSA-N 285.340 2.252 10 20 CECD COc1cc(O)c(CNC[C@H]2CCO[C@H](C)C2)cc1OC 271819337 MOFDNVYTUHSNHT-NEPJUHHUSA-N 295.379 2.314 10 20 CECD O=C(N[C@@H]1CCc2ccccc2OC1)c1cccc(O)c1O 374877800 MNYOXWKSNHGOAB-GFCCVEGCSA-N 299.326 2.221 10 20 CECD CC(=O)N1CCC[C@@H](CN[C@H](C)c2ccccc2O)C1 280939306 IQTDKULOWHSPQL-OCCSQVGLSA-N 276.380 2.301 10 20 CECD CCC[C@](C)(O)C(=O)N1CCOc2cc(N(C)C)ccc21 569246662 KBNOWBDPQIMCCA-INIZCTEOSA-N 292.379 2.029 10 20 CECD C[C@H](CN)CN[C@H](C)c1ccc(Br)cc1O 817963019 QFUTXYMEFYOXBG-RKDXNWHRSA-N 287.201 2.400 10 20 CECD C[C@H]1CC2(CCNCC2)CN1Cc1ccccc1O 818431358 JTXZYJLALBWMRQ-ZDUSSCGKSA-N 260.381 2.356 10 20 CECD Cc1ncc(/C=C\C(=O)NCc2ccc(O)c(O)c2)s1 588401401 CEMJSHKBYQNINP-HYXAFXHYSA-N 290.344 2.192 10 20 CECD CC[C@@H](O)[C@H]1CCCCN1C(=O)c1cc(O)cs1 912118731 GFUFSMVXWICPRA-GHMZBOCLSA-N 269.366 2.219 10 20 CECD CCOc1ccc(CNC[C@@](C)(O)CC)c(O)c1 732229201 HSOBZVPNHHDUFM-AWEZNQCLSA-N 253.342 2.042 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)c2ccn(C)n2)c1O 839195740 GOBPVSOEHDXBPD-SECBINFHSA-N 291.326 2.318 10 20 CECD CCCCOC(=O)[C@H](C)OC(=O)c1ccc(C)c(O)c1O 744909671 KXWRIYMYSLTNJF-JTQLQIEISA-N 296.319 2.295 10 20 CECD CCOC(=O)[C@@H](F)C1CN(Cc2cccc(CC)c2O)C1 848913773 DRECXEHGJMUVDP-AWEZNQCLSA-N 295.354 2.288 10 20 CECD COc1ccc(O)c(CN2CCC([C@H]3CCNC3)CC2)c1 843126327 JJXAACFEGTWNDH-AWEZNQCLSA-N 290.407 2.222 10 20 CECD COc1cc(Cl)cc(CNCC[C@@H]2CCNC2)c1O 841037407 SRDHUCKAUSYNGQ-JTQLQIEISA-N 284.787 2.143 10 20 CECD O=C(NCCCOCC1CCOCC1)c1cc(O)cs1 740928139 FZUJRUTZMOSIND-UHFFFAOYSA-N 299.392 2.017 10 20 CECD Cc1cccc(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)c1O 843059204 GEADEVANBDSKQG-AEGPPILISA-N 260.381 2.260 10 20 CECD Oc1c(Cl)cccc1CNC[C@@H]1CCCNC1 841032260 AYHVAITWERPCGN-SNVBAGLBSA-N 254.761 2.135 10 20 CECD C[C@@H](NC[C@H]1COCCO1)c1cc2c(cc1O)CCCC2 756435104 VSOAQGGOEPPZDT-DOMZBBRYSA-N 291.391 2.337 10 20 CECD CNC[C@@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 923282744 PWVXKHAEBWDFKH-INIZCTEOSA-N 275.440 2.492 10 20 CECD CCN(C)c1ccc(CN(C)Cc2cnc[nH]2)cc1 852288258 MHHHNDXCQFTFPQ-UHFFFAOYSA-N 258.369 2.498 10 20 CECD Cc1cc(O)c(CN2CC[C@H]3NC(=O)CC[C@H]3C2)cc1C 853554614 BPBZBEDQWRNISE-DZGCQCFKSA-N 288.391 2.110 10 20 CECD COc1ccc(N(C)CCOC2CC2)c(OC)c1 930077663 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Cc1ccc([C@@H](C)N[C@H](C)c2ncnn2C)c(O)c1 276696571 VJSYLONPISXSBX-GHMZBOCLSA-N 260.341 2.241 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@]1(C)CCCOC1 272917679 NFEMAAHCJQTGKZ-HNNXBMFYSA-N 263.337 2.167 10 20 CECD C[C@H]1CC[C@@H](C)N1CC(=O)N(C)c1ccc(N)cc1 706291734 SAEMOLVLXQAZOH-TXEJJXNPSA-N 261.369 2.104 10 20 CECD CC[C@@H](NC[C@@H](O)COCC1CC1)c1ccc(F)cc1O 796737491 VZTZYSARQMENBA-UKRRQHHQSA-N 297.370 2.360 10 20 CECD C[C@@H](N[C@H](CCO)C1CC1)c1ccc(F)cc1O 756741951 ZCNAHPBJGXSIAD-NOZJJQNGSA-N 253.317 2.343 10 20 CECD Cc1ccc(CN2CCC[C@H](C(=O)NC3CC3)C2)c(O)c1 1333336946 SGCHRMYRASQUEQ-AWEZNQCLSA-N 288.391 2.191 10 20 CECD CN(C)c1cc(F)c(CNC(C)(C)CC(=O)O)cc1F 1261845724 MICZULVETYTJCF-UHFFFAOYSA-N 286.322 2.374 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1ccccc1O 1116449287 PLNVMWDPHLOKFV-UHFFFAOYSA-N 251.326 2.166 10 20 CECD C[C@H](NC(=O)NC1CC(CC(=O)O)C1)c1ccccc1O 1607457300 VDNGBMOPRIZZDG-WHXUTIOJSA-N 292.335 2.006 10 20 CECD O=C(CC[C@@H]1CCCN1)NCc1cc(Cl)ccc1O 1580542225 LEZMYXGKXYDQDE-LBPRGKRZSA-N 282.771 2.194 10 20 CECD Nc1ccc(CNC(=O)c2ccc3c(c2)OCCCO3)cc1 1580445824 XZHLCUOKMXIJFX-UHFFFAOYSA-N 298.342 2.360 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CC[C@H]1C(=O)O 1595891265 QZARLYWDUXRWKC-QWHCGFSZSA-N 291.347 2.242 10 20 CECD Cc1cc(C)c(C(=O)NCc2ccc(O)c(O)c2)o1 159146291 BWMOLZNDCWSMSA-UHFFFAOYSA-N 261.277 2.238 10 20 CECD C[C@H](CN(Cc1ccc(N(C)C)cc1)C1CC1)C(=O)O 833515951 BRFWMBJQHNKNSC-GFCCVEGCSA-N 276.380 2.438 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H]([C@@H](C)O)C2)c1O 167858212 GBQVITFSKDDJOC-KOLCDFICSA-N 297.782 2.451 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](C)[C@@H](CN)C2)c1O 163389568 SCFISVYYETWUPH-PWSUYJOCSA-N 298.814 2.471 10 20 CECD CC(C)OC1CCN(C(=O)Cc2ccc(N)cc2)CC1 695124049 LNFAEGXNMJGAAK-UHFFFAOYSA-N 276.380 2.227 10 20 CECD C[C@@H](NCCN1CCSCC1)c1ccccc1O 223662088 LLLWTTBDIPPFDO-GFCCVEGCSA-N 266.410 2.092 10 20 CECD COc1ccc(O)c([C@H](C)NCCC(=O)OC(C)C)c1 182435833 WPZKQYAHDXNIES-NSHDSACASA-N 281.352 2.393 10 20 CECD CN1CCCc2cc(CNC(=O)NCC(F)F)ccc21 73917279 LQQFLTUDQYXXJG-UHFFFAOYSA-N 283.322 2.133 10 20 CECD Oc1cc2c(cc1CN[C@H]1CCCSC1)OCO2 135702353 UUQZAMRGMOAHIM-JTQLQIEISA-N 267.350 2.106 10 20 CECD CN(C)c1ccc(CN2CCC[C@@](C)(C(=O)O)C2)cc1 86782705 KJCUNKZITAHDLW-MRXNPFEDSA-N 276.380 2.439 10 20 CECD C[C@@H]1COCCN1Cc1c(O)ccc2ccncc12 46478108 GORHWXPCSBIHCA-LLVKDONJSA-N 258.321 2.161 10 20 CECD O=C(Cc1noc2ccccc12)NCc1ccccc1O 133940295 SZJPXEPEBNUIOW-UHFFFAOYSA-N 282.299 2.392 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H]3CC[C@@H](C2)N3C)c1 93614924 JUYJUIMVTZDTDQ-CABCVRRESA-N 290.407 2.459 10 20 CECD Cc1c(CNC(=O)N[C@@H]2CCOC2)n(C)c2ccccc12 349733581 JOPIFLLNRDUPFX-GFCCVEGCSA-N 287.363 2.075 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2ccc(N(C)C)cc2)CCO1 271890305 OGVKWRSOEWJIIC-JSGCOSHPSA-N 276.380 2.184 10 20 CECD Oc1ccccc1CNC[C@@H]1CCCCN1C1CC1 277475162 KWXZLNHZESGJGL-HNNXBMFYSA-N 260.381 2.499 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@@H](O)C2(C)C)cc1F 272322538 IRCLUYIBASXTLJ-ZIAGYGMSSA-N 266.360 2.141 10 20 CECD C[C@@H](N[C@H](C)c1ncnn1C)c1ccc(F)c(F)c1O 276638277 OLDWWKVVJGZBAD-HTQZYQBOSA-N 282.294 2.211 10 20 CECD CCOc1ccc(O)c(CNCCC2(O)CCC2)c1 284118214 TUOBIXWIZIPBMJ-UHFFFAOYSA-N 265.353 2.186 10 20 CECD CC[C@@H](NCCCC(=O)NC)c1ccc(F)cc1O 286186108 RAEYZODNHJVUSR-GFCCVEGCSA-N 268.332 2.098 10 20 CECD CCCNC(=O)CN(CC)c1ccc(OCC)cc1 299431693 VBIXXYKIDOEONZ-UHFFFAOYSA-N 264.369 2.438 10 20 CECD CCc1nc(C)c(C(=O)NCc2cccc(OC)c2O)o1 293772991 STEJGNVZJPUIMT-UHFFFAOYSA-N 290.319 2.190 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](N)C(C)C)c1 817959723 URKCHXMUPHBMEH-GXFFZTMASA-N 252.358 2.035 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](n2cc(Cl)cn2)C1 812392830 XUCZJKVCDNZCJB-SECBINFHSA-N 297.767 2.391 10 20 CECD C[C@H](N[C@H](CN)C1CCCC1)c1cc([N+](=O)[O-])ccc1O 817981750 NJXWYSWGRFYAGG-IINYFYTJSA-N 293.367 2.469 10 20 CECD CN(C(=O)/C=C\c1cccnc1)c1ccc([N+](=O)[O-])nc1 493274024 RLVXEHZUFSYVKO-DAXSKMNVSA-N 284.275 2.061 10 20 CECD C[C@@H](NC(=O)c1c(C2CC2)cnn1C)c1ccccc1O 827955722 DMIRXZGNPROSEV-SNVBAGLBSA-N 285.347 2.494 10 20 CECD Cc1cccc(CN2CCC[C@H](n3ccnn3)C2)c1O 822504599 WXSFTSIANICLDJ-AWEZNQCLSA-N 272.352 2.129 10 20 CECD C[C@H](N[C@@H]1COC[C@H]1C)c1cc(F)cc(F)c1O 903395074 JFYUCULZKFNJLM-RGNHYFCHSA-N 257.280 2.356 10 20 CECD CCn1nc(C)c(CNCc2ccc(N(C)C)cc2C)n1 823851755 ZLFIGIGRWQGYBJ-UHFFFAOYSA-N 287.411 2.271 10 20 CECD COc1ccc(N(CC(=O)NC2CC2)CC2CC2)cc1 831582788 HPJGZNZYOUKZFC-UHFFFAOYSA-N 274.364 2.190 10 20 CECD N[C@@H]1Cc2ccccc2N(Cc2cccc3c2CCNC3)C1 662282174 SZFLGDLRTDXFGG-QGZVFWFLSA-N 293.414 2.222 10 20 CECD CC(C)C1(O)CN(Cc2c(O)cccc2Cl)C1 839132945 NUEVEOMNJNGZQB-UHFFFAOYSA-N 255.745 2.248 10 20 CECD CCOc1ccc(O)c(CN(CCC(=O)O)C(C)C)c1 833663678 ZUZKHUPTSKPKDB-UHFFFAOYSA-N 281.352 2.476 10 20 CECD C[C@@H]1CN(C(=O)c2cc(O)cs2)CC(C)(C)O1 731871459 LRYOJMBSPQCVCY-MRVPVSSYSA-N 255.339 2.093 10 20 CECD NCC[C@H](NCc1c(O)ccc(Cl)c1F)C(F)F 841073271 GPHZDRADNJPOEK-QMMMGPOBSA-N 282.693 2.257 10 20 CECD NC[C@]12CCC[C@H]1CN(Cc1cccc(F)c1O)C2 844902625 UBLNJPRXXOGBQN-WFASDCNBSA-N 264.344 2.092 10 20 CECD COc1ccc(CNCC[C@@]2(O)CCCOC2)cc1C 846111380 SMIFDBFPPBAIPK-INIZCTEOSA-N 279.380 2.025 10 20 CECD C[C@H](N)C[C@@H](C)NCc1cc(Br)ccc1O 843130024 WQZBNPNPYYFOEL-DTWKUNHWSA-N 287.201 2.370 10 20 CECD C[C@](O)(CNC(=O)c1cc(O)cs1)c1ccsc1 740937563 OLWXCZLHPNLDGH-LBPRGKRZSA-N 283.374 2.153 10 20 CECD CC[C@@H](NCc1cc(OC)ccc1O)[C@H](O)C(C)C 840968280 QDMIIMHZICAVIO-UKRRQHHQSA-N 267.369 2.286 10 20 CECD CCCN(CC(=O)O)Cc1cc(Cl)c(F)cc1O 840997811 MBLOQBZIMUCBNR-UHFFFAOYSA-N 275.707 2.481 10 20 CECD NCc1ccc2c(c1)CCCN2CC[C@H]1CCCNC1 843350045 IOOQMJWHADEPMT-CQSZACIVSA-N 273.424 2.288 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1CCOCC1 846480408 VZOHGLBQSGPIIL-UHFFFAOYSA-N 269.728 2.088 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)O[C@H]1CCCCC1=O 759588747 OEZSKLSDNUSXED-OWNNVSBGSA-N 276.288 2.166 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1[C@H]2C[C@@H]3CN[C@@H]1[C@H]3C2 925499182 WRYYKOMXFRFZAN-KVDVXYDOSA-N 285.435 2.147 10 20 CECD CC[C@](C)(O)CN[C@H](C)c1cc(F)cc(F)c1O 756554959 QPNKKMQQHMAKLE-OQPBUACISA-N 259.296 2.482 10 20 CECD CC[C@@H](CCO)N[C@@H](C)c1cc(F)cc(F)c1O 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O=C(O)c1ccnc(Sc2ncc(Cl)s2)n1 1608954389 OYPVEQQKUDYVQY-UHFFFAOYSA-N 273.726 2.436 10 20 CECD CCCN(Cc1ccc(OC)c(OC)c1O)CC(C)(C)O 1334901498 JJYMHYLYFBNPLB-UHFFFAOYSA-N 297.395 2.392 10 20 CECD Cc1nc([C@@H](C)NCc2ccc(N(C)C)cc2)no1 1347223032 WRGRLSKACPNQQD-SNVBAGLBSA-N 260.341 2.295 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CCC[C@@H](F)C1 1352669619 JXXLXMMOHXLDSF-MWLCHTKSSA-N 267.300 2.242 10 20 CECD CO[C@@]1(C)CCCN(Cc2cc3c(cc2O)OCO3)C1 230299909 AZSGMJQTWINAAZ-HNNXBMFYSA-N 279.336 2.122 10 20 CECD Cc1c(CNC[C@@H]2[C@H]3CNC[C@H]32)n(C)c2ccccc12 1579534291 DEKLDIIWNBRSDZ-FICVDOATSA-N 269.392 2.042 10 20 CECD C[C@@H](C(=O)O)N(Cc1cccc(F)c1O)C1CCC1 1589486712 LFWMRSHDVJQLDQ-VIFPVBQESA-N 267.300 2.359 10 20 CECD COc1cc(C)cc(CN(C2CC2)[C@@H](C)C(=O)O)c1O 1594054427 HHPAGCQMDOXNFA-JTQLQIEISA-N 279.336 2.147 10 20 CECD CN(C)c1ccc(CN(CC(=O)O)Cc2ccco2)cc1 1777039612 HKQJIAVBEWEPJX-UHFFFAOYSA-N 288.347 2.432 10 20 CECD C[C@@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc(N)cc1 19397047 HXXJGIQENQZWID-RISCZKNCSA-N 278.352 2.182 10 20 CECD O=C1NC(=S)S/C1=C\c1ccn(-c2ccccc2)n1 160792417 FAOLWFJCBXDSGG-FLIBITNWSA-N 287.369 2.361 10 20 CECD CC(C)COC[C@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 151421297 CCKZNNJCKSZGOT-WMLDXEAASA-N 294.439 2.437 10 20 CECD CCCCN(C)S(=O)(=O)Nc1ccc(O)cc1Cl 849308347 LRBWAOVHCPHSKT-UHFFFAOYSA-N 292.788 2.434 10 20 CECD CSCCCn1cc(COc2ccc(N)cc2)nn1 881314313 POULBTXHZKPZBD-UHFFFAOYSA-N 278.381 2.192 10 20 CECD COCCC1(CNCc2cccc(OC)c2O)CC1 151222582 MFJJTNXJEIXEBS-UHFFFAOYSA-N 265.353 2.307 10 20 CECD CC1(C)C[C@@H](NCc2cc3c(cc2O)OCO3)CCO1 160631432 MXLPMGCHOJBWRZ-NSHDSACASA-N 279.336 2.168 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCCCN(C)C2)c1 700817568 VPOIMQGUVFKYMS-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD CC[C@@H](NCCCNC(C)=O)c1ccc(N(C)C)cc1 121387731 UCALTFPWXWPQIC-MRXNPFEDSA-N 277.412 2.320 10 20 CECD COc1cccc(CN2C[C@@H](C)OC[C@@H]2C)c1O 217780584 UHXZMTLMWQZGOA-WDEREUQCSA-N 251.326 2.010 10 20 CECD C[C@@H](N[C@@H]1C=C[C@H](CO)C1)c1cc(F)ccc1O 185831144 YQPQYKJILNBUSH-JFGNBEQYSA-N 251.301 2.119 10 20 CECD C[C@H](NCCC(=O)N(C)C)c1cc2c(cc1O)CCCC2 185264680 BFKRZGGCRCHLSG-LBPRGKRZSA-N 290.407 2.400 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC(=O)OC(C)C)c1 182435856 WPZKQYAHDXNIES-LLVKDONJSA-N 281.352 2.393 10 20 CECD CC(C)CN(CCN(C)C)Cc1ccccc1O 132544534 JMQRTJNZKWLCDG-UHFFFAOYSA-N 250.386 2.412 10 20 CECD C=Cn1cc(CN2CCOc3cc(N(C)C)ccc32)cn1 194694571 MELNVCJWKLVTDG-UHFFFAOYSA-N 284.363 2.449 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@]1(C)CCCNC1 237085612 SUYGBSXYFBOJPU-QGZVFWFLSA-N 289.423 2.067 10 20 CECD CCCC(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(N)cc1 236672779 MGECRHHOHUXQCJ-CQSZACIVSA-N 289.379 2.389 10 20 CECD C[C@@H](CNC(=O)Cc1ccc(N)cc1)N1CCC[C@@H](C)C1 237560571 AEQDWMSFTBERDZ-KGLIPLIRSA-N 289.423 2.048 10 20 CECD Cc1cnn(CC(=O)NCc2c(C)c3ccccc3n2C)c1 348633361 JLZVPOALIITARM-UHFFFAOYSA-N 296.374 2.308 10 20 CECD CCOc1cccc(CN[C@H](C)CCCCO)c1O 295038218 MKIBFHWQTHRSRI-GFCCVEGCSA-N 267.369 2.432 10 20 CECD CCOC1CC(O)(CN[C@H](C)c2ccc(F)cc2O)C1 278504498 QUSRNNMLHUCCJB-CKQAKLJMSA-N 283.343 2.112 10 20 CECD CCN(C)c1ccc([C@H](C)NCc2cnnn2C)cc1 287435091 TZDUNZSTDOMJKJ-LBPRGKRZSA-N 273.384 2.122 10 20 CECD CC(=O)C(=O)CSc1cc2c(cc1Cl)OCCO2 289653369 NWSGZSOUGMDVET-UHFFFAOYSA-N 286.736 2.361 10 20 CECD CCC[C@]1(NCc2cc(OC)c(OC)cc2O)CCOC1 289947682 YNIKSNRSVHEDSH-INIZCTEOSA-N 295.379 2.458 10 20 CECD COCC[C@H](CO)N[C@@H](C)c1cc2c(cc1O)CCCC2 281719269 UMIBUXRSBGOTPD-SWLSCSKDSA-N 293.407 2.319 10 20 CECD COc1cnc(NC(=O)NCc2ccccc2O)s1 806510993 FJJZKLXAPWVINB-UHFFFAOYSA-N 279.321 2.179 10 20 CECD CNC(=O)C1CCC(N[C@@H]2CCc3cccc(O)c32)CC1 297823676 RNIJQXXIACUQJE-JXQTWKCFSA-N 288.391 2.274 10 20 CECD CC[C@@H](CSC)NC(=O)c1c(F)ccc(O)c1O 297344398 BAVHAFRURMRYRJ-ZETCQYMHSA-N 273.329 2.108 10 20 CECD COc1cccc(CNC(=O)C2CC(C)(C)C2)c1O 802781738 FPYIBPOLIPIQSM-UHFFFAOYSA-N 263.337 2.453 10 20 CECD COCC1(NCc2ccc(OC)c(C)c2)CCOCC1 814302029 NDMFZQMZJPCPLK-UHFFFAOYSA-N 279.380 2.289 10 20 CECD CN1CCCc2cc(CN[C@H]3CCC[C@H]3N)ccc21 817901446 VSRUNXDXCWLXGT-CABCVRRESA-N 259.397 2.038 10 20 CECD CC[C@@H](NC[C@@H]1C[C@H](F)CN1)c1ccc(F)cc1O 817976994 YVGNRGXNWRFMBT-GMXVVIOVSA-N 270.323 2.272 10 20 CECD C[C@@H](NCCCON)c1ccc2ccccc2c1O 902426575 VIQOJHFUGYTWQE-LLVKDONJSA-N 260.337 2.476 10 20 CECD CC(C)n1ccc(CNC(=O)NCc2ccccc2O)n1 738992637 YKRJGXVWMVYIPM-UHFFFAOYSA-N 288.351 2.169 10 20 CECD O=C(NCCCSc1nccs1)NC(CF)CF 838513424 JAKAMTRWXCPXEM-UHFFFAOYSA-N 295.380 2.232 10 20 CECD Cc1ccc(CCNC(=O)NCc2ccccc2O)cn1 732459910 ZJBFTOKFCBWLAX-UHFFFAOYSA-N 285.347 2.138 10 20 CECD CC[C@@H](C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 839513354 XDMMPFFWSDFQJF-CYBMUJFWSA-N 277.412 2.099 10 20 CECD CON1CCC(N(C)Cc2cc(C)ccc2O)CC1 835076264 MLVODMNNLDFHLX-UHFFFAOYSA-N 264.369 2.158 10 20 CECD CCOc1ccc(CNC[C@H](O)c2ccco2)c(O)c1 747098919 HLYHHLHHFPDFDK-AWEZNQCLSA-N 277.320 2.207 10 20 CECD CNC(=O)[C@@]1(C)CCN(Cc2ccc(N(C)C)cc2C)C1 840942021 ZVLBPFOGALIIDS-KRWDZBQOSA-N 289.423 2.019 10 20 CECD COc1ccc(O)c(CN2CCOC[C@@H]2C2CCC2)c1 843427960 DSYJJFPNRFWJCG-OAHLLOKOSA-N 277.364 2.402 10 20 CECD O=C(OCC(=O)C1CCCC1)c1cc(O)cs1 745003144 YKZURDJJFDZHJP-UHFFFAOYSA-N 254.307 2.370 10 20 CECD CCc1cccc(CN2CCNC(=O)[C@H]2CC(C)C)c1O 848906484 WYVAKXUTUNCPPS-OAHLLOKOSA-N 290.407 2.301 10 20 CECD COc1cc(Cl)cc(CNC2(C)CCNCC2)c1O 841065977 VSAOOLBFGAPBLQ-UHFFFAOYSA-N 284.787 2.286 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CCCC[C@@H]2O)c1O 846165904 PGZMMEUHSNGPTL-WXHSDQCUSA-N 265.353 2.355 10 20 CECD CC(C)[C@@H](N)CCN(C)Cc1cccc(F)c1O 843056452 KKLIBZJTQUHSKD-ZDUSSCGKSA-N 254.349 2.337 10 20 CECD CCS(=O)(=O)CCSc1ncc(Cl)s1 849999963 DYGIVLRMTWYOMS-UHFFFAOYSA-N 271.816 2.323 10 20 CECD CO[C@H](CNC(=O)NCc1ccccc1O)C1CCCC1 852655933 GBUUTBFPIROSEC-OAHLLOKOSA-N 292.379 2.397 10 20 CECD C[C@@H]1C[C@H](NCC(C)(C)O)c2c(O)ccc(F)c21 756564905 TZSJZCFFMCNYGZ-SCZZXKLOSA-N 253.317 2.440 10 20 CECD CO[C@H]1C[C@H](N[C@@H](C)c2cc(F)cc(F)c2O)C1 858584678 UZSSPJYKJNULRC-HGNGGELXSA-N 257.280 2.498 10 20 CECD CCOCc1cc(CN[C@H]2C[C@@H](CO)C2)ccc1OC 865662923 NMNOYEWSSYAMTR-OTVXOJSOSA-N 279.380 2.092 10 20 CECD COC(=O)c1csc(CN[C@H](C)c2ccccc2O)n1 879649105 IGKYFFKRHRJVTL-SECBINFHSA-N 292.360 2.486 10 20 CECD CCCOc1ccc(CNCC(=O)NC(C)C)cc1C 873010043 YJUCVQBMGVIWPW-UHFFFAOYSA-N 278.396 2.398 10 20 CECD Oc1ccccc1CNc1nccc(N2CCCC2)n1 774525279 XWPRJHCJRQMWOY-UHFFFAOYSA-N 270.336 2.395 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCCC[C@@H]1N)c1ccccc1O 872311023 WATMVTXXUOVHAY-BNOWGMLFSA-N 276.380 2.477 10 20 CECD CC[C@@H](NCc1ccc(C(N)=O)nc1)c1ccccc1O 775513884 VXLYLEAONOMSOW-CYBMUJFWSA-N 285.347 2.127 10 20 CECD CCN(C)c1ccc(CN(C)[C@H](C)CS(C)(=O)=O)cc1 773754094 CPGIEFXUPFFYQL-CYBMUJFWSA-N 298.452 2.008 10 20 CECD C[C@@H](O)[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 780787559 VYBROLNIGNDUBS-BDAKNGLRSA-N 273.735 2.387 10 20 CECD C[C@H](NCC(=O)NCC(F)F)c1cc(Cl)ccc1O 795844421 JZMGBQHYYYVHHY-ZETCQYMHSA-N 292.713 2.078 10 20 CECD COc1ccc(CN[C@@H]2C[C@H](OC)C2(C)C)c(O)c1OC 893096528 MWPZUSAZIUTTFF-OLZOCXBDSA-N 295.379 2.313 10 20 CECD OC[C@@H](NCc1cc(F)cc(F)c1O)C1CCCC1 708390337 OWFQISWIHSFKES-CYBMUJFWSA-N 271.307 2.311 10 20 CECD COc1ccc(CN[C@H]2CCCC[C@H]2C(N)=O)cc1C 757911663 YTZZXKQTYSNGSH-KGLIPLIRSA-N 276.380 2.137 10 20 CECD CN1CCCc2cc(CNC(=O)NC3(C)CC3)ccc21 1318944820 PGGPEZOSMCQYJN-UHFFFAOYSA-N 273.380 2.421 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2cccnc2C)c1 1329200792 HHWXQDCQGQPBQQ-UHFFFAOYSA-N 270.332 2.263 10 20 CECD C[C@H](NCCc1cn[nH]c1)c1cc(F)cc(F)c1O 1323891440 LHIYUTWNEYKPMH-QMMMGPOBSA-N 267.279 2.287 10 20 CECD Cc1cnc(CNC(=O)NCCc2ccc(N)cc2)c(C)c1 1346479755 VPAGVAHBBOPRGD-UHFFFAOYSA-N 298.390 2.323 10 20 CECD O=C(NCc1cccc(O)c1O)c1csc(C2CC2)n1 1528771100 JUQYVSTYPCMLTC-UHFFFAOYSA-N 290.344 2.362 10 20 CECD Cc1cccc(O)c1CN(C)[C@H](COC(C)C)C(=O)O 1607858186 LGLDNEFPMFAGLQ-CYBMUJFWSA-N 281.352 2.011 10 20 CECD CC[C@@](C)(NCc1ccc(OC)c(C)c1)C(=O)O 1604913407 WTPXSJVWAQSKHZ-CQSZACIVSA-N 251.326 2.347 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@]2(C)C(=O)O)c1O 229119157 DCSFJFXEPGBOJS-AWEZNQCLSA-N 299.754 2.493 10 20 CECD COc1cc(CNC[C@H]2CCN2)c(O)c(C(C)(C)C)c1 1579152802 ILUQFPDFEGAGRD-GFCCVEGCSA-N 278.396 2.150 10 20 CECD Nc1ccc(CNC(=O)NCCc2ccsc2)cc1 1580445822 XVVLMUAQDDTBFY-UHFFFAOYSA-N 275.377 2.372 10 20 CECD CC(C)N(C)CCCN[C@H](C)c1cc(C(=O)O)ccc1O 1593264001 DZLQHJKCSPCILL-GFCCVEGCSA-N 294.395 2.471 10 20 CECD CCOCCN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 161907079 DJXVLNPYTUXVRP-ZDUSSCGKSA-N 296.386 2.349 10 20 CECD CCOc1cccc(CN2CCC[C@@H](C)[C@H]2CN)c1O 250516604 OROJWMQXNUNPKK-TZMCWYRMSA-N 278.396 2.350 10 20 CECD COc1ccc(O)c(CN(C)C[C@@H]2CCCOC2)c1 156030138 OWVVCGMJMWFXDQ-LBPRGKRZSA-N 265.353 2.259 10 20 CECD COc1ccc(O)c(CN[C@H](C)CCCCO)c1 272368019 GDRSWZMBSMGAFZ-LLVKDONJSA-N 253.342 2.042 10 20 CECD COC[C@]1(C)CCN(Cc2cccc(OC)c2O)C1 294137814 FZXCCNADWAIVTJ-OAHLLOKOSA-N 265.353 2.259 10 20 CECD CC1(C)CCN(Cc2ccccc2O)CC[S@]1=O 322096424 IHIKBVAYCOSOST-GOSISDBHSA-N 267.394 2.125 10 20 CECD COc1cccc(CNC[C@@H]2CC[C@H](C)O2)c1O 398174444 VJEYAUXHGJBKFV-JQWIXIFHSA-N 251.326 2.058 10 20 CECD CCN(CC)C(=O)[C@@H](C)N(C)Cc1ccccc1O 109769036 RRHBYVIVCJFHBJ-GFCCVEGCSA-N 264.369 2.081 10 20 CECD COc1ncc(C)cc1NC(=O)c1ccc(C)c(O)c1O 179532604 LBOMWYMAWHKAJG-UHFFFAOYSA-N 288.303 2.371 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccsc2)c1 114542205 DGKCOGABTZUNMF-UHFFFAOYSA-N 263.318 2.392 10 20 CECD Oc1ccc(Cl)cc1CN[C@H]1CC[C@H](O)CC1 252705657 QXIYEIZITHKHAU-HAQNSBGRSA-N 255.745 2.439 10 20 CECD CN(C)C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 125489037 FPNCWNYEDWOWPG-AWEZNQCLSA-N 279.403 2.275 10 20 CECD CN(C)c1ccc(CNC(=O)Nc2ccon2)cc1F 180505227 LHGZUHBJRRDLKU-UHFFFAOYSA-N 278.287 2.201 10 20 CECD COc1ccc(O)c(CNC2CC(OC(C)C)C2)c1 186594738 QFVCJQRHHWAKCY-UHFFFAOYSA-N 265.353 2.446 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)Nc1ccc([N+](=O)[O-])cn1 183598722 BFMUDABURAUKPK-SECBINFHSA-N 289.291 2.444 10 20 CECD C[C@@H](C1CC1)N(C)C(=O)/C=C/c1ccc(O)c(O)c1 180649437 PXLPSMJAEDRJMJ-GOJXHPMJSA-N 261.321 2.368 10 20 CECD C[C@@H](N)[C@H]1CCCCN1Cc1cc(F)ccc1O 219584677 RLKMCHHWBWCVIU-ZWNOBZJWSA-N 252.333 2.233 10 20 CECD CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(N(C)CC)cc1 268739542 RETFCABGMJFRJS-QWHCGFSZSA-N 277.412 2.318 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H]1O 271347275 PHTPFWLIDFJDAV-DOMZBBRYSA-N 266.360 2.094 10 20 CECD O[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 271043252 OPQHTWZDDJWVML-MRXNPFEDSA-N 260.381 2.244 10 20 CECD COC[C@@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 273472171 JWHLCSAXKDIERK-TVQRCGJNSA-N 280.324 2.376 10 20 CECD COCCCCCNCc1ccc([N+](=O)[O-])c(OC)c1O 278928081 VSSBFTBGMOVKHI-UHFFFAOYSA-N 298.339 2.215 10 20 CECD CCN1C(=O)/C(=C/c2c(Cl)cnn2C)SC1=S 275534040 QYZNINSLEBSEFS-YWEYNIOJSA-N 287.797 2.295 10 20 CECD CC[C@@H](NCC[C@H](O)COC)c1cccc(Cl)c1O 287728627 PATZKGNLEADJAE-GXFFZTMASA-N 287.787 2.484 10 20 CECD CN(C)c1ccc(CN[C@@H]2COc3ccccc3[C@@H]2O)cc1 288644677 UQTXRLBTSWFMGR-AEFFLSMTSA-N 298.386 2.337 10 20 CECD CCCN1CCC[C@H]1CNCc1cc(OC)ccc1O 809716848 ZYGSZVKXQDKHKL-AWEZNQCLSA-N 278.396 2.365 10 20 CECD CCc1c(C(=O)NCc2cccc(OC)c2O)ccn1C 290115871 MUTAYQCYKIDZII-UHFFFAOYSA-N 288.347 2.232 10 20 CECD CCOC(=O)N1CC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1 296307939 DXIZCHZQJLHJFG-CHWSQXEVSA-N 290.363 2.200 10 20 CECD O=C(c1cc(O)cs1)N1CCC2(CCOCC2)CC1 807553427 HUAIDDXRVAVDCG-UHFFFAOYSA-N 281.377 2.487 10 20 CECD Cc1cc(CN2CCOC[C@]23CCOC3)ccc1N(C)C 294278093 VWMSAEXNBVJQFF-QGZVFWFLSA-N 290.407 2.052 10 20 CECD OCc1ccnc(NCc2c(O)ccc3c2CCCC3)n1 811808323 DMHHFBUTDWQLDO-UHFFFAOYSA-N 285.347 2.165 10 20 CECD CC[C@@H]1C(=O)NCCN1Cc1ccc2ccccc2c1O 816503009 ZUHLOVHSWGSNEN-OAHLLOKOSA-N 284.359 2.256 10 20 CECD COc1ccc(N2CC[C@H](CNCC3(C)COC3)C2)cc1 818220107 FFROYTARNLALDH-CQSZACIVSA-N 290.407 2.148 10 20 CECD C[C@H](NCC1=CCNCC1)c1ccc(F)cc1O 817968116 PFGMEUWOGOBKFQ-JTQLQIEISA-N 250.317 2.102 10 20 CECD Cc1cc(O)c(CN(CCO)CC(F)F)cc1Cl 825744814 RQEBIAHIWXTQHO-UHFFFAOYSA-N 279.714 2.413 10 20 CECD CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C)c1ccccc1O 827940383 CODCMPCHWQYOAA-RISCZKNCSA-N 292.379 2.120 10 20 CECD O=C1CC[C@@H]2CN(Cc3cc(Cl)ccc3O)CC[C@H]2N1 827140149 IFXABRRMONNGTE-ZWNOBZJWSA-N 294.782 2.146 10 20 CECD C[C@@H](NC(=O)NOCC1CC1)c1ccc(N(C)C)cc1 838612886 USYPILNWXCEOCK-LLVKDONJSA-N 277.368 2.454 10 20 CECD Cc1ccc(C(=O)Nc2cc(CC3CC3)[nH]n2)c(O)c1O 830881111 AXGLCIGVEKDKQL-UHFFFAOYSA-N 287.319 2.334 10 20 CECD O=C(/C=C/C1CCCC1)NCc1ccc(O)cc1O 910943453 CSTPVBFTJYOXDR-VMPITWQZSA-N 261.321 2.460 10 20 CECD C[C@H]1CCCN(Cc2cccc(F)c2O)[C@@H]1CCN 844901219 FZCVMLSBEXUJPN-SMDDNHRTSA-N 266.360 2.481 10 20 CECD C[C@H](Sc1ncc(Cl)s1)C(=O)N(C)C 849997905 GNLCLIGSOPEKCR-YFKPBYRVSA-N 250.776 2.365 10 20 CECD COc1cc(CN(C)Cc2nc(C)no2)c(O)cc1C 848505756 QGICGPOQDGIHPY-UHFFFAOYSA-N 277.324 2.033 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CCS[C@@H]2C)c1O 843434780 NWBNYLYYDWKEFW-SCZZXKLOSA-N 298.364 2.293 10 20 CECD Cc1nn(CC(=O)NCc2ccccc2O)c(C)c1Cl 748345987 TZZBOWFOFWGXPM-UHFFFAOYSA-N 293.754 2.175 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1cc(Cl)cc(F)c1O 846705372 ZEUXJMNSINYTDW-KWQFWETISA-N 272.751 2.496 10 20 CECD C[C@@H]1CC[C@H](NC(=O)NCCc2ccc(N)cc2)C1 841886135 YMJYUHYZODFFJC-RISCZKNCSA-N 261.369 2.299 10 20 CECD COc1ccc(CN[C@@H](CCN)C(F)(F)F)cc1C 841089911 BRUPOSBTITWLSL-LBPRGKRZSA-N 276.302 2.373 10 20 CECD NC[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1O 841031323 ROTYXBNHUPSCTB-GXFFZTMASA-N 252.333 2.138 10 20 CECD CCOc1ccc(CNc2nncn2CC)c(O)c1 922659582 GSLFZWPTMXIWDQ-UHFFFAOYSA-N 262.313 2.014 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1ccc(N(C)C)cc1C 840916927 OCCWHXPVOVVIMS-INIZCTEOSA-N 289.423 2.162 10 20 CECD CN(C[C@H](O)COc1ccc(F)cc1)c1ccc(N)cc1 923399563 FLMDKWVXCVQUHG-HNNXBMFYSA-N 290.338 2.284 10 20 CECD Cc1ccc(C(=O)NC[C@H]2Cc3ccccc3O2)c(O)c1O 751534647 YUICTCHXHRFLRG-GFCCVEGCSA-N 299.326 2.140 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CCOCN1 928955339 VPKKKHAARWWVBV-UHFFFAOYSA-N 291.376 2.090 10 20 CECD CCn1cc(CN[C@@H](C)c2cc(F)cc(F)c2O)nn1 850522345 OVFJTOGZIVJXMU-QMMMGPOBSA-N 282.294 2.133 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@@H]([S@@](C)=O)C2)c1O 850356641 QUZYUIWBZBYZDK-VFGMZZLHSA-N 297.420 2.180 10 20 CECD COc1cc(N(C)CCOC2CC2)cc(OC)c1OC 929707734 NWTURJVGTNAVPP-UHFFFAOYSA-N 281.352 2.328 10 20 CECD CC[C@H](NC)C(=O)NCc1ccc(N(CC)CC)cc1 852789919 LYCCRGMFINQOOQ-HNNXBMFYSA-N 277.412 2.147 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCC[C@@H]([S@](C)=O)C1 850356358 OVIJNTMYTSYRMF-HTGLOVNISA-N 297.420 2.180 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CC1(OC)CCC1 935948376 LJUPICWISSKXJM-UHFFFAOYSA-N 298.379 2.453 10 20 CECD Cc1cccc(O)c1CN1CCOC2(CCOCC2)CC1 877399209 KJGYSUDTRZRDPU-UHFFFAOYSA-N 291.391 2.472 10 20 CECD CCCOc1ccc(CN[C@H]2CCCN(C)C2=O)cc1C 873071101 JEWNUYPNBRVLQO-HNNXBMFYSA-N 290.407 2.494 10 20 CECD COC[C@@H](C)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773145561 NOLICTTZHSPRBE-VXGBXAGGSA-N 279.384 2.148 10 20 CECD CC[C@H](CCO)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776146165 GNROOBRYRIPKGR-TZMCWYRMSA-N 293.411 2.274 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1cc(F)cc(F)c1O 887329375 FZBLZBZYOAGNBM-CQSZACIVSA-N 284.306 2.291 10 20 CECD COc1cc(C)cc(CN(CCO)C2CCCC2)c1O 893872246 WQVCNAIFLOMEQQ-UHFFFAOYSA-N 279.380 2.446 10 20 CECD O=C(Nc1cccc2c1OCO2)c1cc(O)cs1 782881538 ZEOXNZWTCCQTHA-UHFFFAOYSA-N 263.274 2.435 10 20 CECD CN(Cc1cccs1)C(=O)CN(C)c1ccc(N)cc1 702093054 YLEODDDIAUMYCJ-UHFFFAOYSA-N 289.404 2.425 10 20 CECD COc1ccc(CNC(=O)c2ccc3c(c2)CCO3)c(O)c1 794376983 OJKPXHGRIJDTFV-UHFFFAOYSA-N 299.326 2.266 10 20 CECD COc1ccc(CNc2nccn3nc(C)cc23)c(O)c1 795284148 IRMREXRSMVVPLA-UHFFFAOYSA-N 284.319 2.364 10 20 CECD CS[C@H](C(=O)NCc1cccc(O)c1O)C(C)(C)C 1548791634 RVPIESLSOJDBIS-GFCCVEGCSA-N 283.393 2.492 10 20 CECD CS[C@@H]1CC[C@@H](NC(=O)c2cccc(O)c2O)C1 229412865 MXWKXWUKBGCNCJ-RKDXNWHRSA-N 267.350 2.112 10 20 CECD C[C@@H](NCc1cc(Cl)ccc1O)C(=O)NC(C)(C)C 134493246 GRSFMCOLGFAJJA-SECBINFHSA-N 284.787 2.438 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)CC1CC1 155443407 ZFODJIVCKOXJQT-UHFFFAOYSA-N 260.381 2.365 10 20 CECD COCC[C@@H](C)CNCc1c(O)cccc1OC 840955088 MPNMRBUGVUOEFN-LLVKDONJSA-N 253.342 2.163 10 20 CECD CC[C@H](C)[C@@H](O)CNCc1cc(F)cc(F)c1O 882993710 FPQZSWGYJXNWGR-UFBFGSQYSA-N 259.296 2.167 10 20 CECD COc1cccc(CN[C@@H]2CCS[C@@H]2C)c1O 310564140 KXXCQSUUOPJVNN-MWLCHTKSSA-N 253.367 2.384 10 20 CECD C[C@H](CNCc1cc(F)cc(F)c1O)C[C@@H](C)O 708481389 RTSMLRBBGODRIH-DTWKUNHWSA-N 259.296 2.167 10 20 CECD CN(C)C1CCC(NCc2cc(F)ccc2O)CC1 715551713 IXUQHPLQZKEACP-UHFFFAOYSA-N 266.360 2.494 10 20 CECD COCCN(Cc1ccccc1O)C[C@@H]1CCCO1 109761935 DZDJCIBAIWPVCK-AWEZNQCLSA-N 265.353 2.020 10 20 CECD COc1ccnc(CN(C)Cc2ccccc2O)c1 111235370 LSPVHMRHCIHSTJ-UHFFFAOYSA-N 258.321 2.428 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cc[nH]n2)cc1 55091597 VQQMXFFJQOPKHF-UHFFFAOYSA-N 272.352 2.186 10 20 CECD CCC[C@](C)(CO)NCc1ccc(N2CCOCC2)cc1 304249213 PMQFQQOVXODJLK-QGZVFWFLSA-N 292.423 2.164 10 20 CECD CN(Cc1cc(F)ccc1O)C[C@H]1CCCOC1 180086456 SPFVNORDZJFQTF-LLVKDONJSA-N 253.317 2.390 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H](O)CSC 187911968 UPISTZVZKFRBTI-CYBMUJFWSA-N 269.410 2.328 10 20 CECD Cc1ccc(O)c(CN(C)[C@H]2CCN(C)C[C@H]2C)c1 290364726 HBPSFSKQBPYTCX-HIFRSBDPSA-N 262.397 2.473 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)OC[C@H]2C)c1O 247053713 VHLLDWGBZOCDJC-NEPJUHHUSA-N 265.353 2.318 10 20 CECD C/C=C/C[C@@H](CO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 274598161 GYFXVDHRRRDGQZ-SEUFLZDSSA-N 280.324 2.278 10 20 CECD C[C@H](NC[C@@H]1CC[C@H](O)C1)c1cc([N+](=O)[O-])ccc1O 276669350 RPKHMXWHNJLOAA-UMNHJUIQSA-N 280.324 2.112 10 20 CECD COc1ccc(O)c(CN(CCO)Cc2ccccc2)c1 271824815 PTKDAARCQVICOR-UHFFFAOYSA-N 287.359 2.395 10 20 CECD COC1(C)CCN(C(=O)c2ccc(C)c(O)c2O)CC1 272975722 LIUBRYYWSJJIRP-UHFFFAOYSA-N 279.336 2.047 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@]2(CCOC2)O1 373498538 ZLLCVKPGRLYJJS-XHDPSFHLSA-N 297.782 2.425 10 20 CECD CCCCN(Cc1ccccc1O)[C@@H]1CCN(C)C1=O 282533526 VIBAEMCZHPYXCG-CQSZACIVSA-N 276.380 2.225 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](CO)C[C@@H]2C)c1O 289123816 XFHDNPOIZXVPTJ-JQWIXIFHSA-N 295.354 2.327 10 20 CECD CC[C@H](N[C@@H](CCSC)C(=O)NC)c1ccccc1O 806664067 ZGMVMCZOIBUHFY-STQMWFEESA-N 296.436 2.301 10 20 CECD C[C@H](NCCCc1cnn(C)n1)c1ccc(N(C)C)cc1 293720833 NRKSRUQISBKJMU-ZDUSSCGKSA-N 287.411 2.165 10 20 CECD CN(C(=O)/C=C\c1cnn(C)c1)c1cnc2ccccc2n1 813286360 ULLHRKYZGVWICA-FPLPWBNLSA-N 293.330 2.040 10 20 CECD Cc1cc(C)c([C@H](C)NCCN2CCO[C@@H](C)C2)c(O)c1 815576681 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C[C@@H]1C[C@@H](NCC(=O)NCC2CC2)c2c(O)ccc(F)c21 757630965 AZUVSIXVRSFAPJ-BXKDBHETSA-N 292.354 2.195 10 20 CECD CC[C@H](O)CCCN[C@@H](C)c1cc(C(=O)OC)ccc1O 756731592 CJJLEMOQPOKARN-AAEUAGOBSA-N 295.379 2.381 10 20 CECD O=S(=O)(Cc1cccc(F)c1)NCc1ccccc1O 751150299 AFJXITOUYSOYMJ-UHFFFAOYSA-N 295.335 2.151 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1cc(C)ccc1O 756731961 DTKNRUWXINVLMI-STQMWFEESA-N 267.369 2.403 10 20 CECD CC(C)C[C@H](O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756497624 RHDZYVWVOCMHBC-JQWIXIFHSA-N 282.340 2.358 10 20 CECD C[C@@H](NC(=O)NCCCC1(O)CCC1)c1ccccc1O 868717165 NUITWOHYVGGEJX-GFCCVEGCSA-N 292.379 2.448 10 20 CECD COc1ccc(N(C)C[C@H]2CC3(CC3)C(=O)O2)cc1OC 763672215 NAPHWZLDJBHPMT-GFCCVEGCSA-N 291.347 2.236 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncc([N+](=O)[O-])cn1 760538253 YALBZVZQJSDBFV-UHFFFAOYSA-N 287.323 2.371 10 20 CECD C[C@@H]1N(C(=O)/C=C/c2ccc(O)c(O)c2)CCOC1(C)C 779535937 YTGJPGPYXZZKMN-ZRQQLDRUSA-N 291.347 2.137 10 20 CECD Cc1ccc2c(c1)N[C@H](c1ccc(O)c(O)c1)NC2=O 877864219 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CCCCN(Cc1ccccc1O)C[C@H](O)CN(C)CC 846894214 UPDVROMOCOAASM-MRXNPFEDSA-N 294.439 2.307 10 20 CECD c1cc2c(cc1CNCc1csnn1)CCCO2 1334328760 SRWYYHKGRLZHPB-UHFFFAOYSA-N 261.350 2.153 10 20 CECD CN(Cc1c(O)ccc2ccccc12)C[C@@H]1COCCO1 853558896 LAKOIBJDOYHTII-CQSZACIVSA-N 287.359 2.393 10 20 CECD CCOc1cccc(CNCCN(C)CC(F)F)c1O 858336657 OZXCREXNYHHJKJ-UHFFFAOYSA-N 288.338 2.077 10 20 CECD CC[C@@H](CCO)NCc1cc(F)c(N(C)C)cc1F 858142735 KXDJTYPLHNOPRP-NSHDSACASA-N 272.339 2.281 10 20 CECD Cc1cc(O)c(CNCC2CC3(C2)OCCO3)cc1C 922800470 PZTIBDBAJWSVDW-UHFFFAOYSA-N 277.364 2.252 10 20 CECD Cc1n[nH]cc1C(=O)NCc1cc(Cl)ccc1O 857547685 PPXQYYOEAGOSBO-UHFFFAOYSA-N 265.700 2.007 10 20 CECD C[C@@H](NCc1cnn(C)c1)c1cc(F)cc(F)c1O 756450910 VTKJQKWKEYAMSK-MRVPVSSYSA-N 267.279 2.255 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2cocn2)c1 756830969 JOOWTTUKQFUSTM-SECBINFHSA-N 276.292 2.018 10 20 CECD CC(C)CN1CC(=O)N[C@H]1c1cc(F)c(N(C)C)cc1F 864377762 YAAZYGCUBRXUFC-OAHLLOKOSA-N 297.349 2.117 10 20 CECD 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2.221 10 20 CECD COc1cc(C)cc(CNCCc2nccnc2C)c1O 894863512 GXOYCEFJIFTGHR-UHFFFAOYSA-N 287.363 2.140 10 20 CECD O=C(Nc1ccc2c(c1)COC2)c1cccc(O)c1O 193151699 AMBHKTJGZJXIQP-UHFFFAOYSA-N 271.272 2.380 10 20 CECD C[C@@H]1COC[C@H]1NCc1ccc(N2CCCC2)cc1 710990981 VIYGBVYPZFPTBW-CZUORRHYSA-N 260.381 2.411 10 20 CECD COc1ccc(CNC(=O)c2cnccc2C)c(O)c1 794388472 VMNWJVUOLRPGCB-UHFFFAOYSA-N 272.304 2.034 10 20 CECD C[C@@H](NC[C@@]12CCC[C@@H]1C2)c1cccc(-c2nn[nH]n2)c1O 1603664492 PAKLPABBVMWOBE-UVWXRNBGSA-N 299.378 2.413 10 20 CECD CO[C@@H]1CCN(Cc2cc(C)c(C)cc2O)[C@@H](C(=O)O)C1 1610237950 QWMZEHBDPHYWKV-ZIAGYGMSSA-N 293.363 2.073 10 20 CECD COc1cccc(CNC[C@H]2CCC[C@H](O)C2)c1O 230670224 HFHPMVXHSOALPS-AAEUAGOBSA-N 265.353 2.042 10 20 CECD C[C@H](NCCC1(C)CC1)c1cccc(-c2nn[nH]n2)c1O 1589960812 HGWXCIISZBBKCT-JTQLQIEISA-N 287.367 2.413 10 20 CECD COCc1nc(C)cc(Sc2ncc(C(=O)O)s2)n1 1599300353 DCXLAQIETLDIDV-UHFFFAOYSA-N 297.361 2.237 10 20 CECD CN(C)c1ccc(CNCCc2cccc(C(=O)O)n2)cc1 1777040045 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CCNC(=O)[C@@H](C)N[C@@H](CC)c1ccc(C)cc1O 280282061 YOIBUOJHZHJGIK-YPMHNXCESA-N 264.369 2.266 10 20 CECD O=C(/C=C\c1ccc2c(c1)OCO2)NCc1ccccc1O 388332609 DWIIOQGMUDXELV-VURMDHGXSA-N 297.310 2.451 10 20 CECD CCOc1ccc(O)c(CNCc2nnc(C(C)C)[nH]2)c1 294837542 QTKHFEWQPTUQCW-UHFFFAOYSA-N 290.367 2.322 10 20 CECD O=C(NCC(F)(F)Br)c1cc(O)cs1 807775498 MTBVMDVKSPONEL-UHFFFAOYSA-N 286.097 2.171 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC(=O)NCC1CC1 393003164 ZWJYPJCIKBSNSG-DGCLKSJQSA-N 288.391 2.365 10 20 CECD C[C@@H](NCC[C@H]1CCNC1)c1cc(F)cc(F)c1O 817955556 YUBWLQLWILUYQT-NXEZZACHSA-N 270.323 2.321 10 20 CECD Cc1ccc(O)c(CN2CCNC(=O)c3ccccc32)c1 811508421 PEDFNMKRUZNRJF-UHFFFAOYSA-N 282.343 2.451 10 20 CECD Cc1cc(O)c(CN(C)C[C@H]2COCCO2)cc1Cl 827139806 FMDPJSWQOQLBDN-LBPRGKRZSA-N 285.771 2.201 10 20 CECD CCC[C@H](O)CC(=O)N[C@H](C)c1ccccc1O 827941092 MAUIEZYJQGWSQS-MNOVXSKESA-N 251.326 2.121 10 20 CECD C[C@H](NCC[C@H](O)C1CC1)c1c(O)cccc1F 903411053 LMIHQEVMQFWEPR-CABZTGNLSA-N 253.317 2.343 10 20 CECD CN(Cc1ccccc1O)C(=O)C(C)(C)CCC(=O)O 911231401 RRRQBYZBTWHHTN-UHFFFAOYSA-N 279.336 2.242 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H]3CO[C@@H](C)C3)C2)cc1 842713892 JYQPDLKOCCQTQD-ZNMIVQPWSA-N 290.407 2.289 10 20 CECD C[C@@H]1C[C@@H](NCc2c(O)ccc(Cl)c2F)CO1 842773540 ADBQDIBPCZIKAP-HTQZYQBOSA-N 259.708 2.452 10 20 CECD CCc1cccc(CN2[C@H]3CC[C@H]2CC(O)C3)c1O 848881162 NBMAFKTZTFRFBQ-KBPBESRZSA-N 261.365 2.442 10 20 CECD C[C@H](NCCN1CCO[C@H](C)C1)c1ccc(Cl)cc1O 841748366 XBISIOMNDISBJQ-NEPJUHHUSA-N 298.814 2.417 10 20 CECD COc1ccc(N(C)Cc2ccc(S(C)(=O)=O)o2)cc1 844354837 IHPKOZPZYUNCAA-UHFFFAOYSA-N 295.360 2.328 10 20 CECD O=C(NC[C@H](O)c1c(F)cccc1F)c1cc(O)cs1 740933649 VMLAXPQMOXYGDI-JTQLQIEISA-N 299.298 2.195 10 20 CECD CCc1cccc(CNCCc2nccnc2C)c1O 848914539 PGWGYGSVXCGZSL-UHFFFAOYSA-N 271.364 2.385 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC[C@H]1CCCC1=O 759598413 WSYCZVNZFFSWOK-SMYYYNMVSA-N 290.315 2.414 10 20 CECD NC(=O)C1(CNCc2ccc3c(c2)CCCO3)CCCC1 921747914 FRVHKQBNBAINKH-UHFFFAOYSA-N 288.391 2.147 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1cc(Cl)ccc1O 759174909 ZTDFIXSNHLWKOU-GXTWGEPZSA-N 285.771 2.329 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@H]1C[C@@H](O)C1 858296798 VHPBCCPABMEBFR-OCAPTIKFSA-N 259.708 2.045 10 20 CECD COc1cccc(CN[C@H](C)C[C@H]2CCOC2)c1O 759836821 KNKHPZKQBHZLJQ-VXGBXAGGSA-N 265.353 2.306 10 20 CECD Cc1cc(Br)c(O)c(CNC[C@H]2CCN2C)c1 922575981 IXCOGMGXQBSQQI-LLVKDONJSA-N 299.212 2.257 10 20 CECD CC(C)CC(=O)NCc1ccc(N2CCC(O)CC2)cc1 856208648 SHXWKQQLVJWFTJ-UHFFFAOYSA-N 290.407 2.310 10 20 CECD Cc1ccc(O)c(CNC(=O)CSC(C)C)c1 862760847 XHXPYDJSWLFQKE-UHFFFAOYSA-N 253.367 2.458 10 20 CECD CCOC(=O)[C@@H](NCc1cccc(CC)c1O)C1CC1 1118399507 FOWCDMLXBZRHKR-AWEZNQCLSA-N 277.364 2.386 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@@H](C)c1ccc(F)cc1O 760883551 CEIWMARKRCRJHI-VZJVUDMVSA-N 283.343 2.376 10 20 CECD COc1ccc2c(c1)CCN2C(=O)/C=C\[C@H]1CCCNC1 876630790 KUTYWPAGVHMOLO-LLPBQKLSSA-N 286.375 2.140 10 20 CECD Oc1cccc2c1[C@H](NC[C@@H]1C[C@@H]3CC[C@H](C1)N3)CC2 873261749 RFFOTKQNZQHJRF-FAAHXZRKSA-N 272.392 2.500 10 20 CECD CCN1C[C@@H](CN[C@H](C)c2c(O)cccc2F)CC1=O 886633463 WKTZTILKWIJWIK-GHMZBOCLSA-N 280.343 2.050 10 20 CECD C[C@H]1CCC[C@H](C)N1C(=O)CN(C)c1ccc(N)cc1 702069621 OHRLTUXCTGUJKA-STQMWFEESA-N 275.396 2.495 10 20 CECD COc1ccc(CNC(=O)Nc2cc(C)ccn2)c(O)c1 797643957 ORIMLKBXOMMRSH-UHFFFAOYSA-N 287.319 2.426 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)N1C[C@@H](C)C[C@H](C)C1 743259481 AESRRHUZHCHSHX-QWRGUYRKSA-N 298.408 2.335 10 20 CECD CC(C)S(=O)(=O)CCCN(C)Cc1ccccc1O 758715098 GTSDVCHBMXKQHH-UHFFFAOYSA-N 285.409 2.037 10 20 CECD CN(CCC(F)(F)F)C(=O)c1c(F)ccc(O)c1O 1326241474 JFBBRVGZJHVQQC-UHFFFAOYSA-N 281.205 2.261 10 20 CECD CCN(CCSC)c1nnc(-c2sccc2O)n1C 1337955784 HWUJEASTYIFISO-UHFFFAOYSA-N 298.437 2.439 10 20 CECD Cc1noc(C)c1[C@H](C)NC(=O)NCc1ccc(N)cc1 1353338900 JHDZCSNSPBIIPD-VIFPVBQESA-N 288.351 2.434 10 20 CECD O=C(O)[C@H]1CC[C@H](NCc2cccc(Cl)c2O)C1 1601796627 XWQFIHYJQSIETF-WPRPVWTQSA-N 269.728 2.389 10 20 CECD CCN1CCc2cc(CN[C@H]3C[C@H](C(=O)O)C3)ccc21 1776877981 FDFOEXLYCRVRNX-HDJSIYSDSA-N 274.364 2.022 10 20 CECD CCN1CCc2cc(CN[C@H](C(=O)O)C3(C)CC3)ccc21 1776884792 XMMXEOFCVPZQFK-OAHLLOKOSA-N 288.391 2.412 10 20 CECD COc1cccc(O)c1CN[C@@H]1C[C@@H](OC)C12CCC2 839182219 LRSHEGQAFDJBQL-HUUCEWRRSA-N 277.364 2.448 10 20 CECD Oc1ccccc1CN1CCC([C@@H]2CCNC2)CC1 843127293 PNNVOKUQGOGKBG-CQSZACIVSA-N 260.381 2.214 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)c1nnc2n1CCC2 37149509 HUYRDJXSMSYOFZ-VIFPVBQESA-N 292.770 2.434 10 20 CECD C[C@H]1C[C@@H](NCc2cccc(Br)c2O)CO1 402323146 RXKCXNWPYRFNTA-WCBMZHEXSA-N 286.169 2.422 10 20 CECD CC(C)n1ccc(NC(=O)c2cccc(O)c2O)n1 311411809 AZJSGKCBMZMXFV-UHFFFAOYSA-N 261.281 2.128 10 20 CECD COc1cccc(CNC2CC(SC)C2)c1O 708311603 UOJJZZNXYUJDMT-UHFFFAOYSA-N 253.367 2.384 10 20 CECD CCn1cc(C(=O)NCCCSc2nccs2)cn1 114374540 ZQCHOKDRJQBKAE-UHFFFAOYSA-N 296.421 2.272 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 126797238 XRVWDFNPFVPVKY-UWVGGRQHSA-N 254.761 2.215 10 20 CECD C[C@@H](NC[C@H]1CCCN1C)c1ccc(F)cc1O 185141824 SRCIRFXKYRXHLY-ZYHUDNBSSA-N 252.333 2.276 10 20 CECD COC(=O)c1occc1CNCc1ccc(N(C)C)cc1 35230432 UXDMIOZUGPBIPG-UHFFFAOYSA-N 288.347 2.422 10 20 CECD CCOC(=O)[C@H](NCc1cccc(OC)c1O)[C@@H](C)CC 187870822 JXCIEGJQKHQGIH-SMDDNHRTSA-N 295.379 2.468 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1coc(CN)c1 187580604 LICGFGWVOZTNJN-UHFFFAOYSA-N 288.347 2.496 10 20 CECD CCOc1cccc(CN2CCC[C@](C)(C(=O)O)C2)c1O 86783755 NEMPMVXEEPBNJL-INIZCTEOSA-N 293.363 2.478 10 20 CECD CO[C@@H](C)CCC(=O)N(C)Cc1ccccc1O 183917889 KLPSQQYESVURGM-NSHDSACASA-N 251.326 2.166 10 20 CECD COC(=O)COc1ccc(N(C)Cc2ccn(C)c2)cc1 273248453 ZZWXWFDTNLSSRX-UHFFFAOYSA-N 288.347 2.213 10 20 CECD Cc1ccc(O)c([C@H](C)NCCCC(=O)N(C)C)c1 185193992 CJDXDDNFSSXVLM-LBPRGKRZSA-N 264.369 2.220 10 20 CECD Cc1ccc([C@H](C)NC[C@H](O)C2CCOCC2)c(O)c1C 273530773 WEKUWDGFIOACTD-BBRMVZONSA-N 293.407 2.447 10 20 CECD Oc1ccc(F)cc1CN[C@H]1CCCc2cn[nH]c21 272242699 AWDAFGNSUGVBEV-LBPRGKRZSA-N 261.300 2.422 10 20 CECD Cc1ccc(O)c(CN2CCO[C@]3(CCO[C@@H]3C)C2)c1 279709357 SHXYKRFMWVMQMO-CZUORRHYSA-N 277.364 2.080 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](C)C[C@H](C)O)c1 273555686 GXADQPZMGDCAAN-SRVKXCTJSA-N 295.379 2.236 10 20 CECD CCOC(=O)[C@@H](F)C1CN(Cc2cc(C)c(C)cc2O)C1 294043588 WLGZRRBYUGUGEN-HNNXBMFYSA-N 295.354 2.342 10 20 CECD C[C@H](N[C@H]1CCNC1)c1cc(Br)ccc1O 817945028 RPVJAUBGMIGLKJ-WPRPVWTQSA-N 285.185 2.167 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](C)CCCCN)c1 817976420 LUGJVKKJJCVAOU-VXGBXAGGSA-N 294.395 2.347 10 20 CECD C[C@H](N[C@@H]1CCNC1)c1ccc(Br)cc1O 817944902 OSXWHUNMVTXRJR-WCBMZHEXSA-N 285.185 2.167 10 20 CECD Cc1ccc(O)c(CN(C)[C@@H]2CC(C)(C)OC2=O)c1 814179940 KDFXAIOODAQION-GFCCVEGCSA-N 263.337 2.227 10 20 CECD NC(=O)C[C@H]1CCN(Cc2ccc3ccccc3c2O)C1 816613478 VYHCBKIIWQNWCN-GFCCVEGCSA-N 284.359 2.243 10 20 CECD Cc1cc(O)c(CN[C@@H](C)c2nncn2C)cc1Cl 825241703 WKOHQLZQRQOKRX-VIFPVBQESA-N 280.759 2.333 10 20 CECD CCc1cccc(CNC[C@H]2CC(=O)N(C3CC3)C2)c1O 848918797 MIIYHOWWTIEMMN-GFCCVEGCSA-N 288.391 2.055 10 20 CECD CN(C)c1ccc(CN2CC[C@@H]3NCC[C@@H]3C2)cc1F 843128904 YYBLETVZXCMMJT-HIFRSBDPSA-N 277.387 2.076 10 20 CECD C[C@H]1CN(Cc2c(O)ccc(Cl)c2F)CC[C@H]1N 843050947 CGDRAHUVLRCKGR-GZMMTYOYSA-N 272.751 2.354 10 20 CECD CCOc1cccc(CNCCC[C@@H]2CCCN2)c1O 841072269 HUNMEFWUESJNJW-CQSZACIVSA-N 278.396 2.413 10 20 CECD CCN(CCNC(=O)Nc1ccc(N)cc1)C(C)C 841300185 MEHHDSSKEMTUAD-UHFFFAOYSA-N 264.373 2.121 10 20 CECD C[C@H](C[S@](C)=O)N[C@H](C)c1ccc(Cl)cc1O 841753910 OJGAGXNEKLHNTM-MHIIWPAESA-N 275.801 2.463 10 20 CECD COc1cc(O)c(CN[C@H](C)CCCCN)cc1OC 841079349 KGRJQLMGNAPGAD-LLVKDONJSA-N 282.384 2.017 10 20 CECD O=C(N[C@@H](c1ccccn1)C1CC1)c1cccc(O)c1O 928619078 PBTJRFBBELGUBK-CQSZACIVSA-N 284.315 2.374 10 20 CECD CC[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C1CC1 855856961 FTMNPSMNPAJMRH-HXUAIIEXSA-N 261.321 2.416 10 20 CECD Cc1ccnn1CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 860950135 JQKBQEPPXMUEFB-CYBMUJFWSA-N 286.379 2.135 10 20 CECD Cc1nc[nH]c1C(=O)N(C)Cc1ccc(N(C)C)cc1 873860765 XKWAXRFGPBKHAY-UHFFFAOYSA-N 272.352 2.056 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@H]2C[C@H]2C1 887767310 HITGHCQJUCPWIC-GASCZTMLSA-N 285.391 2.448 10 20 CECD CC[C@H]1CO[C@@H](C)CN1Cc1cc(OC)c(OC)cc1O 775642834 PCYLUEANKFRXMR-AAEUAGOBSA-N 295.379 2.409 10 20 CECD C[C@H]1CCN(Cc2cc(F)cc(F)c2O)C[C@H]1CO 895380534 ZGHYPYHGHLVFFM-ONGXEEELSA-N 271.307 2.121 10 20 CECD COc1ccc(CN[C@@H]2CCOC(C)(C)C2)c(O)c1OC 893238982 XASMHSIMWUHYAV-GFCCVEGCSA-N 295.379 2.457 10 20 CECD Cc1cc(O)c(CNCCN2CC=CCC2)cc1C 793322614 OHLVYGXBBVHURB-UHFFFAOYSA-N 260.381 2.361 10 20 CECD OC[C@H](NCc1cc(F)cc(F)c1O)C1CCCC1 708390340 OWFQISWIHSFKES-ZDUSSCGKSA-N 271.307 2.311 10 20 CECD Oc1c(Br)cccc1CNC[C@H]1C[C@H](O)C1 720926910 VPIPFIUQXQEGBH-CZMCAQCFSA-N 286.169 2.015 10 20 CECD C[C@@H](CC(=O)NCCc1ccc(O)c(O)c1)C1CC1 762275193 OANFFWMZKLMKPA-JTQLQIEISA-N 263.337 2.193 10 20 CECD CNC[C@@H](C)CNCc1c(O)ccc(Cl)c1F 1261370478 KQZPHPOHUPSRKA-MRVPVSSYSA-N 260.740 2.130 10 20 CECD C[C@@H](N[C@@H]1CC[C@H](C(=O)O)C1)c1cc(F)ccc1O 1603255566 OYMQFHQHHULJAD-WCABBAIRSA-N 267.300 2.435 10 20 CECD O=C(N[C@H](C(=O)O)c1ccc(F)cc1)c1cc(O)cs1 1605731116 NULCWIKLESGFOT-NSHDSACASA-N 295.291 2.149 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)N1CCCC1)c1ccccc1O 228089591 LYKMPNWIGYGXEZ-GXTWGEPZSA-N 276.380 2.444 10 20 CECD C[C@@H](CN[C@@H](C)c1cc(Cl)ccc1O)C(=O)O 1589067873 QSJCCZQPRSECRG-YUMQZZPRSA-N 257.717 2.417 10 20 CECD C[C@]1(C(=O)O)CCCN(Cc2cccc(F)c2O)C1 1593776505 OTQXEVGOIOPITF-AWEZNQCLSA-N 267.300 2.218 10 20 CECD Cc1cccc(CNC[C@H]2CCN(C3CC3)C2)c1O 124702933 QKAZUCIAMNGAQA-CYBMUJFWSA-N 260.381 2.275 10 20 CECD C[C@H](NCC1([S@](C)=O)CC1)c1cc(F)ccc1O 282191897 GGPDPOONOBVHNC-YYSFKGJASA-N 271.357 2.093 10 20 CECD C[C@H](NCC1([S@](C)=O)CC1)c1ccc(N(C)C)cc1 282390092 RDBCQVOEJZYBHV-BUXKBTBVSA-N 280.437 2.314 10 20 CECD CNC(=O)C[C@H](C)N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 322947869 QXVJMQDCKWVWOI-SDDRHHMPSA-N 276.380 2.363 10 20 CECD CCC[C@H](NCc1ccc2c(c1)CCCO2)C(=O)O 900023380 WQNAQKRRKLCKGE-ZDUSSCGKSA-N 263.337 2.355 10 20 CECD CSC[C@@H](CCO)N[C@H](C)c1cc(F)cc(F)c1O 1342407756 SDLBZPHKPRRJSJ-PSASIEDQSA-N 291.363 2.435 10 20 CECD O=C1CCc2cc(NC(=O)c3cccc(O)c3O)ccc2N1 188164013 IRJUDLZPCSOTDY-UHFFFAOYSA-N 298.298 2.235 10 20 CECD COC[C@@H](CCO)NCc1ccc(N2CCCCC2)cc1 219139447 JMCKKFBYPYNYGA-MRXNPFEDSA-N 292.423 2.164 10 20 CECD CN(CCOCC(F)(F)F)c1ccc2c(c1)OCO2 121355329 SKQCNTCBSNMDCV-UHFFFAOYSA-N 277.242 2.430 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NOCCOCC 186008459 SRKQPBRGRSJHKS-UHFFFAOYSA-N 296.367 2.282 10 20 CECD CCOc1cccc(CN2CCC(C)(C(=O)O)CC2)c1O 86777107 FZZXHXXTFDNTHU-UHFFFAOYSA-N 293.363 2.478 10 20 CECD NC[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 44527673 QKMAUYKLPGKCBF-SNVBAGLBSA-N 254.761 2.216 10 20 CECD COCCC1(C(=O)NCc2cc(OC)ccc2O)CCC1 133460708 GVHIVMOFRKNWIG-UHFFFAOYSA-N 293.363 2.224 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2CCC=CO2)cc1 194626137 MOZNHBANGUSYFW-HNNXBMFYSA-N 291.347 2.367 10 20 CECD CN1CC[C@H]2[C@H](CCCN2Cc2cc(F)ccc2O)C1 290647603 YZNPDKXCKXZZIA-DOMZBBRYSA-N 278.371 2.447 10 20 CECD C[C@H](N[C@@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 86758483 TWAGIAZHJOAPJJ-IINYFYTJSA-N 262.353 2.266 10 20 CECD CC(C)(C)n1cc(C(=O)Nc2ccc(N)cc2)cn1 236766762 ZIZLVANIINKTJD-UHFFFAOYSA-N 258.325 2.473 10 20 CECD c1cc(N2CCOCC2)ccc1CNCC[C@@H]1CCOC1 230164652 KAHVTNIKFMTQIV-MRXNPFEDSA-N 290.407 2.039 10 20 CECD CCOc1ccc(O)c(CN[C@H](COC)[C@@H]2CCCO2)c1 278778416 YVZORQQMIOGKKA-ZBFHGGJFSA-N 295.379 2.075 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H](C)CN(C)C 288153083 ZNJXNLMGTSRXLG-ZDUSSCGKSA-N 293.411 2.264 10 20 CECD COC(=O)[C@]1(C)CN(Cc2cc(OC)ccc2O)C[C@H]1C 282251699 BHUXMVUYCCAKCX-BDJLRTHQSA-N 293.363 2.032 10 20 CECD CO[C@H](CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 293751386 QIPOABRERJQPKX-LKFCYVNXSA-N 280.324 2.376 10 20 CECD CC1(C)CCCN(C(=O)c2c(F)ccc(O)c2O)C1 295283524 PSCCUONQXCMCCS-UHFFFAOYSA-N 267.300 2.499 10 20 CECD C[C@@H](CN(C)C)NCc1cc(Cl)cc(F)c1O 809726467 ODYKGGWFXLZVOP-QMMMGPOBSA-N 260.740 2.224 10 20 CECD COc1cc(NC(=O)N(C)Cc2ccccc2O)ccn1 806664492 SVGYYCBCNCZJSO-UHFFFAOYSA-N 287.319 2.460 10 20 CECD Cc1nnc(N[C@H](C)c2ccc(N3CCOCC3)cc2)o1 804378536 VINSCEKJJOIIOO-LLVKDONJSA-N 288.351 2.388 10 20 CECD CN(Cc1cc(Cl)c(F)cc1O)CC1CC(O)C1 294652508 KYDOPBLMCDWLHC-UHFFFAOYSA-N 273.735 2.387 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1cccc(OC)c1O 292746927 RBWNUIPRCYFPGJ-LBPRGKRZSA-N 294.395 2.043 10 20 CECD CCc1[nH]ccc1C(=O)NCc1cc(OC)ccc1O 802783355 OSMSNQRIWLEYTK-UHFFFAOYSA-N 274.320 2.221 10 20 CECD Cc1nn(C)cc1[C@@H](C)NCCc1ccc(N)cc1 817955674 FGPGBSZCUYSSRW-LLVKDONJSA-N 258.369 2.204 10 20 CECD CON1CCC(NCc2c(O)ccc(Cl)c2F)CC1 817418101 AJQHGQXOCAFMPG-UHFFFAOYSA-N 288.750 2.300 10 20 CECD COC(=O)c1cnc(SC[C@H]2COC(C)(C)O2)s1 829681108 NYRSEVVXRNWYNS-SSDOTTSWSA-N 289.378 2.173 10 20 CECD COc1ccc(CNCc2ccnn2CC2CC2)c(O)c1 825753912 WQNIDILURAGLMY-UHFFFAOYSA-N 287.363 2.297 10 20 CECD COC1(CCNC(=O)c2cc(O)cs2)CCC1 832865420 CULLPTGCROBYMQ-UHFFFAOYSA-N 255.339 2.143 10 20 CECD CCOc1ccc(CN2CC(C)(COC)C2)c(O)c1 839145700 RRDITGASVHCVPW-UHFFFAOYSA-N 265.353 2.259 10 20 CECD Cc1ccc([C@H](C)NC[C@@]2(C)CCC(=O)N2)c(O)c1C 834910209 VWTDKYSCOXNKMW-BLLLJJGKSA-N 276.380 2.328 10 20 CECD CO[C@@H](C)CCNC(=O)NCc1ccc(N(C)C)cc1C 734526703 IMDRRXSPXQRAHP-ZDUSSCGKSA-N 293.411 2.285 10 20 CECD Cc1cc(C(=O)OCCCO)c(C)n1-c1ccccn1 914906645 OZTINDNLEISLCG-UHFFFAOYSA-N 274.320 2.028 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CCN(C(C)C)C2=O)c1O 846152883 VGNNQNRUNDFKQD-YPMHNXCESA-N 292.379 2.061 10 20 CECD Cc1ccc(C(=O)O[C@@H]2CCC(C)(C)C2=O)c(O)c1O 840222057 XGGCGKFOFJBRFW-SNVBAGLBSA-N 278.304 2.321 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1(O)CCCCC1 846474922 CXIKOAMBQUEIAF-UHFFFAOYSA-N 283.755 2.357 10 20 CECD CCc1cccc(CN2CC[C@@](C)(C(=O)OC)C2)c1O 848890325 SHKAAGZVHPIRPB-MRXNPFEDSA-N 277.364 2.340 10 20 CECD COc1ccc(CN[C@H](C)[C@H]2CCCNC2)cc1C 841032847 GEPVHLODUSXTPD-HIFRSBDPSA-N 262.397 2.481 10 20 CECD CCN(CC)C(=O)CCCNC(=O)Nc1ccc(N)cc1 841300267 ONQFNBGWDYPIER-UHFFFAOYSA-N 292.383 2.039 10 20 CECD CO[C@@H]1COCC[C@H]1CNCc1ccc(N(C)C)cc1C 840949947 DEIVAEOBTKNVSL-DOTOQJQBSA-N 292.423 2.202 10 20 CECD C[C@@H](C(=O)NCc1ccc(N2CCOCC2)cc1)C1CC1 747907912 MLMBAXXCFZGXAB-CYBMUJFWSA-N 288.391 2.186 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](O)[C@H](C)C1 840938208 LTLUDTHOGDUNBF-CZUORRHYSA-N 262.397 2.264 10 20 CECD CCOc1cccc(CNCCCCCCN)c1O 843128299 JPWOICPZZWMGHC-UHFFFAOYSA-N 266.385 2.400 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCCNCC2)c1 841058823 VUCYTCKQFDYZRH-CYBMUJFWSA-N 264.369 2.023 10 20 CECD COCC1CCC(NC(=O)NCc2ccccc2O)CC1 840275974 HSYHMCUJXJOTEN-UHFFFAOYSA-N 292.379 2.397 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@]2(C)C(=O)O)cc1 756391808 YIIGDYBZHVOERM-ZBFHGGJFSA-N 276.380 2.486 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H]2[C@H](C)O)cc1 852557988 DKGHQKRJMIVTTO-XJKSGUPXSA-N 262.397 2.488 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCc3cccnc32)c1 862754988 AARMXCZENDDDRR-CQSZACIVSA-N 282.343 2.442 10 20 CECD CCOc1ccc(N2CCN(Cc3cnc[nH]3)CC2)cc1 1116880299 KCEVDVVYGBYENA-UHFFFAOYSA-N 286.379 2.131 10 20 CECD CC(C)(C)c1cnc(S[C@@H]2CCC(=O)NC2=O)s1 765827824 LTDFUJAXNRTFAP-SSDOTTSWSA-N 284.406 2.338 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H]1CC[C@H](C(N)=O)C1 1117779002 CWQRAJSMMCSADS-XQHKEYJVSA-N 288.391 2.493 10 20 CECD Cc1ccc(CNC2CCN([C@H]3CCOC3)CC2)c(O)c1 877636278 RNZFSKORYDGXHV-INIZCTEOSA-N 290.407 2.044 10 20 CECD CC[C@@H]1C(=O)N(CC)CCN1Cc1cccc(C)c1O 779217040 NUZNJLGZITVVQH-CQSZACIVSA-N 276.380 2.143 10 20 CECD CCc1nc([C@@H](C)NCc2ccc(C)cc2O)n[nH]1 877130416 RIKMXASICBMWJO-SNVBAGLBSA-N 260.341 2.232 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCc2ccco2)c1O 774942614 OCMYREHWYMTQDY-UHFFFAOYSA-N 278.264 2.192 10 20 CECD O=C(NCc1ccccc1O)c1ccc(-c2nc[nH]n2)cc1 771416018 BTFUAFSDIHQMGV-UHFFFAOYSA-N 294.314 2.107 10 20 CECD CC[C@H](NC(=O)c1ccc(C)c(O)c1O)c1ncc[nH]1 785421420 OTAULQVMMPCQCO-JTQLQIEISA-N 275.308 2.010 10 20 CECD Cc1[nH]nc(NCc2ccc(N3CCOCC3)cc2)c1C 886196248 MECBZNUKJWRRIS-UHFFFAOYSA-N 286.379 2.475 10 20 CECD CCc1nc([C@H](C)NCc2cc(C)cc(OC)c2O)n[nH]1 894370707 OEZXHOBJXTXDBS-JTQLQIEISA-N 290.367 2.241 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CCCOC2)cc1 784563769 JTLNHOSDTQKFIQ-CYBMUJFWSA-N 293.363 2.101 10 20 CECD COc1ccc(CN2CCC[C@](C)(O)CC2)c(O)c1OC 894145457 LNBNNBYBVLPTJO-INIZCTEOSA-N 295.379 2.146 10 20 CECD CSCC[C@@H](C)NC(=O)c1ccc(C)c(O)c1O 780947901 OUXYROSYLBPFCZ-SECBINFHSA-N 269.366 2.278 10 20 CECD COc1cc(CN2CC(OC(F)F)C2)c(O)cc1C 797820823 PNFPRTAOZOBRQX-UHFFFAOYSA-N 273.279 2.133 10 20 CECD CCc1cccc(CN2CC[C@]3(CCN(C)C3)C2)c1O 692089523 FTAPIPORTMTMBZ-KRWDZBQOSA-N 274.408 2.482 10 20 CECD COc1ccc(CNC(=O)c2cncc(C)c2)c(O)c1 794387456 IKJXSUZPHZGKRJ-UHFFFAOYSA-N 272.304 2.034 10 20 CECD O=C(O)CN(Cc1cc(Cl)ccc1O)C(=O)CC1CC1 1339601757 GGKABFMPURTYDR-UHFFFAOYSA-N 297.738 2.259 10 20 CECD CC(C)[C@@H](C(=O)NCc1ccc(N)cc1)N1CCCCC1 1356226960 DNENDOGFIZXMHK-INIZCTEOSA-N 289.423 2.396 10 20 CECD C=C=CCNC(=O)NCc1ccc(N2CCCC2)cc1 1518822799 YMAOHRHENUVNLC-UHFFFAOYSA-N 271.364 2.427 10 20 CECD COc1ccc(CNC(=O)c2ccc(F)cc2N)c(O)c1 1296967353 APUWYECDCHIKRH-UHFFFAOYSA-N 290.294 2.052 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CC[C@H](C(=O)O)CC1 1606169686 BIUIZEKBPUNHID-HAQNSBGRSA-N 291.347 2.242 10 20 CECD CCOc1cccc(CNC[C@H]2CCC[C@H](O)C2)c1O 230670186 BEOSBYUVAOYIMV-JSGCOSHPSA-N 279.380 2.432 10 20 CECD NC[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2cccnc2)C1 1580273254 HOTAFAATFKIFRI-LZNQSLFOSA-N 293.370 2.259 10 20 CECD COc1ccc(CN[C@H]2C[C@@H]3C[C@]3(C(=O)O)C2)cc1C 1599573916 QIXZNOKASMTBHV-WWGRRREGSA-N 275.348 2.347 10 20 CECD C[C@H](C[C@@H](O)c1ccccc1)NC(=O)Cc1ccc(N)cc1 161509532 WGOQFHACODEKOH-CXAGYDPISA-N 298.386 2.440 10 20 CECD CC[C@@H](NC[C@H](C)CN1CCOCC1)c1ccccc1O 155936985 PKOXZESLHKKWAD-GOEBONIOSA-N 292.423 2.401 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CCCCO1 159771144 AHCSEDQEROLDOP-INIZCTEOSA-N 289.375 2.456 10 20 CECD CS[C@H]1CC[C@@H](N(C)C(=O)c2cccc(O)c2O)C1 707342156 FABJERZYVNZMAV-ZJUUUORDSA-N 281.377 2.454 10 20 CECD CN(CC(=O)NCc1cccs1)Cc1ccccc1O 109769561 NFKIWPIPJWNTEE-UHFFFAOYSA-N 290.388 2.202 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@H]3CCCOC3)ccc21 170798050 JREDBCUYTQIWAI-OAHLLOKOSA-N 288.391 2.112 10 20 CECD COc1ccc(N2CCC(NC(=O)N3CCC3)CC2)cc1 170698715 HPEBLUWPUNVZAQ-UHFFFAOYSA-N 289.379 2.079 10 20 CECD C[C@H]1CCCN(C(=O)CN(C)c2ccc3c(c2)OCO3)C1 121250972 LHUAZOVUAOORHB-LBPRGKRZSA-N 290.363 2.110 10 20 CECD CCNC(=O)[C@H](C)NCc1cc(Cl)cc(Cl)c1O 36795149 WIBOBQZNISJXFX-ZETCQYMHSA-N 291.178 2.313 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H](C)N1 125064553 XZEFIMLYNCMWGW-UWVGGRQHSA-N 254.761 2.228 10 20 CECD CSC[C@@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183450233 NOWHMGSYJWDEIH-ZJUUUORDSA-N 283.393 2.144 10 20 CECD COCCC1(CNC(=O)c2ccc(C)c(O)c2O)CCC1 182613470 ISLMKPZCIDHLKM-UHFFFAOYSA-N 293.363 2.343 10 20 CECD Cc1noc(C)c1C[C@H](C)NC(=O)c1cccc(O)c1O 193081813 RLESXGWUDGXJAI-QMMMGPOBSA-N 290.319 2.064 10 20 CECD Oc1c(F)cccc1CN1CCO[C@H]2CCC[C@H]21 228003598 PTEMWAWBWAPTRI-OLZOCXBDSA-N 251.301 2.285 10 20 CECD COc1ccc(N(C)CCc2cnn(C)c2)c(OC)c1 269822397 PVWMYNJADFFDPU-UHFFFAOYSA-N 275.352 2.116 10 20 CECD CCN(C)C(=O)CN(C)c1ccc(OC)c(Cl)c1 268187228 OUNLZCALPWQLAT-UHFFFAOYSA-N 270.760 2.263 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273591059 PDQCXYPAWPWMOW-BHDSKKPTSA-N 282.340 2.358 10 20 CECD CCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)C1CC1 278294459 VEIKBLKBAXAZGE-UHFFFAOYSA-N 266.297 2.293 10 20 CECD COC[C@@H](CN[C@@H](C)c1cc(Cl)ccc1O)OC 273478230 TXKLIWMSBLXKRB-GXSJLCMTSA-N 273.760 2.358 10 20 CECD COc1cccc(CNC[C@H]2COC3(CCCC3)O2)c1O 271380873 DJKHFBDQHBCCFZ-ZDUSSCGKSA-N 293.363 2.176 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@@]2(CCCOC2)O1 373634445 FAWQULBBIYKYFV-MLGOLLRUSA-N 295.354 2.301 10 20 CECD CO[C@H]1COC[C@@H]1N[C@H](C)c1cc2c(cc1O)CCCC2 290224471 RDOSLZQSGANYEM-PJQXDXOGSA-N 291.391 2.335 10 20 CECD CCOC(=O)CC(=O)NCc1ccc(N(CC)CC)cc1 299680707 RPZSOCBNHNGVTO-UHFFFAOYSA-N 292.379 2.102 10 20 CECD CN(C)C1CCC(NC(=O)c2cc(O)cs2)CC1 817770228 KIMNPNWBZFQECG-UHFFFAOYSA-N 268.382 2.056 10 20 CECD CCOc1ccc(CN2CCN(C)C[C@H]2CC)c(O)c1 816660949 VZYLODATEWVLOF-CQSZACIVSA-N 278.396 2.317 10 20 CECD Cc1ncsc1/C=C\C(=O)N1CCc2ccncc21 492711124 DTVCLMAMJBUQSI-IHWYPQMZSA-N 271.345 2.449 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1nccs1 588403243 AVKIOAWGMQUGJA-RQOWECAXSA-N 262.290 2.206 10 20 CECD C[C@H](NC[C@@H]1CCCCCN1)c1cc([N+](=O)[O-])ccc1O 902481761 GQESKRQSRDNFKG-RYUDHWBXSA-N 293.367 2.483 10 20 CECD Cc1ccc(C(=O)OCCCOC(C)C)c(O)c1O 733476209 MTFKRNRUXRFNEL-UHFFFAOYSA-N 268.309 2.378 10 20 CECD CCOc1cccc(CN[C@H](CN)C2CCCC2)c1O 841087454 NTVUBFZQSVWUJB-CQSZACIVSA-N 278.396 2.398 10 20 CECD CCOc1ccc(CN2CCC[C@H](CO)[C@H]2C)c(O)c1 840977470 IHIGSUCJVVZIRP-TZMCWYRMSA-N 279.380 2.384 10 20 CECD CCN(CC)c1ccc(CN2CCCO[C@H](CN)C2)cc1 841100962 QCSLNHKIUDTHJF-QGZVFWFLSA-N 291.439 2.082 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1cccc(Br)c1O 841066218 YKNXIXSCCYUILA-CABZTGNLSA-N 299.212 2.385 10 20 CECD CCOc1ccc(CN[C@@H](CC2CC2)C(=O)OC)c(O)c1 840958775 SDMFBLDZBKEVFH-AWEZNQCLSA-N 293.363 2.222 10 20 CECD CCc1nncn1CCN[C@H](C)c1ccc(C)cc1O 756618889 CSJXFFYSZZWBCQ-GFCCVEGCSA-N 274.368 2.205 10 20 CECD COC[C@H](NCc1ccc2c(c1)CCCO2)[C@@H]1CCCO1 922078725 GUXAQOKWMQQZTK-RDJZCZTQSA-N 291.391 2.295 10 20 CECD Cc1ccc([C@H](C)NCc2nc(C(N)=O)cs2)c(O)c1 850539091 AEMSCNXVNDPXCY-VIFPVBQESA-N 291.376 2.107 10 20 CECD CNC(=O)CCCN(Cc1ccc(N(C)C)cc1)C(C)C 1118368955 UBGTZPPJVMYXAB-UHFFFAOYSA-N 291.439 2.489 10 20 CECD CCN1C[C@@H](C)N(Cc2cc(OC)ccc2O)C[C@H]1C 775711876 JOPFFTROXUFGCX-CHWSQXEVSA-N 278.396 2.315 10 20 CECD C[C@H]1[C@@H](C)N(C)CCN1Cc1ccc(N(C)C)cc1 775986904 SNMLISOYSZIKOX-KGLIPLIRSA-N 261.413 2.277 10 20 CECD CCOc1cccc(CN[C@H]2CCn3ccnc3C2)c1O 778187009 CGKYHGRJGUJCDR-ZDUSSCGKSA-N 287.363 2.092 10 20 CECD CN1c2ccccc2C(=O)N[C@H]1c1cccc(F)c1O 778520099 NXVWDKBMPJRHHG-CQSZACIVSA-N 272.279 2.410 10 20 CECD Nc1ccc(OCc2cn(CC3CC=CC3)nn2)cc1 881319125 SIOFEORPQHMUIA-UHFFFAOYSA-N 270.336 2.406 10 20 CECD C[C@H](NC[C@H]1CCCN1CCCO)c1c(O)cccc1F 886615676 LGSPZKZVWSRAPQ-QWHCGFSZSA-N 296.386 2.029 10 20 CECD CC(=O)OC[C@@H](C)NCc1cc(Cl)ccc1O 895156060 RHDYAZJFJVKNDJ-MRVPVSSYSA-N 257.717 2.087 10 20 CECD C/C=C(\C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891253188 RKASMKXZTJJYEQ-ROCHPLJESA-N 289.423 2.438 10 20 CECD CCOC(=O)/C(=C\c1cn(CC)nc1C)c1nccn1C 899349376 BKTXSXJJQBUSJJ-LCYFTJDESA-N 288.351 2.049 10 20 CECD CCOC(=O)C1(CNCc2ccc3c(c2)CCCO3)CC1 893659821 LAZDWWJYZVJZCP-UHFFFAOYSA-N 289.375 2.445 10 20 CECD Cc1cccc(O)c1CN1CCO[C@H](c2ccnn2C)C1 897563543 WSDNLHJATNDEPY-INIZCTEOSA-N 287.363 2.008 10 20 CECD COc1cc(C)cc(CNCC(C)(C)CCO)c1O 894304507 RCNQZXUPGCYFBT-UHFFFAOYSA-N 267.369 2.207 10 20 CECD COc1ccc(O)c(CNCCO[C@@H]2CCCCO2)c1 894799301 LJCVJDMHUIRNQU-OAHLLOKOSA-N 281.352 2.034 10 20 CECD CCC(CC)C(=O)NCc1ccc(OC)cc1O 794379602 SDRDSOOZBBDLKS-UHFFFAOYSA-N 251.326 2.453 10 20 CECD COc1ccc(CNC(=O)Nc2ncccc2C)c(O)c1 794760968 AACLMIUPPGGPAB-UHFFFAOYSA-N 287.319 2.426 10 20 CECD OC[C@@H](CC(F)(F)F)NCc1cc(Cl)ccc1O 717714222 XCYKDNRCASOUHK-SECBINFHSA-N 283.677 2.449 10 20 CECD COc1ccc(CNC(=O)[C@H](C)OCC(C)C)c(O)c1 794388426 SWWKNVXNMLFWPC-NSHDSACASA-N 281.352 2.078 10 20 CECD C[C@H](C(=O)NCCCSc1nccs1)n1ccnc1 1318659225 CXKOQPNKCRLAKE-SNVBAGLBSA-N 296.421 2.199 10 20 CECD COC(=O)c1cc(CNC(=O)c2cc(O)cs2)oc1C 1327643204 OOHXRENLWCIEQB-UHFFFAOYSA-N 295.316 2.072 10 20 CECD COc1cccc(CN=c2c(C)c[nH]cc2[N+](=O)[O-])c1O 1258056262 ROHFICRLEIHIOI-UHFFFAOYSA-N 289.291 2.046 10 20 CECD CN(C)c1ccc(CN(C)[C@@H](CC(=O)O)C(F)F)cc1 1777039609 GUCDNQVRURBSIP-LBPRGKRZSA-N 286.322 2.293 10 20 CECD CN(C)c1ccc(CN2CC[C@H](C(=O)O)C2(C)C)cc1 1777039445 SMJLMPJXEWWCBS-CQSZACIVSA-N 276.380 2.438 10 20 CECD CNC1(C(=O)NCc2c(O)ccc3c2CCCC3)CCC1 1340987584 WJYJBUZNEWNRDF-UHFFFAOYSA-N 288.391 2.029 10 20 CECD Oc1ccc(F)cc1CNC[C@H]1CCC[C@@H](O)C1 226611447 OUUIPSQCGNKDSD-GXFFZTMASA-N 253.317 2.172 10 20 CECD CC(C)(C)[C@H](NCc1cc(F)c(F)cc1O)C(=O)O 1573817919 VSFSMFWWGWZZSL-LLVKDONJSA-N 273.279 2.259 10 20 CECD COc1cc(C)cc(CN[C@H](C)C2CCNCC2)c1O 1579145321 QADRTBMIHNHRAT-GFCCVEGCSA-N 278.396 2.187 10 20 CECD COc1cc(C)cc(CN2CC[C@H](C)C[C@H]2C(=O)O)c1O 1599392308 LAYGMWCNJKXQKH-GWCFXTLKSA-N 293.363 2.394 10 20 CECD CCn1nccc1CN[C@H](C)c1cc(OC)ccc1O 845971929 OFUINVHULBAWQJ-LLVKDONJSA-N 275.352 2.468 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)[C@@H](C)CN1C 894482277 BJVQHGVLABQZIC-UWVGGRQHSA-N 270.323 2.195 10 20 CECD C[C@H](N[C@@H](C)c1nncn1C)c1ccc(N(C)C)cc1 37293640 KVZYSNHQQIYQLY-RYUDHWBXSA-N 273.384 2.293 10 20 CECD COC[C@@]1(C)CCN(Cc2cccc(OC)c2O)C1 294137811 FZXCCNADWAIVTJ-HNNXBMFYSA-N 265.353 2.259 10 20 CECD COC(=O)CCCCN1CCCc2cc(CN)ccc21 700899877 XEHALKLZNQGQSE-UHFFFAOYSA-N 276.380 2.241 10 20 CECD COCCCCNC(=O)NCc1ccc(N(C)C)c(F)c1 58560223 LTBLRSJAJWDYMM-UHFFFAOYSA-N 297.374 2.118 10 20 CECD N[C@H]1CC[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 178710450 DDKPTMYUAYKWHA-GJZGRUSLSA-N 287.407 2.030 10 20 CECD CSc1cccnc1C(=O)NCc1ccc(N)cc1 26662334 XGXBMFOAVNIFQG-UHFFFAOYSA-N 273.361 2.316 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NCc2nc[nH]n2)cc1 66457057 MDWPUNFHVCEARA-UHFFFAOYSA-N 295.346 2.142 10 20 CECD COC(=O)COc1ccc(N(C)Cc2cnoc2C)cc1 189432909 LUWPGVTWYSZIRO-UHFFFAOYSA-N 290.319 2.171 10 20 CECD COC(=O)[C@@H](c1cccnc1)N(C)Cc1ccccc1O 121138330 NDILEVZRPUKXFO-OAHLLOKOSA-N 286.331 2.133 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc3c(c2)CNC3)cc1 316949078 CETTYBWWAPJRDO-UHFFFAOYSA-N 295.386 2.286 10 20 CECD Cc1ncc(S(=O)(=O)Nc2ccc(O)c(C)c2)s1 225613016 BFXYTJWYVVADMH-UHFFFAOYSA-N 284.362 2.266 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cc[n+]([O-])cc2)cc1 46740696 IXLAQGCWMJKGKF-UHFFFAOYSA-N 299.374 2.096 10 20 CECD COc1ccc(O)c(CN2CCO[C@@H](C)[C@H]2C)c1 180257239 PKVUOEZTCJJQEH-MNOVXSKESA-N 251.326 2.010 10 20 CECD Cc1ccc([C@H](O)CNCc2ccc3c(c2)CCO3)o1 265959103 ISLWYECGHIXLQF-CQSZACIVSA-N 273.332 2.346 10 20 CECD COCCn1cc(CNCc2ccc(OC)c(C)c2)cn1 266236539 VYRDJSAMJBWQEU-UHFFFAOYSA-N 289.379 2.136 10 20 CECD C[C@H](O)[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 272543283 PPNXEPSESJJJMF-WCQYABFASA-N 266.360 2.094 10 20 CECD C[C@H](N[C@@H]1CCc2c[nH]nc2C1)c1ccc(F)cc1O 370399378 UCGWHZOQXRZIEW-JOYOIKCWSA-N 275.327 2.463 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCSC2)cc1OC 280536166 SGCNSEVAJYGILG-JTQLQIEISA-N 283.393 2.252 10 20 CECD CC1(C)CN(CCN[C@H]2CCc3cccc(O)c32)CCO1 297640429 JSVQYTSHQIKCLB-AWEZNQCLSA-N 290.407 2.080 10 20 CECD CC(=O)C(=O)COC(=O)CCCC1CCCCC1 808484005 FZRVBCCLAWAPLY-UHFFFAOYSA-N 254.326 2.438 10 20 CECD COc1cccc(CN(C)CCCn2ccnc2C)c1O 290581948 UQHGLTYLHJSEAJ-UHFFFAOYSA-N 289.379 2.428 10 20 CECD C[C@@H](CN)N[C@H](C)c1cc(Br)c(F)cc1O 817970284 QNDSMZWLMLDLEB-NKWVEPMBSA-N 291.164 2.292 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCCc2ccco2)c1 725841932 RSILKGRDFADGCT-UHFFFAOYSA-N 262.265 2.226 10 20 CECD CCn1c(-c2cc[nH]n2)nnc1N(C)Cc1ccccc1O 828607775 WZJGFVQIDSWKFE-UHFFFAOYSA-N 298.350 2.030 10 20 CECD COc1cccc([C@H](C)N[C@@H]2COC[C@@H]2C)c1O 903393584 PQQDTCRKZLSGNI-JBLDHEPKSA-N 251.326 2.086 10 20 CECD CCN(C)c1ccc([C@H](C)NC(COC)COC)cc1 834892181 QLVQKGUEWMSHOV-ZDUSSCGKSA-N 280.412 2.455 10 20 CECD Cc1cc(CN(C)C[C@@H](C)C(=O)O)ccc1N(C)C 846226021 WXXCGQVUXSTKNU-GFCCVEGCSA-N 264.369 2.214 10 20 CECD C[C@]1(CN)CCN(Cc2cccc(Br)c2O)C1 843114530 CYUXWNXMMZJRRX-CYBMUJFWSA-N 299.212 2.325 10 20 CECD COc1cc(O)c(CNCCC[C@@H]2CCCN2)cc1OC 841072420 JYCDKQIKFXQFPX-CYBMUJFWSA-N 294.395 2.031 10 20 CECD CCc1cccc(CNC[C@@H]2CC(=O)N(C3CC3)C2)c1O 848918798 MIIYHOWWTIEMMN-LBPRGKRZSA-N 288.391 2.055 10 20 CECD C[C@H](NC(=O)Cc1cncc(O)c1)c1ccc(N(C)C)cc1 848373841 MMHTXPYUKVLFLW-LBPRGKRZSA-N 299.374 2.273 10 20 CECD CC(C)(NC(=O)NCCc1ccc(N)cc1)C1CC1 841958401 FSJHMWIYBPPFMA-UHFFFAOYSA-N 261.369 2.299 10 20 CECD O=C(c1cc(O)cs1)N1CCC([C@H]2CCOC2)CC1 753488979 VNAKMZWBJDKHBI-NSHDSACASA-N 281.377 2.342 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CC23CCOCC3)c1 858517623 SXLQRDCJTJMMNG-CQSZACIVSA-N 290.363 2.069 10 20 CECD CON(C)CCN[C@@H](C)c1ccc(C)c(C)c1O 850479409 SDOHVWLLKAIJAS-LBPRGKRZSA-N 252.358 2.153 10 20 CECD Cc1cc(CN2CC[C@H]([C@H](C)N)C2)ccc1N(C)C 923331451 MBXWYTNUCWKCGS-ZFWWWQNUSA-N 261.413 2.230 10 20 CECD C[C@H](NC[C@H]1C[C@@H](O)C1)c1ccc(Cl)cc1O 858543415 IPTIWRKRCCLWPO-ATZCPNFKSA-N 255.745 2.467 10 20 CECD C[C@@H](NC(=O)NCCn1cccc1)c1ccccc1O 868379001 MONQDDUMMZRFTM-GFCCVEGCSA-N 273.336 2.254 10 20 CECD Cc1cncc(CNC(=O)NCc2ccccc2O)c1 760329888 RCULIWQUHXIAPP-UHFFFAOYSA-N 271.320 2.095 10 20 CECD CCOc1cccc(CN2CCN(C)[C@@H](C)[C@H]2C)c1O 775986464 QUNIRCOOQNRXNB-QWHCGFSZSA-N 278.396 2.315 10 20 CECD COc1ccc(O)c([C@H](C)Nc2nccn3cnnc23)c1 771196748 KQDZULQGEYUDRK-VIFPVBQESA-N 285.307 2.012 10 20 CECD CCN(C)c1ccc(Cn2cc([C@](C)(O)CC)nn2)cc1 881314833 GGWHVLIYZYRZJP-MRXNPFEDSA-N 288.395 2.400 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1ncccn1 888681952 LTPDHGGWMRDWPA-UHFFFAOYSA-N 285.351 2.173 10 20 CECD O=C(NCCCSc1nccs1)C(F)F 787349128 GNGWEVDGIIFGDQ-UHFFFAOYSA-N 252.311 2.007 10 20 CECD CC[C@H](C)C[C@@H](CO)NCc1ccc(OC)c(OC)c1O 895111603 GUCJLZQJLMQMNN-AAEUAGOBSA-N 297.395 2.296 10 20 CECD COc1cc(C)cc(CN2CCC[C@H]2C(C)(C)O)c1O 894452949 ADYPZVPOHGMBGX-AWEZNQCLSA-N 279.380 2.445 10 20 CECD CC[C@H](C)[C@@H](O)CNCc1cc(C)cc(OC)c1O 894250050 CZKBWGALAGSRLS-AAEUAGOBSA-N 267.369 2.206 10 20 CECD COc1cc(C)cc(CNC[C@H](C)N(C)C2CC2)c1O 894245430 BLFGTXVVOBENOF-LBPRGKRZSA-N 278.396 2.282 10 20 CECD COc1cc(C)cc(CN2CCN(C)[C@H](C)[C@H]2C)c1O 894487111 GJFZIOOOYHZVDU-CHWSQXEVSA-N 278.396 2.234 10 20 CECD N[C@@H]1CCCN(Cc2ccc(Br)cc2O)C1 691480310 YUTIBQVSSBYSPG-LLVKDONJSA-N 285.185 2.078 10 20 CECD CSc1ccccc1C(=O)N1C[C@H](C)S(=O)[C@@H](C)C1 791172241 HSIQSQWVVYCOJX-QWRGUYRKSA-N 297.445 2.390 10 20 CECD CC1(C)CN(Cc2c(O)ccc(Cl)c2F)CCN1 792164473 IRJVXZQYESKLHG-UHFFFAOYSA-N 272.751 2.369 10 20 CECD Cc1ccc(O)c(CNCC(=O)NCc2ccccc2)c1 71408178 BZPXVUTXWFKNSC-UHFFFAOYSA-N 284.359 2.107 10 20 CECD C[C@H](N[C@@H](CO)CC1CC1)c1ccc(F)cc1O 756769379 LAZFFTRQHJMEDM-JOYOIKCWSA-N 253.317 2.343 10 20 CECD CCOC[C@@H]1CCCN(C(=O)NCc2ccc(N)cc2)C1 1335737260 NRQXWOOKLUNFLG-CQSZACIVSA-N 291.395 2.227 10 20 CECD Nc1ccc(CNC(=O)c2ncoc2[C@H]2CCCO2)cc1 1346210777 YVXFBLIBIJQMOU-GFCCVEGCSA-N 287.319 2.038 10 20 CECD C[C@@](CC(=O)O)(NCc1cc(F)cc(F)c1O)C1CC1 1604091648 USBDXLONRSRYRK-AWEZNQCLSA-N 285.290 2.403 10 20 CECD O=C(O)C1=CC[C@@H](NCc2cccc(Cl)c2O)C1 1608586853 QKCLXGRLQOFEHL-SNVBAGLBSA-N 267.712 2.309 10 20 CECD O=C(N[C@H]1CCCCC[C@H]1C(=O)O)c1cc(O)cs1 1601568861 KTHFKHCAGJRDKV-ZJUUUORDSA-N 283.349 2.217 10 20 CECD Cc1cc(CN[C@H]2CCC[C@@H]2C(=O)O)ccc1N(C)C 1607647687 GXEZTYJKFXEAGQ-KBPBESRZSA-N 276.380 2.404 10 20 CECD CC(C)c1cc(NC(=O)Cc2ccc(N)cc2)[nH]n1 228310325 DALOGXKZBINLBX-UHFFFAOYSA-N 258.325 2.297 10 20 CECD CN(C(=O)[C@@H]1C[C@H]1c1cccnc1)c1ccc(N)cc1 1578386139 OSNPIUWSLJPLNA-LSDHHAIUSA-N 267.332 2.430 10 20 CECD N[C@H]1CC=C(C(=O)N2CCC=Cc3ccccc32)C1 1580171330 MBLTYJWVQWGAGX-AWEZNQCLSA-N 254.333 2.484 10 20 CECD O=C(O)C1CCN(Cc2ccc(Cl)cc2O)CC1 1594933736 KOWCIJLPEKPYQC-UHFFFAOYSA-N 269.728 2.342 10 20 CECD CCc1ncc(CNCc2ccc(C(=O)O)cc2O)s1 1776988917 JPZBQTGFDUGERK-UHFFFAOYSA-N 292.360 2.399 10 20 CECD CC(C)CC[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776323207 HFDAHUYXFYTDNF-LBPRGKRZSA-N 296.323 2.279 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCC(=O)NC(C)C 36781631 UCXIIDOUMHZNKF-RYUDHWBXSA-N 276.380 2.363 10 20 CECD CCOc1cccc(CNC2(CO)CCCC2)c1O 53044599 QBILQESCNBIGDQ-UHFFFAOYSA-N 265.353 2.186 10 20 CECD Oc1ccc(F)cc1CNCCC[C@@H]1CCOC1 402369076 GIVDIHIKROOJEC-LLVKDONJSA-N 253.317 2.438 10 20 CECD CS[C@H]1CC[C@H](N(C)C(=O)c2cccc(O)c2O)C1 707342150 FABJERZYVNZMAV-UWVGGRQHSA-N 281.377 2.454 10 20 CECD CC[C@H](NCc1nnc(C)n1C)c1ccccc1O 393217452 RCLSXZLWTMJBBG-LBPRGKRZSA-N 260.341 2.070 10 20 CECD COc1ccc(N(C)CC(=O)N[C@H](C)C(C)C)cc1OC 68300978 LEWRDHPFZVXGQV-GFCCVEGCSA-N 294.395 2.301 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnc(Cl)cn1 178207981 KYOQOOSDHJVIPR-UHFFFAOYSA-N 277.711 2.108 10 20 CECD CCOc1ccc(O)c(CN(C)[C@H](C)COC)c1 179372476 AHZIKVBTJMJJEE-LLVKDONJSA-N 253.342 2.258 10 20 CECD CCOC(=O)N[C@@H]1CCCN(Cc2cccc(C)c2O)C1 179691915 GUFJJHAILZHUBJ-CQSZACIVSA-N 292.379 2.411 10 20 CECD COC(=O)[C@H](c1cccnc1)N(C)Cc1ccccc1O 121138179 NDILEVZRPUKXFO-HNNXBMFYSA-N 286.331 2.133 10 20 CECD CCN(CC)c1ccc(CN2CC[C@](C)(O)C2)cc1 180199428 JFIHHJOOMYJGFE-INIZCTEOSA-N 262.397 2.490 10 20 CECD Cc1cccc(CN2CCCC3(C2)OCCO3)c1O 182079476 HYENYTGMJOVUEM-UHFFFAOYSA-N 263.337 2.040 10 20 CECD CN1CCCc2cc(CNC(=O)C3=CCCCO3)ccc21 73132593 ZKQZKFHWJPGSRN-UHFFFAOYSA-N 286.375 2.380 10 20 CECD CC[C@H](CSC)N(C)C(=O)c1cccc(O)c1O 126523392 BQNPDQPLCCDSCI-SECBINFHSA-N 269.366 2.311 10 20 CECD C[C@@H](NCCC(=O)N(C)C)c1cc(Cl)ccc1O 185264390 LIWITECPQGMSLC-SECBINFHSA-N 270.760 2.175 10 20 CECD CCn1cc(NC(=O)NCc2ccc(N(C)C)cc2)cn1 43645649 QLVXLBPHZBZQBX-UHFFFAOYSA-N 287.367 2.291 10 20 CECD O=C(CSc1nccs1)NC(=O)NC1CCCC1 48874240 DIROPEOSWSUTPX-UHFFFAOYSA-N 285.394 2.004 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)NC(C)(C)C)c1 135727780 YUPUEWMBZUFQRZ-MNOVXSKESA-N 294.395 2.355 10 20 CECD CSCCNCc1ccc(N2CCOCC2)c(F)c1 237507671 VTNYIBMXMXWJJU-UHFFFAOYSA-N 284.400 2.115 10 20 CECD Cc1cccc(CN2CCO[C@H]([C@@H]3CCCO3)C2)c1O 180707038 UDUFRDGOFBHYJV-GJZGRUSLSA-N 277.364 2.080 10 20 CECD CCCCN(Cc1ccccc1O)CC1OCCO1 282456406 MGHUQHFTOKXSKL-UHFFFAOYSA-N 265.353 2.367 10 20 CECD C[C@H](NCCF)c1ccc(N2CCOCC2)c(F)c1 281204305 YHNHWIXWWBWURC-NSHDSACASA-N 270.323 2.282 10 20 CECD C[C@H](N[C@H]1CC[C@@H](CO)C1)c1ccc(F)c(F)c1O 296659060 ZPRBHFHHCVUVPK-AEJSXWLSSA-N 271.307 2.482 10 20 CECD CC(=O)C(=O)COC(=O)/C=C/c1nc2ccccc2s1 808489779 DMJJCSRXRGEZOA-VOTSOKGWSA-N 289.312 2.011 10 20 CECD C[C@H](N[C@H]1CCNC1)c1ccc(Br)cc1O 817944903 OSXWHUNMVTXRJR-WPRPVWTQSA-N 285.185 2.167 10 20 CECD CN(Cc1ccc2ccccc2c1O)C[C@@H]1COCCO1 827141434 SZTJYHOLZPJRGT-OAHLLOKOSA-N 287.359 2.393 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C[C@H](N)C1CC1 828147852 MBTZNFUWTFIUAE-AWEZNQCLSA-N 276.380 2.258 10 20 CECD Cc1ccnc([C@H](C)NC(=O)c2cc(O)cs2)n1 823703499 JDCGLPHNXRBHKO-QMMMGPOBSA-N 263.322 2.043 10 20 CECD CC(=O)CCCCCNC(=O)/C=C\c1ccc(O)c(O)c1 909099194 POAULYKAMYGCAR-CLFYSBASSA-N 291.347 2.377 10 20 CECD O=C(O)[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCCO2 900043445 UHCSOPAESYCLMR-KGLIPLIRSA-N 275.348 2.355 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc(CO)c1 588406031 LASTXPMCEOSLAM-ALCCZGGFSA-N 285.299 2.242 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1CCOC1 739688731 SDYYFRSDYVNSOR-CQSZACIVSA-N 276.380 2.138 10 20 CECD Cc1cnn(C)c1C(=O)NCc1ccc(N2CCCC2)cc1 839525293 QQGUDVSMZUQVFI-UHFFFAOYSA-N 298.390 2.259 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccnc(C3CC3)n2)cc1 732631453 ZENGHTTXPVXHGI-UHFFFAOYSA-N 296.374 2.350 10 20 CECD Cc1noc(C2CN(Cc3c(O)cccc3Cl)C2)n1 839130802 HFMRGIRCBFVEGL-UHFFFAOYSA-N 279.727 2.336 10 20 CECD CCNC(=S)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840871508 ZQSVTTUBNUVPDZ-LBPRGKRZSA-N 279.453 2.476 10 20 CECD CC[C@@H](N)CNCc1cc(C)cc(Br)c1O 841072547 PLHBNAUNKWKPHF-SNVBAGLBSA-N 287.201 2.290 10 20 CECD C/C(=C/C(=O)N(CC(=O)O)Cc1ccccc1O)C1CC1 911486092 MIOTZNFSEFZKOD-FLIBITNWSA-N 289.331 2.162 10 20 CECD CCCCN(Cc1ccccc1O)C[C@@H]1CCC(=O)N1 844323414 ODPQLMWMSBDCSP-AWEZNQCLSA-N 276.380 2.273 10 20 CECD COc1cccc([C@@H](C)N[C@H]2C[C@H](OC)C2)c1O 858584495 RTANYTXBKZCTHP-GMTAPVOTSA-N 251.326 2.229 10 20 CECD CN(C(=O)/C=C\c1ccc(Cl)nc1)c1cn[nH]c1 759243434 TYTSWBXZTFLARP-HYXAFXHYSA-N 262.700 2.134 10 20 CECD CC(C)NC(=O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756359802 DLFCRROGXKYDKR-KOLCDFICSA-N 280.343 2.194 10 20 CECD Cc1ccncc1/C=C\C(=O)NCc1ccc(O)c(O)c1 752599645 IWSCBVSVKUZDAZ-HYXAFXHYSA-N 284.315 2.131 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H](C)CN(C)C(C)C)c1 858469323 UOKGNCLNJHUAMH-CYBMUJFWSA-N 293.411 2.229 10 20 CECD CC[C@@H](NCCN(C)C(=O)OC)c1ccc(N(C)C)cc1 850549380 CHBSZAIXCCLNEU-OAHLLOKOSA-N 293.411 2.492 10 20 CECD Nc1ccc(CCNC(=O)N(C2CC2)C2CC2)cc1 861640102 ILVWIWQHALDLET-UHFFFAOYSA-N 259.353 2.148 10 20 CECD Cc1nnc(CN(C)Cc2cc(F)c(N(C)C)cc2F)o1 862412606 USDFRJSCOZYADV-UHFFFAOYSA-N 296.321 2.354 10 20 CECD C[C@H]1C[C@H](NC(=O)N[C@H](C)c2ccccc2O)CCO1 868469659 MNFZHDJGIZPVOA-QJPTWQEYSA-N 278.352 2.320 10 20 CECD CC1(C)CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768449688 YJUXMVKRUDOCTI-AWEZNQCLSA-N 277.364 2.440 10 20 CECD Cc1ccc(CN2CC[C@@H](n3cccn3)C2)c(O)c1 877544416 PJBZGTJFOXUHTF-CQSZACIVSA-N 257.337 2.344 10 20 CECD CC(C)c1cc(C(=O)N(C)c2ccc(N)cc2)nn1C 877077528 LSVJWJYKIMRXAI-UHFFFAOYSA-N 272.352 2.402 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H](OC(=O)N(C)C)C1 877560403 PXIKPIOMBQDOMV-ZDUSSCGKSA-N 292.379 2.363 10 20 CECD COc1ccc(O)c(CN2CCN(C(C)(C)C)CC2)c1 133402604 NZGTVWFKCGCWTA-UHFFFAOYSA-N 278.396 2.317 10 20 CECD CCOC(=O)C1(CNCc2ccc(OC)c(C)c2)CC1 770665219 GPNVYXHDSFHJDD-UHFFFAOYSA-N 277.364 2.437 10 20 CECD COC(=O)[C@H]1CC12CCN(Cc1c(C)cccc1O)CC2 876739247 BTGBLZWRGKMILO-CQSZACIVSA-N 289.375 2.476 10 20 CECD Cc1ccc(C(=O)N(C)Cc2cccc(O)c2)c(O)c1O 780970535 WDUIXLGTPPWKLZ-UHFFFAOYSA-N 287.315 2.384 10 20 CECD CCc1cccc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)c1O 895780641 RCHNPPXOFOEADC-CFVMTHIKSA-N 261.365 2.157 10 20 CECD COc1ccc(CN2CC[C@H](OC)C[C@H]2C)c(O)c1OC 894254765 UWGSYEBTOWEWKG-YPMHNXCESA-N 295.379 2.409 10 20 CECD CC[C@@](C)(OC)C(=O)NCc1ccc(N(C)C)cc1C 795102992 AEXMYERFFYOURE-MRXNPFEDSA-N 278.396 2.492 10 20 CECD CC[C@H](N[C@@H]1CCCN(CC)C1=O)c1ccccc1O 722362085 XCWNRRRNTFHBIH-UONOGXRCSA-N 276.380 2.444 10 20 CECD Nc1ccc(CN2CCC(O[C@H]3CCOC3)CC2)cc1 1336118266 VQFUKCKIVHIFBP-INIZCTEOSA-N 276.380 2.039 10 20 CECD Nc1ccc(CNC(=O)NCCOC2CCCCC2)cc1 1356586914 ZOUYLRXFNXWODS-UHFFFAOYSA-N 291.395 2.417 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@H](C(=O)O)C2)cc1F 1606056053 VUBPRUSMKVLJMI-NEPJUHHUSA-N 280.343 2.235 10 20 CECD C[C@@H]1CC[C@](NCc2ccc(N(C)C)cc2)(C(=O)O)C1 1776628245 IXAUCYVBUAVJHA-MLGOLLRUSA-N 276.380 2.486 10 20 CECD Cn1cnnc1NCc1ccc(N2CCCCC2)cc1 162089664 BCZYZHVAUITUAY-UHFFFAOYSA-N 271.368 2.418 10 20 CECD CC[C@H](NC[C@H](C)N1CCN(C)CC1)c1ccccc1O 155688106 LEBVTBTZWHBWSI-HOCLYGCPSA-N 291.439 2.069 10 20 CECD Cc1cc(CN(C)Cc2ccc(N(C)C)cc2)n[nH]1 1116323021 ZREFKABUPQIFOO-UHFFFAOYSA-N 258.369 2.416 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2ccc(C)cc2O)C1 876779668 BHXWTMAAIABPJU-AWEZNQCLSA-N 262.397 2.474 10 20 CECD CCc1cnc(CNC(=O)Cc2ccc(N)cc2)s1 178835065 RAQJWKSPSMBPSG-UHFFFAOYSA-N 275.377 2.147 10 20 CECD CCC(CC)(CO)NCc1cc(F)cc(F)c1O 708440970 GGKNTBIBVYHPTP-UHFFFAOYSA-N 259.296 2.311 10 20 CECD OCC1(NCc2cc(Cl)ccc2O)CCCC1 53044658 BIHSWGOMSPTYCQ-UHFFFAOYSA-N 255.745 2.440 10 20 CECD COC(C)(C)C[C@H](C)NCc1cc2c(cc1O)OCO2 174553261 NGGANHQTTBEXQZ-JTQLQIEISA-N 281.352 2.414 10 20 CECD CCCCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183474693 UZLBBSZUFDUSBU-SNVBAGLBSA-N 251.326 2.335 10 20 CECD C[C@H](NC[C@@H](O)COCC1CC1)c1ccc(N(C)C)cc1 129855554 DFLFUXDFKJEHOH-SUMWQHHRSA-N 292.423 2.191 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)ncn1 125739063 RWTSIGJVYMGSNY-UHFFFAOYSA-N 284.363 2.123 10 20 CECD CO[C@]1(C)C[C@H](NC(=O)c2cccc(O)c2O)C1(C)C 185778385 RPWXRIDWDSBCER-XHDPSFHLSA-N 279.336 2.031 10 20 CECD C[C@H](N[C@H](C)CO[C@@H]1CCOC1)c1cc(F)ccc1O 185674132 YSKWLTZHDGPNJF-NTZNESFSSA-N 283.343 2.376 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](O)COCC(C)C)c(O)c1 185117387 ADBVXONTKMSKIY-ZIAGYGMSSA-N 281.396 2.385 10 20 CECD CS[C@@H](C)CNC(=O)N(C)Cc1ccccc1O 133809072 YJWBNYHMZVUHAF-JTQLQIEISA-N 268.382 2.285 10 20 CECD Cc1cc(O)c(CN[C@@H](C)c2nnnn2C2CC2)cc1C 191833256 NUSCYUMVPLMBAL-NSHDSACASA-N 287.367 2.181 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cc(C)ccc2O)C1 93813956 KKXKDNCQMZOAIE-HNNXBMFYSA-N 263.337 2.086 10 20 CECD CCN(CC)CCSc1ncc(C(=O)OC)s1 295165385 HPBUKSNWOULHDL-UHFFFAOYSA-N 274.411 2.364 10 20 CECD CCC[C@@](C)(O)C(=O)N(C)Cc1ccc(N(C)C)cc1 269312719 OUCVXTOAEYGTCT-MRXNPFEDSA-N 278.396 2.262 10 20 CECD CC(C)c1cc(C(=O)NCc2ccccc2O)no1 271020453 HUWUUMAKBKIZPL-UHFFFAOYSA-N 260.293 2.434 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cncn1C 277662922 LVEGFNFOVBBKHJ-UHFFFAOYSA-N 286.379 2.148 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCO[C@@]3(CCOC3)C2)cc1C 374268302 FRTYETOKRYBSBP-WBVHZDCISA-N 291.391 2.437 10 20 CECD CC[C@@](C)(OC)C(=O)NCc1ccc(N(C)C)cc1 280853993 BTWRVBRKNRGLHF-OAHLLOKOSA-N 264.369 2.184 10 20 CECD N[C@H]1CC=C(C(=O)N2CCN(C3CC3)c3ccccc32)C1 638284738 CNIZYRJIJBBXMX-ZDUSSCGKSA-N 283.375 2.050 10 20 CECD CC(=O)C(=O)CSc1nnc(Cc2cccc(F)c2)o1 808021259 GGZBEMQZQJHJEX-UHFFFAOYSA-N 294.307 2.050 10 20 CECD NCCN(Cc1ccccc1O)c1ccc([N+](=O)[O-])cc1 809734772 KZUGUIFNLWFVCZ-UHFFFAOYSA-N 287.319 2.266 10 20 CECD CC[C@H](CO)C(=O)NCc1cc(Cl)cc(Cl)c1O 813683986 BPCPXZQMTCSHBT-SSDOTTSWSA-N 292.162 2.334 10 20 CECD COCc1cc(NCc2cc(C)ccc2O)ncn1 813354163 LUTOMHMMKACAPF-UHFFFAOYSA-N 259.309 2.249 10 20 CECD COc1ccc(C[C@H](C)NCCc2ccc(N)cc2)cn1 817957687 OCTOOGMEMFMDPK-ZDUSSCGKSA-N 285.391 2.436 10 20 CECD CNC(=O)[C@H]1CCCCN1Cc1cc(Cl)c(C)cc1O 824560981 NSQFUWVIFRKDLZ-CYBMUJFWSA-N 296.798 2.455 10 20 CECD CN(C)c1ccc(CN2CC[C@H](CCCO)C2)cc1 825338304 ODDWVNXQZGJRJS-AWEZNQCLSA-N 262.397 2.347 10 20 CECD C[C@H](O)CCN(C)Cc1ccc(Br)cc1O 824828753 FABSMGRGBWALNH-VIFPVBQESA-N 288.185 2.357 10 20 CECD CCc1n[nH]cc1C(=O)N[C@H](C)c1ccccc1O 827923203 LNNBLAOQEGJMGX-SECBINFHSA-N 259.309 2.169 10 20 CECD CCCN(CCC)C(=O)COC(=O)c1cc(O)cs1 732355215 HMKWYHDOJVAOAO-UHFFFAOYSA-N 285.365 2.259 10 20 CECD COc1ncc(/C=C/C(=O)N2CCc3cccc(C)c32)cn1 492733959 ICTILFWFPRRBBZ-VOTSOKGWSA-N 295.342 2.396 10 20 CECD COCC1(CNC(=O)NCc2ccccc2O)CCCC1 836660136 RZLOIJRBQQMAIY-UHFFFAOYSA-N 292.379 2.398 10 20 CECD CC[C@@H]1OCC[C@H]1NCc1cc(F)cc(C(C)=O)c1O 839197970 FAPDAPMIQOKRIM-KGLIPLIRSA-N 281.327 2.391 10 20 CECD COc1cccc([C@@H](C)NCC[C@@H](O)C2CC2)c1O 903410189 DPFKPQNIAVOLFT-ZWNOBZJWSA-N 265.353 2.212 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)CCC2CCC2)cc1 832267387 RKVAYJHNWRLGDV-INIZCTEOSA-N 289.423 2.449 10 20 CECD COCCCCC(=O)NCc1ccc(N(C)C)cc1C 734406174 PQFUGCLZDZKOEJ-UHFFFAOYSA-N 278.396 2.494 10 20 CECD Cc1ncsc1/C=C\C(=O)NCc1ccc(O)c(O)c1 588522298 LKGZSECHZFHWPD-PLNGDYQASA-N 290.344 2.192 10 20 CECD CCc1cccc(CN[C@H]2CCN(CC(F)F)C2)c1O 848918365 XEWPDWFHZNBRJE-ZDUSSCGKSA-N 284.350 2.384 10 20 CECD COc1cc(Cl)cc(CN2[C@@H](C)CNC[C@H]2C)c1O 843066304 UOQDNJPBWOWZRZ-AOOOYVTPSA-N 284.787 2.236 10 20 CECD COC(=O)[C@@H]1CN(Cc2cccc(C)c2O)C[C@H]1C1CC1 846122395 IMYMCTYXNPAWDE-LSDHHAIUSA-N 289.375 2.332 10 20 CECD CC[C@@H](O)[C@@H](C)C(=O)NCc1cc(Cl)ccc1O 911898958 SXRKWLLUPOJNEZ-LDYMZIIASA-N 271.744 2.069 10 20 CECD CCCC[C@H](CN)NCc1ccc(OCC)cc1O 841028373 CJRQXIAWJKNRRW-CYBMUJFWSA-N 266.385 2.398 10 20 CECD Cc1cc(N(C)C)ccc1CN1[C@H]2CC[C@H]1COC2 840953483 SEQZZHWPPIFENO-HOTGVXAUSA-N 260.381 2.424 10 20 CECD COCCCCN(C)CCN(C)c1ccc(OC)cc1 844402479 ZACQYZSEPRTTMY-UHFFFAOYSA-N 280.412 2.490 10 20 CECD Cc1cc(C(=O)OCC[C@H](C)O)c(C)n1-c1ccccn1 849680398 QHEPZSUVCCBIJE-LBPRGKRZSA-N 288.347 2.417 10 20 CECD Cc1ccc([C@@H](C)N[C@H](CO)C2CCOCC2)c(O)c1 757660050 ZFYCLKMMDBKIJW-IUODEOHRSA-N 279.380 2.139 10 20 CECD CN(C)c1ccc(CNC(=O)NCC2(C)CC2)cc1F 752020426 QQBVZZFVZPEVAW-UHFFFAOYSA-N 279.359 2.491 10 20 CECD CN(C)c1ccc(CNC(=O)COC(F)(F)F)cc1F 931147328 XMYNJWIOGUUJDQ-UHFFFAOYSA-N 294.248 2.044 10 20 CECD C[C@H](N[C@@H]1COC[C@@H]1O)c1ccc(N2CCCCC2)cc1 866418961 ZWULAFDTGHWKSX-XKQJLSEDSA-N 290.407 2.087 10 20 CECD CSC1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 872627397 BWLQDHRJLHYELM-AWEZNQCLSA-N 295.404 2.145 10 20 CECD CN(C)c1cc(F)c(CN2Cc3cnn(C)c3C2)cc1F 877632556 FCHUGHMPIQUPEG-UHFFFAOYSA-N 292.333 2.280 10 20 CECD C[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1ccc(N(C)C)cc1 773012355 XJZQBJHTVDQHOQ-RAEVTNRLSA-N 288.391 2.497 10 20 CECD Cc1ccncc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773766966 FJELARPZOGENST-LLVKDONJSA-N 286.331 2.162 10 20 CECD CCN(CC)C(=O)CCCNCc1ccc(C)cc1O 876933810 ZTTIVXYTNWUPKH-UHFFFAOYSA-N 278.396 2.439 10 20 CECD C[C@H](NCCN1CCSCC1)c1c(O)cccc1F 886526477 MVJRXKVHEWXTIW-NSHDSACASA-N 284.400 2.231 10 20 CECD CC(C)C(=O)NCCCN[C@H](C)c1c(O)cccc1F 886557199 WADVICXRAIJRKV-LLVKDONJSA-N 282.359 2.344 10 20 CECD OCCc1ccc(CNCc2cc(F)cc(F)c2O)cc1 898168386 CRHFXTSWLZBUOI-UHFFFAOYSA-N 293.313 2.495 10 20 CECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccoc2)c1 795855388 ZLLMDXQNCGUQMM-SECBINFHSA-N 297.332 2.033 10 20 CECD CCOc1ccc(CNCCCCCO)c(O)c1 790483091 IDQOGGWSOALXKA-UHFFFAOYSA-N 253.342 2.043 10 20 CECD CC(C)(C)CN(CC(=O)O)Cc1cc(F)ccc1O 692152078 VZTSTSDLYKBNFH-UHFFFAOYSA-N 269.316 2.464 10 20 CECD CCN(CC)Cc1ccc(N2CCN(C)CC2)c(F)c1 1319678360 DLJVNUZTUHXAFY-UHFFFAOYSA-N 279.403 2.419 10 20 CECD CN[C@H](C)CCN[C@H](C)c1cc(OC)ccc1O 1326037804 YHQVOBXMMAZZAC-GHMZBOCLSA-N 252.358 2.049 10 20 CECD Cc1cc(CN2CC[C@@](O)(C3CC3)C2)ccc1N(C)C 1330334284 MDGZGWDHGZIZNB-KRWDZBQOSA-N 274.408 2.408 10 20 CECD C[C@H](C(=O)O)C1(NCc2cc(F)cc(F)c2O)CC1 1332017786 SPFCTYXUBGTTLX-SSDOTTSWSA-N 271.263 2.013 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnn(C3CC3)c2)cc1 1351331582 YACFPMSNCUNXBY-UHFFFAOYSA-N 284.363 2.214 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2CC2(Cl)Cl)cc1 1356239366 RAPPDKNQZBDOKQ-VIFPVBQESA-N 259.136 2.079 10 20 CECD COc1ccc(O)c(CNCc2cccc(CO)c2)c1 224794563 PUQQXJATIXCOOF-UHFFFAOYSA-N 273.332 2.183 10 20 CECD Cc1oc(/C=C2/SC(=S)N(C)C2=O)cc1C(=O)O 1600838013 LEBYGWOJXLHPKS-XBXARRHUSA-N 283.330 2.117 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cc(F)c(N(C)C)cc1F 1603498409 BZGGABDGRAQEII-GFCCVEGCSA-N 286.322 2.326 10 20 CECD C[C@@H](NC[C@@H]1CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589978772 PVDNPNMSYNJELE-ZJUUUORDSA-N 287.367 2.269 10 20 CECD C[C@H](NC[C@@]1(C)CCCNC1)c1cc(C(=O)O)ccc1O 1593250128 REBABYHSQKSAFI-ZBEGNZNMSA-N 292.379 2.131 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)c1cnccn1 151064431 NAJQPJWZDYMFGH-AWEZNQCLSA-N 298.390 2.164 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCn3ccnc3C1)CC2 834773550 GUVVNMXSTVWCBF-CHWSQXEVSA-N 269.348 2.181 10 20 CECD COc1ccc(O)c(CN2[C@H]3CCC[C@H]2CC(N)C3)c1 843054413 XUWWTNZUHCAPCK-KBPBESRZSA-N 276.380 2.245 10 20 CECD Cc1cc(C(=O)NCCc2ccc(N)cc2)c(C)o1 40675606 OBAZKVRPDASJPB-UHFFFAOYSA-N 258.321 2.451 10 20 CECD CC1CCN(c2ccc(CNC(=O)CN(C)C)cc2)CC1 108453886 CIKAQTRPDSWATD-UHFFFAOYSA-N 289.423 2.101 10 20 CECD CCONC(=O)NCc1c(O)ccc2c1CCCC2 174602454 VIKPSKYTVIWTEW-UHFFFAOYSA-N 264.325 2.022 10 20 CECD CCOc1ccc(O)c(CNc2cc(CO)ccn2)c1 1350294634 RSBGLSKGBSHHBL-UHFFFAOYSA-N 274.320 2.290 10 20 CECD CCC[C@@](C)(CO)NCc1ccc(N2CCOCC2)cc1 304249211 PMQFQQOVXODJLK-KRWDZBQOSA-N 292.423 2.164 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCCCF)c1 123716870 PCMVTCXXBSOYPX-VIFPVBQESA-N 270.304 2.121 10 20 CECD C[C@@H](NCc1ccc(N2CCCC2)cc1)c1nncn1C 37293661 LGTGOCAAXKVHLM-CYBMUJFWSA-N 285.395 2.266 10 20 CECD Cc1cccc(CN2CCOCC3(CCOCC3)C2)c1O 183269206 NHLCLSLLQFAKPI-UHFFFAOYSA-N 291.391 2.330 10 20 CECD CCOC(=O)CN(C)Cc1c(O)cccc1Cl 128579231 ZITPMDKYTPFLMX-UHFFFAOYSA-N 257.717 2.041 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1cc(C)c(C)cc1O 123835476 BEPJBAGVEVBIFC-LBPRGKRZSA-N 265.353 2.250 10 20 CECD COc1ccc(O)c(CN2CC[C@@H]3[C@@H](CCCN3C)C2)c1 217915208 CGXRPGNODYLISG-XJKSGUPXSA-N 290.407 2.317 10 20 CECD CC(C)[C@@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186423788 BUZKUWDCIKUFEK-WDEREUQCSA-N 265.353 2.437 10 20 CECD COc1cccc(CN[C@](C)(CO)c2ccccc2)c1O 227212489 ZUTIBSACAQJMQU-QGZVFWFLSA-N 287.359 2.398 10 20 CECD CC(C)OCC(=O)NCc1c(O)ccc2c1CCCC2 266558736 OXWLGEXFPLPRPF-UHFFFAOYSA-N 277.364 2.312 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]2C[C@H](C)O)c1O 269865258 XAEDWTJQQPEQQD-IINYFYTJSA-N 295.354 2.469 10 20 CECD C[C@@H](NC[C@H]1CCOC1)c1ccc(F)c(F)c1O 276916214 LRQWYRVTDLAYJQ-RKDXNWHRSA-N 257.280 2.358 10 20 CECD C[C@H](N[C@H](C)CC[S@](C)=O)c1ccc(F)c(F)c1O 276896454 IIGAOVKVBSVUIF-MGOSUKFUSA-N 291.363 2.478 10 20 CECD COc1cc(O)c(CN(C)CC(C)C)cc1OC 271121034 XWVQLYSRUHQQOM-UHFFFAOYSA-N 253.342 2.497 10 20 CECD O=C(c1cccc(O)c1O)N1CCCC2(CCOCC2)C1 278887819 HNPTYJPKVLXLJI-UHFFFAOYSA-N 291.347 2.131 10 20 CECD CCCCN(C)C[C@H](C)NC(=O)NCc1ccccc1O 291168908 GKZNIUUEMQOZPZ-ZDUSSCGKSA-N 293.411 2.312 10 20 CECD CO[C@H](C)[C@@H](C)NC(=O)NCc1ccc(N(C)C)cc1C 811960331 ULJNMKUXQDNQBR-CHWSQXEVSA-N 293.411 2.284 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)CN 818608332 ZZWURORMDOPJAO-CYBMUJFWSA-N 277.412 2.084 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CCCCN2)c1 817949869 OMHAWZBAXBPGHZ-RYUDHWBXSA-N 264.369 2.194 10 20 CECD C[C@H](CC(=O)O)NCCCSc1nccs1 820085900 YICZSKWKJRSEJA-MRVPVSSYSA-N 260.384 2.078 10 20 CECD CN(C)CCC1CCN(C(=O)c2cc(O)cs2)CC1 827549594 PECYFZUQNNPCSE-UHFFFAOYSA-N 282.409 2.258 10 20 CECD O=C(/C=C/c1cccnc1)N1C[C@@H](CO)c2ccccc21 492939955 GXJZXAVJZAMNPS-NPQIQWPPSA-N 280.327 2.218 10 20 CECD CCC[C@H](O)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 822832392 LMKVAPDZZRXSMD-BBRMVZONSA-N 292.423 2.269 10 20 CECD CC[C@H](O)[C@H](C)C(=O)NCc1c(O)ccc2c1CCCC2 901131589 MFLRTKMLXKJOOP-NHYWBVRUSA-N 291.391 2.294 10 20 CECD OC[C@@H](CN[C@@H]1CCc2cccc(O)c21)Cc1ccco1 834624026 DWWBYTNRJDTDNB-IUODEOHRSA-N 287.359 2.413 10 20 CECD Nc1ccc(CC(=O)Nc2ncc(C3CC3)[nH]2)cc1 832191926 PCHUIKVJRDUVJJ-UHFFFAOYSA-N 256.309 2.051 10 20 CECD COC(=O)[C@@H]1CC[C@H](N[C@@H](C)c2cccc(OC)c2O)C1 903131352 RHDQHQGTOZDXTM-TUAOUCFPSA-N 293.363 2.393 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(CC)C1)c1ccc(F)cc1O 834888605 BHFMROHXCXVTSH-AAEUAGOBSA-N 280.343 2.193 10 20 CECD CC[C@H](C)CONC(=O)NCCc1ccc(N)cc1 841906289 FADPQHSHUUAGCV-NSHDSACASA-N 265.357 2.088 10 20 CECD C[C@@H]1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CO1 845282547 PKYWWLUKVOCUAE-LDYMZIIASA-N 284.743 2.022 10 20 CECD COCC1(CC(=O)N[C@H](C)c2cc(OC)ccc2O)CC1 843832258 VLZMRLLQEVZLJS-LLVKDONJSA-N 293.363 2.395 10 20 CECD CC[C@H]1CO[C@@H](C)CN1Cc1cc2c(cc1O)OCO2 131514258 SKQACKSKQZDFOL-JQWIXIFHSA-N 279.336 2.120 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H]2CCCNC2=O)c(O)c1 840824924 AWJXHLAPYPEYKF-OLZOCXBDSA-N 276.380 2.186 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H](C)[C@H]2CN)c1 843051752 LJUHNVOYJRBRIY-IUODEOHRSA-N 278.396 2.350 10 20 CECD CC[C@H](NC(=O)Nc1ccc(N)cc1)[C@@H]1CCCO1 841297811 IITXZLLJNFUKHA-STQMWFEESA-N 263.341 2.348 10 20 CECD COc1ccc(N(C)CC2CCN(C)CC2)cc1OC 846750181 OAGFIQPGIPRWST-UHFFFAOYSA-N 278.396 2.482 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1cc(Cl)cc(F)c1O 843122212 PBGMMSSQNSBGSU-QWRGUYRKSA-N 290.741 2.317 10 20 CECD CN(C)c1ccc(CN[C@H](CCN)C(F)(F)F)cc1F 841090986 TUBQDWWQIFDLNT-GFCCVEGCSA-N 293.308 2.261 10 20 CECD COC1CC(C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 858200008 WPECENJPTQHWKF-UHFFFAOYSA-N 276.380 2.136 10 20 CECD C[C@@H]1C[C@@H](Nc2cnn(CCO)c2)c2c(O)ccc(F)c21 756855869 ODZJTBUMTCXXSO-BXKDBHETSA-N 291.326 2.381 10 20 CECD CN(C)c1cc(F)c(CNCC(F)F)cc1F 858163721 KSGLFHTWPCIKSN-UHFFFAOYSA-N 250.239 2.386 10 20 CECD CC(C)N(C)C[C@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 851951562 YUDZSYZVWRDYOU-RHSMWYFYSA-N 293.455 2.104 10 20 CECD Cc1cc(CN2CC[C@@]3(CCCN3)C2)ccc1N(C)C 923380526 OQMZWKHWHIRGHB-KRWDZBQOSA-N 273.424 2.389 10 20 CECD CC[C@@H](C)CS(=O)(=O)N[C@H](C)c1ccccc1O 867834915 UXGQQOAHEBWULU-GHMZBOCLSA-N 271.382 2.419 10 20 CECD CN(C)c1ccc(CNC(=O)C2(F)CCOCC2)cc1F 865051693 SFEKBUPUQWAUOF-UHFFFAOYSA-N 298.333 2.027 10 20 CECD C[C@@H]1N(C(=O)c2cc(O)cs2)CCOC1(C)C 764337745 MFGPQHIIYISZAL-QMMMGPOBSA-N 255.339 2.093 10 20 CECD Oc1ccccc1CN1CCC[C@H](n2ccnc2)C1 779008774 XWBXOUTXUZQJNF-AWEZNQCLSA-N 257.337 2.426 10 20 CECD C[C@H](C[C@H]1CCOC1)NC(=O)/C=C/c1ccc(O)c(O)c1 779527994 FGGKZOKDLNFGLR-VWRYTFAISA-N 291.347 2.042 10 20 CECD CC[C@H](NCCN1CCNC1=O)c1cccc(Cl)c1O 886745159 PFPFESCROPYUCV-LBPRGKRZSA-N 297.786 2.112 10 20 CECD CC(C)N(CCNC(=O)NCc1ccc(N)cc1)C(C)C 1120660576 UZKNFNVTQMOCAD-UHFFFAOYSA-N 292.427 2.187 10 20 CECD COc1cccc(CNS(=O)(=O)CC2(C)CCC2)c1O 881916917 CDVBTZVACRHYMJ-UHFFFAOYSA-N 299.392 2.010 10 20 CECD C[C@@H](NCCN1CC=CCC1)c1c(O)cccc1F 886605799 YTMXDKHFGDCRFR-GFCCVEGCSA-N 264.344 2.444 10 20 CECD Oc1cccc(Cl)c1CN1CCc2ncncc2C1 895722363 IBABQGYEQYNWKG-UHFFFAOYSA-N 275.739 2.394 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@H]([C@@H]2CCCO2)C1 894089066 PRJFQPODGNGMCL-KBPBESRZSA-N 299.317 2.050 10 20 CECD Oc1cccc(Cl)c1CNCC1(O)CCCC1 83552527 ZYZCDXCENYFQQC-UHFFFAOYSA-N 255.745 2.440 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2ccc(N(C)C)cc2C)C1 896957900 FONIBSLSPUBEEQ-HNNXBMFYSA-N 290.407 2.446 10 20 CECD CC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCC1 784014338 BFERXDBLFIYWFT-UHFFFAOYSA-N 264.277 2.014 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H]2CCO)c1O 894499184 GDTHSWXDKZQKSE-CYBMUJFWSA-N 265.353 2.056 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)C[C@@H](C)[S@]1=O 894552543 UWSATXCKUVOODI-MCCHPSBSSA-N 289.347 2.012 10 20 CECD CCOc1cccc(CNC[C@H]2CC[C@H](O)C2)c1O 188839381 GPRKPBYVFVULEV-AAEUAGOBSA-N 265.353 2.042 10 20 CECD C[C@@H](N[C@H](CO)CC1CC1)c1ccc(F)cc1O 756769381 LAZFFTRQHJMEDM-SKDRFNHKSA-N 253.317 2.343 10 20 CECD CCN1CCN(C(=O)/C=C/c2cnn(C)c2)c2ccccc21 1318399489 ZMQVLYLQHSZRAL-CMDGGOBGSA-N 296.374 2.306 10 20 CECD Cc1ncc(C(=O)NCc2ccc(O)c(O)c2)c(C2CC2)n1 1321641594 FEYJNQSCHFZLNS-UHFFFAOYSA-N 299.330 2.004 10 20 CECD CCc1ncc(NC(=O)NCc2cc(C)ccc2O)cn1 1329401913 CCFWMUIQQCRBDS-UHFFFAOYSA-N 286.335 2.375 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCCCN2)c1 1326319140 VPUVAEYYDKTPCH-BXUZGUMPSA-N 292.379 2.110 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@H](c1cc(C(=O)O)ccc1O)N2 1607830147 ULDMRUKVXDTJNC-CQSZACIVSA-N 298.298 2.253 10 20 CECD Cc1ccc(CNC(C)(C)CCC(=O)O)c(O)c1 1600418457 ABDLDGYZTQXMSP-UHFFFAOYSA-N 251.326 2.434 10 20 CECD O=C(O)c1cccc2c1CCN2C(=O)/C=C/c1cccnc1 1602456991 BYRXUCCBIVWEDG-VOTSOKGWSA-N 294.310 2.382 10 20 CECD CC[C@@](C)(NCc1ccc(N(C)C)c(C)c1)C(=O)O 1604912801 LFZNACOWTDRALL-OAHLLOKOSA-N 264.369 2.404 10 20 CECD COc1cc(C)c(CN(C)C2C[C@@H]3CC[C@H](C2)N3)c(O)c1 1579145172 WATYSTXDZZZENK-PBWFPOADSA-N 290.407 2.424 10 20 CECD CC[C@@H](NCC(C)C)c1cccc(-c2nn[nH]n2)c1O 1590463904 MNDNRRGPFYJDRI-GFCCVEGCSA-N 275.356 2.269 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C(C)(C)C(=O)O 1598505766 UECNRXSNBINZHO-UHFFFAOYSA-N 275.707 2.480 10 20 CECD Nc1ccc(NC(=O)[C@@H]2Cc3ccccc3O2)cc1 19277310 JHACSRSULHCZKP-AWEZNQCLSA-N 254.289 2.211 10 20 CECD Nc1ccc(NC(=O)N[C@@H](CO)C2CCCCC2)cc1 841300798 UJOWWNZWPJGHCC-AWEZNQCLSA-N 277.368 2.332 10 20 CECD CC(=O)N1CCC(N[C@@H](C)c2ccccc2O)CC1 37138455 NOIQPXYOKXAHRW-NSHDSACASA-N 262.353 2.054 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)c1ccccc1F 38109195 HJVGERRPHVCQOH-UHFFFAOYSA-N 295.335 2.352 10 20 CECD COc1ccc(O)c(CN2CCCOC(C)(C)C2)c1 378440359 AZMMPZYNJORBME-UHFFFAOYSA-N 265.353 2.402 10 20 CECD CCc1cccc(CN(C)CC(C)(C)S(C)(=O)=O)c1O 713911936 QXFNVNLMEVQKQL-UHFFFAOYSA-N 299.436 2.210 10 20 CECD O=C(O)[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NCc1ccc2c(c1)CCO2 115603576 DMFSQNUGQYVSEJ-SDADXPQNSA-N 287.359 2.210 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2C)on1 115279674 MVTPUMUBWHDIGU-UHFFFAOYSA-N 273.336 2.287 10 20 CECD C[C@H](CC(=O)c1ccco1)NC(=O)c1cccc(O)c1O 185840576 NEIAHEWCDBUMEU-SECBINFHSA-N 289.287 2.082 10 20 CECD CC(=O)CCCC(=O)NCc1ccc(N(C)C)c(F)c1 184301249 MNTQCAREFQNDTR-UHFFFAOYSA-N 280.343 2.267 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](CCO)CSC)c1 185530312 BIRAITGTEBUKGF-QWRGUYRKSA-N 285.409 2.165 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)c1nncn1C 37017391 QXMGXZSKWQNYIU-QMMMGPOBSA-N 266.732 2.025 10 20 CECD COCC[C@@](C)(O)CN[C@@H](C)c1ccc(F)c(F)c1O 187723500 VDMHTLGKUKIXQY-LKFCYVNXSA-N 289.322 2.109 10 20 CECD Nc1ccncc1C(=O)NCc1ccc(N2CCCC2)cc1 188093663 DCNXKAHJRJMMCH-UHFFFAOYSA-N 296.374 2.194 10 20 CECD CCN(C(=O)c1ccoc1CC(N)=O)c1cccc(C)c1 505603917 BGHUWTAVMMPNFB-UHFFFAOYSA-N 286.331 2.283 10 20 CECD CCN1CCN(Cc2cc(F)ccc2O)C[C@@H]1C 226564830 NDDWUYBHINNCDS-NSHDSACASA-N 252.333 2.057 10 20 CECD COC[C@@H](C)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273412858 QEOACELHXIYXJF-WDEREUQCSA-N 281.352 2.112 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 273445319 DYDTXPZDFPWZFA-AAEUAGOBSA-N 299.436 2.483 10 20 CECD C[C@H](NC[C@@H](O)C(F)(F)F)c1ccc(F)c(F)c1O 276947822 QJPSZPUQWBWUON-YLWLKBPMSA-N 285.212 2.244 10 20 CECD CC[C@H](NCC[C@H](O)COC)c1cccc(Cl)c1O 287728625 PATZKGNLEADJAE-GWCFXTLKSA-N 287.787 2.484 10 20 CECD CC[C@@H](NCc1nncn1C)c1cccc(Cl)c1O 287565612 GKSLDRPICUCFNI-LLVKDONJSA-N 280.759 2.415 10 20 CECD CN(C)CC1(NCc2ccc(N(C)C)c(F)c2)CCC1 282334468 UPIDHRMLZPCPTB-UHFFFAOYSA-N 279.403 2.466 10 20 CECD Cc1cc(CN[C@@](C)(C(N)=O)C(C)C)ccc1N(C)C 297829225 ZOHLAZKKXRQNNQ-MRXNPFEDSA-N 277.412 2.051 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]3CN(C)CC[C@H]32)c1 290611153 WPKIGHQENSOUCS-CZUORRHYSA-N 290.407 2.317 10 20 CECD COCCCCOC(=O)/C=C\c1ccc(O)c(O)c1 803400484 AZPQUWZPTJPJHJ-ALCCZGGFSA-N 266.293 2.081 10 20 CECD CCN(CC(=O)N(C)C)Cc1cc(Cl)c(F)cc1O 816485788 ADPZKCRTWBSRRI-UHFFFAOYSA-N 288.750 2.095 10 20 CECD Cc1cc(C(=O)NC2(CCO)CC2)c(C)n1-c1ccccn1 817137388 OJHKFCNRSDJMLH-UHFFFAOYSA-N 299.374 2.134 10 20 CECD COc1cccc(CNC[C@H](CC(C)C)C(=O)O)c1O 818630671 YORFRMBAUPBRGC-LBPRGKRZSA-N 281.352 2.237 10 20 CECD CN(Cc1cc(Cl)c(F)cc1O)C1CC(O)C1 816569759 VYXIFNBAIWQAEB-UHFFFAOYSA-N 259.708 2.140 10 20 CECD CC(=O)C(=O)COc1ccc(C(F)(F)F)cc1F 829531766 RQCCWONZBOGLHR-UHFFFAOYSA-N 264.174 2.381 10 20 CECD CCCONC(=O)NCc1ccc(N2CCCC2)cc1 828241469 SWRJCTGXWPBFIJ-UHFFFAOYSA-N 277.368 2.428 10 20 CECD CC/C=C\CNC(=O)NCc1cc(OC)ccc1O 838474684 ORJPEUQGFVGMFD-PLNGDYQASA-N 264.325 2.166 10 20 CECD C[C@@]1(NC(=O)c2cc(O)cs2)CCO[C@@H]1C1CC1 832127748 ZHOAXOWUUXNCDY-DGCLKSJQSA-N 267.350 2.141 10 20 CECD CN(C)Cc1ccccc1CNC(=O)c1cc(O)cs1 732257766 ASXVOMVIXUOKFA-UHFFFAOYSA-N 290.388 2.445 10 20 CECD COCC1(Cc2nc(Cc3ccc(N)cc3)no2)CC1 843161137 QCAYGCWIQUIJKS-UHFFFAOYSA-N 273.336 2.212 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H]3CC[C@@H](C2)N3)c1O 843352903 ZDHMVLPISRHTFY-KGLIPLIRSA-N 292.354 2.060 10 20 CECD CCc1cccc(CN2CCN(C)[C@@H](C)[C@H]2C)c1O 848904440 UBYXPMVYOVFWEM-QWHCGFSZSA-N 262.397 2.479 10 20 CECD CC[C@H]1CO[C@@H](C)CN1Cc1cccc(OC)c1O 131505026 CNMVDKRPJPKOBB-AAEUAGOBSA-N 265.353 2.400 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@@H](C)CCO 840894097 PBLFFNIXLSUARV-UONOGXRCSA-N 264.413 2.353 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)C(F)(F)F 840930632 NGGLNOKXZLHILX-GFCCVEGCSA-N 276.302 2.074 10 20 CECD COCCN(C)CCN[C@H](C)c1ccc(Cl)cc1O 841747110 NUFRCGSVDGPDON-LLVKDONJSA-N 286.803 2.274 10 20 CECD COc1cccc([C@H](C)NCC2(N(C)C)CC2)c1O 846171240 FHSHTYRQJXNQTD-NSHDSACASA-N 264.369 2.146 10 20 CECD N[C@@H]1CCC[C@@H](NCc2cc(Cl)ccc2O)C1 841055260 MQRKPOJNAATIOP-VXGBXAGGSA-N 254.761 2.405 10 20 CECD CCc1cccc(CN2CCN(C)[C@@H](C)[C@@H]2C)c1O 848904441 UBYXPMVYOVFWEM-STQMWFEESA-N 262.397 2.479 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCN(c3ccccn3)C2)cc1 841298182 NCYYGPXUNYNDCZ-CQSZACIVSA-N 297.362 2.064 10 20 CECD CCc1cc(C(=O)N(C)Cc2ccccc2O)c(C)nn1 759930780 GPACFXAGOHAZRZ-UHFFFAOYSA-N 285.347 2.325 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)C(=O)OC1CCCC1 752816601 JZHJGQBWQRHTFA-QMMMGPOBSA-N 283.349 2.058 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C\c2cnccc2C)c1 752598507 BHKPBBSGOWMGPR-UTCJRWHESA-N 298.342 2.434 10 20 CECD CN1Cc2ccccc2[C@H]1CNC(=O)Cc1ccc(N)cc1 867999241 WUXJDYXOLLNJEF-QGZVFWFLSA-N 295.386 2.114 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@]2(C)CCCOC2)c1 862757352 QFAAMUMEFICBJN-OAHLLOKOSA-N 263.337 2.134 10 20 CECD CC1=C(C(=O)NCCc2ccc(O)c(O)c2)CCC1 767785288 MNQDWYVAKYFRGV-UHFFFAOYSA-N 261.321 2.257 10 20 CECD Oc1ccccc1CN1CCC(O[C@@H]2CCOC2)CC1 779023971 AEVVDJBYAYXUOV-OAHLLOKOSA-N 277.364 2.162 10 20 CECD CNCCN(C)Cc1cc(Cl)cc(Cl)c1O 69801034 YKLFFEOVMDPNPQ-UHFFFAOYSA-N 263.168 2.350 10 20 CECD CC[C@@H](NCCOCCO)c1cc(Cl)ccc1O 775485534 WAPKQNXGPCIBDW-GFCCVEGCSA-N 273.760 2.095 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCS1 773743801 LHZGOXHMCDRZGW-NOZJJQNGSA-N 281.377 2.041 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCC(F)F)c1 1122382500 SIXPNUDQTAMCSQ-UHFFFAOYSA-N 258.268 2.155 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)CO1 784441301 DSBLHVWCISLOGP-DGCLKSJQSA-N 289.375 2.312 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2C(=O)NCC2(C)C)cc1 895315526 AQSHMNKZGKVDTI-OAHLLOKOSA-N 289.423 2.147 10 20 CECD COC[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CCO1 1204328627 KYVDSBWZTNJCMS-KRWDZBQOSA-N 290.407 2.134 10 20 CECD COC(=O)[C@@H](CC(C)C)NCc1cc(F)ccc1O 186412701 BMIJAMJPPRRHIC-GFCCVEGCSA-N 269.316 2.209 10 20 CECD CN(C)c1ccc(CNS(=O)(=O)c2ccsc2)cc1 795775449 KXIWVNIKSAOGAA-UHFFFAOYSA-N 296.417 2.293 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@]1(C)C(=O)O 710265519 GVTXLLLYOFJQLJ-MLGOLLRUSA-N 276.380 2.295 10 20 CECD COCCC1(NCc2cc(OC)c(OC)cc2O)CCC1 793329627 PWWQPWCCZJYZED-UHFFFAOYSA-N 295.379 2.458 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1Cc1c(O)cccc1OC 768172227 NSHGCIMMFVURDH-NWDGAFQWSA-N 265.353 2.400 10 20 CECD COc1cccc(O)c1CN1CCC[C@@](C)(C(=O)O)C1 1610356972 SMBQEIPVGYHQEZ-OAHLLOKOSA-N 279.336 2.088 10 20 CECD CO[C@H](C(=O)Nc1c(Cl)ccc2nonc12)C1CC1 1348522558 NRBQEVNFOVJJGX-NSHDSACASA-N 281.699 2.240 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]1F 1346681148 LMFXRMLSSZDURC-VXGBXAGGSA-N 251.301 2.489 10 20 CECD CCCN(c1ccc(CN)cc1)[C@H](C)[C@@H]1C[C@@H]1C(=O)O 1605320801 PSGIDBDYPPUPJL-UGFHNGPFSA-N 276.380 2.471 10 20 CECD CCCC[C@H](CN)N[C@H](C)c1cc(C(=O)O)ccc1O 1605237916 MIAXSSNDIRJHGI-ZYHUDNBSSA-N 280.368 2.259 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1cc(C(=O)O)no1 1600236469 WJJFIEFTFUPNDF-UHFFFAOYSA-N 289.335 2.037 10 20 CECD C[C@H](Oc1cccc(F)c1)C(=O)NCc1ccc(N)cc1 1576295126 KIGKUHLDOMCDCW-NSHDSACASA-N 288.322 2.492 10 20 CECD CC[C@@H](C(=O)O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1594749985 YSTSGFGQZWGXLF-GXFFZTMASA-N 278.352 2.041 10 20 CECD COc1ccc(CNCc2cccc(C)c2O)cn1 124693398 OIYYOHVKUPOCDC-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1ccc(O)c(CN[C@H](C)[C@@H]2CCCO2)c1 20208959 ASOCTUIMADJRAU-YGRLFVJLSA-N 251.326 2.058 10 20 CECD Nc1ccc(NC(=O)NCCOC2CCSCC2)cc1 904501077 REHCFTKYRRDOHW-UHFFFAOYSA-N 295.408 2.303 10 20 CECD COc1cccc(O)c1CNC[C@@H]1C[C@H](C)O[C@@H]1C 840964408 RYHODUVXCVJQNV-TUAOUCFPSA-N 265.353 2.304 10 20 CECD CC(C)c1ocnc1C(=O)NCCc1ccc(N)cc1 832658692 ALWHEECDDIEZNA-UHFFFAOYSA-N 273.336 2.353 10 20 CECD Cn1cc(CNCc2cc(Cl)ccc2O)cn1 41158868 RHUXCTNRPOENAP-UHFFFAOYSA-N 251.717 2.069 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)C(C)(C)C)c1 273552440 GDFJRVAODNKBNY-IINYFYTJSA-N 267.369 2.458 10 20 CECD O=C(NCc1ccccc1O)C1CCSCC1 264833686 RUNLVAMGJMVIEY-UHFFFAOYSA-N 251.351 2.152 10 20 CECD COc1cccc(CN[C@@H](CO)C2CCCC2)c1O 289514145 IGROEFQNQZZVPN-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD CCCN1CC[C@H](NCc2cccc(OCC)c2O)C1 389286677 WFYDRFBDFSAUJM-AWEZNQCLSA-N 278.396 2.365 10 20 CECD Oc1cc2c(cc1CN[C@H]1CCC(F)(F)C1)OCO2 389425009 OMOMHLWFXNBQPK-VIFPVBQESA-N 271.263 2.398 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc3nccn3c2)cc1 57826538 RLUWWQAYUREDII-UHFFFAOYSA-N 294.358 2.330 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(N)CCCC2)cc1 178711959 VDBRPHZHSRZYTR-UHFFFAOYSA-N 289.423 2.421 10 20 CECD Cc1cccc(CN2CCC[C@@H](CCC(N)=O)C2)c1O 179905088 DRODICFFAYYELT-ZDUSSCGKSA-N 276.380 2.178 10 20 CECD Cc1cc(N(C)Cc2ccc(N3CCOCC3)cc2)ncn1 301272623 VTPNYXMJTUBQFZ-UHFFFAOYSA-N 298.390 2.258 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncnc2nc[nH]c12 301308991 XFJQBSRIPSTBIP-UHFFFAOYSA-N 282.351 2.339 10 20 CECD COC1(C(=O)NCCc2ccc(O)c(O)c2)CCCCC1 184960131 UCQQXDQEQUJTSW-UHFFFAOYSA-N 293.363 2.106 10 20 CECD CN(Cc1cc(F)ccc1O)C[C@H]1CCC[C@@H]1O 180260084 JTLZNDHFFLZZJL-MFKMUULPSA-N 253.317 2.124 10 20 CECD C[C@H](Cn1ccnc1)NCc1cccc(Cl)c1O 124706855 CLNFURASAYBPLR-SNVBAGLBSA-N 265.744 2.420 10 20 CECD COc1ccc(O)c(CN(C)CCc2ccncc2)c1 183757604 DBYQLSHYVFHGQG-UHFFFAOYSA-N 272.348 2.470 10 20 CECD Cc1cc(C(=O)NC[C@@H]2CCCO2)c(C)n1-c1ccccn1 77657834 MBCZFADYRRJWLF-AWEZNQCLSA-N 299.374 2.398 10 20 CECD COc1ccc(O)c([C@@H](C)NS(=O)(=O)c2ccco2)c1 188710865 BOJAUIVKEBRPND-SECBINFHSA-N 297.332 2.033 10 20 CECD COc1cccc(CNC(=O)NCCC(C)C)c1O 73427482 GSZQNKGIBXDSPA-UHFFFAOYSA-N 266.341 2.246 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)CCC(F)(F)F 284197079 HLRONDRIHYIJDS-UHFFFAOYSA-N 297.298 2.106 10 20 CECD Cc1cccc(NCCNCc2ccccc2O)n1 133485217 UHVKSOJGODTDAN-UHFFFAOYSA-N 257.337 2.297 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)CCS1 191668692 AKBBZWBIRGXTII-SNVBAGLBSA-N 281.377 2.448 10 20 CECD CCCCN(CCOC)C(=O)Cc1ccc(N)cc1 236733129 IYIRNIBJZSYIOD-UHFFFAOYSA-N 264.369 2.086 10 20 CECD COc1cc(CN2CCO[C@@H](C)[C@H]2C)c(O)cc1C 245547933 WVGSFMPIPJROTK-NEPJUHHUSA-N 265.353 2.318 10 20 CECD CCCN(Cc1ccccc1O)c1nccn2cnnc12 271326065 KYWUNGDFKDWSEK-UHFFFAOYSA-N 283.335 2.247 10 20 CECD C[C@H](N[C@@H](CO)c1cnn(C)c1)c1cc(Cl)ccc1O 273536960 XOEKHWIGISUDCH-ZANVPECISA-N 295.770 2.163 10 20 CECD Cc1ccc(O)c(CNC[C@H]2COC3(CCCC3)O2)c1 271450586 RTBMTRUNWYIOEI-AWEZNQCLSA-N 277.364 2.476 10 20 CECD CC[C@@H](NC[C@@H](O)c1cnn(C)c1)c1ccc(C)cc1O 280239238 VWYHDBWPDXSFIW-GDBMZVCRSA-N 289.379 2.208 10 20 CECD COC[C@@H](CO)N[C@H](C)c1cc(Cl)c(Cl)cc1O 280843147 AVECLDBKZNXJKE-HTQZYQBOSA-N 294.178 2.357 10 20 CECD COC[C@@H](O)CCN[C@H](C)c1c(C)cc(C)cc1O 294650396 GSYYZPOKPBDWCJ-OLZOCXBDSA-N 267.369 2.057 10 20 CECD CC[C@H](NC[C@](C)(O)COC)c1cccc(Cl)c1O 806140720 ZOSPYCBZKMWRLU-JSGCOSHPSA-N 287.787 2.484 10 20 CECD CCOC1CC(N(C)Cc2cc(OC)ccc2O)C1 290652381 ZCVVHYXVVGZRGC-UHFFFAOYSA-N 265.353 2.400 10 20 CECD CC[C@@H](NC[C@H](O)CN(C)C)c1cccc(Cl)c1O 806137088 GQMGBIISYZJOOW-GXFFZTMASA-N 286.803 2.009 10 20 CECD C[C@H](N[C@@H]1CCNC1)c1cccc(C(F)(F)F)c1O 817945273 YSIHXDKKYWHDAB-DTWKUNHWSA-N 274.286 2.424 10 20 CECD CCN(Cc1cc(Cl)cc(F)c1O)[C@H](C)CO 814169648 LKJVRCKRANDPPO-MRVPVSSYSA-N 261.724 2.387 10 20 CECD CCOCc1cc(CNC2([C@H](C)O)CC2)ccc1OC 827579886 KKXKHOZNSGFDKB-LBPRGKRZSA-N 279.380 2.235 10 20 CECD CCOc1ccc(CNCc2nc(C(C)C)n[nH]2)c(O)c1 824603141 LBMNCPSZJRYBMI-UHFFFAOYSA-N 290.367 2.322 10 20 CECD Nc1ccc(CCNCc2cccc3c2CCNC3)cc1 903917907 ONNHOFDUMFFQHJ-UHFFFAOYSA-N 281.403 2.247 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC[C@@H]1CCCS1 588404937 UBPAOLFKLINJKX-QZPNVGJNSA-N 279.361 2.123 10 20 CECD Cc1ccc([C@H](C)NCCN2C[C@@H]3CC[C@H](C2)O3)c(O)c1 834888022 CIVVIWWLSSGBLZ-SOUVJXGZSA-N 290.407 2.214 10 20 CECD CN(Cc1cccnc1)C(=O)/C=C\c1ccc(O)c(O)c1 588403451 JUPNVGQUCCMOCQ-ALCCZGGFSA-N 284.315 2.165 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)O[C@H]1CCOC1 914118928 AORMMKDRIIZVRO-AWEZNQCLSA-N 278.352 2.076 10 20 CECD COC(=O)c1cccc(C(=O)NCc2ccccc2O)c1 748345436 LHELZTYUEZUSQG-UHFFFAOYSA-N 285.299 2.109 10 20 CECD COc1cccc([C@H](C)NCc2cc(C)[nH]n2)c1O 846143418 FTDZFKGARBBXBE-JTQLQIEISA-N 261.325 2.283 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@@H]2CN)c1O 843352084 DFOTWMHLWGLOAW-GFCCVEGCSA-N 282.771 2.171 10 20 CECD CC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)[C@H](O)C(C)C 840525350 NGEPOQHAPCOULO-YTCBSGDJSA-N 293.363 2.023 10 20 CECD COc1ccc(O)c(CNC[C@H]2NCCc3ccccc32)c1 841068731 IMNLFOFQCUPRLX-QGZVFWFLSA-N 298.386 2.377 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1C[C@H]2CC[C@H]1O2 846475195 DHARANWGMSKRRK-NQBHXWOUSA-N 281.739 2.229 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)[C@H]1CCNC1 843049597 SFWNEFNUFUENHV-KRWDZBQOSA-N 273.424 2.471 10 20 CECD Cc1cc(Br)c(O)c(CN2CCC[C@@H](N)C2)c1 843043857 MCEFREVWBIHRMB-LLVKDONJSA-N 299.212 2.386 10 20 CECD CC(C)N1C[C@@H](N[C@H](C)c2cc(F)cc(F)c2O)CC1=O 756736542 IFGVPYXYCHFSMH-KOLCDFICSA-N 298.333 2.330 10 20 CECD Oc1ccc(Cl)c(F)c1CNCCOCCF 853091867 XFDIZWNIUWMIKR-UHFFFAOYSA-N 265.687 2.260 10 20 CECD Cc1ccc([C@H](C)NCCN2CCO[C@@H](C)C2)c(O)c1 756542560 BIRMEUWWDYKFJB-KBPBESRZSA-N 278.396 2.072 10 20 CECD CN(C)c1cc(F)c(CNC[C@](C)(O)C2CC2)cc1F 858134287 NWNAPIAYOJYPPL-HNNXBMFYSA-N 284.350 2.281 10 20 CECD COc1ccc(CNCC[C@@H](C)N(C)C)cc1C 697874464 YXQPQRGGFXZYFR-CYBMUJFWSA-N 250.386 2.433 10 20 CECD CO[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)C(C)C 769910831 RDRZSBUQHUBGNP-CQSZACIVSA-N 282.359 2.179 10 20 CECD C[C@H]1CC(NC(=O)NCc2ccccc2O)C[C@H](C)O1 767323327 WZPGQBMWJBJHOH-QWRGUYRKSA-N 278.352 2.147 10 20 CECD C[C@@H](NC(=O)CC1C[C@@H]2CC[C@H](C1)N2)c1ccccc1O 870988673 WNAZMSKMAMGMLR-RLAWYHOSSA-N 288.391 2.490 10 20 CECD C[C@H](N[C@@H]1CCCN(CCCO)C1)c1c(O)cccc1F 886615410 FTAVUXBOCIECKW-QWHCGFSZSA-N 296.386 2.029 10 20 CECD COc1ccc(CN(C)Cc2cccn2C)c(O)c1OC 892092335 DDUPUZAYWAPSNK-UHFFFAOYSA-N 290.363 2.380 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)[C@H](C)OC)c1 191655629 DEIUVXCYWVSRCT-DCAQKATOSA-N 253.342 2.475 10 20 CECD COc1ccc2c(c1)CCCN2C(=O)/C=C\c1cnn(C)c1 791036239 RDWTUHWOIIYUBH-YVMONPNESA-N 297.358 2.421 10 20 CECD C[C@H](NC(=O)NC[C@@H]1CCOC1)c1ccc(N(C)C)cc1 1320381951 PUUPSLFQZHCIJH-STQMWFEESA-N 291.395 2.149 10 20 CECD CC(C)CNC(=O)CN[C@@H](C)c1cc(Cl)ccc1O 1323831265 WRHSRSMAUOXODJ-JTQLQIEISA-N 284.787 2.468 10 20 CECD CS[C@H]1CC[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 1344100351 YYZQSDGYQVMOFM-YUMQZZPRSA-N 285.340 2.251 10 20 CECD C[C@@H](NC[C@H]1CCCCO1)c1cc(C(=O)O)ccc1O 1609779134 OUSFDPXJOKJHNR-ZYHUDNBSSA-N 279.336 2.310 10 20 CECD Cc1cccc(CNC2CN(C(=O)OC(C)(C)C)C2)c1O 224892944 RWZURVDPUGHSHK-UHFFFAOYSA-N 292.379 2.410 10 20 CECD COc1ccc(CN[C@@H]2CC[C@H](CC(=O)O)[C@H]2C)c(O)c1 1607259940 GZKJSNYFYBXKJR-JTNHKYCSSA-N 293.363 2.380 10 20 CECD C[C@@H]1CN(C/C=C\c2ccc(N(C)C)cc2)C[C@H]1C(=O)O 1599866930 LDDPAGMUMRHKRZ-WSXGPOFGSA-N 288.391 2.418 10 20 CECD CN(Cc1ccns1)c1ccc(OCC(=O)O)cc1 1598532458 QMSZUEADTKVUPG-UHFFFAOYSA-N 278.333 2.243 10 20 CECD O=C(O)c1ccc(NCc2ccc(F)cc2O)nc1 1777678974 QJNRSOOCKWAWPY-UHFFFAOYSA-N 262.240 2.237 10 20 CECD COc1ccc(N2CCC(NC[C@H](C)CCO)CC2)cc1 151918797 MUNFYKBDKJIFFV-CQSZACIVSA-N 292.423 2.272 10 20 CECD CC[C@H](NC[C@@H](C)N1CCN(C)CC1)c1ccccc1O 155687895 LEBVTBTZWHBWSI-ZBFHGGJFSA-N 291.439 2.069 10 20 CECD COCCO[C@H]1CCCN(Cc2cc(F)ccc2O)C1 802653364 SYAWQAJNSKEEIN-AWEZNQCLSA-N 283.343 2.159 10 20 CECD COc1cccc(O)c1CNCCC(C)(C)OC 865755979 UKHWXAJXWDBQKN-UHFFFAOYSA-N 253.342 2.306 10 20 CECD COc1ccc(O)c(CNC[C@@]2(O)CCC[C@@H]2C)c1 294002320 MHLSOKBPUJHNHG-NHYWBVRUSA-N 265.353 2.042 10 20 CECD CO[C@H](C)CCNCc1ccc(N2CCOCC2)cc1 313341655 MPDCIGMZMPLBQL-CQSZACIVSA-N 278.396 2.038 10 20 CECD COc1ccc(O)c(CNC[C@H](C)CC2(C)OCCO2)c1 716023724 WRBMJMXTMIEFQH-GFCCVEGCSA-N 295.379 2.280 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cc(C)[nH]n2)c1 716493208 KHPLCCNYFNQGHC-SNVBAGLBSA-N 261.325 2.283 10 20 CECD CS[C@H](CO)[C@H](C)NCc1cccc(Cl)c1O 224857329 YIZRZCDUJWIREW-GZMMTYOYSA-N 275.801 2.248 10 20 CECD CC[C@@H](O)CCNC1CCN(c2ccc(OC)cc2)CC1 305175990 VIGUJAJEYBAWFB-MRXNPFEDSA-N 292.423 2.415 10 20 CECD CC(C)N1CC[C@H](N[C@H](C)c2ccc(F)c(F)c2O)C1=O 187784431 VREDKPUJCTVFGL-SKDRFNHKSA-N 298.333 2.330 10 20 CECD O=C(Nc1cccc(N2CCOCC2)c1)c1ccccc1O 131752845 KNCHRXGQEALEMD-UHFFFAOYSA-N 298.342 2.481 10 20 CECD O=C1OCC[C@@]12CCCN2Cc1cccc(Cl)c1O 190039593 DTAKSZSLEMWLJK-AWEZNQCLSA-N 281.739 2.327 10 20 CECD COc1ccc(O)c([C@@H](C)NCCOCC2CC2)c1 182370210 HTWJOHSUJOBWEQ-LLVKDONJSA-N 265.353 2.478 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCSC2)c1 273460487 IBIXVVKUFSEVKB-GXSJLCMTSA-N 281.377 2.335 10 20 CECD CCN(C)C(=O)COc1ccc(N2CCCC2)cc1 273588877 SBJFLAHTMKUXBJ-UHFFFAOYSA-N 262.353 2.144 10 20 CECD COCC[C@H](CO)N[C@H](C)c1ccc(C)c(C)c1O 281726193 UVMRRJBNWIPSIL-CHWSQXEVSA-N 267.369 2.057 10 20 CECD CCC[C@H](OC(=O)c1ccc(C)c(O)c1O)C(=O)OCC 801834835 XAFSXGJBTXVNIT-NSHDSACASA-N 296.319 2.295 10 20 CECD COc1ccc(N(C)C[C@@H](O)c2cccnc2)c(OC)c1 295042527 WWNGNPBJOUYULW-OAHLLOKOSA-N 288.347 2.269 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)CN 818608333 ZZWURORMDOPJAO-ZDUSSCGKSA-N 277.412 2.084 10 20 CECD C[C@H](N[C@H]1CC[C@@H](CN)C1)c1cc(F)ccc1O 817982238 PRJCKKCOFDHBSZ-UMNHJUIQSA-N 252.333 2.309 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)c1c[nH]ccc1=N 817902838 ZDFQMUQPOCPGFO-LLVKDONJSA-N 269.348 2.280 10 20 CECD COC[C@H]1CCCCN1Cc1cc(OC)c(OC)cc1O 825294569 UCNJHWXRTOYZME-CYBMUJFWSA-N 295.379 2.410 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)N=c2cc[nH]cc2)c1 728938966 SIQWDQSHFSCYAZ-SNVBAGLBSA-N 287.319 2.100 10 20 CECD CCO/C=C/C(=O)N1CCOc2cc(N(C)C)ccc21 493044231 HDCIQDFPYZRHMS-VQHVLOKHSA-N 276.336 2.028 10 20 CECD COC(=O)c1cnc(SC[C@@](C)(O)C(F)F)s1 905959810 URTIILVGSDPXCL-SECBINFHSA-N 283.321 2.038 10 20 CECD C[C@@H](CC(=O)O)NCc1ccc2c(c1)CCCN2C 820084571 MRFPQMLZXNQDCN-NSHDSACASA-N 262.353 2.022 10 20 CECD O=C(NCc1ccc2c(c1)CCO2)c1cc(O)cs1 732281747 BWZLIKLFXHBZAA-UHFFFAOYSA-N 275.329 2.319 10 20 CECD Cc1nn(C)c(C)c1[C@@H](C)C(=O)NCc1ccccc1O 748347259 XPCXSCMCTHMXKP-SNVBAGLBSA-N 287.363 2.162 10 20 CECD CCCCN1CC(=O)N[C@H]1c1cc(C)c(C)cc1O 742442720 NCXWUNMHWSOOKS-OAHLLOKOSA-N 262.353 2.240 10 20 CECD CC1(C)CC[C@H]1NC(=O)NCCc1ccc(N)cc1 841905612 GSWHZNOCQPKXIQ-CYBMUJFWSA-N 261.369 2.299 10 20 CECD NC[C@H](NCc1cc2c(cc1O)OCO2)C1CCCCC1 841039608 WIKIEOLHWCSBTG-ZDUSSCGKSA-N 292.379 2.118 10 20 CECD CCc1cccc(CN2CCO[C@H]([C@H]3CCCO3)C2)c1O 848891222 XMBITURHDSYJQO-CVEARBPZSA-N 291.391 2.334 10 20 CECD COC(=O)CC1CC(N[C@H](C)c2cc(OC)ccc2O)C1 845971145 HKFABKJEDGFELQ-VOMCLLRMSA-N 293.363 2.393 10 20 CECD COc1ccc(CNC(=N)N2CCCCCC2)c(O)c1 849024840 BRFYMQAIPJIEJH-UHFFFAOYSA-N 277.368 2.301 10 20 CECD CCc1cccc(CN[C@@](C)(COC)CC(=O)OC)c1O 848902115 KTGNSGPIMZSFRR-MRXNPFEDSA-N 295.379 2.012 10 20 CECD COc1cccc([C@H](C)NCCC[C@@H](C)O)c1O 846169290 ZSTJJDRIDMZXIC-MNOVXSKESA-N 253.342 2.212 10 20 CECD CCO[C@H](C)C(=O)NCc1cc(Cl)ccc1O 846473656 VHGXRRGHXXYWNV-MRVPVSSYSA-N 257.717 2.087 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@]3(CCCN3)C2)c1O 841105625 SIUKZUSJQROBIB-HNNXBMFYSA-N 296.798 2.382 10 20 CECD CCN(C(=O)/C=C/c1cnccc1C)c1cnn(C)c1 848343715 OGLQCDRHGRDXER-AATRIKPKSA-N 270.336 2.190 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@@H]2NCC[C@@H]2C1 843127711 SIYWXYIARAGREP-MFKMUULPSA-N 266.772 2.229 10 20 CECD CCO[C@@H]1C[C@H](NCc2cccc(CC)c2O)[C@H]1OC 848902702 GQBZKOOHNTWVHN-SQWLQELKSA-N 279.380 2.237 10 20 CECD CC(C)OCc1noc(COC(=O)c2cc(O)cs2)n1 922441240 WXEOSCNUENXSJA-UHFFFAOYSA-N 298.320 2.119 10 20 CECD CC(C)N1C[C@H](N[C@@H](C)c2cc(F)cc(F)c2O)CC1=O 756736540 IFGVPYXYCHFSMH-GXSJLCMTSA-N 298.333 2.330 10 20 CECD OC[C@@H](CNCc1ccc2c(c1)CCO2)CC1CC1 850386527 LPGOOHZOZDCMPB-CQSZACIVSA-N 261.365 2.120 10 20 CECD Cc1cc(O)c(CN(C)Cc2nnc3n2CCC3)cc1C 768224070 PYWXZERBOCGLIF-UHFFFAOYSA-N 286.379 2.179 10 20 CECD CN(C)c1ccc(CN2CCc3c[nH]nc3C2)cc1 769469474 YTINJEQJGXJKFZ-UHFFFAOYSA-N 256.353 2.034 10 20 CECD C[C@@H](N[C@@H]1COCC[C@H]1O)c1cc2c(cc1O)CCCC2 866498422 WGRYZLDHSOXJCM-HFBAOOFYSA-N 291.391 2.071 10 20 CECD CC(=O)c1cc(C(=O)NCc2cc(C)ccc2O)n(C)c1 862760913 YDVXSPHKMUYEIM-UHFFFAOYSA-N 286.331 2.172 10 20 CECD CCOC(=O)C1(C)CC(NCc2cc(OC)ccc2O)C1 866298224 VFTFCHILDVILDF-UHFFFAOYSA-N 293.363 2.222 10 20 CECD CC(C)(C)c1[nH]cnc1C(=O)NCc1ccccc1O 866755954 PFWXEKFPAIPGMM-UHFFFAOYSA-N 273.336 2.343 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCc3cnc(C)n3C2)c1 862755018 ASUYLLFAVDLPQL-CYBMUJFWSA-N 299.374 2.084 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCC[C@@H]2OC)cc1OC 776257549 YFXBDDNGPIUTFU-FZMZJTMJSA-N 295.379 2.314 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H]2CCO[C@@H]2C)cc1 878805375 KTVIJBHXZOJCJC-CABCVRRESA-N 292.423 2.488 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1ccccn1 772768936 MEDGJJYJYITTQR-FNORWQNLSA-N 271.272 2.249 10 20 CECD Cc1ccc(CN2CCC[C@@H](N3CCCC3=O)C2)c(O)c1 876715734 RWLPAWGKNHJNDL-OAHLLOKOSA-N 288.391 2.287 10 20 CECD CC1(NCc2ccc(Br)cc2O)COC1 877690959 HGXOCNIFIDDNJM-UHFFFAOYSA-N 272.142 2.033 10 20 CECD Nc1ccc(OCc2cn(CC[C@@H]3CCCO3)nn2)cc1 881329123 PNRMIVGXYVGJDR-AWEZNQCLSA-N 288.351 2.008 10 20 CECD CCCN(CC(=O)N(CC)CC)Cc1ccccc1O 75829204 UGBZYKAXNCARFX-UHFFFAOYSA-N 278.396 2.473 10 20 CECD CC(C)COC(=O)[C@H](C)NCc1cc(F)cc(F)c1O 894538322 JNKRFUFBEUJUEZ-VIFPVBQESA-N 287.306 2.348 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@]1(C)CCCOC1 272917681 NFEMAAHCJQTGKZ-OAHLLOKOSA-N 263.337 2.167 10 20 CECD CC[C@H](NC[C@]1(OC)CCOC1)c1ccc(F)cc1O 796939469 CLOHVDJGKHUQDY-DZGCQCFKSA-N 283.343 2.378 10 20 CECD COc1ccc(CN[C@@H]2CCCC[C@H]2OC)c(O)c1OC 895152705 NJGYKVWIFNVIKC-CHWSQXEVSA-N 295.379 2.457 10 20 CECD CN(CCC(=O)O)Cc1ccc(Br)cc1O 691415315 SDHPHXFKAZYECZ-UHFFFAOYSA-N 288.141 2.061 10 20 CECD COc1cccc(O)c1CN(C)C[C@@H]1CCCOC1 769340283 VLNDZBUVSLNUFN-LBPRGKRZSA-N 265.353 2.259 10 20 CECD Cc1cccc(CN[C@@H]2CCn3ccnc3C2)c1O 779192196 LKGWVIJIQQIZAJ-CYBMUJFWSA-N 257.337 2.002 10 20 CECD COc1ccc(CNC[C@H]2CC[C@H](NC(C)=O)C2)cc1C 994567164 CBYRURCADOOZJI-HOTGVXAUSA-N 290.407 2.398 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@@H](C)N1 1236575640 SQNYFOYBGDGILG-HUUCEWRRSA-N 273.424 2.469 10 20 CECD CCOCCN1CCN(c2ccc(OCC)cc2)CC1 1339266161 TZVGFBKODBYNQC-UHFFFAOYSA-N 278.396 2.244 10 20 CECD CC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C(F)F 1330676640 JRTWTBGDHPJIDA-DNQSNQRASA-N 271.263 2.271 10 20 CECD CC1(C(=O)O)CN(Cc2ccc3ccccc3c2O)C1 1593808941 YDPRAHCDBJCRIP-UHFFFAOYSA-N 271.316 2.452 10 20 CECD CC[C@](C)(CC(=O)O)NCc1cc(F)ccc1O 1594826055 ZBGKPFVFMLTAQH-CYBMUJFWSA-N 255.289 2.264 10 20 CECD CCC[C@@H](C(=O)O)N(C)Cc1cc(F)cc(C(C)=O)c1O 1776747912 JIXAZACLTLQAKK-ZDUSSCGKSA-N 297.326 2.419 10 20 CECD C[C@H]1CCO[C@@H]1CCN(C)c1ccc(OCC(=O)O)cc1 1776650047 UTSKFUPKQMUFRD-SWLSCSKDSA-N 293.363 2.401 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCC[C@@H](N)C2)cc1F 166458944 ZENKZZNWBJGFJI-QWHCGFSZSA-N 293.386 2.025 10 20 CECD CN(C(=O)NCCCSc1nccs1)C1CC1 154598096 XJGPZPGOHOCFBR-UHFFFAOYSA-N 271.411 2.429 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)[C@H](O)C(F)(F)F 865711615 PKGWFZRXYPBRAZ-PELKAZGASA-N 275.270 2.023 10 20 CECD CCOc1cccc(CN[C@@H](C)[C@@H](O)C(F)(F)F)c1O 865711404 NKEZEXMQLFENII-QPUJVOFHSA-N 293.285 2.192 10 20 CECD Cc1cc(CN2CCOc3cc(N(C)C)ccc32)n[nH]1 1320377753 BZDKZGDGJPVLLS-UHFFFAOYSA-N 272.352 2.183 10 20 CECD CCOc1cccc(CN[C@H](CO)C2CCCC2)c1O 289673332 RPWIVTFXSYSHSP-CQSZACIVSA-N 279.380 2.432 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCS(=O)(=O)C(C)C)c1 290193931 GCQONKXTMYKQEI-GFCCVEGCSA-N 285.409 2.174 10 20 CECD CC(C)CN1CCN(Cc2cc(F)ccc2O)CC1 179886456 RQBDUTGUBYJUIE-UHFFFAOYSA-N 266.360 2.305 10 20 CECD Oc1ccc(F)cc1CN1CCCN2CCC[C@H]2C1 300415980 BBPCVFZUAFWMDT-AWEZNQCLSA-N 264.344 2.201 10 20 CECD Nc1ccc(NC(=O)NC2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)cc1 300649284 ZUNFVSMVQWCRBK-VDUILEQBSA-N 257.337 2.435 10 20 CECD CCn1cc(CN[C@H](C)c2ccc(C)cc2O)nn1 404470042 YEKHDDYTVXBLNU-LLVKDONJSA-N 260.341 2.163 10 20 CECD CCc1cccc(CNCCc2cnn(C)c2)c1O 709417172 OFNAOXUPBKBSTR-UHFFFAOYSA-N 259.353 2.020 10 20 CECD Nc1ccc(CC(=O)N2CCCC[C@@H]2CCC(=O)O)cc1 50927212 YRAOULRJEITYNI-CQSZACIVSA-N 290.363 2.057 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)NCc1c(O)cccc1Cl 113330517 GALAUYGHRFCNHK-UWVGGRQHSA-N 284.787 2.438 10 20 CECD COC(=O)c1cnc(Sc2nccs2)c([N+](=O)[O-])c1 302782317 SOCJNMNNUJJSNY-UHFFFAOYSA-N 297.317 2.384 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCOCC3)cc2)CCCO1 179397101 DUEHJDLVQJNNFC-OAHLLOKOSA-N 290.407 2.134 10 20 CECD CCCNC(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 62575087 JHLNOLORTBJFOO-CYBMUJFWSA-N 291.395 2.231 10 20 CECD Oc1ccccc1CN1CCC[C@H]1CN1CCCC1 179563988 XSPKSWYNHHKRRY-HNNXBMFYSA-N 260.381 2.452 10 20 CECD c1cc2c(cc1CNCCCOC[C@@H]1CCCO1)CCO2 37362871 SEVKHWHJCPTNQT-INIZCTEOSA-N 291.391 2.297 10 20 CECD 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286.169 2.076 10 20 CECD CC(=O)C1(C(=O)NCc2c(O)ccc3c2CCCC3)CC1 293712336 NSJCWZLBMYRYAL-UHFFFAOYSA-N 287.359 2.256 10 20 CECD COC[C@@]1(C)CCN(Cc2cc(OC)c(OC)cc2O)C1 295094329 JRIIQRZIJDRTOU-INIZCTEOSA-N 295.379 2.268 10 20 CECD COC(=O)c1cnc(SC[C@H](O)C(C)C)s1 298179261 GKFKUIOLLXHGRF-ZETCQYMHSA-N 261.368 2.039 10 20 CECD CC[C@H](N[C@@H](C)C(=O)NC)c1cccc(Cl)c1O 292006729 YHESKARELRDLTC-KWQFWETISA-N 270.760 2.221 10 20 CECD Cc1cccc(CNCc2nnc(C(C)C)[nH]2)c1O 294907600 XWDQOOLBWKSFOP-UHFFFAOYSA-N 260.341 2.232 10 20 CECD C[C@H](NC(=O)C(C)(F)F)c1ccc(N2CCOCC2)cc1 808457177 HASQTNKHWVYMGR-NSHDSACASA-N 298.333 2.356 10 20 CECD COCCCCCOC(=O)c1ccc(C)c(O)c1O 735137218 LGKGCWLSFCDGMD-UHFFFAOYSA-N 268.309 2.380 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@H](C(=O)O)C1 901416555 UBXPDEPFEOZYTQ-CQSZACIVSA-N 276.380 2.358 10 20 CECD COc1ccc(CN[C@@H]2C[C@H]3CCCCN3C2=O)cc1C 835072274 DZEUVLCEQDWVMP-HUUCEWRRSA-N 288.391 2.247 10 20 CECD O=C(CSc1nccs1)NCC(=O)c1cccs1 731564096 OMNNZZYVWYMPQM-UHFFFAOYSA-N 298.414 2.296 10 20 CECD CC[C@H](CO)N(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 838560459 XHLLNHBAPUWUMU-GXTWGEPZSA-N 293.411 2.226 10 20 CECD COC[C@H](N[C@H](C)c1cccc(OC)c1O)[C@H]1CCCO1 846167583 LAMLJILOGNGODE-KWCYVHTRSA-N 295.379 2.245 10 20 CECD Cc1ccc(CN2CCOc3cc(N(C)C)ccc32)nn1 840938265 AJKKVZGPZWXIFM-UHFFFAOYSA-N 284.363 2.250 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCC[C@@H](N)C2)c1O 841057295 IWXCDHQJACVKNB-NEPJUHHUSA-N 284.787 2.414 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC(CCN)CC2)c1O 846224939 DPVKHPIPGYJTDX-UHFFFAOYSA-N 294.370 2.295 10 20 CECD CCOc1ccc(CN[C@H]2CCNCC2(C)C)c(O)c1 841073663 VUQWATIXZKAQAE-HNNXBMFYSA-N 278.396 2.269 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCNCC2(C)C)cc1C 841072100 GKDCLAINZNFDNR-OAHLLOKOSA-N 262.397 2.487 10 20 CECD CCN(Cc1ccc(N)cc1)C[C@@H](O)C(F)(F)F 1336285374 LIRIBOIGSSKIJJ-LLVKDONJSA-N 262.275 2.014 10 20 CECD CN(C)c1ccc(CN[C@@H]2Cc3ccccc3NC2=O)cc1 858281579 UXQVNIFIIYBBAN-QGZVFWFLSA-N 295.386 2.406 10 20 CECD CC(C)(C)CN(CC(=O)O)Cc1cccc(F)c1O 854244304 ZBUHRSVFWWNUFI-UHFFFAOYSA-N 269.316 2.464 10 20 CECD CCOc1cccc(CN2CCc3c[nH]nc3C2)c1O 769468652 MJCAHLSBXPINJY-UHFFFAOYSA-N 273.336 2.072 10 20 CECD COc1cc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c(O)cc1C 768444863 CZZZSHDNBDVIEM-ZBUHCNDUSA-N 297.420 2.051 10 20 CECD CCCOc1ccc(CNC[C@@H]2COCCO2)cc1C 873017070 UUAMHKDGVFUWJU-OAHLLOKOSA-N 279.380 2.289 10 20 CECD Cc1ccc(CN[C@@H]2CCN(CC(F)F)C2)c(O)c1 877594179 OGLRQHZNZMXQLC-GFCCVEGCSA-N 270.323 2.130 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC2(C3CC3)CC2)c1O 775034897 UAUNHWIBGSEXFM-UHFFFAOYSA-N 278.308 2.341 10 20 CECD CCN1C[C@@H](C)N(Cc2cc(F)ccc2O)C[C@@H]1C 779018341 FUKDTVGASGXGEA-NWDGAFQWSA-N 266.360 2.446 10 20 CECD C[C@H]1CCN(Cc2c(O)cccc2Cl)[C@H](C(N)=O)C1 779200497 HDEMKOMTPINKBZ-CABZTGNLSA-N 282.771 2.131 10 20 CECD Cc1cnc([C@@H](C)n2cc(COc3ccc(N)cc3)nn2)o1 881354151 VGVRZPITXZVJKU-LLVKDONJSA-N 299.334 2.345 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCN(C3CC3)C2)c1O 894240695 FAFDBJSOKHEXIN-CYBMUJFWSA-N 276.380 2.036 10 20 CECD COc1cc(C)cc(CN(C)C2(CO)CCC2)c1O 895357084 IFDHEORBZXVKNQ-UHFFFAOYSA-N 265.353 2.056 10 20 CECD CCC[C@@H](NCc1cc(C)ccc1O)C(=O)OC 83385017 JPMYAUSLQJHVAL-GFCCVEGCSA-N 251.326 2.132 10 20 CECD COc1cccc(CN2CC[C@@H](OC(C)C)C2)c1O 701727108 AXUCZZYOYBDHSE-CYBMUJFWSA-N 265.353 2.400 10 20 CECD CC[C@@H](CCO)NCc1cc(Cl)cc(OC)c1O 169089288 NISMZYSQBSQPFL-NSHDSACASA-N 273.760 2.305 10 20 CECD CCc1ccc(S(=O)(=O)NCc2ccccc2O)cc1 751149407 XHHOKCUSBRXRQI-UHFFFAOYSA-N 291.372 2.433 10 20 CECD CCOCC1(C(=O)NCc2ccc(N(C)C)cc2C)CC1 799335876 DXLKFYYPQSACMO-UHFFFAOYSA-N 290.407 2.494 10 20 CECD Oc1cc(Br)ccc1CNC[C@@H](O)C1CC1 691428617 MSNDMRMSKVLMFM-GFCCVEGCSA-N 286.169 2.015 10 20 CECD C[C@H](N[C@H](CCO)C1CC1)c1ccc(F)cc1O 756741957 ZCNAHPBJGXSIAD-TVQRCGJNSA-N 253.317 2.343 10 20 CECD COc1ccc(CNC(=O)c2ncccc2C)c(O)c1 794390538 KYNFOGFFIHHQSO-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COc1cccc(O)c1CNC[C@H](OC)C(F)(F)F 733330226 SVTVGKNLSVJGGK-NSHDSACASA-N 279.258 2.068 10 20 CECD C[C@H](C(=O)O)C1(NCc2cc(F)c(N(C)C)cc2F)CC1 1329681636 ISWNXSULAOSETK-SECBINFHSA-N 298.333 2.374 10 20 CECD CN(C)c1ccc(CN2C[C@H](C(=O)O)CC2(C)C)cc1 1777039391 SQRBNZXVAYAIRV-CYBMUJFWSA-N 276.380 2.438 10 20 CECD CCn1ccc(C(=O)N[C@H](C)c2ccccc2O)n1 1352251809 FKPDHYMRDXKDJD-SNVBAGLBSA-N 259.309 2.100 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H](C)CC(N)=O 228614717 UMKMMOYKLBGMAC-MXWKQRLJSA-N 262.353 2.102 10 20 CECD CC(C)(C)n1cccc(C(=O)Oc2ccc(N)cc2)c1=O 1575294031 GTTHTEUXMMSEHD-UHFFFAOYSA-N 286.331 2.405 10 20 CECD COc1cc(Cl)cc(CNCCc2ccnn2C)c1O 231036754 ATTCMAKCPKMWIU-UHFFFAOYSA-N 295.770 2.120 10 20 CECD Oc1ccc(Br)cc1CN[C@@H]1CCCOC1 163932861 NURIXGRAEFCVIW-LLVKDONJSA-N 286.169 2.423 10 20 CECD CC[C@@H](O)CCN[C@H](C)c1cc(OC)ccc1O 168826052 CGESFSRWTWESEG-GHMZBOCLSA-N 253.342 2.212 10 20 CECD COc1cccc(CNC[C@@]2(O)CCC[C@H]2C)c1O 293051283 ROFZXTVBLPTHPK-ABAIWWIYSA-N 265.353 2.042 10 20 CECD COc1ncccc1CNCc1cc(C)ccc1O 71407996 XIMFDBCCZTVXGK-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CC(=O)NCCN(C)Cc1cc(Cl)cc(Cl)c1O 308294663 JJZFIXYLSDEAQF-UHFFFAOYSA-N 291.178 2.267 10 20 CECD CCCNC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 176486946 YGCMFXFQLGRHMC-UHFFFAOYSA-N 295.358 2.076 10 20 CECD CO[C@H]1CCC[C@H](C(=O)NCc2ccccc2O)C1 815833401 LRGYXCXVOLKKAQ-AAEUAGOBSA-N 263.337 2.214 10 20 CECD C[C@H](NCCc1nnc2ccccn12)c1ccccc1O 20128210 FVHVXNUTTWVWOF-LBPRGKRZSA-N 282.347 2.328 10 20 CECD COc1ccc(O)c(CNc2cc(Cl)nc(N)n2)c1 301304323 XBLSJIXFNUUUEQ-UHFFFAOYSA-N 280.715 2.039 10 20 CECD CCOC[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(C)C 188863466 PBEVRLOEDSRIKO-CYBMUJFWSA-N 282.340 2.451 10 20 CECD Cc1cc(C(=O)N2CCC[C@H](O)C2)c(C)n1-c1ccccn1 73746368 NIDNDXNGGYYXES-AWEZNQCLSA-N 299.374 2.086 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@@]2(C)CCCO2)cc1 126976888 DTKKXNNQDPOVBU-MRXNPFEDSA-N 291.395 2.121 10 20 CECD CCn1nncc1CN[C@H](C)c1cc(C)ccc1O 527913728 BEVWTZXZTDRJRG-LLVKDONJSA-N 260.341 2.163 10 20 CECD CCC(=O)N1CCCN(Cc2ccc(N(C)C)cc2)CC1 92186797 LFTBCYIOOMZNRU-UHFFFAOYSA-N 289.423 2.197 10 20 CECD CCOc1ccc(N(CC)Cc2ncnn2C)cc1 267409011 SQMNTTCSPCFSIT-UHFFFAOYSA-N 260.341 2.240 10 20 CECD CN(Cc1ccccc1O)Cc1nnc2n1CCCCC2 264694077 IAJLXRRQGCUASJ-UHFFFAOYSA-N 286.379 2.342 10 20 CECD CC[C@H]1CC[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)O1 268131733 MLZHCGQSZPNKGC-SWLSCSKDSA-N 294.370 2.466 10 20 CECD CC[C@H](N[C@@H]1CCCCNC1=O)c1ccc(C)cc1O 279990254 FGUZHFRIMZETNF-UONOGXRCSA-N 276.380 2.410 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)C(=O)N(C)C)c(O)c1C 276918770 QLXYHMLMZMNMHZ-RYUDHWBXSA-N 264.369 2.136 10 20 CECD COc1ccc(O)c(CNCC2CCN(C3CC3)CC2)c1 278721403 PRRUSEXRCBSMNZ-UHFFFAOYSA-N 290.407 2.365 10 20 CECD Cc1ccc(C(=O)N2CCOC3(CCCC3)C2)c(O)c1O 271327419 YJEULEITFPFSIL-UHFFFAOYSA-N 291.347 2.191 10 20 CECD CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)c1cccc(O)c1O 370498564 HQOCBVIREAQORZ-GDLCADMTSA-N 291.347 2.031 10 20 CECD COc1nccc(CN(C)Cc2ccc(N(C)C)cc2)n1 294582880 QMQJHUJEVUIOKD-UHFFFAOYSA-N 286.379 2.183 10 20 CECD COC(=O)N1CC(N[C@H](C)c2c(C)cc(C)cc2O)C1 294821627 QKCMVLIXHJYLPT-LLVKDONJSA-N 278.352 2.110 10 20 CECD CCOC1CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 294953049 SCBZPWPTAKABOD-UHFFFAOYSA-N 299.374 2.350 10 20 CECD C[C@@H](NC[C@@H]1CCCN1)c1cc(F)cc(F)c1O 817951453 FWHSMABJBPFFFD-SCZZXKLOSA-N 256.296 2.073 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCCNCC2)c1 817969016 PJNLQUAAIFCMHR-RYUDHWBXSA-N 264.369 2.194 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccco2)c1 728983993 JFDWHGYEFUUPCR-VIFPVBQESA-N 261.277 2.485 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@@H](O)C1CCC1 825240648 PQSWAFLWUWHXDC-GFCCVEGCSA-N 273.735 2.435 10 20 CECD CC1(C)CCCN1CCNCc1cc(F)ccc1O 825326562 NLHNOMVGAWBDNV-UHFFFAOYSA-N 266.360 2.495 10 20 CECD CCCN1CCC[C@@H](C(=O)N(C)Cc2ccccc2O)C1 906991417 NHTRULLNWPLQBF-OAHLLOKOSA-N 290.407 2.473 10 20 CECD CCOCc1cc(CNCC(C)(C)C(=O)O)ccc1OC 901507581 ZPDMHWDUAPBIAN-UHFFFAOYSA-N 295.379 2.432 10 20 CECD CC[C@@H](OC)C(=O)NCc1ccc(N(C)C)cc1C 734405047 RQGCVVWJBIVJPI-CQSZACIVSA-N 264.369 2.102 10 20 CECD CCOCc1cc(CN[C@@H](C)CCCN)ccc1OC 841078932 DNPDYPXXXHGZDK-ZDUSSCGKSA-N 280.412 2.449 10 20 CECD CC1(C)CNCCN1Cc1cccc(Br)c1O 843054460 MSKJXFXDEISBIB-UHFFFAOYSA-N 299.212 2.339 10 20 CECD CC[C@H](CCO)NCc1ccc(N(C)C)cc1C 840933237 FXXCGIVLEFERDH-CQSZACIVSA-N 250.386 2.312 10 20 CECD CCCNC(=S)NCc1cc(Cl)ccc1O 844584143 OSGOLGZDKSLJMN-UHFFFAOYSA-N 258.774 2.420 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc3n[nH]cc3c2)c1 746689979 UYKVSZNBSPHWKZ-UHFFFAOYSA-N 297.314 2.207 10 20 CECD NCCNC(=O)N(Cc1ccccc1O)C1CCCCC1 841922266 DVCOWCUMTTXZCX-UHFFFAOYSA-N 291.395 2.195 10 20 CECD CC(C)ON1C(=O)CN(Cc2cc(Cl)ccc2O)C1=O 842250689 WYPYAUXNQCYFFL-UHFFFAOYSA-N 298.726 2.150 10 20 CECD COc1cccc(CN[C@@H](C)C2(OC)CCC2)c1O 840970132 PZCZGSSNEAUXNF-NSHDSACASA-N 265.353 2.448 10 20 CECD CN(C)c1ccc(OC[C@@H]2CCNC(=O)CC2)cc1 842043695 OEVMCXBBYBQEDU-LBPRGKRZSA-N 262.353 2.048 10 20 CECD COc1ccc(N2CCC(N[C@@H]3CO[C@H](C)C3)CC2)cc1 842673333 JNMBPRCQGADIHB-HIFRSBDPSA-N 290.407 2.431 10 20 CECD CCOCCOCCN[C@@H](C)c1c(O)cccc1F 927087789 UWFBRYKGGVHAJO-NSHDSACASA-N 271.332 2.235 10 20 CECD Cc1cc(O)c(CN[C@@H](CN)CC(C)C)cc1C 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Cc1ccc(C(=O)NC[C@H](O)C2CCCCC2)c(O)c1O 272711703 FCWNMBGZWZZBJI-ZDUSSCGKSA-N 293.363 2.077 10 20 CECD O=C(NCC1(c2ccccn2)CC1)c1cc(O)cs1 802577330 DPBMXQODGRQLAB-UHFFFAOYSA-N 274.345 2.310 10 20 CECD CN1CC[C@@]2(CCN(Cc3ccc(N(C)C)c(F)c3)C2)C1 292687978 BCWAGAMQYCTSJJ-QGZVFWFLSA-N 291.414 2.419 10 20 CECD CC(C)(C)N1C[C@H](N[C@H]2CCc3cccc(O)c32)CC1=O 296275272 CARHCBOTSOTCSF-OLZOCXBDSA-N 288.391 2.369 10 20 CECD O=C(NC[C@@H]1COc2ccccc21)c1cccc(O)c1O 811562649 IRYPHRXGEFLSPZ-SNVBAGLBSA-N 285.299 2.004 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)c3cc[nH]c3)C2)cc1 819582724 PHEZUMKOXYKQHS-CYBMUJFWSA-N 299.374 2.280 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2cc(Cl)c(F)cc2O)C1 827501085 PXOGJVWAKHEKLP-OTSSQURYSA-N 287.718 2.226 10 20 CECD Cc1nnc(CN(C)Cc2cc(C)c(C)cc2O)o1 827039233 LGHCDCRVYPISAH-UHFFFAOYSA-N 261.325 2.332 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)C(=O)Nc1ccccc1 732578485 PHGQSYOXPDKOOA-VIFPVBQESA-N 290.344 2.211 10 20 CECD Oc1cccc2c1[C@@H](NC[C@@H](O)COc1ccccc1)CC2 834502628 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282.359 2.059 10 20 CECD Oc1c(F)cc(F)cc1CN1C[C@@H]2[C@H](C1)C2(F)F 895149602 MCRBGJPGZZZVRF-DTORHVGOSA-N 261.218 2.367 10 20 CECD COc1cccc(CNCc2cccnc2C)c1O 705571531 XPTAEXHQXFLTOC-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1ccc(CNc2ncccc2[N+](=O)[O-])c(O)c1 795283640 FMSARUQMVCEPKI-UHFFFAOYSA-N 275.264 2.316 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H]2CCC(=O)[C@H]2C)c1 793688156 CWFRAQNNDNGWDK-QWRGUYRKSA-N 291.347 2.022 10 20 CECD COc1ccc(CN[C@@H]2C[C@@H](C)N(C(C)=O)C2)cc1C 987645266 OIKKODDYMLCVAJ-IUODEOHRSA-N 276.380 2.103 10 20 CECD COC(=O)[C@@H](C)CN(Cc1ccc(N)cc1)C1CC1 1345159275 DYDJCJBXZAJLEX-NSHDSACASA-N 262.353 2.042 10 20 CECD COc1ccc(N(C)Cc2c[nH]c(C(=O)O)c2)cc1F 1599583817 CLLOBQLSVTZRCH-UHFFFAOYSA-N 278.283 2.497 10 20 CECD C[C@@H]1CCC[C@]1(NCc1ccc2c(c1)CCO2)C(=O)O 1776639641 PSDZAOCJGXGTMD-BDJLRTHQSA-N 275.348 2.355 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)CN2CCCC2=O)c1 37782914 XPBWAIIYNGMFKI-STQMWFEESA-N 276.380 2.362 10 20 CECD CCC[C@H](O)CNC1CCN(c2ccc(OC)cc2)CC1 305098929 AIGQTIUXPGLPOE-INIZCTEOSA-N 292.423 2.415 10 20 CECD COc1ccc(O)c(CNCc2ccc(F)nc2)c1 189106575 OHTPHEOZJZMULW-UHFFFAOYSA-N 262.284 2.225 10 20 CECD COC(=O)C(C)(C)C(=O)[C@H](C)Sc1nccs1 286407068 CIUPCZJETFGPPW-ZETCQYMHSA-N 273.379 2.392 10 20 CECD Cc1nnc(NC(=O)NCc2ccc(N(C)C)cc2)s1 43408854 UNWNCBHQZPMJPC-UHFFFAOYSA-N 291.380 2.234 10 20 CECD CCOc1cccc(CN2CC[C@](C)(C(=O)OC)C2)c1O 93813690 VEIVACDPDXOABM-INIZCTEOSA-N 293.363 2.176 10 20 CECD C[C@]1(C(=O)O)CCCN(Cc2cc(F)ccc2O)C1 235769239 JDKOKRHBPAMLDN-AWEZNQCLSA-N 267.300 2.218 10 20 CECD COC[C@H](NCc1cccc(Cl)c1O)[C@@H]1CCCO1 279440089 PDBDBPLHZGJZPA-STQMWFEESA-N 285.771 2.329 10 20 CECD CN(C)c1ccc(CNC(=O)[C@]2(C)CCCOC2)cc1 272594239 CYZFZHOIOAFWML-MRXNPFEDSA-N 276.380 2.186 10 20 CECD C[C@H](NC[C@@H]1CC[C@@H](O)C1)c1cc([N+](=O)[O-])ccc1O 276669341 RPKHMXWHNJLOAA-HOSYDEDBSA-N 280.324 2.112 10 20 CECD CCn1nc(NC(=O)c2cccc(O)c2O)cc1C1CC1 279281876 LMJXQGYLEOBENY-UHFFFAOYSA-N 287.319 2.444 10 20 CECD COC[C@H](N[C@H](C)c1cc(F)ccc1O)[C@H]1CCCO1 278620807 CFVMYACKCUKUTE-RIEGTJTDSA-N 283.343 2.376 10 20 CECD C[C@H](NC[C@@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O 273372640 GLSWGCNLXHMGHB-ONGXEEELSA-N 266.297 2.130 10 20 CECD CCOCc1cc(CNCCC(C)(C)O)ccc1OC 274781301 VSLVFBHNFAZOQB-UHFFFAOYSA-N 281.396 2.482 10 20 CECD CCCCN(CC(=O)N1CCC1)Cc1ccccc1O 282511552 SBKPFWCSRHPADN-UHFFFAOYSA-N 276.380 2.227 10 20 CECD Cc1cc(C)c([C@@H](C)N[C@H]2CC(=O)N(C3CC3)C2)c(O)c1 294804140 PEKPETZJTQNDLP-OLZOCXBDSA-N 288.391 2.423 10 20 CECD COC(=O)c1cnc(S[C@H](C)C(=O)C2CC2)s1 295379339 TVUISMHZXCSYGJ-ZCFIWIBFSA-N 271.363 2.389 10 20 CECD CCN(Cc1cc(Cl)cc(OC)c1O)[C@H](C)CO 292723675 FPUULRVCQTVSJY-SECBINFHSA-N 273.760 2.257 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)NOCC1CC1 292351294 FCEPUCLBFLTZNL-UHFFFAOYSA-N 289.379 2.428 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCCCO1 802172056 AHWDNEIDWKBFGW-UHFFFAOYSA-N 277.368 2.298 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCC(=O)N(C)C)c1O 808687085 JTGNQRMZQVECHG-JTQLQIEISA-N 284.787 2.483 10 20 CECD C[C@@H](CS(C)(=O)=O)NCc1ccc2ccccc2c1O 816549838 ZTNRDGKXQUPSMW-NSHDSACASA-N 293.388 2.068 10 20 CECD CO[C@]1(CNCc2cc(Cl)c(F)cc2O)CCOC1 816570595 ZQHQTDGKGDVOMB-ZDUSSCGKSA-N 289.734 2.080 10 20 CECD Cc1ccc(O)c(CNC(=O)CCNC(C)(C)C)c1 827165872 CGXUPECTWGLLTJ-UHFFFAOYSA-N 264.369 2.095 10 20 CECD COC(=O)NC1CCN(Cc2cccc(C)c2O)CC1 827928901 AZBSSTKSAOQJLU-UHFFFAOYSA-N 278.352 2.021 10 20 CECD Cc1cccnc1CNC(=O)/C=C\c1ccc(O)c(O)c1 588404112 LPECUSGCYWPZMZ-ALCCZGGFSA-N 284.315 2.131 10 20 CECD OCC[C@H](N[C@@H]1CCc2cccc(O)c21)C1CCOCC1 834766380 SVAOQUHTYRCTQC-LSDHHAIUSA-N 291.391 2.147 10 20 CECD Cc1nc(CNC(=O)c2cc(O)cs2)cs1 731871347 CHPYBACFDHXLDN-UHFFFAOYSA-N 254.336 2.149 10 20 CECD CCc1cc(NCc2cc(OC)ccc2O)ncn1 733995013 VSJBBTUYZROUPT-UHFFFAOYSA-N 259.309 2.365 10 20 CECD COC(=O)[C@]1(C)CCCN(Cc2cc(C)ccc2O)C1 840975149 LUWBPGZDKQIHFF-MRXNPFEDSA-N 277.364 2.476 10 20 CECD Nc1ccc(NC(=O)Nc2cc3n(n2)CCCC3)cc1 841300640 YJRWKANMUXGJJF-UHFFFAOYSA-N 271.324 2.446 10 20 CECD O=C(NC1CC2(CCC2)C1)c1c(F)ccc(O)c1O 846665306 UDSLKDUXOQTTTR-UHFFFAOYSA-N 265.284 2.299 10 20 CECD Cc1ccc(NCCNCc2ccccc2O)nc1 922926231 RAXUUZKLBNWTDG-UHFFFAOYSA-N 257.337 2.297 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@H](C)CN[C@H](C)[C@H]2C)c1O 923446329 YGUGNBAIYUNQHQ-GMTAPVOTSA-N 294.370 2.305 10 20 CECD CC[C@@H](O)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 850529755 SRANUMIRXQFOQA-FXPVBKGRSA-N 253.317 2.440 10 20 CECD CC[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@H]1O 862253784 SNIDHYFQROJIMU-ZUZCIYMTSA-N 284.350 2.234 10 20 CECD C[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)CCO1 862214758 DBYRPBXUCZXOKV-SNVBAGLBSA-N 270.323 2.252 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H]2CCCN(C)C2=O)cc1 766437535 PAZXPFKBNLCGHK-XJKSGUPXSA-N 289.423 2.414 10 20 CECD CC1=CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 779543713 YFXZWWQTJGDMBX-HWKANZROSA-N 259.305 2.290 10 20 CECD CN1CCN(c2ccc(CNC3CC=CC3)cc2)CC1 771844382 UDXRWYVIVWGYEG-UHFFFAOYSA-N 271.408 2.247 10 20 CECD CC[C@H](NC[C@@]1(O)CCN(C)C1)c1cc(Cl)ccc1O 775555136 JSIPDESVBVVJEE-ZFWWWQNUSA-N 298.814 2.153 10 20 CECD COC(=O)C(C)(C)N(C)Cc1cccc(Cl)c1O 775675236 UXFIUSRIXCSUTJ-UHFFFAOYSA-N 271.744 2.429 10 20 CECD C=CC(=O)NCc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1 1120461405 MFILGHOGIHFGQW-RYUDHWBXSA-N 292.354 2.242 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@]2(C)CCCOC2)c1 781352012 RVZVARAHDUCUJV-MEDUHNTESA-N 293.363 2.395 10 20 CECD COc1cncc(NCc2ccc(OC)c(OC)c2O)c1 895691292 FFDGBEIXKGNPBQ-UHFFFAOYSA-N 290.319 2.425 10 20 CECD COc1cc(C)cc(CNCCOCC2CC2)c1O 894254426 OLEALZBBAUOBLD-UHFFFAOYSA-N 265.353 2.225 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1cc(C)cc(OC)c1O 894992398 AVRHUIBLYHZRTO-CYBMUJFWSA-N 293.363 2.141 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)[C@@](C)(CO)C2)c1O 895345870 WYTJJFAVKDWBDG-BLLLJJGKSA-N 279.380 2.160 10 20 CECD COc1ccc(CNC(=O)CC(C)(C)CC(C)=O)c(O)c1 794377816 KXUQIQTWBUWLAN-UHFFFAOYSA-N 293.363 2.412 10 20 CECD CN1CC[C@]2(CCN(Cc3c(O)ccc4ccncc34)C2)C1 793748887 VGJAOYRQLLBXCI-SFHVURJKSA-N 297.402 2.468 10 20 CECD COc1cccc(O)c1CNCCOC(F)(F)F 788967693 UJAIRFCFSWLGAX-UHFFFAOYSA-N 265.231 2.027 10 20 CECD COC(=O)NC1CN(Cc2ccc3ccccc3c2O)C1 1328219704 KMLBRPIQHUUVSG-UHFFFAOYSA-N 286.331 2.086 10 20 CECD FC(F)CN1CCC(NCc2ccc3c(c2)CCO3)CC1 1330081726 PEVKYPOLTFIKIW-UHFFFAOYSA-N 296.361 2.441 10 20 CECD COC1CC(C(=O)NCc2ccc3c(c2)CCCN3C)C1 1331552267 BKVNISMUSHFCRS-UHFFFAOYSA-N 288.391 2.110 10 20 CECD CCOc1ccc(N2CCN(CCC[C@H](C)O)CC2)cc1 1347839253 DTNVWZZZXLPEBR-HNNXBMFYSA-N 292.423 2.368 10 20 CECD CC(C)[C@@H](CO)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1604332942 MVJWDKPCBLOXPB-CMPLNLGQSA-N 281.352 2.006 10 20 CECD Nc1ccc(CNC(=O)[C@H]2CC(=O)Nc3ccccc32)cc1 1580443585 RHERQERIOKZYFC-AWEZNQCLSA-N 295.342 2.011 10 20 CECD CN(Cc1ccccc1O)Cc1ccc(C(=O)O)n1C 1598530500 IGHDGWBIDSWHJS-UHFFFAOYSA-N 274.320 2.061 10 20 CECD CCc1cccc(CN[C@@](C)(CCF)C(=O)O)c1O 1597586874 NCVNLLXDADZIKT-AWEZNQCLSA-N 269.316 2.247 10 20 CECD O=C(O)CC[C@H]1CCCCN1C(=O)c1cc(O)cs1 1595012309 ZUJVISDSSLRRKB-SECBINFHSA-N 283.349 2.313 10 20 CECD CCN1CCc2cc(CN[C@@H](C(=O)O)C(C)C)ccc21 1776877767 XBCJZAIKEHCALI-OAHLLOKOSA-N 276.380 2.268 10 20 CECD CCN(C)c1ccc(CNCCSCC(=O)O)c(C)c1 1776856432 XGTKOEXEHNGEBU-UHFFFAOYSA-N 296.436 2.359 10 20 CECD COc1cc(O)c(CN2CCS[C@H](C)C2)cc1OC 160145063 JDZQSQLIKGLJFN-SNVBAGLBSA-N 283.393 2.347 10 20 CECD O=C(NCCCc1ccccc1)c1cccc(O)c1O 126274369 BTPYNKVFWVLEMH-UHFFFAOYSA-N 271.316 2.460 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](OC)[C@H](C)C1 824815066 IBWSUQSSDGKHEI-BXUZGUMPSA-N 265.353 2.258 10 20 CECD CCc1cccc(CNCCCn2cccn2)c1O 691513876 QNUMDKZYJWOFOE-UHFFFAOYSA-N 259.353 2.331 10 20 CECD COc1cc(Cl)cc(CNCCc2cnccn2)c1O 390206593 MUNRRIDIVMXPKI-UHFFFAOYSA-N 293.754 2.177 10 20 CECD COc1cc(Cl)cc(CNCCC2(O)CCC2)c1O 397661924 JHZWQRSNUPLZSA-UHFFFAOYSA-N 285.771 2.449 10 20 CECD Oc1ccc(Cl)cc1CNCC[C@@H](O)C1CC1 898206083 LMNGJEJPEMKWCF-CYBMUJFWSA-N 255.745 2.296 10 20 CECD COC(=O)CN(Cc1cccc(C)c1O)C(C)C 179743638 SAYCUPXMSKORNF-UHFFFAOYSA-N 251.326 2.084 10 20 CECD O=C(NCc1ccc(O)c(O)c1)Nc1ccccc1 174373085 RXUSOMNLAZMRTK-UHFFFAOYSA-N 258.277 2.420 10 20 CECD COc1cccc(CNC(=O)[C@@H]2Cc3ccccc3O2)c1O 175930111 WOXIWLYGNBKZBV-HNNXBMFYSA-N 299.326 2.021 10 20 CECD CCN(CCN)Cc1cc(Cl)cc(Cl)c1O 300872328 XMPVJDOTTDNFFJ-UHFFFAOYSA-N 263.168 2.480 10 20 CECD CC[C@@H](C)[C@@H](C)NCC(=O)NCc1ccc(N(C)C)cc1 183060905 UMUYRTXGBZPSBD-ZIAGYGMSSA-N 291.439 2.393 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@@H](C)O 129579534 KLNXIFFZNCRQPN-LLVKDONJSA-N 278.377 2.266 10 20 CECD COc1ccc(N(C)CCOC[C@H]2CCCO2)cc1F 121787419 NHCFQQNCMOHIBK-CYBMUJFWSA-N 283.343 2.466 10 20 CECD COc1ncccc1NC(=O)/C=C/c1ccc(O)c(O)c1 180938007 CSGCYISGERUNQL-FNORWQNLSA-N 286.287 2.153 10 20 CECD COc1cc(Cl)cc(CNCCCC(=O)O)c1O 229050905 JPQBWMHRPSQRJW-UHFFFAOYSA-N 273.716 2.009 10 20 CECD C[C@H](O)CN[C@@H](C)c1cc(Br)c(F)cc1O 134899469 NRRYCENOMWBXJN-BQBZGAKWSA-N 292.148 2.325 10 20 CECD COc1ccc(N(C)Cc2cncn2C)c(OC)c1 269794846 HAYAUNXGWSEJCH-UHFFFAOYSA-N 261.325 2.074 10 20 CECD CC(C)Cn1cc(NC(=O)c2cccc(O)c2O)cn1 279350540 RUBRVIYSQOJJQT-UHFFFAOYSA-N 275.308 2.203 10 20 CECD COc1ccc(CN(C)c2ccc(OC)c(F)c2)nn1 283321422 ZQGNOADYSIRZMS-UHFFFAOYSA-N 277.299 2.269 10 20 CECD CCN(CC)c1ccc(CN[C@]2(C)CCOC2=O)cc1F 289876590 RPOZKDBPFNWHTA-MRXNPFEDSA-N 294.370 2.467 10 20 CECD CC[C@@H](N[C@@H](CO)CCOC)c1cccc(Cl)c1O 287055939 NENGKEULSVCQFM-ZWNOBZJWSA-N 287.787 2.484 10 20 CECD CN(C)C(=O)O[C@H]1CCCN(Cc2cc(F)ccc2O)C1 294817035 ONXPXXXYXOCQCZ-ZDUSSCGKSA-N 296.342 2.194 10 20 CECD C[C@@H]1CN(C2CC2)C[C@H]1N[C@@H]1CCc2cccc(O)c21 297820726 RJVSAKZQPUDJRQ-KCPJHIHWSA-N 272.392 2.452 10 20 CECD Cc1c(CNC(=O)[C@H]2CN(C)C[C@H]2C)n(C)c2ccccc12 487554662 RULYFMSEMDHBPI-DOMZBBRYSA-N 299.418 2.301 10 20 CECD COC[C@@H](O)CN1C[C@H](C(C)C)Cc2cc(OC)ccc21 817298681 OOYIKSVTHCBKHX-CABCVRRESA-N 293.407 2.337 10 20 CECD OC[C@H](CC(F)F)NCc1cc(Cl)c(F)cc1O 816591824 OVCVFKKCXTYVTK-ZETCQYMHSA-N 283.677 2.290 10 20 CECD C[C@H](NCC1(C)CCNCC1)c1cc([N+](=O)[O-])ccc1O 817965514 WJAXCZASCFWKTL-NSHDSACASA-N 293.367 2.341 10 20 CECD Cn1ncc2c1CCC[C@@H]2NCCc1ccc(N)cc1 817956290 VTPTWLCECGGTKR-HNNXBMFYSA-N 270.380 2.212 10 20 CECD CCN(CC)c1ccc(CNCCC(=O)N(C)OC)cc1 818965090 PEHOAPNKFPYHIZ-UHFFFAOYSA-N 293.411 2.032 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2cccc(Cl)c2O)C1 827812555 PMAUSRPSMOIBQR-MGCOHNPYSA-N 269.728 2.087 10 20 CECD COC(=O)c1cnc(SCc2ccnc(C)n2)s1 829677727 JQVBZAOLVLNLAY-UHFFFAOYSA-N 281.362 2.320 10 20 CECD O=C(/C=C\c1cccnc1)N1C[C@H](O)Cc2ccccc21 493257755 GSGHQHUGLHDQIJ-ZPIQOJFGSA-N 280.327 2.045 10 20 CECD COC(=O)C1(C)CN(Cc2cc(C)c(C)cc2O)C1 822534874 ZQNGELDFMHLVNK-UHFFFAOYSA-N 263.337 2.004 10 20 CECD COc1cccnc1CNCc1cccc(C)c1O 825249325 BWMCLETWMYCGHC-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CC[C@@H]1OCC[C@H]1NCc1ccc(N2CCOCC2)cc1 839190963 DKFOOIWSJFXMOR-SJORKVTESA-N 290.407 2.180 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC(C(C)(C)O)C1 840953325 PWIFAKGYXVQCFR-UHFFFAOYSA-N 262.397 2.264 10 20 CECD C[C@H](N)[C@H]1CCCN(Cc2cccc(F)c2O)C1 843052787 WEOIMXPFCYTYMB-QWRGUYRKSA-N 252.333 2.091 10 20 CECD CCc1cccc(CNCCN2CCC(OC)CC2)c1O 848900621 IFWUECIVHPJLKM-UHFFFAOYSA-N 292.423 2.155 10 20 CECD COC/C=C/C(=O)NCc1ccc(N2CCCCC2)cc1 848225229 FCNGUUONBOMUMS-AATRIKPKSA-N 288.391 2.496 10 20 CECD C[C@H]1CN(C(=O)c2ccc(CN=[N+]=[N-])o2)C[C@H](C)O1 1537963003 OBKRJWPLGHLLLZ-IUCAKERBSA-N 264.285 2.339 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)C[C@H](C)N 843486125 QGCSJTFDUGDBOL-ZDUSSCGKSA-N 277.412 2.227 10 20 CECD CO[C@H](C)CCC(=O)NCc1cc(Cl)ccc1O 846473146 JOCTVUZJLRQTOF-SECBINFHSA-N 271.744 2.477 10 20 CECD Oc1cc2c(cc1CN[C@@H]1Cc3cccc(O)c3C1)OCO2 758545116 MEKDCRHKZLKHAH-GFCCVEGCSA-N 299.326 2.084 10 20 CECD CC(C)N1C[C@H](N[C@@H](C)c2cc(F)ccc2O)CC1=O 756739753 ZCFMOKQKCSATAM-CMPLNLGQSA-N 280.343 2.191 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](C)S(C)(=O)=O)c(O)c1C 756770178 VHQWWBUATGECTC-CMPLNLGQSA-N 285.409 2.093 10 20 CECD Cc1ccc(O)c(CNC(=O)c2[nH]c(C)c(C=O)c2C)c1 862753372 CQMWIEHDZXAUHS-UHFFFAOYSA-N 286.331 2.388 10 20 CECD Cn1c(CNC(=O)c2cc(O)cs2)nc2ccccc21 760158536 IYWSIPNJCPAFRG-UHFFFAOYSA-N 287.344 2.270 10 20 CECD C[C@@H](N[C@H]1C[C@@H](CO)C1)c1cc(Cl)ccc1O 866416660 YZDHHFIEHNETBY-KKZNHRDASA-N 255.745 2.467 10 20 CECD CN(C(=O)CCC1CCOCC1)c1ccc(N)cc1 877078375 NUVQZFZKUKDRBP-UHFFFAOYSA-N 262.353 2.438 10 20 CECD C[C@@H](NCc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCCOC1 779985462 FUKOUJZKQSJRFT-GHMZBOCLSA-N 280.324 2.205 10 20 CECD COCCCOCCN(C)Cc1ccc(C)cc1O 877172846 URORYGUUCPRWND-UHFFFAOYSA-N 267.369 2.186 10 20 CECD Cc1ccc(CNCc2ncnn2C(C)(C)C)c(O)c1 877501420 OYKSDFSUOCPIJK-UHFFFAOYSA-N 274.368 2.337 10 20 CECD Cc1cccc(O)c1CN1CCO[C@@H](COC(C)C)C1 877404089 YFGVUPBIXWHGNT-CQSZACIVSA-N 279.380 2.326 10 20 CECD CCOc1cccc(CN[C@@H]2CCn3ccnc3C2)c1O 778187008 CGKYHGRJGUJCDR-CYBMUJFWSA-N 287.363 2.092 10 20 CECD C[C@H]1[C@@H](C)N(Cc2ccc(N(C)C)c(F)c2)CCN1C 775983995 DUPKMDNQPNSEJR-QWHCGFSZSA-N 279.403 2.416 10 20 CECD COCCN(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773624241 KIMVHNQSEQNIQP-GFCCVEGCSA-N 279.384 2.101 10 20 CECD C[C@H](NS(=O)(=O)C1CCC1)c1ccc(N(C)C)cc1 882085589 YGAXWUZZRJVKKP-NSHDSACASA-N 282.409 2.286 10 20 CECD Cc1cc(C)c([C@@H](C)NCCN2CCOC[C@H]2C)c(O)c1 788586606 DQHDVJVOQPFDCE-HUUCEWRRSA-N 292.423 2.380 10 20 CECD COC[C@H]1CCCCN1Cc1ccc(OC)c(OC)c1O 894784266 KURPIBVKHHDSHD-CYBMUJFWSA-N 295.379 2.410 10 20 CECD CCc1nnc(SCC(=O)c2ccc(O)c(O)c2)s1 710996969 LTQFAZPCWMIRLY-UHFFFAOYSA-N 296.373 2.487 10 20 CECD COc1cccc(CNCC[C@@H]2CCCC[C@@H]2O)c1O 897538980 KKXHULDIOJMGQJ-JSGCOSHPSA-N 279.380 2.432 10 20 CECD Nc1ccc(CN2CCC([C@H]3CCCN3)CC2)cc1 1235889087 WJGIKYJRUVBCHH-MRXNPFEDSA-N 259.397 2.233 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)Cc1nc[nH]n1 1237601573 CNQRPQXXYKAPFX-UHFFFAOYSA-N 271.368 2.037 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCCCN2)c1 1326319144 VPUVAEYYDKTPCH-FZMZJTMJSA-N 292.379 2.110 10 20 CECD CN(CC1CC1)C[C@H]1CCN(Cc2ccc(N)cc2)C1 1336285525 MNJGFNZOQGCBPR-MRXNPFEDSA-N 273.424 2.433 10 20 CECD CC(C)(C)c1cc(C(=O)NCc2ccc(N)cc2)[nH]n1 1341923761 OSAMBHPITHZSCE-UHFFFAOYSA-N 272.352 2.219 10 20 CECD CC[C@H](F)C(=O)N(C)Cc1ccc(N(C)C)cc1 1346418384 SIFNJDURAVNOPO-ZDUSSCGKSA-N 252.333 2.459 10 20 CECD CCNc1nccnc1NCc1ccc(OC)cc1O 1350480221 PQNKSZBALGHPOX-UHFFFAOYSA-N 274.324 2.235 10 20 CECD CCCN(CC(=O)O)Cc1cc(C)cc(OC)c1O 1605309532 TWWDZLIQBMMBKK-UHFFFAOYSA-N 267.325 2.006 10 20 CECD Nc1ccc(CC(=O)N(CC(=O)O)C2CCCCC2)cc1 1601215885 JTTBAQWULPUHAN-UHFFFAOYSA-N 290.363 2.057 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C(=O)O)[C@@H]2C)cc1C 1610475664 HXOWKLBLBGJSLA-WCQYABFASA-N 263.337 2.304 10 20 CECD Oc1ccc(Br)cc1CNC[C@H]1CCCO1 15416804 YQLSYWKUCIJCSI-LLVKDONJSA-N 286.169 2.423 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](O)C[C@@H]2C)c1O 384957723 RCWKPYKVBCRYOH-QPUJVOFHSA-N 283.755 2.203 10 20 CECD Cc1cccc(CN[C@H](CO)CC(F)(F)F)c1O 717817856 LTWSYKJNTJZHMD-JTQLQIEISA-N 263.259 2.104 10 20 CECD CN(CCO)Cc1ccc(OCc2ccccc2)cc1O 182938106 MFTQYVCEXKNUBC-UHFFFAOYSA-N 287.359 2.395 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cn(C)cn2)cc1 178995205 CXYJEQGCEHCKBS-UHFFFAOYSA-N 286.379 2.196 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1(N)CCCCC1 37801154 PZUBHXNMALVLLD-UHFFFAOYSA-N 289.423 2.373 10 20 CECD CN(C)c1ccc(CNC(=O)N(C)[C@H]2CCSC2)cc1 129727741 MNEUBIGLYAKPKR-AWEZNQCLSA-N 293.436 2.400 10 20 CECD CCC[C@](C)(NCc1cc(OC)ccc1O)C(=O)OC 180036244 NTDHHWWOJNZYBD-HNNXBMFYSA-N 281.352 2.222 10 20 CECD COC(=O)COc1ccc(N(C)Cc2cccn2C)cc1 183228408 JBJPWGSALBWXQM-UHFFFAOYSA-N 288.347 2.213 10 20 CECD CC(C)N1CCC(NCc2cc3c(cc2O)OCO3)CC1 42879549 NSDLRVYVOMAYJS-UHFFFAOYSA-N 292.379 2.083 10 20 CECD CCN1CCCN(Cc2cccc(Cl)c2O)CC1=O 191543460 CLRALQMKCBVPQC-UHFFFAOYSA-N 282.771 2.100 10 20 CECD Cn1c(-c2ccccc2)cnc1SCCS(C)(=O)=O 48597499 BBABQGCCQRWHPA-UHFFFAOYSA-N 296.417 2.224 10 20 CECD Cn1cc(NCc2ccc(N3CCOCC3)c(F)c2)cn1 237697754 DHMBZWWOIPTKHN-UHFFFAOYSA-N 290.342 2.008 10 20 CECD CCCN(Cc1ccccc1O)C[C@H](O)COC(C)C 266594507 VHPKNWOBXRIPDL-HNNXBMFYSA-N 281.396 2.390 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2cc(OC)ccc2O)C1 180550376 JFBNIOQVCYOINZ-ZDUSSCGKSA-N 278.396 2.174 10 20 CECD CC(C)(C)c1cnc(CNC(=O)Cc2ccc(N)cc2)o1 236618066 HQJXPEJLOHLDRI-UHFFFAOYSA-N 287.363 2.413 10 20 CECD CCn1nncc1CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 527918867 FJWAXRJOBBWWJW-BXKDBHETSA-N 290.342 2.481 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)/C=C/CN(C)C 264635983 PBURGOSJEXURLR-BQYQJAHWSA-N 289.423 2.219 10 20 CECD CC[C@@H]1CC[C@H](C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)O1 274949054 REJMGKCNHIDFTP-JVLSTEMRSA-N 293.363 2.103 10 20 CECD CCOC1CC(O)(CN[C@H](C)c2ccc(N(C)C)cc2)C1 278428579 JEIXPBITXKTZNR-NVPAJSRCSA-N 292.423 2.333 10 20 CECD CC(C)[C@H](CCO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273603078 SJBRZPPNLJBGGG-GWCFXTLKSA-N 282.340 2.358 10 20 CECD Oc1ccc(Cl)cc1CN[C@@H]1CCc2c[nH]nc2C1 374546551 VTJLFMSFOXDZCQ-GFCCVEGCSA-N 277.755 2.416 10 20 CECD Oc1ccccc1CN1CCC(OC[C@@H]2CCOC2)CC1 374917370 YBBQKHLZYMPJLS-CQSZACIVSA-N 291.391 2.410 10 20 CECD CC[C@@H](NCCS(=O)(=O)CC)c1ccc(C)cc1O 280089828 MGZATEOEHAZFKE-CYBMUJFWSA-N 285.409 2.176 10 20 CECD CC[C@@H](N[C@@H]1CCN(CCOC)C1)c1ccc(F)cc1O 286015623 JMEFNVSQISNCCZ-UKRRQHHQSA-N 296.386 2.293 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H]2CCCC[C@H]2N)cc1 296698304 IBELCDYCLAHTBA-GOEBONIOSA-N 289.423 2.276 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CC1(F)F 817559520 VAEWCLNTSXWQTB-ISVAXAHUSA-N 285.290 2.190 10 20 CECD O=S1CCN(Cc2ccc3ccccc3c2O)CC1 816504515 PYNCCQMMKOXJPR-UHFFFAOYSA-N 275.373 2.110 10 20 CECD COc1cccc(O)c1CN1CC2(CCNCC2)C[C@H]1C 818431221 HBBUOELCRMBDBT-CYBMUJFWSA-N 290.407 2.365 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)CNC)cc1 826019448 FPYDJSHGDTXZOA-AWEZNQCLSA-N 291.439 2.347 10 20 CECD CCOC(=O)CCCN(C)c1ccc(OC)c(OC)c1 726597455 PFPXSGFGJXWXKH-UHFFFAOYSA-N 281.352 2.483 10 20 CECD CCN(C/C=C\c1ccc(N(C)C)cc1)CC(=O)O 901426104 AVZKCOHCQHMZOW-WAYWQWQTSA-N 262.353 2.172 10 20 CECD C[C@@H]1C(=O)N(CN(C)Cc2ccc(N(C)C)cc2)C[C@@H]1C 839953975 UQBYESSGUKYGBH-KBPBESRZSA-N 289.423 2.256 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](CC(F)F)C(=O)O 901815406 ZGPWHXIXKIIEJA-LBPRGKRZSA-N 286.322 2.259 10 20 CECD CCc1cccc(C(=O)NCc2ccc(OC)cc2O)n1 831033150 POROQIGFVHISQD-UHFFFAOYSA-N 286.331 2.288 10 20 CECD Cc1cc(C)n(CCOC(=O)c2ccc(C)c(O)c2O)n1 731720994 MMDFRHHJWRTYIQ-UHFFFAOYSA-N 290.319 2.077 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)NC[C@@H](C)N)cc1 841985302 GZSXZUDJXZZGJG-CYBMUJFWSA-N 292.427 2.021 10 20 CECD CCN(CCSC)C(=O)/C=C\c1ccc(O)c(O)c1 844122415 HSMASQIUIVWPJN-ALCCZGGFSA-N 281.377 2.323 10 20 CECD O=C(O)CN(Cc1ccccc1O)C(=O)[C@H]1CC=CCC1 911483556 CUUWHUNQQKFSIA-LBPRGKRZSA-N 289.331 2.162 10 20 CECD C[C@@H](NC(=O)[C@H]1CCC(=O)C1)c1ccc(N(C)C)cc1 843859091 UVBRXGDFGLBUOM-YPMHNXCESA-N 274.364 2.299 10 20 CECD CO[C@@H]1CCCC[C@H]1NC(=O)NCCc1ccc(N)cc1 846173827 UKSHCTXWOBBPSL-HUUCEWRRSA-N 291.395 2.068 10 20 CECD C[C@H](N[C@H]1CCCN(C)C1=O)c1cc(Cl)ccc1O 756638370 OSSZWAZKOSYZCJ-CABZTGNLSA-N 282.771 2.317 10 20 CECD CO[C@H]1CCN(Cc2c(O)ccc3ccncc23)C1 751946574 YNCLVZYSDVOWHP-LBPRGKRZSA-N 258.321 2.161 10 20 CECD Cc1occc1CN(C)C(=O)c1c(F)ccc(O)c1O 764443302 PCHSPDQHKSZFHU-UHFFFAOYSA-N 279.267 2.411 10 20 CECD O=C(OCc1ccccc1[N+](=O)[O-])c1cccc(O)c1O 776281559 HCTPQLXVBDMTKW-UHFFFAOYSA-N 289.243 2.363 10 20 CECD Cc1cccc(O)c1CNCc1nc(C(C)(C)C)n[nH]1 877582606 BTLDGRWXDCWRTN-UHFFFAOYSA-N 274.368 2.406 10 20 CECD COc1cc(CN2CC(C)(O)C2)c(O)c(C(C)(C)C)c1 877580750 HQVCJUFLMYYPJI-UHFFFAOYSA-N 279.380 2.265 10 20 CECD O=C(OCCN1CCCCC1)c1cc(O)cs1 770365690 AFFUSDBCIBBJDU-UHFFFAOYSA-N 255.339 2.096 10 20 CECD C[C@H](N[C@H](C)c1nnnn1C1CC1)c1c(O)cccc1F 886598972 OFIVAVGFGAQFBP-DTWKUNHWSA-N 291.330 2.265 10 20 CECD COC(=O)[C@H](NCc1cc(Cl)cc(F)c1O)C1CC1 789573510 KJRZQSUELWQKQL-LLVKDONJSA-N 287.718 2.226 10 20 CECD CC[C@]1(O)CCN(Cc2cc(C)cc(OC)c2O)C1 894502961 DHEHMKWQEADENY-HNNXBMFYSA-N 265.353 2.056 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)Cc1cnc[nH]1 796438693 COZIAFFRBSQEKR-UHFFFAOYSA-N 258.369 2.498 10 20 CECD CCN(CCC(=O)OC)Cc1cc(F)cc(F)c1O 893969334 LLNIPRKDGBAYOT-UHFFFAOYSA-N 273.279 2.055 10 20 CECD COc1cccc(O)c1CN[C@H]1C[C@@H](OC)C1(C)C 753374250 RMNXYMPLMLASPT-UONOGXRCSA-N 265.353 2.304 10 20 CECD C[C@H](N[C@H]1CC=C(C(=O)O)C1)c1c(O)cccc1F 1604331018 SYDYYYVVJALTHI-WPRPVWTQSA-N 265.284 2.355 10 20 CECD C[C@H](Sc1ncc(C(=O)O)s1)c1cnccn1 1604456005 ABOCSUCEUJSIBQ-LURJTMIESA-N 267.335 2.485 10 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OFWRPYSRHSGAQD-UHFFFAOYSA-N 277.364 2.050 10 20 CECD COc1ncc(/C=C\C(=O)N(C)c2ccccc2OC)cn1 775806291 GTRNILXWAWSEGC-HJWRWDBZSA-N 299.330 2.170 10 20 CECD COc1cccc(CNC(=O)c2ccc3cc[nH]c3n2)c1O 779534068 DHQYXRWSUCBIFY-UHFFFAOYSA-N 297.314 2.207 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2C[C@@H](N)C2)c2c(O)ccc(F)c21 873250447 HRGDXMLYXKFHRT-SVDPJWKOSA-N 264.344 2.407 10 20 CECD CCC(=O)N1CCC(N[C@H](C)c2ccccc2O)CC1 877756625 ZMZBLBQJDYVBES-GFCCVEGCSA-N 276.380 2.444 10 20 CECD CN(C(=O)[C@@H]1CSCCS1)c1ccc(N)cc1 877080488 JTIXZGVISMCYDP-NSHDSACASA-N 268.407 2.080 10 20 CECD Oc1c(F)cc(F)cc1CNc1cnn(CCF)c1 883188704 OTAROUZDIDOLJB-UHFFFAOYSA-N 271.242 2.449 10 20 CECD C[C@H]1CC[C@@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)C1 784569029 ZLGJWAKPHCMBJL-GXSJLCMTSA-N 278.304 2.260 10 20 CECD CCCN(Cc1nccc(N)n1)Cc1ccccc1O 269698166 KWUVVZTWDXBENP-UHFFFAOYSA-N 272.352 2.177 10 20 CECD CCn1cccc(CNCc2ccc(OC)c(C)c2)c1=O 788524405 MYXROLKPPPOXPP-UHFFFAOYSA-N 286.375 2.475 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CC[C@@H](C)C2)c1 780461668 NFKYLRJBLDDSHV-PWSUYJOCSA-N 278.352 2.389 10 20 CECD CC(=O)c1ccc(C(=O)N2CC(N=[N+]=[N-])C2)s1 409422573 GHBLCXROCQCWEG-UHFFFAOYSA-N 250.283 2.085 10 20 CECD COc1ccc(CNC(=O)c2ccnc(F)c2F)c(O)c1 794378302 SBKBLYUDDRLHDY-UHFFFAOYSA-N 294.257 2.004 10 20 CECD CC(C)CNCc1ccc(N2CCOCC2)c(F)c1 57993849 ZHMFDLKZGLBMPU-UHFFFAOYSA-N 266.360 2.408 10 20 CECD CN(CCOCC1CC1)C(=O)Nc1ccc(N)cc1 94990330 NHNCQMOGPFFEAV-UHFFFAOYSA-N 263.341 2.159 10 20 CECD C[C@H](NC[C@H](C)N(C)C1CC1)c1cc(C(=O)O)ccc1O 1604331866 HENCATWWTLIBOW-QWRGUYRKSA-N 292.379 2.224 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 228929751 ILNVPJBTZVLAEC-STQMWFEESA-N 277.412 2.316 10 20 CECD C[C@H](CN[C@H](C)c1cc(Cl)ccc1O)C(=O)O 1589067858 QSJCCZQPRSECRG-HTQZYQBOSA-N 257.717 2.417 10 20 CECD COC(=O)c1cnc(SC/C(C)=C\C(=O)O)s1 1599009788 WTNZTQHKUUSGMJ-UTCJRWHESA-N 273.335 2.053 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCC[C@H]2C(=O)O)c1O 1599420639 MMQHPRYLSGLZGX-MNOVXSKESA-N 299.754 2.397 10 20 CECD C[C@@H]1CC[C@H](COc2ccc(N(C)C)c(C(=O)O)c2)O1 1594306373 FVAFFYYIFGQOSW-ZYHUDNBSSA-N 279.336 2.397 10 20 CECD Cc1cccc(CNC[C@@H]2CCN(C3CC3)C2)c1O 124702727 QKAZUCIAMNGAQA-ZDUSSCGKSA-N 260.381 2.275 10 20 CECD CC(C)NC(=S)NCc1ccc(N(C)C)cc1 7371575 QLXJUTFWCPPZEQ-UHFFFAOYSA-N 251.399 2.125 10 20 CECD c1cc2c(cc1CN[C@@H]1CCNC3(CCC3)C1)CCO2 841089455 NJDUYDYMLKFWQA-OAHLLOKOSA-N 272.392 2.386 10 20 CECD CCc1cccc(CN(CC)[C@H](C)CS(C)(=O)=O)c1O 848887395 VKKLRYAXBAIFNG-GFCCVEGCSA-N 299.436 2.210 10 20 CECD O=C(NCc1ccccc1O)C1Cc2ccccc2C1 236561169 CRGHIRVZEVHFTJ-UHFFFAOYSA-N 267.328 2.423 10 20 CECD CC[C@H](NCC(=O)N(CC)CC)c1ccccc1O 135734443 BADVZWVISFHGCR-ZDUSSCGKSA-N 264.369 2.301 10 20 CECD Oc1cccc(Cl)c1CNCCC1(O)CCC1 284068204 QHKXWVSOOUIGRY-UHFFFAOYSA-N 255.745 2.440 10 20 CECD C[C@@H](CNCc1cc(F)ccc1O)CC1(C)OCCO1 715907678 IJNFTIUWDCNUEN-LLVKDONJSA-N 283.343 2.410 10 20 CECD C[C@@H](NCC1CC2(C1)OCCO2)c1ccc(F)cc1O 927004271 QYUQDTIMWSGPJP-SNVBAGLBSA-N 281.327 2.335 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)C[C@@H](C)O)c1O 228677796 KFOFEGHTMZISMZ-RKDXNWHRSA-N 273.760 2.303 10 20 CECD CN(C)c1ccc(CN2CCC3(CC2)C[C@H]3C(=O)O)cc1 405403797 STEPZEURFMOXLH-HNNXBMFYSA-N 288.391 2.439 10 20 CECD CCCOc1ccc(CN(C)CC2(CO)CC2)c(O)c1 188960027 CWDHKJWFHSGJLN-UHFFFAOYSA-N 279.380 2.385 10 20 CECD CN(C(=O)Nc1ccc(N)cc1)[C@H]1CCSC1 35408177 AFGQZLKRYGBXTO-NSHDSACASA-N 251.355 2.238 10 20 CECD Cc1cc(Cl)cc(CN2CCNC(=O)C2(C)C)c1O 180051062 DCELBEPUDKCVFR-UHFFFAOYSA-N 282.771 2.064 10 20 CECD CCOc1cccc(CN2CCOC[C@@H]2C)c1O 132177107 WESUWHDQBCNBMV-NSHDSACASA-N 251.326 2.012 10 20 CECD Cc1cc(C)c(O)c(CN2CCS(=O)(=O)CC[C@@H]2C)c1 191340650 CWUOXODVIIYDSI-ZDUSSCGKSA-N 297.420 2.018 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)[C@@H](C)N)cc1F 192111037 YFNATPJORBYRFG-NWDGAFQWSA-N 295.402 2.271 10 20 CECD Oc1cc2c(cc1CN1CCOCC13CCCC3)OCO2 93840734 FBBUEYSDHZVYPY-UHFFFAOYSA-N 291.347 2.266 10 20 CECD CCN(CC)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273297349 AKSAZGKSMWJOPG-LLVKDONJSA-N 281.356 2.293 10 20 CECD COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1cc(F)ccc1O 274895472 FSDKHJHPBZQUHO-GWCFXTLKSA-N 281.327 2.305 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H]2CCC[C@@H]2CCO)c1O 279281451 ONLIMJOLNCNUBC-ABAIWWIYSA-N 295.354 2.375 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCc3c[nH]nc3C2)c1 370395858 JOERGYOFTLGWFX-JQWIXIFHSA-N 287.363 2.332 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](O)C(C)C)cc1F 291500477 MQPGSVURKDPFNV-HNNXBMFYSA-N 296.386 2.305 10 20 CECD C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)[C@H]1C 295131814 ICNVMCPQOYNGTD-YUMQZZPRSA-N 253.273 2.107 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H](O)CN2CCCC2)c(O)c1 293248546 BMPJZVWGLFAQPU-GJZGRUSLSA-N 292.423 2.116 10 20 CECD CC(C)(C)n1cc(C(=O)NCc2ccc(N)cc2)cn1 297198032 MNEFSKLJPPSSNA-UHFFFAOYSA-N 272.352 2.150 10 20 CECD CCN(C)c1ccc(CN2CC[C@](C)(C(=O)NC)C2)cc1 815105088 CEGALKUYKPUOSH-KRWDZBQOSA-N 289.423 2.101 10 20 CECD CCOc1ccccc1NC[C@@H](O)COC1CCOCC1 819392775 VXMWCYBXFSGLIQ-CYBMUJFWSA-N 295.379 2.054 10 20 CECD CC[C@@H](NCC1=CCNCC1)c1ccc(F)cc1O 817966994 BJXXCLITSGDXMH-CQSZACIVSA-N 264.344 2.492 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)NCc2ccccc2O)C1 816911966 FQAVWAYIRVGWBC-ZWNOBZJWSA-N 285.347 2.098 10 20 CECD CCn1ccnc1[C@H](C)NCc1cc(OC)ccc1O 825006109 YDRYLIJAONSXJA-NSHDSACASA-N 275.352 2.468 10 20 CECD CCOc1ccc(CNC[C@@H]2CCCC[C@H]2O)c(O)c1 825061177 BFSLHKIXSZELBA-SWLSCSKDSA-N 279.380 2.432 10 20 CECD C[C@H]1CCC[C@@H](C)N1NC(=O)/C=C/c1ccc(O)c(O)c1 907998127 VOQPIXKEJNSFKO-SBDFBNMLSA-N 290.363 2.405 10 20 CECD C[C@H]1CCN(CN(C)Cc2ccc(N(C)C)cc2)C1=O 839954351 VSDIEFGGCYOCMW-ZDUSSCGKSA-N 275.396 2.010 10 20 CECD CC(C)(C)CC(=O)N(CC(=O)O)Cc1ccccc1O 911484764 PPABGUNNRVJPLH-UHFFFAOYSA-N 279.336 2.242 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC[C@H]1CCCO1 844281130 JXSDRQZDJZHHPM-LLVKDONJSA-N 284.743 2.024 10 20 CECD CCCC[C@@H](C)N(C)C(=O)C(=O)Nc1ccc(N)cc1 841132211 LYTGZIYFQPWSSS-LLVKDONJSA-N 277.368 2.244 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(C(=O)O)CC2)cc1 844252477 SPROMRCLABZOGR-UHFFFAOYSA-N 290.363 2.014 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1cccc(OC)c1O 842754328 NWJAWHQBIGVKRI-DGCLKSJQSA-N 267.369 2.288 10 20 CECD CCc1cccc(CNC[C@@H]2CCOC[C@@H]2OC)c1O 848915848 MNOXDLDWXXMIGO-ZFWWWQNUSA-N 279.380 2.096 10 20 CECD CCOc1cccc(CN[C@@H]2CCOC[C@H]2OCC)c1O 759172222 DRASEBJLHSPZQV-UKRRQHHQSA-N 295.379 2.075 10 20 CECD Cc1ccc([C@H](C)NCC(=O)NC2CCCC2)c(O)c1 756704049 DWUYPTDLKJOHKL-LBPRGKRZSA-N 276.380 2.410 10 20 CECD C[C@H](N[C@@H]1CC(=O)N(C)C1)c1cc2c(cc1O)CCCC2 756528728 VYZDYAIGRWPABG-SMDDNHRTSA-N 288.391 2.152 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C(C)(C)F 935948938 SZEMYBGYIKXKPG-UHFFFAOYSA-N 260.305 2.242 10 20 CECD CSCCONC(=O)N[C@H](C)c1ccccc1O 868564835 LNJZZDSYLFSJQU-SECBINFHSA-N 270.354 2.047 10 20 CECD CCC(C)(C)N[C@H](C)C(=O)NCc1cc(C)ccc1O 862757496 WLTYWHODOMAARG-GFCCVEGCSA-N 278.396 2.484 10 20 CECD Cc1ccc(CC(=O)NCCc2ccc(O)c(O)c2)cc1 768899617 KBAPXNDEPWNFOB-UHFFFAOYSA-N 285.343 2.308 10 20 CECD Oc1cc2c(cc1CN1CCc3ccccc3C1)[C@@H](O)CO2 768437753 FXOCUWCPZVTGIE-KRWDZBQOSA-N 297.354 2.376 10 20 CECD CCN(CCC1CC1)Cc1cc2c(cc1O)OC[C@H]2O 760537058 AKNKKFYIOHJJHM-OAHLLOKOSA-N 277.364 2.440 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H]1CN1CCCC1 769143943 DKJPRGULPBNCNJ-CQSZACIVSA-N 290.407 2.461 10 20 CECD C[C@H](NC(=O)C1(O)CCCC1)c1ccc(N(C)C)cc1 775412240 VNWMCNLIEZJLET-LBPRGKRZSA-N 276.380 2.235 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CC[C@@H](N)CC2)c1 870881690 GVGYFTAFSWVTDW-SDDRHHMPSA-N 292.379 2.096 10 20 CECD CC[C@H](NC[C@H](C)S(C)(=O)=O)c1ccc(N(C)C)cc1 773101154 ANZKKUGLAARCRC-WFASDCNBSA-N 298.452 2.226 10 20 CECD COCC[C@]1(NCc2cccc(Cl)c2O)CCOC1 775204593 PUZDBXJGORGOCM-AWEZNQCLSA-N 285.771 2.331 10 20 CECD COC(=O)CN(Cc1ccc(N(C)C)c(F)c1)C1CC1 770280508 KKZYYKSVJNVCRS-UHFFFAOYSA-N 280.343 2.029 10 20 CECD COC(=O)[C@H](CC(F)F)NCc1ccc(OC)c(C)c1 789581865 PJOVNWBTKTYWOU-NSHDSACASA-N 287.306 2.290 10 20 CECD C[C@@H](NC[C@](C)(O)C1CC1)c1ccc(F)cc1O 386613306 KXENWSDEUVFSCV-OTYXRUKQSA-N 253.317 2.343 10 20 CECD C/C=C/C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891247711 UMGMOJLKGICFPP-LQYUOIDQSA-N 275.396 2.048 10 20 CECD CCC[C@@H](CCO)NCc1cc(C)cc(OC)c1O 895418360 NBVFGWVIUVEHCO-ZDUSSCGKSA-N 267.369 2.350 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](C)[C@@H](O)C2)cc1 897685756 RRHCHOLFIWZQKA-BBRMVZONSA-N 262.397 2.345 10 20 CECD CC[C@H](N[C@@H]1CCN(CCOC)C1)c1ccccc1O 274931800 RAHCNESVELSBJS-HIFRSBDPSA-N 278.396 2.154 10 20 CECD COCCC1(NCc2cccc(OC)c2O)CCC1 793329559 MONCATSLJXTKNS-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Cc1cccc(O)c1CNCCO[C@@H]1CCCCO1 894797307 QKJDSQCHCMACGE-OAHLLOKOSA-N 265.353 2.333 10 20 CECD CC1=C(C)CN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 794878379 CQRHWGAWGKHNOQ-HNNXBMFYSA-N 275.348 2.360 10 20 CECD CN(CCC(F)(F)F)Cc1cc2c(cc1O)OC[C@@H]2O 1319798811 MUZMZOMJHXVEDL-NSHDSACASA-N 291.269 2.202 10 20 CECD NC[C@@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1C(F)(F)F 1337838938 VZAQQGOVFUFFNX-YPMHNXCESA-N 287.329 2.228 10 20 CECD Nc1ccc(CNC(=O)N2CCC(n3ccnc3)CC2)cc1 1338793129 MDESNYHNPWRNND-UHFFFAOYSA-N 299.378 2.012 10 20 CECD CCNCC1CCN(Cc2cc(F)ccc2O)CC1 220321042 JABWAONHUANCIT-UHFFFAOYSA-N 266.360 2.353 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1C[C@H]1c1ccncc1 1294926036 XDLYURUBSOHMFP-UONOGXRCSA-N 268.316 2.207 10 20 CECD CC[C@](C)(NCc1cc(F)cc(C(C)=O)c1O)C(=O)O 1609896932 HGZZJJOJGQQOFD-AWEZNQCLSA-N 283.299 2.077 10 20 CECD O=C(O)CN(Cc1cc(Cl)cc(F)c1O)C1CC1 1602057635 OMQINQYLPMNXNS-UHFFFAOYSA-N 273.691 2.234 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1cc(OC)c(C)cc1O 1603498678 UHJUACQFZJXLQU-NSHDSACASA-N 267.325 2.004 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C(=O)O)C2)cc1Cl 1600286635 TULGQWUCIOXQNI-SECBINFHSA-N 269.728 2.261 10 20 CECD CSc1cc(C(=O)NCc2ccc(N)cc2)ccn1 1579387270 VGKYMLWXVYEEDA-UHFFFAOYSA-N 273.361 2.316 10 20 CECD Cc1c(CNCC2[C@H]3CNC[C@H]23)n(C)c2ccccc12 1579534292 DEKLDIIWNBRSDZ-KBPBESRZSA-N 269.392 2.042 10 20 CECD CN(C)c1ccc(CNC2CCC(CN)CC2)cc1 817896866 XLYXHLMFHRJDPQ-UHFFFAOYSA-N 261.413 2.360 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1nncs1 930125735 PIZOJARTHVTPFY-UHFFFAOYSA-N 276.365 2.003 10 20 CECD CCCn1nccc1C(=O)N(C)c1ccc(N)cc1 877074824 SNPONCFSBLNCCC-UHFFFAOYSA-N 258.325 2.152 10 20 CECD CO[C@@H](CNCc1cc(C)ccc1O)C1CCOCC1 877652874 OPRQJQQPRAWILG-INIZCTEOSA-N 279.380 2.232 10 20 CECD C[C@@H](NCCC(=O)N1CCCCC1)c1ccccc1O 135719163 WRTKWCFLMSXMFB-CYBMUJFWSA-N 276.380 2.445 10 20 CECD C[C@@H](CN[C@@H](C)c1cc(F)ccc1O)CN(C)C 310777877 DZGUYMCKWAZKBY-QWRGUYRKSA-N 254.349 2.380 10 20 CECD COc1cc(Cl)cc(CNC[C@@H](O)C2CCC2)c1O 315714912 HWGIPXUIUDLUPO-GFCCVEGCSA-N 285.771 2.305 10 20 CECD Nc1ccc(CC(=O)NCc2cccc(F)c2)cc1 20473220 AZQNQHKQSKSVGA-UHFFFAOYSA-N 258.296 2.267 10 20 CECD CC[C@H](NCCOCCOC)c1ccc(N(C)C)cc1 178632494 CSEPVURLRWEBOY-INIZCTEOSA-N 280.412 2.456 10 20 CECD Cc1ccc(C(=O)NCCSC(F)(F)F)c(O)c1O 182067584 CHERIWXFLXCCLA-UHFFFAOYSA-N 295.282 2.389 10 20 CECD CC[C@H](SC)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 185389130 IBCXPVHQONUCNF-ZANVPECISA-N 283.393 2.287 10 20 CECD COC(=O)[C@@H](C)N(Cc1cc(F)ccc1O)C1CCC1 191641058 NVEIWQLMHCSIOR-SNVBAGLBSA-N 281.327 2.447 10 20 CECD COc1ccc(O)c(CN2CCO[C@@H](C)[C@@H]2C)c1 180257259 PKVUOEZTCJJQEH-QWRGUYRKSA-N 251.326 2.010 10 20 CECD CC[C@@H](OC)C(=O)NCc1c(O)ccc2c1CCCC2 266458806 GBHNXYLJCCDQGK-OAHLLOKOSA-N 277.364 2.312 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(OC)c(C)c2)[C@@H]1OC 274846221 AGZSXSAASOBENG-IMJJTQAJSA-N 279.380 2.286 10 20 CECD COC(C)(C)CC(=O)NCc1ccc(N(C)C)c(F)c1 278331495 WZEJRJPVNPSKAI-UHFFFAOYSA-N 282.359 2.323 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)O[C@]3(CCOC3)C2)cc1C 280390749 WWBAUHFHDZTODN-WMLDXEAASA-N 291.391 2.389 10 20 CECD C[C@H](O)C[C@H]1CCCCN1Cc1cc2c(cc1O)OCO2 280471516 NBTIDOCMEVDNAZ-WCQYABFASA-N 293.363 2.246 10 20 CECD O=C(NCC1=CCCCC1)c1c(F)ccc(O)c1O 295842661 RQDKDBMCKSOGCW-UHFFFAOYSA-N 265.284 2.467 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)C[C@@H](CO)C2)cc1C 817413084 SWGOSUCSOFMMOP-BXUZGUMPSA-N 263.381 2.459 10 20 CECD CC[C@H](CCO)NCc1cc(Cl)c(F)cc1O 816552074 ABWJHWYLIVLELQ-SECBINFHSA-N 261.724 2.435 10 20 CECD CCOCCNCc1cc(Br)cc(F)c1O 715744175 GSRMVEREQFRTST-UHFFFAOYSA-N 292.148 2.420 10 20 CECD CCc1cc(NC(=O)N(C)Cc2ccccc2O)nn1C 817345521 GUWYXLYKBOYSIH-UHFFFAOYSA-N 288.351 2.352 10 20 CECD C[C@@H]1C[C@H](O)CN1Cc1ccc(Br)cc1O 825666418 IUKKPVABAHZUOT-KCJUWKMLSA-N 286.169 2.110 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2C[C@H]2C2CCC2)c(O)c1 823885694 JAACZFXNHCYQCO-UONOGXRCSA-N 290.363 2.389 10 20 CECD CC(C)N1CCCN(C(=O)c2cc(O)cs2)CC1 732285253 ZCWYGLKNKLORCF-UHFFFAOYSA-N 268.382 2.010 10 20 CECD O=C(Nc1ccc2c(c1)OCCO2)c1cc(O)cs1 731861686 JUEGPFIFFJDPSW-UHFFFAOYSA-N 277.301 2.477 10 20 CECD C[C@H](N[C@H]1C[C@@H]2CCCCN2C1=O)c1ccccc1O 834914452 MYJZJDUSCFAFFX-OBJOEFQTSA-N 274.364 2.196 10 20 CECD CN(C[C@@H]1C[C@@]12CCOC2)c1ccc(OCC(=O)O)cc1 903601130 FMFRPUOVCPQHEK-BLLLJJGKSA-N 291.347 2.013 10 20 CECD COc1ccc(N(CCN2CCOCC2)CC(C)C)cc1 732200570 ZKBXDFMAWVGAPX-UHFFFAOYSA-N 292.423 2.490 10 20 CECD COc1cccc([C@H](C)NC[C@@](C)(O)C(C)C)c1O 846147425 UXSHRAYCPYYMSD-XHDPSFHLSA-N 267.369 2.458 10 20 CECD C[C@H]1NCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@@H]1C 843058864 ZZKWRYHBZLSGAB-RKDXNWHRSA-N 299.758 2.136 10 20 CECD CC[C@H](N[C@H](C)C(=O)NC(C)C)c1ccc(F)cc1O 840888809 CRMWUTMKTYSXIX-MFKMUULPSA-N 282.359 2.485 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@]2(CCCN2)C1 841105307 JOTHAELHZPGYQN-CQSZACIVSA-N 266.772 2.374 10 20 CECD CC1(C)[C@H]2CN(C(=O)NCCc3ccc(N)cc3)C[C@H]21 841955097 UQBWEENYEZFUDT-OKILXGFUSA-N 273.380 2.109 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@]2(CCNC2)C1 843120459 LHMJBZWZAXFEPZ-QGZVFWFLSA-N 273.424 2.246 10 20 CECD Cc1cc(O)c(CN2[C@H]3CCNC[C@H]2CC3)cc1C 843057608 FJYSLJFESZAHMY-HUUCEWRRSA-N 260.381 2.335 10 20 CECD C[C@H](NCCC(=O)N(C)C)c1ccc(Cl)cc1O 841746217 DCWZUZRADBPWTF-VIFPVBQESA-N 270.760 2.175 10 20 CECD COc1cccc([C@@H](C)NCCCO[C@H]2CCOC2)c1O 846149839 MVNAICRLBMCVGJ-OLZOCXBDSA-N 295.379 2.247 10 20 CECD N[C@@]12CCC[C@@H]1CN(Cc1cccc(Cl)c1O)C2 857226322 KSYNLASUUPKLPG-BXUZGUMPSA-N 266.772 2.359 10 20 CECD Cc1ccc(O)c([C@@H](C)NCc2ccc(C(N)=O)nc2)c1 756640176 KUZJFMZIJVKQMZ-LLVKDONJSA-N 285.347 2.045 10 20 CECD COCCN(Cc1c(O)cccc1OC)CC(F)(F)F 769188909 RGQDCWKKUQRSRN-UHFFFAOYSA-N 293.285 2.412 10 20 CECD CC(=O)N1CCCN(Cc2cc(Cl)ccc2O)CC1 133273471 DMADFWFPIHLNNA-UHFFFAOYSA-N 282.771 2.100 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1ccc(C)cc1O 877496205 OLROGPGJPWGBSM-GFCCVEGCSA-N 265.353 2.474 10 20 CECD CCNC(=O)C1(CNCc2c(C)cccc2O)CCC1 877475326 OUWZUZGNBKFCLO-UHFFFAOYSA-N 276.380 2.097 10 20 CECD C[C@@H](NCC[C@@]1(O)CCCOC1)c1c(O)cccc1F 886633136 NPBALIUQAIDWHZ-ABAIWWIYSA-N 283.343 2.114 10 20 CECD CCOC(=O)c1cnc(Sc2nnc(CC)o2)s1 882800861 STKMLNVODOSWOE-UHFFFAOYSA-N 285.350 2.416 10 20 CECD C[C@@H](OC(=O)c1cc(O)cs1)c1cnccn1 783608474 RAXKISSANITXRO-SSDOTTSWSA-N 250.279 2.162 10 20 CECD CCOc1ccc(CN[C@@]2(C)CCO[C@@H]2C)c(O)c1 784641318 XKDNJWVPEOVHPS-ABAIWWIYSA-N 265.353 2.448 10 20 CECD Oc1c(F)cc(Cl)cc1CNCCO[C@H]1CCOC1 897200705 AKJKOWMFSSUGSY-NSHDSACASA-N 289.734 2.080 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1cc(Cl)cc([N+](=O)[O-])c1O 782981095 XWAXIFMHSRNCDR-HTQZYQBOSA-N 288.731 2.203 10 20 CECD OC1CCN(c2ccc(CN3CC[C@@H](CF)C3)cc2)CC1 895566514 AAZFYQDQVFFWPX-HNNXBMFYSA-N 292.398 2.439 10 20 CECD CNC[C@H](C)CNCc1cccc(Br)c1O 1325320331 PHVZWDDYYKAFAN-VIFPVBQESA-N 287.201 2.100 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)[C@@H]1C[C@H]1C(=O)O 1600236045 HYYWDCVQVGSBIW-BYCMXARLSA-N 276.380 2.260 10 20 CECD CCC[C@@](C)(O)CNCc1cccc(OCC)c1O 226249763 LZIWZSINSFGMOI-OAHLLOKOSA-N 267.369 2.432 10 20 CECD CCN(CC(=O)O)Cc1cc(C(C)C)ccc1O 1605415635 DTFQVBLNCTXMAO-UHFFFAOYSA-N 251.326 2.422 10 20 CECD COC[C@](C)(CC(=O)O)NCc1cc(Cl)ccc1O 1610244079 ZPOLOXPOEOWCSA-ZDUSSCGKSA-N 287.743 2.015 10 20 CECD CCCC[C@@](C)(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776768671 CAIOTMWNHUQNDX-CQSZACIVSA-N 296.323 2.424 10 20 CECD CCCOc1ccc(CN2CCCC[C@H]2C(N)=O)c(O)c1 162072870 JLSFLCPDQKRGOO-AWEZNQCLSA-N 292.379 2.021 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 155622130 JFVCQQTWKXHGAH-GFCCVEGCSA-N 296.798 2.394 10 20 CECD COc1cccc(CN2CC[C@@H](OC)[C@@H](C)C2)c1O 824814715 DUNRWSBJLLUGNF-WCQYABFASA-N 265.353 2.258 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2nncs2)c1 930215341 SVSPBYDETGBHPG-MRVPVSSYSA-N 265.338 2.103 10 20 CECD O=C(c1cccc(O)c1O)N1CC=C(C(F)(F)F)CC1 167219084 WTDXTJCIIYDGHR-UHFFFAOYSA-N 287.237 2.432 10 20 CECD CC(C)(CNCc1cccc(Cl)c1O)N1CCOCC1 158076395 OAAQBBIEMAWGSK-UHFFFAOYSA-N 298.814 2.246 10 20 CECD CN(C)c1ccc(CN[C@H]2CCN3CCCC[C@H]23)cc1 36996434 CNODLFNIZNNMRS-DLBZAZTESA-N 273.424 2.469 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1cc(C)ccc1O 179895044 FSNIBCPGMJWVGS-CYBMUJFWSA-N 263.337 2.228 10 20 CECD C[C@@H](NCCCN1CCOCC1)c1ccc(N(C)C)cc1 37232286 SJXVGDAXGOSESG-OAHLLOKOSA-N 291.439 2.126 10 20 CECD COc1ccc(O)c(CN2CCS[C@@H]3COCC[C@@H]32)c1 180683437 TVSVXVLZPJXEDT-DZGCQCFKSA-N 295.404 2.107 10 20 CECD Cc1cccc(CNCCOCC(F)(F)F)c1O 124681159 TVZRCVYUETTZTK-UHFFFAOYSA-N 263.259 2.369 10 20 CECD CCN(CC)c1ccc(CNc2ccc(C(N)=O)nn2)cc1 75046934 KWRMJLGBPOUGBJ-UHFFFAOYSA-N 299.378 2.034 10 20 CECD Cc1ccc(C(=O)NC2C[C@H](C)O[C@@H](C)C2)c(O)c1O 182968795 WUJPMZBNQUZJHP-UWVGGRQHSA-N 279.336 2.092 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)COCC(C)C)c1 182316530 JPOQTBSSIIEDJQ-STQMWFEESA-N 297.395 2.085 10 20 CECD O=C(/C=C/c1cccs1)NCc1ccc(O)c(O)c1 182525925 RALVEPOSKGJMQA-GQCTYLIASA-N 275.329 2.489 10 20 CECD COc1cccc(CNC[C@@H]2CCSC2)c1O 228555660 AXFOUWGWLATWKK-JTQLQIEISA-N 253.367 2.244 10 20 CECD C[C@@H]1OCC[C@@]1(C)NCc1ccc(N2CCOCC2)cc1 230153952 REGPEJJZMRWTHP-WMLDXEAASA-N 290.407 2.180 10 20 CECD COCCC[C@@H](C)NCc1ccc(N2CCOCC2)cc1 268826577 JBWBUEUCNGWMHB-OAHLLOKOSA-N 292.423 2.428 10 20 CECD O=C(NCCCNCc1c(O)cccc1Cl)C1CCC1 267693432 GDAYMCZNNCMGLR-UHFFFAOYSA-N 296.798 2.442 10 20 CECD CC(C)[C@@H](CO)N[C@@H](C)c1ccc(F)c(F)c1O 276869362 DOHPLEDVFPOVPL-GZMMTYOYSA-N 259.296 2.338 10 20 CECD Cc1cccc(CN[C@H]2CCO[C@]3(CCOC3)C2)c1O 378459979 UZWFNWGBVYKCEK-GOEBONIOSA-N 277.364 2.128 10 20 CECD CC[C@@H](NCC(C)(C)OCCO)c1ccc(F)cc1O 287331374 MLRHFBXDTFKGIF-CYBMUJFWSA-N 285.359 2.360 10 20 CECD COc1ccc(N2CC[C@@H](CNCc3cc[nH]n3)C2)cc1 818222349 XQUHVDJHLGPIKU-ZDUSSCGKSA-N 286.379 2.034 10 20 CECD CCC(CC)(CNCc1cc2c(cc1O)OCO2)C(=O)O 818631695 NBWSQJWOWAKVOS-UHFFFAOYSA-N 295.335 2.102 10 20 CECD COc1cccc(CN[C@@H](C2CC2)[C@@H](CO)C2CC2)c1O 824846241 QIQIZGJKTNUVOE-HOCLYGCPSA-N 291.391 2.288 10 20 CECD CCN(CC(=O)O)Cc1cc(Cl)cc(C(C)=O)c1O 829635708 QSJFIUPVWWVPEM-UHFFFAOYSA-N 285.727 2.155 10 20 CECD CCc1cc(C(=O)NCc2cc(Cl)ccc2O)n(C)n1 824212983 FCDFWBVMGXKHOJ-UHFFFAOYSA-N 293.754 2.272 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)[C@H](C)N)cc1 826020703 WYQXXMWUWIGVKB-KGLIPLIRSA-N 291.439 2.475 10 20 CECD CN(C)c1ncccc1NC(=O)/C=C\c1ccc(O)c(O)c1 588405806 YOQXXVOFVGNFRI-VURMDHGXSA-N 299.330 2.211 10 20 CECD CN(C)c1ccc(/C=C/CNC(C)(C)C(=O)O)cc1 901488356 IQPGEEDGSMBRLJ-AATRIKPKSA-N 262.353 2.219 10 20 CECD CCC[C@@H](CNC(=O)NCc1cc(OC)ccc1O)OC 838474996 VSUFSZBFMBIZLO-ZDUSSCGKSA-N 296.367 2.015 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@@H]1C(=O)O 901481882 GBZZOEISKNWEMP-LSDHHAIUSA-N 276.380 2.404 10 20 CECD C[C@@H]1CCCCN1[C@H](C)CNC(=O)c1cc(O)cs1 732271200 QRFLTHLODUJGOC-GHMZBOCLSA-N 282.409 2.446 10 20 CECD Cc1cnn(C)c1C(=O)NCCCSc1nccs1 839679771 COLUJPIEKXODEM-UHFFFAOYSA-N 296.421 2.097 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@H]2CCCN2CCCO)c1 834850035 IUKVSVDGOLKZPF-HUUCEWRRSA-N 292.423 2.198 10 20 CECD CCOc1ccc(CNCc2cnc(C)o2)c(O)c1 839170671 RMVZFBGVLBCLJW-UHFFFAOYSA-N 262.309 2.377 10 20 CECD Cc1cc(N(C)C)ccc1CNCCc1cn[nH]c1 840946488 LHOZKXUXINIXMS-UHFFFAOYSA-N 258.369 2.116 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCc2c[nH]nc2C1 840935061 CZAJNFVUYURDHR-HNNXBMFYSA-N 284.407 2.431 10 20 CECD CC(C)[C@H](N)CNCc1cccc(Br)c1O 841029948 PMTNUJUIDLZPOW-LLVKDONJSA-N 287.201 2.228 10 20 CECD O=C(COc1ccc(F)cc1F)NCc1ccccc1O 748346673 SFOJBWIIAXXPDM-UHFFFAOYSA-N 293.269 2.366 10 20 CECD C[C@@H](NCc1nnnn1C1CC1)c1ccc(Cl)cc1O 841747461 BJKUGJVATHHXQV-MRVPVSSYSA-N 293.758 2.218 10 20 CECD C[C@H]1OCC[C@H]1C(=O)NCc1cc(Cl)ccc1O 846473540 MSTSQWKRZKPZLJ-LDYMZIIASA-N 269.728 2.087 10 20 CECD CCc1cccc(CN2CC[S@@](=O)C[C@@H](C)C2)c1O 848907306 LDFJJORYLUQPLV-HXPMCKFVSA-N 281.421 2.155 10 20 CECD Cc1ccc(C(=O)N[C@H]2CS[C@H](C)C2)c(O)c1O 840511270 XKDYDZZQBWSQOO-RKDXNWHRSA-N 267.350 2.030 10 20 CECD C[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)CC2(CCC2)O1 844151942 ACOGNPIRCVYJNP-SECBINFHSA-N 295.310 2.021 10 20 CECD CC(C)(CCc1noc(Cc2ccc(N)cc2)n1)[N+](=O)[O-] 843234644 WPBFVTWUTAJRKS-UHFFFAOYSA-N 290.323 2.231 10 20 CECD COC[C@@H](C)CNC(=O)NCc1cc(Cl)ccc1O 845006323 WQJMSRUBZDJZRH-VIFPVBQESA-N 286.759 2.127 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)[C@@](C)(CO)C2)c1O 852701916 VTONRMMJIFCCOI-QLJPJBMISA-N 295.354 2.184 10 20 CECD CN(CC1=CCSC1)C(=O)/C=C/c1ccc(O)c(O)c1 856370576 XIKDQSJYQUMHNV-HWKANZROSA-N 291.372 2.243 10 20 CECD OCc1cccnc1NCc1ccc(N2CCOCC2)cc1 922289317 KPIQOLCHXOYQRE-UHFFFAOYSA-N 299.374 2.023 10 20 CECD C[C@@H]1CN(C2CC2)C[C@H]1NCc1ccc(N(C)C)cc1 757708298 XIFJWPXWXXECMG-CXAGYDPISA-N 273.424 2.325 10 20 CECD C[C@@H](NC(=O)[C@H]1Cc2ccccc2CN1)c1ccccc1O 877256315 RZRFSGNXWJHJDE-MLGOLLRUSA-N 296.370 2.284 10 20 CECD CCC1(O)CCC(NC(=O)NCc2ccccc2O)CC1 772080971 GVGLSFNXTLFQPG-UHFFFAOYSA-N 292.379 2.275 10 20 CECD COc1ccc(CNC(=O)NC[C@H]2C=CCC2)c(O)c1 883782581 HMSWEYITXWEWPZ-NSHDSACASA-N 276.336 2.166 10 20 CECD C[C@H]1[C@H](C)N(Cc2ccc(N(C)C)cc2)CCN1C 775986903 SNMLISOYSZIKOX-KBPBESRZSA-N 261.413 2.277 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)nc1 773766852 QRLXFLLAFFUDLX-NSHDSACASA-N 286.331 2.162 10 20 CECD C[C@@H](NC[C@@]1(O)CCSC1)c1c(O)cccc1F 886536985 ROODOAFWKJSCFT-RNCFNFMXSA-N 271.357 2.050 10 20 CECD CCc1cnccc1CNC(=O)c1ccc(C)c(O)c1O 781021353 PAAZBTJTCBAUDM-UHFFFAOYSA-N 286.331 2.294 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1C[C@H]1F 1123496617 YVZNTEYSSYCOAL-UONOGXRCSA-N 262.328 2.261 10 20 CECD COC(=O)[C@@](C)(NCc1ccc(N(C)C)cc1)C1CC1 785767349 YWVSIFXRHFOVAG-INIZCTEOSA-N 276.380 2.184 10 20 CECD COc1ccc(CN2CCCCC[C@@H]2CO)c(O)c1OC 895193308 TZQPTRHKAPHYPH-CYBMUJFWSA-N 295.379 2.146 10 20 CECD COc1ccc(CN[C@H](C)COCC2CC2)c(O)c1OC 895168684 ARSHHQJHPPHJNT-LLVKDONJSA-N 295.379 2.314 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1n[nH]cc1C 799588409 ANICMSNMBORBSF-UHFFFAOYSA-N 286.379 2.446 10 20 CECD CC1CCN(C(=O)NCCc2ccc(N)cc2)CC1 91972362 IRPFHCRZOHKPBY-UHFFFAOYSA-N 261.369 2.253 10 20 CECD C[C@H](N[C@H](C)c1cc(F)ccc1O)c1nncn1C 94617330 SZGGYRKQBHWMMF-BDAKNGLRSA-N 264.304 2.072 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2C[C@H](O)C2(C)C)cc1F 1329389539 LYSCXYJPJAOBFC-KBPBESRZSA-N 284.350 2.280 10 20 CECD C[C@H]1CC2(CCNCC2)CN1Cc1ccc(N)cc1 1334755154 XVSYBIDNVDBALT-ZDUSSCGKSA-N 259.397 2.233 10 20 CECD CN(C)c1ccc(CNCC(C)(C)CC(=O)O)cc1 1255787122 VKTRSMDMNSFHSC-UHFFFAOYSA-N 264.369 2.343 10 20 CECD COc1cc(O)c(CN2C[C@H]3C=C[C@H]2C3)cc1OC 1333315310 BDHVSZMVRLRHPY-JQWIXIFHSA-N 261.321 2.170 10 20 CECD C[C@@H]1OCC[C@H]1C(=O)Nc1c(Cl)ccc2nonc12 1261140085 HNLALRYXWGAHCJ-NKWVEPMBSA-N 281.699 2.240 10 20 CECD Cc1conc1COc1ccc(N(C)C)c(C(=O)O)c1 1607923496 VGYRWUYZIXJLKV-UHFFFAOYSA-N 276.292 2.326 10 20 CECD Cc1nccnc1CSc1ncc(C(=O)O)s1 1607991455 RHOIIABRGWXMNW-UHFFFAOYSA-N 267.335 2.232 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](N)C[C@@H]2C)c1O 229104730 LZNIGIMYPJFGHQ-CABZTGNLSA-N 284.787 2.366 10 20 CECD C[C@@H](N[C@H]1CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589974561 YSBYJHRDYKNGHO-KCJUWKMLSA-N 273.340 2.021 10 20 CECD CN(CCC(=O)O)Cc1ccc2ccccc2c1O 1593740013 GIAOGGUYSRMQPH-UHFFFAOYSA-N 259.305 2.452 10 20 CECD CCO[C@@H](C)c1nccn1CC(=O)c1ccc(O)c(O)c1 155539698 YHWVXRYQYJZFDA-JTQLQIEISA-N 290.319 2.275 10 20 CECD C[C@H](NCc1cnsn1)c1ccc(N(C)C)cc1 846861204 PBLNBOFVBKGQTK-JTQLQIEISA-N 262.382 2.455 10 20 CECD Cc1ccc(O)c([C@H](C)NCCc2ccnn2C)c1 184011824 OHILMZFQZPQJIK-LBPRGKRZSA-N 259.353 2.327 10 20 CECD CCOc1cccc(CN[C@@H]2CO[C@H](C)C2)c1O 402351357 SHVCXWRNOTZAGT-PWSUYJOCSA-N 251.326 2.058 10 20 CECD COc1cccc(CN2CCC[C@@H]3COC[C@@H]32)c1O 690779337 CDTUPTQQZSRRRC-OLZOCXBDSA-N 263.337 2.012 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)C1CCCCC1 383922112 HRSIBTANBBISMY-UHFFFAOYSA-N 283.393 2.487 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)[C@H]1CCCCN1 386111701 LOBGNYIJJXMDJT-XJKSGUPXSA-N 261.413 2.373 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@]2(C)CCOC2)c1 397117934 JYCGYJHRZLWNEQ-XHDPSFHLSA-N 265.353 2.478 10 20 CECD CCN(C)CCN[C@H](C)c1cc(OC)ccc1O 54109855 OHCHOCFBTHFSLC-LLVKDONJSA-N 252.358 2.003 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccc[nH]c1=O 60349133 AKKUPRNHZPSBJG-UHFFFAOYSA-N 286.331 2.133 10 20 CECD Cc1nnc(Sc2ncc([N+](=O)[O-])s2)s1 34581200 VJGYZUZDTHJVAE-UHFFFAOYSA-N 260.325 2.362 10 20 CECD CSC1(C(=O)N2CCOc3cc(N(C)C)ccc32)CC1 188905280 SYUUTIJSRIZFSS-UHFFFAOYSA-N 292.404 2.374 10 20 CECD CO[C@H](C)CN[C@H](C)c1ccc(N2CCOCC2)cc1 182431114 WVAFCWFNBOYPBC-ZIAGYGMSSA-N 278.396 2.209 10 20 CECD CN(CC(F)F)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 136876229 KBYUBHCLTIVEDB-HWKANZROSA-N 286.234 2.394 10 20 CECD Cc1cc(C(=O)N[C@@H](C)C(=O)O)c(C)n1-c1ccccc1 237467945 IYXFKMGIDFUKLU-NSHDSACASA-N 286.331 2.297 10 20 CECD COc1cc(Cl)cc(CNCC2(CO)CCC2)c1O 184744790 HSLYBROVDFTOKA-UHFFFAOYSA-N 285.771 2.306 10 20 CECD O=C1OCC[C@]12CCCN2Cc1c(O)ccc(Cl)c1F 365234457 NTGLUXUCFXCBHG-CQSZACIVSA-N 299.729 2.466 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2ccn(C)c2)c1 273612093 WFOLUGQYRBELQM-LLVKDONJSA-N 288.347 2.368 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1cc(Cl)cc(OC)c1O 273477941 IFKFWFIOFQAWID-AWEZNQCLSA-N 298.770 2.285 10 20 CECD C[C@@H](CO)CCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273359603 DLHUSNJLNZHSQD-GHMZBOCLSA-N 282.340 2.360 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@H]1CCC[C@H]1O 271243655 GOKUTTBQEJZCTI-GDBMZVCRSA-N 262.397 2.345 10 20 CECD CCCc1cc(=O)oc2cc(OCC(=O)C(C)=O)ccc12 289734898 SYEPFQZLIYVZHY-UHFFFAOYSA-N 288.299 2.282 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1c(O)cccc1Cl 280997353 XKWYXVJNBNQTMG-MRVPVSSYSA-N 257.717 2.039 10 20 CECD CN(Cc1ccccc1O)C(=O)CN1CCc2ccccc21 299166214 QYPWJBRUSKBMDF-UHFFFAOYSA-N 296.370 2.413 10 20 CECD COC1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CCCC1 295484057 FAQLGPMNSLRUMX-FNORWQNLSA-N 291.347 2.186 10 20 CECD CC[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)[C@H]1CCOC1 817940429 GEWXFPVDAFAPBK-XIRDDKMYSA-N 291.439 2.157 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C2CNC2)cc1F 817903490 PVXQVOQRBPDCAE-GFCCVEGCSA-N 279.403 2.369 10 20 CECD Cc1cc(O)c(CNC2(CO)CCC2)cc1Cl 825413023 QYBDUILWHPWPGN-UHFFFAOYSA-N 255.745 2.359 10 20 CECD CO[C@]1(C)C[C@H](NC(=O)c2cc(O)cs2)C1(C)C 829414582 CYVLMEWVJCZMCF-GXFFZTMASA-N 269.366 2.387 10 20 CECD CCOCc1cc(CNCCC2(CO)CC2)ccc1OC 825040430 KCZYDWXXFBAFDR-UHFFFAOYSA-N 293.407 2.484 10 20 CECD Cc1cccnc1N(C)C(=O)/C=C/c1cccnc1 491994828 BXDOZCODORSIHM-BQYQJAHWSA-N 253.305 2.461 10 20 CECD CCn1cncc1/C=C1/SC(N2CCCCC2)=NC1=O 901436526 UWVCWTOUXDETOD-XYOKQWHBSA-N 290.392 2.359 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCc2ccc3c(c2)CCCO3)C1 900041569 QOERNNRFRJBYOY-KGLIPLIRSA-N 275.348 2.355 10 20 CECD CC(C)N1CC[C@H](N(C)C(=O)c2cc(O)cs2)C1 839790516 AXJLYXZHXQNOIM-JTQLQIEISA-N 268.382 2.008 10 20 CECD O=S(=O)(CCCCF)NCc1cc(Cl)ccc1O 845995719 FLJSRXNNTRSYOO-UHFFFAOYSA-N 295.763 2.215 10 20 CECD CCCNCCNCc1cccc(Br)c1O 841047262 YICYGVPHFXXMHD-UHFFFAOYSA-N 287.201 2.244 10 20 CECD CCc1cccc(CN2C[C@@H](C)O[C@@H](COC)C2)c1O 848905151 HVTVLUBQZGOPQU-IUODEOHRSA-N 279.380 2.190 10 20 CECD CCN1C(=O)/C(=C\c2cncc(OC)c2)SC1=S 849175814 WQSVHACTYQHNOW-BJMVGYQFSA-N 280.374 2.311 10 20 CECD CC[C@](C)(O)CN[C@H](C)c1cccc(OC)c1O 846148223 YDSRANTUMRSIPH-YGRLFVJLSA-N 253.342 2.212 10 20 CECD CN(CC(F)(F)C(F)F)c1ccc(OCC(=O)O)cc1 846280530 ZZJRFXXIPIZNNU-UHFFFAOYSA-N 295.232 2.487 10 20 CECD CN(Cc1ccccc1O)C(=S)NC[C@H]1CCCCO1 758197731 KPLOGRXGLJPCDV-CYBMUJFWSA-N 294.420 2.268 10 20 CECD CN1CCC[C@@H](CNCc2cc(F)c(N(C)C)cc2F)C1 858132194 VZURBURXGJJFMY-LBPRGKRZSA-N 297.393 2.462 10 20 CECD C[C@H](NC[C@H](C)S(C)(=O)=O)c1cc(Cl)ccc1O 756768945 BJWXMZDXRWTURX-IUCAKERBSA-N 291.800 2.129 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](O)c2ccccn2)c1 851900101 PDDGCEFXMAJQKC-BDJLRTHQSA-N 288.347 2.180 10 20 CECD CCOc1ccc(CN2CCO[C@@H](C)[C@H]2C)c(O)c1 769423464 RXKLZSJAXJBCQB-NEPJUHHUSA-N 265.353 2.400 10 20 CECD O=C(c1cc(O)cs1)N1CCCC[C@@H]1c1ncon1 764510073 AIOPOFCYZBCXPP-SECBINFHSA-N 279.321 2.204 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H]1C[C@H](C)O 769451867 NWQDOJBGISCRIS-NWDGAFQWSA-N 265.353 2.136 10 20 CECD OC1CCN(c2ccc(CNCC(F)F)cc2)CC1 877518932 VJIQDZQWWWRESF-UHFFFAOYSA-N 270.323 2.002 10 20 CECD CCOCc1nc([C@@H](C)NCc2ccc(C)cc2O)no1 877541099 LJOPKRGXGMHEKP-LLVKDONJSA-N 291.351 2.471 10 20 CECD C[C@H](C[C@@H]1CCOC1)NC(=O)/C=C\c1ccc(O)c(O)c1 779527990 FGGKZOKDLNFGLR-CLZWFORCSA-N 291.347 2.042 10 20 CECD C[C@H](N[C@H](C)C(=O)NCC(F)(F)F)c1ccccc1O 879651921 PFPFIZLKWUJDDJ-DTWKUNHWSA-N 290.285 2.110 10 20 CECD CC(C)CS(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773084332 PIFRQMDHLKOXJM-LBPRGKRZSA-N 284.425 2.389 10 20 CECD O=C(CC1CCSCC1)NCc1ccc(O)c(O)c1 778916384 GMMOWLWMSADSRF-UHFFFAOYSA-N 281.377 2.247 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2c3c[nH]nc3CC[C@@H]2C)c1 880837962 WKLDKXSMCJUSRU-MEDUHNTESA-N 299.374 2.406 10 20 CECD Cc1cc(O)c(CNCCO[C@@H]2CCOC2)cc1Cl 897201729 MDUJWJFMUGDWQR-GFCCVEGCSA-N 285.771 2.249 10 20 CECD COc1cc(C)cc(CN[C@H]2CCn3ccnc3C2)c1O 894494316 NMQPNUMPWLQHFB-ZDUSSCGKSA-N 287.363 2.010 10 20 CECD C[C@H](NC(=O)CCc1cnc[nH]1)c1ccc(N(C)C)cc1 793855640 KXKDHYHAYLDWNB-LBPRGKRZSA-N 286.379 2.286 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN(C)[C@H](C)C2)c1O 894313002 QCUGOQAKEVVCED-OCCSQVGLSA-N 278.396 2.282 10 20 CECD CC[C@H](NCCN(C)C(=O)OC)c1ccccc1O 689585801 RWTPTEBXTHOIMF-LBPRGKRZSA-N 266.341 2.131 10 20 CECD OCC1(NCc2ccc(Br)cc2O)CCC1 691427789 HCMLRRFERJJJIX-UHFFFAOYSA-N 286.169 2.159 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCO[C@H](C)C1 770745326 GRVDJOIUNBTYMG-NEPJUHHUSA-N 265.353 2.306 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](C)n2ccnc2)c1 1322522648 VGFORVLJWMTLNA-MNOVXSKESA-N 289.335 2.036 10 20 CECD COc1ccc(CNC(=O)c2[nH]c(C)cc2C)c(O)c1 1321066936 CZFXTVHEZWLOIM-UHFFFAOYSA-N 274.320 2.276 10 20 CECD CN(C[C@@H]1CC1(C)C)C(=O)NCc1ccc(N)cc1 1337018228 IGYPEHRWFXKDME-LBPRGKRZSA-N 261.369 2.456 10 20 CECD C=C=CCNC(=O)NCCCSc1nccs1 1348591946 REVZIICVORPJQH-UHFFFAOYSA-N 269.395 2.266 10 20 CECD CN(C)[C@@H]1CCCC[C@@H]1NC(=O)c1cc(O)cs1 1350552922 JVVMWGOKKCCREG-WDEREUQCSA-N 268.382 2.056 10 20 CECD CCOC(=O)[C@H](CC)Sc1ncc(C(=O)O)s1 1605510477 YHDDLIQGLRNQFW-LURJTMIESA-N 275.351 2.275 10 20 CECD CO[C@@H]1CCN(Cc2cc(Cl)ccc2O)[C@@H](C(=O)O)C1 1610238132 TZVRKBJJFBBDQZ-VXGBXAGGSA-N 299.754 2.110 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](N)[C@@H](C)C2)c1O 229104472 INUYZXOVBXQHPS-CABZTGNLSA-N 284.787 2.223 10 20 CECD COc1cccc(CN2CC[C@H](C)C[C@@H]2C(=O)O)c1O 1599672549 IFDOIONXNAVJGU-CMPLNLGQSA-N 279.336 2.086 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H]1[C@@H](C(=O)O)C1(F)F 1599628307 MPZXVSWQYFPRTC-AAEUAGOBSA-N 297.301 2.414 10 20 CECD C[C@H](NCC[C@H](O)C1CC1)c1cc(F)ccc1O 903406159 GZZFINDKWOMNGD-ZANVPECISA-N 253.317 2.343 10 20 CECD COc1cccc(CN[C@H]2CCN3CCC[C@H]3C2)c1O 252666923 CUVLSCBCTBJFPJ-KBPBESRZSA-N 276.380 2.117 10 20 CECD CN(Cc1ccccc1O)C(=O)C1CCSCC1 264851056 ZYRAJIHLCOXRTO-UHFFFAOYSA-N 265.378 2.494 10 20 CECD CN(C)CC(C)(C)NCc1cccc(Cl)c1O 308608471 NFOHXPDSZUHXDB-UHFFFAOYSA-N 256.777 2.475 10 20 CECD CC[C@]1(NCc2cccc(OC)c2O)CCOC1 386009510 UIOKKZBCYGDFSA-AWEZNQCLSA-N 251.326 2.060 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Cc2ccncc2)c1 121735002 LMTCWQHPOFVPEQ-LLVKDONJSA-N 286.331 2.216 10 20 CECD CC(C)(C)CNC(=O)C(C)(C)NCc1ccccc1O 121236842 YEPMZJOAUKTSAB-UHFFFAOYSA-N 278.396 2.423 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C=C1CCC1 186397164 PQWXDJYCLYFBJL-SNVBAGLBSA-N 261.321 2.255 10 20 CECD C[C@H](NCCN1CCOCC1(C)C)c1ccccc1O 183488394 VOKORRBRZUIMLC-ZDUSSCGKSA-N 278.396 2.154 10 20 CECD C[C@]1(O)CCN(Cc2cccc(Br)c2O)C1 180193493 FHBOYGWVZMGQQK-LBPRGKRZSA-N 286.169 2.111 10 20 CECD C[C@@H]1COCCN1Cc1ccc(N(C)C)c(F)c1 130748081 JIOKCISZVGQDFV-LLVKDONJSA-N 252.333 2.112 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2ccnn2C)cc1 195250435 WDSZEQWSYUPOTL-UHFFFAOYSA-N 286.379 2.196 10 20 CECD Cc1ccc(C(=O)NCCc2ccc(O)c(O)c2)c(O)c1 98074643 LRGDZELULLVTQI-UHFFFAOYSA-N 287.315 2.084 10 20 CECD CC(C)CS(=O)(=O)N(C)Cc1ccc(N(C)C)cc1 263717697 QXKLBVBCGBOZRX-UHFFFAOYSA-N 284.425 2.170 10 20 CECD O=C(NCC[C@@H]1CCCCO1)NCc1ccccc1O 272520929 JXRBZFIIWVJPKR-ZDUSSCGKSA-N 278.352 2.151 10 20 CECD CCN(CC)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273297353 AKSAZGKSMWJOPG-NSHDSACASA-N 281.356 2.293 10 20 CECD Cc1cccc(CN2CCO[C@]3(CCO[C@H]3C)C2)c1O 279607295 FFYMFZSTCKQPPT-XJKSGUPXSA-N 277.364 2.080 10 20 CECD CCCc1nc(C(=O)NCc2ccccc2O)co1 273587813 FQBFFOYMAIYAAK-UHFFFAOYSA-N 260.293 2.263 10 20 CECD CC(C)[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCO1 271567479 SZLUIDKLAAXONB-DZGCQCFKSA-N 292.379 2.395 10 20 CECD C[C@]1(CNCc2ccc(N3CCOCC3)cc2)CCOC1 397168541 CXIVPXXWYUCIAE-QGZVFWFLSA-N 290.407 2.039 10 20 CECD Cc1nccnc1CCN[C@H](C)c1ccccc1O 295071808 SCXTYYRKFJCDRG-LLVKDONJSA-N 257.337 2.384 10 20 CECD CCOc1ccc(CN2CCOCC23CC3)c(O)c1 802658454 BRAKBVDNTKWCPD-UHFFFAOYSA-N 263.337 2.156 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)[C@H](CO)CC(C)(C)C 825039920 BKDHABDSCUROBH-LBPRGKRZSA-N 295.379 2.350 10 20 CECD Cc1noc([C@@H](C)NCc2ccc(N(C)C)cc2)n1 729683824 BWXOTXCJWDWFAX-SNVBAGLBSA-N 260.341 2.295 10 20 CECD Cc1ccc(O)c(CN(CC(F)F)C[C@@H](C)O)c1 825098395 IDGUYGKQYRBZND-SNVBAGLBSA-N 259.296 2.149 10 20 CECD CN(C)c1ccc(CN(C(=O)[C@@H](O)C2CC2)C2CC2)cc1 821033410 SENUMYGBTHZXLE-INIZCTEOSA-N 288.391 2.015 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H](N3CC=CC3)C1)CCC2 742161935 APTZBBWBFDIZIV-QGZVFWFLSA-N 284.403 2.327 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN[C@H](C)C2)c1O 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CC(C)CCO[C@@H](C)C(=O)NCc1ccc(O)c(O)c1 159135411 TYKSQJQNPQOFBW-NSHDSACASA-N 281.352 2.165 10 20 CECD CN(C)c1ccc(CN(CC(=O)O)C2CCC2)cc1 848640662 UFXNJDQTSVYCGX-UHFFFAOYSA-N 262.353 2.192 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](C)CN(C)C)c1 293692562 NVTLINWRVQMVHU-VXGBXAGGSA-N 266.385 2.249 10 20 CECD Cc1cc(CN[C@@H]2CCc3cccc(O)c32)n(C)n1 296581202 WBCJTPPBICXDGC-CYBMUJFWSA-N 257.337 2.211 10 20 CECD COc1ccc(CNCCc2cncn2C)cc1C 401753978 ZOZMARMZNARQMW-UHFFFAOYSA-N 259.353 2.069 10 20 CECD COCCCN(CCOC)Cc1cc(F)cc(F)c1O 708382730 HGEVNQWYGIPHOW-UHFFFAOYSA-N 289.322 2.155 10 20 CECD COc1ccc(O)c(CN[C@@H]2CS[C@H](C)C2)c1 397962966 ISFXLPLUKNATKP-KOLCDFICSA-N 253.367 2.384 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NC1CCOCC1 115662835 QVLXIRKUTALVSN-UHFFFAOYSA-N 291.395 2.039 10 20 CECD CCOC(=O)C1CCN(Cc2cc(F)ccc2O)CC1 179867808 PZWQWZNLTQPFSX-UHFFFAOYSA-N 281.327 2.306 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(C=O)[nH]1 175104870 YTULUUFXHZRQAW-UHFFFAOYSA-N 285.347 2.165 10 20 CECD CCCCCN(CC(N)=O)Cc1cc(OCC)ccc1O 180808169 XMWDJZLXOCBMDO-UHFFFAOYSA-N 294.395 2.268 10 20 CECD CCOc1cccc(CN2CCCN3CCC[C@@H]3C2)c1O 134202386 GWPXGWGYZMLQBS-OAHLLOKOSA-N 290.407 2.461 10 20 CECD C[C@@H](CN1CCCCC1)NCc1cc2c(cc1O)OCO2 42880073 YGRGRTSPTQABIE-LBPRGKRZSA-N 292.379 2.085 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)c1cccc(O)c1O 193096412 HSXCDDMJLZEXSH-VIFPVBQESA-N 267.325 2.031 10 20 CECD COCC(C)(C)N(C)Cc1cccc(OC)c1O 292862650 VMSMKTQKWOWBAM-UHFFFAOYSA-N 253.342 2.258 10 20 CECD CCOC(=O)[C@@H](C)NCc1ccc(N2CCCC2)cc1 49371374 OHBYVRSRZNYTGM-CYBMUJFWSA-N 276.380 2.328 10 20 CECD CCn1nncc1CN[C@H](C)c1ccc(C)c(C)c1O 527919184 FNEQJLAWQMMHET-GFCCVEGCSA-N 274.368 2.471 10 20 CECD C/C=C(\C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 267572406 JLQIDLMCIRDGAH-KGVSQERTSA-N 292.354 2.245 10 20 CECD C[C@@H]1C[C@@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 272356708 AZOVWRSMHOHHQX-QIPCVNDGSA-N 291.347 2.042 10 20 CECD CC(C)[C@@H](C)CC(=O)NCc1ccc(O)c(O)c1 158993060 XYQLAEVRNDZQQN-JTQLQIEISA-N 251.326 2.396 10 20 CECD COc1cccc(CNC(=O)C[C@@H]2CCC(=O)[C@H]2C)c1O 280018848 TZKOCDHTVHRGAT-QWRGUYRKSA-N 291.347 2.022 10 20 CECD CC[C@@H]1CN(Cc2ccccc2O)C[C@H](C)[S@]1=O 289586373 KFAVSSOQVPJPMO-WHWRDJHUSA-N 267.394 2.124 10 20 CECD Cc1cc(CN(C)Cc2nccn2C)ccc1N(C)C 293721605 FRQPMZPZJGNGBF-UHFFFAOYSA-N 272.396 2.427 10 20 CECD Cc1ccc(CN[C@@H]2CCc3cccc(O)c32)c(=O)n1C 296518806 QUWMQGQIPQNGEP-CQSZACIVSA-N 284.359 2.176 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 298665733 QMJCIQQOHDOAQD-LSDHHAIUSA-N 276.380 2.136 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2O[C@H](C)C[C@@H]2C)c1 800519153 MIFLTFRXLBHBQG-BQVMBELUSA-N 293.363 2.392 10 20 CECD C[C@H](NC(=O)C(=O)c1cccn1C)c1ccc(N(C)C)cc1 807273988 FBRDCVWLCHGUGH-LBPRGKRZSA-N 299.374 2.151 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](NC(C)=O)C2)cc1 817412805 PNSHGFLJEANYGH-INIZCTEOSA-N 289.423 2.243 10 20 CECD O=Cc1nc(/C=C\c2ccc(N3CCC(O)CC3)cc2)c[nH]1 905085837 UAXUFGCVMHSVBR-RJRFIUFISA-N 297.358 2.354 10 20 CECD CCN(Cc1cc(Cl)c(C)cc1O)[C@@H]1CCNC1=O 825773528 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CECD C[C@@H]1C[C@@H](O)CN1Cc1c(O)ccc(Cl)c1F 792178047 BMONHJFPXHJTOK-HTQZYQBOSA-N 259.708 2.140 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)CC[C@@H]1O 792181281 ZSBVEHBTXQHOGB-KCJUWKMLSA-N 273.735 2.387 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](C(=O)NC3CC3)C2)c1 1319701657 JBLUMYPPIGJBGA-ZDUSSCGKSA-N 288.391 2.191 10 20 CECD CO[C@@H]1CCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1 1337744234 RNGWBIHFFLQZGY-HUUCEWRRSA-N 276.380 2.184 10 20 CECD CCO[C@@H]1CCCC[C@H]1NC(=O)NCc1ccc(N)cc1 1357434376 IZCYMFHQMYNCON-HUUCEWRRSA-N 291.395 2.416 10 20 CECD C[C@@H](N[C@H]1CC=C(C(=O)O)C1)c1c(O)cccc1F 1604331016 SYDYYYVVJALTHI-SCZZXKLOSA-N 265.284 2.355 10 20 CECD CN(C)c1cc(F)c(CNC2(C)CCNCC2)cc1F 1578423040 NRHVHBPOHRSQOA-UHFFFAOYSA-N 283.366 2.263 10 20 CECD C[C@](O)(CC(=O)NCc1ccc(N)cc1)c1ccccc1 1576261131 XZGAEFQTNXXWII-KRWDZBQOSA-N 284.359 2.183 10 20 CECD C[C@@]1(C(=O)O)CCCN1Cc1cc(F)c(F)cc1O 1589186760 CBORHBKDKNBNAD-ZDUSSCGKSA-N 271.263 2.110 10 20 CECD O=C(O)[C@@H]1CC[C@H]1C(=O)NCc1c(O)ccc2ccccc12 1595181706 RYALCCHDSNZDFU-CHWSQXEVSA-N 299.326 2.272 10 20 CECD CCN1CCc2cc(CN[C@H]3C=C[C@@H](C(=O)O)C3)ccc21 1776877505 OZYXJAYEODGHOI-CABCVRRESA-N 286.375 2.188 10 20 CECD CC[C@@H](C)OCC(=O)N[C@@H](C)c1cc(OC)ccc1O 162187466 LNXQCRKFKBGGHF-MNOVXSKESA-N 281.352 2.393 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)c1ccn(C)n1 839190539 HRDVCOKNTZBMKJ-LLVKDONJSA-N 257.337 2.206 10 20 CECD Cc1nccn1CCCNCc1cc(F)cc(F)c1O 882903341 AJLMUNAJXFSIGO-UHFFFAOYSA-N 281.306 2.355 10 20 CECD Oc1ccc(Cl)cc1CN[C@@H]1C[C@H]2CC[C@@H]1O2 152757287 HHYFRTAETOBUOW-WZRBSPASSA-N 253.729 2.455 10 20 CECD CC1(NCc2cc(F)cc(F)c2O)CCOCC1 708438602 XHYLKVAFLDKXAC-UHFFFAOYSA-N 257.280 2.329 10 20 CECD C[C@@H](NC[C@@H](O)CC(F)(F)F)c1ccccc1O 879649456 UHBPITKWCFLNLB-BDAKNGLRSA-N 263.259 2.356 10 20 CECD CN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)CC1CC1 52128159 PRPWEFRWANJWPG-UHFFFAOYSA-N 289.423 2.053 10 20 CECD COCC[C@H](C)NC(=O)N[C@@H](C)c1cc(OC)ccc1O 103515418 HBUJTTRTUYMIEE-QWRGUYRKSA-N 296.367 2.186 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H](C(=O)O)C2)c1O 178897940 QUYFZZDENRIZTC-VIFPVBQESA-N 297.738 2.155 10 20 CECD CN(C)C(=O)c1ccnc(NCc2ccc(N(C)C)cc2)c1 112513198 KVVOULJABFAQPE-UHFFFAOYSA-N 298.390 2.462 10 20 CECD Cc1cccc(CN2CCN(CC3CC3)CC2)c1O 179753919 SCWFSZVFGULRGA-UHFFFAOYSA-N 260.381 2.228 10 20 CECD CCCN(CCC1OCCO1)Cc1ccccc1O 124490394 PKMJNOODCYLTFY-UHFFFAOYSA-N 265.353 2.367 10 20 CECD Cc1ccc(C[C@H](CO)NCc2ccccc2O)cc1 188981677 AFAFBAYZJZPMHJ-MRXNPFEDSA-N 271.360 2.394 10 20 CECD C[C@@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H](C)S1 126430719 WMUXAFHDIHAHSI-RKDXNWHRSA-N 267.350 2.064 10 20 CECD COc1ccc(O)c(CN[C@H]2CCCc3c2cnn3C)c1 37087196 QUPZJIGISJUSDX-AWEZNQCLSA-N 287.363 2.302 10 20 CECD COCC(C)(C)C(=O)N[C@@H](C)c1cc(OC)ccc1O 131502305 FUKKHPZJELZHPP-JTQLQIEISA-N 281.352 2.251 10 20 CECD C[C@@H](NCCc1cn[nH]c1)c1ccc(N(C)C)cc1 289738287 KMDMWPFOWSEAMO-GFCCVEGCSA-N 258.369 2.369 10 20 CECD CCc1nnc(CN(C)c2ccc(OC)cc2OC)o1 132128803 SXTCBLBDNOSVPN-UHFFFAOYSA-N 277.324 2.286 10 20 CECD Cc1ncsc1C(=O)N(C)Cc1ccccc1O 48606776 SJWCHEQRKUXIBU-UHFFFAOYSA-N 262.334 2.429 10 20 CECD COc1cccc(CNCCc2scnc2C)c1O 295062685 QLMHDZFPGVZDSK-UHFFFAOYSA-N 278.377 2.498 10 20 CECD CCOc1cccc(CN[C@@H](CC(C)C)C(=O)O)c1O 43432017 NIJNPCKHIVEKMU-LBPRGKRZSA-N 281.352 2.380 10 20 CECD CCOC(=O)CN(CC)c1ccc(OC)c(OC)c1 266023918 XTVPOMVUZMPPPA-UHFFFAOYSA-N 267.325 2.093 10 20 CECD C[C@@H]1OCC[C@@]12CN(Cc1cccc(Cl)c1O)CCO2 279702520 RITZWNCYFBFARK-XHDPSFHLSA-N 297.782 2.425 10 20 CECD COC(=O)[C@@H]1CCCCCN1Cc1ccccc1O 360020603 VBBUSTCZADCLRS-ZDUSSCGKSA-N 263.337 2.310 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)COC1CCCC1 274895601 DWKDORPMEPSQKR-LLVKDONJSA-N 293.363 2.104 10 20 CECD CC[C@@H](NCCCC(=O)NC)c1ccc(C)cc1O 280113175 NSTPNIWRPUTGRG-CYBMUJFWSA-N 264.369 2.268 10 20 CECD CN(C)c1ccc(CN(C(=O)Cn2cccn2)C2CC2)cc1 298375967 NSDVAFMMXCEFEO-UHFFFAOYSA-N 298.390 2.140 10 20 CECD Cc1nc(CCNCc2ccc3ccccc3c2O)n[nH]1 816566563 YZXPQPNAKFZNGF-UHFFFAOYSA-N 282.347 2.304 10 20 CECD C[C@H]1CN(Cc2ccc3ccccc3c2O)C[C@H](CO)O1 816588172 HTUWQVKTPFTUND-SWLSCSKDSA-N 287.359 2.127 10 20 CECD CCOc1ccc(CN(C)[C@H]2CC(C)(C)OC2=O)c(O)c1 814181131 WBLIKEDTRAOJMX-ZDUSSCGKSA-N 293.363 2.317 10 20 CECD COC[C@@]1(CN[C@@H](C)c2c(C)cc(C)cc2O)CCCN1 817973684 GIKGBLKNTYJIJU-YOEHRIQHSA-N 292.423 2.428 10 20 CECD CCN1C[C@H](NCc2cc(Cl)c(C)cc2O)CC1=O 826064438 KEADXWUGBGTTBJ-LLVKDONJSA-N 282.771 2.064 10 20 CECD C[C@@H]1[C@H](O)CCN1Cc1cc(Cl)c(F)cc1O 825104268 SGIVGESNUXIYNX-RDDDGLTNSA-N 259.708 2.140 10 20 CECD Oc1c(Cl)cccc1CN1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 824839402 YJGCOOHCLMXDJG-HBJVGIJOSA-N 277.751 2.431 10 20 CECD Oc1cc2c(cc1CNCC[C@H]1C[C@H]3CC[C@H]1O3)OCO2 839163576 ILBLYDNXZKYMRK-ZKYQVNSYSA-N 291.347 2.168 10 20 CECD CC(C)(C)c1n[nH]c(CNCc2ccccc2O)n1 839168089 BYGUHWYYGKFNHU-UHFFFAOYSA-N 260.341 2.098 10 20 CECD C[C@H](NCC(=O)NCC1CC1)c1ccc(Cl)cc1O 841754638 UGEYFGPUTSDYCF-VIFPVBQESA-N 282.771 2.222 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](C(=O)O)C2)cc1 840995590 WZVBTRBJWXDQQS-AWEZNQCLSA-N 276.380 2.439 10 20 CECD NC[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 843048731 UXGDILBKKWZJIP-INIZCTEOSA-N 273.424 2.458 10 20 CECD CN1CCCN=C1NCc1c(O)ccc2c1CCCC2 849011129 VJWSWPUUPXNVFK-UHFFFAOYSA-N 273.380 2.052 10 20 CECD CC[C@@H]1CN(C(=O)c2cc(O)cs2)[C@H](CC)CO1 846660666 YXSHUOXJOUGFDV-MWLCHTKSSA-N 269.366 2.483 10 20 CECD C[C@H](NC[C@H]1CC(=O)N(C2CC2)C1)c1cc(F)ccc1O 846205642 IRHPOXZVEQWXBF-WDEREUQCSA-N 292.354 2.193 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](C)NC[C@H]2C)c1O 842474802 XELFTLBFINUNGR-VHSXEESVSA-N 296.798 2.430 10 20 CECD CC[C@@H](NCC(=O)NCc1ccc(N(C)C)cc1)C1CC1 852555380 SIIQOOLYCHBLIX-MRXNPFEDSA-N 289.423 2.147 10 20 CECD C[C@H](NCC1CC2(C1)OCCO2)c1cc(F)cc(F)c1O 927004726 VRWOOVPCDGIIPD-VIFPVBQESA-N 299.317 2.474 10 20 CECD CCC[C@H](O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 935461320 ABITXMUDNPMHFF-FZMZJTMJSA-N 264.369 2.091 10 20 CECD CC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)CCS1 768465619 JCRAVYHGFYBPGT-RISCZKNCSA-N 295.404 2.145 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@H]1C[C@@H](O)C1 862528038 MDSWHBPPFZZODJ-OTSSQURYSA-N 259.708 2.045 10 20 CECD NC(=O)CN(Cc1cc(Cl)ccc1O)C1CCCC1 132981359 CKKNZULUFCLSAE-UHFFFAOYSA-N 282.771 2.276 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1CCSC1 762207817 RUHWVIKQTGYFTC-SECBINFHSA-N 288.463 2.495 10 20 CECD COc1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)on1 775411048 NTZKQSVJBYOMIM-JTQLQIEISA-N 289.335 2.240 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773028126 YBQQPPWBKHNATP-BYCMXARLSA-N 276.380 2.355 10 20 CECD CO[C@@H]1[C@H](C)[C@H](NC(=O)c2cc(O)cs2)C1(C)C 776249952 AKZGPEWOAFCPLM-PPKCKEKNSA-N 269.366 2.243 10 20 CECD Cc1cc(NC(=O)NCc2ccc(N(C)C)cc2)nc(C)n1 880314097 VVCGYDQKKUGHDF-UHFFFAOYSA-N 299.378 2.481 10 20 CECD CC(C)C[C@H]1CN(C)CCN1C(=O)c1cc(O)cs1 886597972 QQNDNTJTUPLAIU-NSHDSACASA-N 282.409 2.256 10 20 CECD CS[C@@H](CO)[C@H](C)NCc1cc(Cl)ccc1O 219079379 PXKDMIKATLSBNK-UFBFGSQYSA-N 275.801 2.248 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H]3C[C@@]3(CO)C2)cc1F 783737433 ZXOFTJJIEFQSND-YOEHRIQHSA-N 292.398 2.486 10 20 CECD Cc1ccc(C(=O)N[C@H](C)Cc2ccncc2)c(O)c1O 780958387 GKORBQFWKHOFEU-LLVKDONJSA-N 286.331 2.162 10 20 CECD COc1ccc(CNS(=O)(=O)CC2CCCC2)c(O)c1 795362747 RCRRJAJDYWZKSQ-UHFFFAOYSA-N 299.392 2.010 10 20 CECD COc1ccc(CNC(=O)OCC2CC2)c(O)c1 795356805 HGZSRKDLEREPGD-UHFFFAOYSA-N 251.282 2.037 10 20 CECD CCc1cccc(CN[C@H](C)Cn2cccn2)c1O 691512524 MZXKJMYOTOUIJY-GFCCVEGCSA-N 259.353 2.329 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@H](O)C2CC2)c1O 79770704 ZPZPAAAJYFZCAB-AWEZNQCLSA-N 297.782 2.451 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1CCC(O)CC1 792179787 UPYRLNUVHRJHOD-UHFFFAOYSA-N 290.407 2.228 10 20 CECD COc1ccc(O)c(CNCC2(O)CCC(C)CC2)c1 87044000 IDTAUKGHFBBNNS-UHFFFAOYSA-N 279.380 2.432 10 20 CECD CN(Cc1cccc(O)c1)C(=O)c1cccc(O)c1O 790558186 FXTBJYSKVPECJK-UHFFFAOYSA-N 273.288 2.076 10 20 CECD c1cc(N2CCCC2)ccc1CNC[C@H]1CCCNC1 1325321748 ZJICEDSPIHSDQK-INIZCTEOSA-N 273.424 2.376 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1cc(F)ccc1O 1320026750 WZBSJYFBISOGMP-UHFFFAOYSA-N 269.316 2.305 10 20 CECD CCn1[nH]cnc1=N[C@H](C)Cc1ccc(N(C)C)cc1C 1336665261 KIJJOVGLBUBZBR-CYBMUJFWSA-N 287.411 2.137 10 20 CECD CC(=O)N[C@H]1Cc2ccccc2N(Cc2ccc(N)cc2)C1 1262487749 DLZNTVNOBZSWQP-KRWDZBQOSA-N 295.386 2.336 10 20 CECD Nc1ccc(CNC(=O)NCC[C@H]2C[C@H]3CC[C@H]2O3)cc1 1346453874 RMDQOPBKHGBKPA-NWANDNLSSA-N 289.379 2.026 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@H]1F)c1ccc(N2CCOCC2)cc1 1262725676 FUSXOPGCYLOXPC-NILFDRSVSA-N 292.354 2.058 10 20 CECD C[C@H](NC(=O)CCCC(=O)O)c1ccc(N(C)C)cc1 1593015674 RMJKKEQKFYHOPV-NSHDSACASA-N 278.352 2.185 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)C2CC2)cc1C 1755223525 KNWAGFQORGLXKJ-QWHCGFSZSA-N 290.407 2.396 10 20 CECD CCC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)CCO1 160508132 SUAZNUMZNKQCIS-CYBMUJFWSA-N 295.379 2.410 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](N)[C@H](C)C2)c1O 252849837 INUYZXOVBXQHPS-SKDRFNHKSA-N 284.787 2.223 10 20 CECD CN1CCC[C@H]2CN(Cc3ccc(N)cc3)CC[C@@H]21 167470056 GDRLRKQZJWBIHM-HOCLYGCPSA-N 259.397 2.185 10 20 CECD C[C@H](CC(C)(C)O)NCc1ccc(N(C)C)cc1 295077217 PWRGKCSWQHYVGH-GFCCVEGCSA-N 250.386 2.392 10 20 CECD CCC[C@](C)(CO)NCc1cccc(OC)c1O 304831196 IRBSUIVGBGYYMC-CQSZACIVSA-N 253.342 2.042 10 20 CECD C[C@@H](NCc1cnns1)c1ccc(N(C)C)cc1 400248605 JGPYPQJLGAMFJP-SNVBAGLBSA-N 262.382 2.455 10 20 CECD COc1ccc(O)c(CN[C@@H](C)[C@H](OC)C2CC2)c1 388240759 QNDODUNXIXYKOJ-BONVTDFDSA-N 265.353 2.304 10 20 CECD CC[C@H](NCCCN1CCN(C)CC1)c1ccccc1O 20128456 QHZMBVNNSNFSCL-INIZCTEOSA-N 291.439 2.070 10 20 CECD C[C@H](N[C@H](C)CO)c1cc(Br)ccc1O 134913563 PBUYEHVRCDLXQT-SFYZADRCSA-N 274.158 2.186 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](OC)C2)c1O 300102313 UPPHUEBXTJWRNH-LLVKDONJSA-N 271.744 2.275 10 20 CECD CSc1ccc(C(=O)NCCc2ccc(O)c(O)c2)o1 122179349 UFQWHFLBGFDRTR-UHFFFAOYSA-N 293.344 2.385 10 20 CECD C[C@@H](NC[C@]1(O)CCOC1)c1ccc2ccccc2c1O 186178017 PSWICIGMLIBABD-SJKOYZFVSA-N 287.359 2.347 10 20 CECD CCc1ncsc1C(=O)NCc1ccc(O)c(O)c1 182510269 MPNKYAIMUFJFPH-UHFFFAOYSA-N 278.333 2.047 10 20 CECD CN(Cc1ccccc1O)Cc1cnc2cnccn12 91956603 XCANLWZWSLBPRH-UHFFFAOYSA-N 268.320 2.067 10 20 CECD Nc1ccc(NC(=O)CNC(=O)CCC2CCCC2)cc1 238139930 MMSBVZXSNPJBDS-UHFFFAOYSA-N 289.379 2.294 10 20 CECD O=C1NC(=S)S/C1=C\c1ccc(O)c(F)c1 255517646 OOIFJQFYEVSOCA-YWEYNIOJSA-N 255.295 2.020 10 20 CECD Cc1nc(C(=O)N(C)Cc2ccc(N(C)C)cc2)c[nH]1 264806106 ZHLVGYLNRRWILY-UHFFFAOYSA-N 272.352 2.056 10 20 CECD Cc1cc(O)c(CN=c2[nH]ncn2-c2cccnc2)cc1C 367489973 MKAUJJYYLFXIII-UHFFFAOYSA-N 295.346 2.019 10 20 CECD COCC[C@@H]1COCCN1Cc1cc(Cl)ccc1O 368265164 IHJYIDALGMFVMA-CYBMUJFWSA-N 285.771 2.283 10 20 CECD C[C@@H](NCC1(C(N)=O)CCCC1)c1ccccc1O 272888030 SCJFVQAYBGWELS-LLVKDONJSA-N 262.353 2.089 10 20 CECD CSC1(CNC(=O)c2c(F)ccc(O)c2O)CCC1 295156354 DUGBTKSXJYLJQQ-UHFFFAOYSA-N 285.340 2.252 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](SC)C2)c1O 294962958 FAKAKJBXKKZBBE-SNVBAGLBSA-N 298.364 2.246 10 20 CECD Cc1ncsc1CCNC(=O)NCc1ccccc1O 297026437 HJYZNAJZXJKKML-UHFFFAOYSA-N 291.376 2.199 10 20 CECD CNC(=O)OC[C@@H]1CCCCN1Cc1cc(C)ccc1O 290279680 YXPCJNUOKJQLGW-AWEZNQCLSA-N 292.379 2.411 10 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267.350 2.428 10 20 CECD COc1ccc(O)c(CNCC2(N)CCCCC2)c1 841039285 ISYYBDQVBUUFKW-UHFFFAOYSA-N 264.369 2.152 10 20 CECD COc1ccc(N(C)CC(=O)Nc2c(C)n[nH]c2C)cc1 844353667 UOAARCIQEOMSEB-UHFFFAOYSA-N 288.351 2.110 10 20 CECD Cc1ccncc1CNC(=O)NCCc1ccc(N)cc1 841911705 WSOMSYZMTAUIGE-UHFFFAOYSA-N 284.363 2.014 10 20 CECD N=C(NCCc1ccccc1)NCc1ccccc1O 849057329 NJWDWDARSJJCQR-UHFFFAOYSA-N 269.348 2.249 10 20 CECD CCCN(Cc1ccc(OCC)cc1O)[C@@H]1CCNC1 843052590 OCTCLIFPLYTZDE-CQSZACIVSA-N 278.396 2.365 10 20 CECD C[C@@H](NC[C@H]1CCCNC1=O)c1ccc(Cl)cc1O 841756478 VYIFTPNUDPAEQX-NXEZZACHSA-N 282.771 2.222 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2c(O)ccc(Cl)c2F)C1 840998809 SMPWAWVKDAMYEU-ZDUSSCGKSA-N 287.718 2.481 10 20 CECD COc1ccc(CN[C@@H](CN)C(C)(C)C)cc1C 841087326 JWJYECRKPUHHGQ-AWEZNQCLSA-N 250.386 2.467 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](CN2CCCC2)C1 743490412 UUYWZWPDACFNGE-NSHDSACASA-N 280.393 2.012 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@@H](N)C2)cc1F 841056958 GHHHPHFILQXGPU-OLZOCXBDSA-N 265.376 2.251 10 20 CECD CSc1cc(C(=O)NCc2ccccc2O)ccn1 748347155 WPRQGKSGRMGFBV-UHFFFAOYSA-N 274.345 2.439 10 20 CECD C[C@@H](CN)CNCc1ccc(N2CCCCC2)cc1 841050167 YRJGZQPZFCINBJ-AWEZNQCLSA-N 261.413 2.361 10 20 CECD Cc1cc(CN(C)[C@H](CN)C2CC2)ccc1N(C)C 923357509 PAMYRTSMWVCKDI-MRXNPFEDSA-N 261.413 2.230 10 20 CECD CCOCCCC(=O)N[C@H](C)c1ccccc1O 827931130 ZGFROLKVBNOBGE-LLVKDONJSA-N 251.326 2.386 10 20 CECD COc1cccc(CN[C@@H](CO)CCC(C)C)c1O 858241346 PTBKSIXPWBEBEZ-CYBMUJFWSA-N 267.369 2.288 10 20 CECD CC(C)(C)OCCOC(=O)c1cccc(O)c1O 758580198 ITMSMBCLLHULSM-UHFFFAOYSA-N 254.282 2.070 10 20 CECD CN(C)c1ccc(N(C)C(=O)/C=C/c2cn(C)cn2)cc1 935216997 ZFQPMMBCSARGRC-BJMVGYQFSA-N 284.363 2.162 10 20 CECD CC[C@H](N[C@H]1CCCN(C)C1=O)c1ccc(N(C)C)cc1 766435874 BJVONMVJVRJFTI-HOTGVXAUSA-N 289.423 2.414 10 20 CECD CCN1C[C@@H](C)N(Cc2cc3c(cc2O)OCO3)C[C@@H]1C 769467828 ZRGINNBMGHMFGP-NWDGAFQWSA-N 292.379 2.035 10 20 CECD CCC[C@H](CNC(=O)c1c(F)ccc(O)c1O)OCC 863935939 YDIQYCUOCWCLAD-SECBINFHSA-N 285.315 2.172 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H](C)c2cnn(C)c2)c1 862754549 FZVBPBMSASOYTO-LBPRGKRZSA-N 287.363 2.244 10 20 CECD C[C@@H](NCc1ccc(C(=O)N(C)C)[nH]1)c1ccccc1O 877756487 LYGQXXDNSNEZQP-LLVKDONJSA-N 287.363 2.273 10 20 CECD Cc1ccc(CN[C@H]2CCO[C@]3(CCOC3)C2)c(O)c1 877132820 OKUNPWRRNWALRT-GOEBONIOSA-N 277.364 2.128 10 20 CECD N=C(NCc1cc(Cl)ccc1O)NCC1CC1 887363388 VNDIYYJEYJCRMN-UHFFFAOYSA-N 253.733 2.070 10 20 CECD COc1ccc(O)c(CNC[C@@H]2C[C@@H](C)O[C@@H]2C)c1 686511664 HBJLKSIBUQRNDP-UTUOFQBUSA-N 265.353 2.304 10 20 CECD CC[C@H](N[C@H](CO)C1CCOCC1)c1ccc(F)cc1O 796935888 GYSHUXAUACCRBB-LSDHHAIUSA-N 297.370 2.360 10 20 CECD CCc1cccc(CN(C)CC(=O)N2CCCC2)c1O 692091890 HYZFGEMGUOPOMV-UHFFFAOYSA-N 276.380 2.009 10 20 CECD CCC[C@@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1 1776748107 IHISCKKHCIDBGL-AWEZNQCLSA-N 264.369 2.438 10 20 CECD COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@H]3F)CC2)cc1 1337092687 NUWRNYUIHDZKKX-HUUCEWRRSA-N 292.354 2.138 10 20 CECD Cc1nc2n(n1)CCN(Cc1ccc(N3CCCC3)cc1)C2 1254010650 HWUWVLRIHUSZRN-UHFFFAOYSA-N 297.406 2.203 10 20 CECD Nc1ccc(CNC(=O)NCCCOC2CCCC2)cc1 1335988509 XCLBXHONMFKAKT-UHFFFAOYSA-N 291.395 2.417 10 20 CECD C[C@H](OC1CCCCC1)C(=O)NCc1cccc(O)c1O 1347542776 RHBCQKAVZKZVKF-NSHDSACASA-N 293.363 2.452 10 20 CECD C/C=C/C[C@@H](CO)NCc1cc(F)c(N(C)C)cc1F 1261787924 FZIJIQUSLNMKRL-ITKZLYELSA-N 284.350 2.448 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@@H](c1cc(C(=O)O)ccc1O)N2 1607830146 ULDMRUKVXDTJNC-AWEZNQCLSA-N 298.298 2.253 10 20 CECD CNC(=O)[C@@]1(C)CCN(Cc2c(O)cccc2Cl)C1 228099008 APZDCLCAEZMJFS-AWEZNQCLSA-N 282.771 2.004 10 20 CECD Cc1cc(CCNC(=O)[C@@H](C)CN)c(C)n1-c1ccccc1 1579592778 LFAZNPWWTJCNHG-ZDUSSCGKSA-N 299.418 2.348 10 20 CECD C[C@H]1NCC[C@@H]1NC/C=C\c1ccc(N(C)C)cc1 1579505155 MQWWOWNJFARQPS-DUIDPNDXSA-N 259.397 2.106 10 20 CECD COc1cccc(CN[C@H](CCO)C(C)(C)C)c1O 231074206 NQNGIFHXDSJAFX-CYBMUJFWSA-N 267.369 2.288 10 20 CECD CC[C@@H](CNCc1ccc2c(c1)CCN2CC)C(=O)O 1776714836 FUHLLDPXSDGVGL-ZDUSSCGKSA-N 276.380 2.269 10 20 CECD CCC[C@@](C)(O)C(=O)N[C@H](C)c1cc(OC)ccc1O 153888983 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AHMTXUHFSUPUSY-UHFFFAOYSA-N 276.380 2.143 10 20 CECD CC[C@@H](C)[C@H](C)NCC(=O)NCc1ccc(N(C)C)cc1 183060951 UMUYRTXGBZPSBD-KGLIPLIRSA-N 291.439 2.393 10 20 CECD C[C@@H]1OCC[C@]1(C)NCc1ccc(N2CCOCC2)cc1 230153961 REGPEJJZMRWTHP-YOEHRIQHSA-N 290.407 2.180 10 20 CECD CCS(=O)(=O)C[C@@H](C)N(C)Cc1ccc(N(C)C)cc1 93416670 QJPIODPQUNFOIZ-CYBMUJFWSA-N 298.452 2.008 10 20 CECD CC[C@@H](NCC[C@H](O)COC)c1ccc(N(C)C)cc1 90951325 AYRHNWSCECDKID-JKSUJKDBSA-N 280.412 2.191 10 20 CECD Cc1ncc(/C=C\C(=O)N2CCOc3ccncc32)s1 255550619 MWNBKHPQTVNZKZ-IHWYPQMZSA-N 287.344 2.285 10 20 CECD CO[C@@H](C)[C@H](C)NCc1ccc(N(C)C)c(F)c1 269057621 WYMMUZPULDSVRQ-QWRGUYRKSA-N 254.349 2.405 10 20 CECD COc1ccc(O)c([C@H](C)NCCCc2nc(C)no2)c1 271854018 RYVTVDMWHDDTNG-JTQLQIEISA-N 291.351 2.376 10 20 CECD Cc1cc(CN2C[C@H](O)C(C)(C)C2)ccc1N(C)C 294024853 HQRGOZRLCSMHDJ-HNNXBMFYSA-N 262.397 2.264 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccccc2O)[C@H]1SC 298229943 BFEQGBFOIFCXHF-MRVWCRGKSA-N 267.394 2.391 10 20 CECD COC(=O)[C@H](CNCc1cc(F)ccc1O)CC(C)C 813332186 QOMNHCJOFGKYEA-LBPRGKRZSA-N 283.343 2.456 10 20 CECD Cc1cc(Br)cc([C@@H](C)NC[C@@H](C)N)c1O 817972968 QOSBBBDICBZVED-RKDXNWHRSA-N 287.201 2.461 10 20 CECD Cc1cccc(CN2CCC(OC(=O)N(C)C)CC2)c1O 816655851 VQDULNGXMQRHDL-UHFFFAOYSA-N 292.379 2.363 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(N(C)C)c(F)c1 824702343 LSXLUVWWAZOWIA-OCCSQVGLSA-N 294.370 2.323 10 20 CECD CCOc1ccc(O)c(CN(C)Cc2cnc[nH]2)c1 826769841 SPZJNFZDHWRJAK-UHFFFAOYSA-N 261.325 2.146 10 20 CECD CC(C)c1noc(COC(=O)c2cc(O)cs2)n1 731910556 SNDYEDLDUQYCRG-UHFFFAOYSA-N 268.294 2.317 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1ccc(C(=O)O)[nH]1 833695368 MZMPSLHVUBYEOW-UHFFFAOYSA-N 287.363 2.411 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1nonc1C 733892392 JSJFMIXQBJYAML-UHFFFAOYSA-N 288.351 2.106 10 20 CECD CCN1C[C@@H](N[C@@H](C)c2ccc(Cl)cc2O)CC1=O 841759301 YJLZNTKSSOBCTI-ONGXEEELSA-N 282.771 2.317 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC[C@H](CN)C1 841083277 AKSYMQHCLAWDBS-ZFWWWQNUSA-N 261.413 2.278 10 20 CECD COC(=O)c1cnc(SCc2cc3n(n2)CCC3)s1 845316251 GKLSPOXEIUWIIV-UHFFFAOYSA-N 295.389 2.365 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)c2ccccn2)cc1 844851772 GHDXSUMISXCTJR-UHFFFAOYSA-N 299.374 2.299 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](CC(C)C)OC)c1 841407329 XXSTZFIZBROVQJ-CQSZACIVSA-N 281.352 2.078 10 20 CECD C[C@@H]1C[C@H](NCc2cc(Cl)ccc2O)CCN1 841061851 OARFNGNAQRTRJH-BXKDBHETSA-N 254.761 2.276 10 20 CECD CCNC(=O)[C@H](C)N[C@H](C)c1ccc(Cl)cc1O 841745308 XHHWYAKLABWUSS-BDAKNGLRSA-N 270.760 2.221 10 20 CECD CN(C)c1ccc(CN[C@@H](CCN)C(F)(F)F)cc1 841090881 PHHYGUQYYYWOEE-LBPRGKRZSA-N 275.318 2.122 10 20 CECD CCCN(Cc1cccc(OC)c1O)C1CCNCC1 843045242 SJRIBIYIRGNVLO-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CC[C@H](C)C[C@@H](CO)NCc1c(O)cccc1OC 842753374 FEYLCAFIFROCMR-RYUDHWBXSA-N 267.369 2.288 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@]12CCOC2=O 840937577 KCSBMADISBFVNP-KRWDZBQOSA-N 288.391 2.343 10 20 CECD C[C@@H](N[C@@H]1CCN(C)C1)c1cc(Cl)ccc1O 756533545 IOMJWCFLJDVCFQ-MWLCHTKSSA-N 254.761 2.400 10 20 CECD Cc1ccc(O)c(CNC(=O)CCOC(C)C)c1 862760685 UNTXPKBMSSQGCZ-UHFFFAOYSA-N 251.326 2.132 10 20 CECD Cc1nn(CC(F)F)cc1C(=O)NCc1ccccc1O 934936564 UVPAAIYXJIJLTB-UHFFFAOYSA-N 295.289 2.092 10 20 CECD C[C@@H](N[C@@H]1COC[C@@H]1O)c1cc(Cl)c(Cl)cc1O 866421026 UYTKFSKIBQWVCK-CXTDYRRUSA-N 292.162 2.109 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCSC2)c1 762536341 NBEXSUSCTSJYHQ-NXEZZACHSA-N 281.377 2.331 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@](C)(O)COC)cc1 765934747 CRLDIFBROSLOKD-CZUORRHYSA-N 280.412 2.191 10 20 CECD OC1CCN(c2ccc(CN3C[C@H]4C[C@H]4C3)cc2)CC1 877651638 ZIBJCZAGISUZJD-GASCZTMLSA-N 272.392 2.099 10 20 CECD CC[C@@H](CO)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 779735106 BEYKKXRTLGYGFX-AWEZNQCLSA-N 290.407 2.262 10 20 CECD CS[C@H](C)CNCc1ccc(N2CCC(O)CC2)cc1 877112903 UWRRPPNONUFQNO-CYBMUJFWSA-N 294.464 2.489 10 20 CECD C[C@H]1N(C(=O)/C=C\c2ccc(O)c(O)c2)CCOC1(C)C 779535927 YTGJPGPYXZZKMN-JPVGGKMYSA-N 291.347 2.137 10 20 CECD C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)C(F)(F)F 783922551 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QOHKJHVEZXWPDD-CQSZACIVSA-N 280.437 2.482 10 20 CECD C/C=C/C=C/C(=O)N1CCN(c2ccc(OC)cc2)CC1 8028939 XOSKNNZSIFVDQJ-VNKDHWASSA-N 286.375 2.476 10 20 CECD CC(C)[C@H](C(=O)O)C(=O)NCc1cccc(Cl)c1O 1588807897 KSYVOXVNGWRQIJ-JTQLQIEISA-N 285.727 2.019 10 20 CECD CCC[C@@H]1CN(Cc2cc(OC)ccc2O)CCO1 180318778 DOYDBFMORKZNPE-CQSZACIVSA-N 265.353 2.402 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)c1ccccc1 81571659 OINSYSNNTXVUFY-UHFFFAOYSA-N 277.345 2.213 10 20 CECD CCCN1CC[C@H](NCc2ccc(N(C)C)cc2)C1 328166558 IZNNOMGFERTLEZ-HNNXBMFYSA-N 261.413 2.327 10 20 CECD C[C@H](NCCO)c1ccc(N2CCCCC2)c(F)c1 20550961 CSNUVCYQFLZUMO-LBPRGKRZSA-N 266.360 2.459 10 20 CECD COc1ccc(O)c(CNc2nc(C)ns2)c1 301954702 KTONVNVADJPQME-UHFFFAOYSA-N 251.311 2.173 10 20 CECD CN[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 128321122 IYWLRWRXAJPHRV-SNVBAGLBSA-N 254.761 2.229 10 20 CECD Cc1cccc(CNCC(=O)NCc2ccccc2)c1O 158124838 IZMQPXMHOVZOBV-UHFFFAOYSA-N 284.359 2.107 10 20 CECD CCN(CC)C(=O)CN[C@@H](C)c1ccc(F)cc1O 228795215 PNYAGGITQNOJBL-JTQLQIEISA-N 268.332 2.050 10 20 CECD CN(C(=O)/C=C/c1cncc(F)c1)c1ccccn1 134525901 AFYQEQWKJQGVRR-AATRIKPKSA-N 257.268 2.292 10 20 CECD CC[C@H](O)CCNCc1cccc(Br)c1O 131681792 IGUGLUBSQFZVOJ-JTQLQIEISA-N 288.185 2.405 10 20 CECD Nc1ccc(NC(=O)NCC(F)(F)C(F)F)cc1 230715517 VPVHPSSIVVHPQH-UHFFFAOYSA-N 265.210 2.291 10 20 CECD CN(Cc1ccccc1O)C(=O)c1c[nH]nc1C1CC1 184497970 DBZKRLKCDRVKMT-UHFFFAOYSA-N 271.320 2.265 10 20 CECD NC(=O)CCN(C(=O)/C=C\c1cccnc1)c1ccccc1 255414508 LZQPOXGWSDHFNG-HJWRWDBZSA-N 295.342 2.003 10 20 CECD Cc1cc(C)cc(N(C)C(=O)c2ccoc2CC(N)=O)c1 350680296 CLEXOBMZKQYHDU-UHFFFAOYSA-N 286.331 2.201 10 20 CECD COc1ccc(N(C)CCN2CCOCC2)cc1Cl 268173448 MEOLCBSJYIKALW-UHFFFAOYSA-N 284.787 2.117 10 20 CECD COC(=O)CN(Cc1cc(Cl)ccc1O)C(=O)C(C)C 272278404 SWRJPGUKBBKWGZ-UHFFFAOYSA-N 299.754 2.203 10 20 CECD COc1ccc2c(c1)CCCCN2CC(=O)N1CCC1 270944749 ZHRJYVIPTTZCJI-UHFFFAOYSA-N 274.364 2.070 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@](O)(C2CC2)C1 373270483 KZAWGORHWCGYJJ-CQSZACIVSA-N 267.756 2.392 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@]12CCNC2 372493048 UFTSUVWYZNMDJU-WMLDXEAASA-N 288.391 2.130 10 20 CECD C[C@H](NC[C@@H](CO)[C@@H]1CCOC1)c1ccc(N(C)C)cc1 280912528 QMTOJYQPHBVYFE-IMJJTQAJSA-N 292.423 2.048 10 20 CECD Cc1nc([C@H](C)N2CCOc3cc(N(C)C)ccc32)no1 280994571 MCVJCJAWTGLWMM-JTQLQIEISA-N 288.351 2.404 10 20 CECD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1ccc(N)cc1 387161132 RHWRISONJHVSAT-UHFFFAOYSA-N 299.330 2.378 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@H](C)C(=O)N(C)C)c1O 808706392 JBIHUBGZZQGNTN-NXEZZACHSA-N 284.787 2.481 10 20 CECD CC[C@@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCN1 817896388 ICVCTLOSAVGGEP-CVEARBPZSA-N 261.413 2.373 10 20 CECD Oc1ccccc1CNCc1cnnn1-c1ccccc1 814298580 XNXDDVLZKGERCV-UHFFFAOYSA-N 280.331 2.263 10 20 CECD Cc1cc([C@@H](C)NCCc2ccc(N)cc2)nn1C 817957319 KVNSCLUGASWDJN-GFCCVEGCSA-N 258.369 2.204 10 20 CECD C[C@@H](N[C@H]1CCCNC1)c1cc(Cl)ccc1O 817941439 QHJACSDRZYVOLU-KOLCDFICSA-N 254.761 2.448 10 20 CECD NCC1(CC(=O)NCc2c(O)ccc3c2CCCC3)CC1 817997779 WFQALELBXMHJQU-UHFFFAOYSA-N 288.391 2.016 10 20 CECD COc1cccc(CNC(=O)C[C@@H](C)C2CC2)c1O 729860274 WHANVWXOBXVAAC-SNVBAGLBSA-N 263.337 2.453 10 20 CECD CCOCc1cc(CNC[C@H](O)C2CCC2)ccc1OC 825240163 IKFKJJURLLIWPT-INIZCTEOSA-N 293.407 2.482 10 20 CECD CCN1CC[C@@H](N(C)C(=O)c2cc(O)cs2)C[C@H]1C 828491262 XWYWDELAZHTDRN-GHMZBOCLSA-N 282.409 2.399 10 20 CECD Cc1cc(Br)c(O)c(CN[C@@H](C)C(=O)O)c1 820949347 RDSHTTPVSGWHEM-ZETCQYMHSA-N 288.141 2.026 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CCN[C@@H]1C 828144362 DAECABJXORRNFX-OCCSQVGLSA-N 276.380 2.129 10 20 CECD CC1=NO[C@](C)(C(=O)NCc2ccc(N(C)C)c(F)c2)C1 902989848 CCFDTEWJYKTRAD-HNNXBMFYSA-N 293.342 2.063 10 20 CECD CCN1C[C@H](N[C@H](C)c2cc(Cl)ccc2O)CC1=O 834889845 KJARNAGQNIVOOI-MWLCHTKSSA-N 282.771 2.317 10 20 CECD c1cnc(CNCCCSc2nccs2)cn1 838963034 SIANNJOWOKJXNT-UHFFFAOYSA-N 266.395 2.205 10 20 CECD CCO[C@H](CCN(C)C)CN[C@H]1CCc2cccc(O)c21 834620966 ZHVSPVVNXNTYNG-CABCVRRESA-N 292.423 2.326 10 20 CECD CCC[C@H](CNC(=O)NCc1ccc(N(C)C)cc1)OC 836222429 YECMGDYCRLVRCW-OAHLLOKOSA-N 293.411 2.367 10 20 CECD O=C(O)N1CCC(NCc2cc(Cl)ccc2O)CC1 738638405 HNBAWAYPYSEPLN-UHFFFAOYSA-N 284.743 2.278 10 20 CECD O=C(NCc1ccccc1O)c1ccc2c(c1)OCCCO2 748353100 LPZREGHIWPOLAR-UHFFFAOYSA-N 299.326 2.484 10 20 CECD COC(=O)C1CCC(NC(=O)Nc2ccc(N)cc2)CC1 841299580 FAYUYPIIWUQPDN-UHFFFAOYSA-N 291.351 2.122 10 20 CECD C[C@H]1CCC[C@@H]1NC(=O)NCCc1ccc(N)cc1 841795013 VQGKXJTURGCQJD-FZMZJTMJSA-N 261.369 2.299 10 20 CECD C[C@H]1CCCc2ncc(C(=O)NCc3ccccc3O)n21 845833624 NHIKCDSDUXMDJG-NSHDSACASA-N 285.347 2.416 10 20 CECD Cc1cnc(CCNCc2ccc(N(C)C)cc2C)cn1 840953571 VEKUMQNAPZZCOP-UHFFFAOYSA-N 284.407 2.492 10 20 CECD C[C@H]1CCCC[C@H]1CNC(=O)C(=O)Nc1ccc(N)cc1 841021272 SXHFYGRTKSTBBE-RYUDHWBXSA-N 289.379 2.150 10 20 CECD C[C@@H]1NCCN(Cc2cc(Cl)cc(F)c2O)[C@@H]1C 843056845 AUHINIGQPNBLSY-DTWKUNHWSA-N 272.751 2.367 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@@H](C)c1cc2c(cc1O)CCCC2 840826647 RDOSLZQSGANYEM-XNJJOIOASA-N 291.391 2.335 10 20 CECD CC(C)[C@H]1CN(Cc2cccc(Cl)c2O)CCN1 843105129 PGQKXGPVVQKYEG-CYBMUJFWSA-N 268.788 2.475 10 20 CECD CCn1cnnc1NCc1c(O)ccc(Cl)c1F 922659917 WZCRXDXZCLDIAQ-UHFFFAOYSA-N 270.695 2.408 10 20 CECD Cc1ccc([C@H](C)NCCOC[C@H]2CCOC2)c(O)c1 756564167 QQITVXULXPJXBM-KBPBESRZSA-N 279.380 2.404 10 20 CECD CC[C@@](C)(O)CN[C@H](C)c1cc(F)cc(F)c1O 756554950 QPNKKMQQHMAKLE-AMIZOPFISA-N 259.296 2.482 10 20 CECD Cn1ncnc1CN(Cc1ccco1)Cc1ccccc1O 750044380 HCOVWLHWFDKJGI-UHFFFAOYSA-N 298.346 2.316 10 20 CECD Nc1ccc(CC(=O)NCCCc2ccco2)cc1 851648060 XNAUZBWTGLJSJW-UHFFFAOYSA-N 258.321 2.153 10 20 CECD COc1ccc(NC(=O)c2ccc(C)c(O)c2O)cn1 751530943 WLVOQBJLADRWEY-UHFFFAOYSA-N 274.276 2.062 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1cnco1 759618843 UQAUVNBRHVYGSQ-UHFFFAOYSA-N 272.304 2.189 10 20 CECD CCOC(C)(C)C(=O)NCc1cc(C)ccc1O 869410212 HNXRSDDWTGOVAM-UHFFFAOYSA-N 251.326 2.132 10 20 CECD CN(C)c1ccc(CNC(=O)NC2(C3CC3)CC2)cc1 760494410 XKYNBMVPQSOXQL-UHFFFAOYSA-N 273.380 2.494 10 20 CECD CN1CCCC12CCN(C(=O)c1cc(O)cs1)CC2 761168739 UXUNGZZWWFOMQV-UHFFFAOYSA-N 280.393 2.154 10 20 CECD CSC1CCN(C(=O)c2cc(O)cs2)CC1 869644693 ZBHLAUUAZRRMOS-UHFFFAOYSA-N 257.380 2.421 10 20 CECD CCn1cc(CN(C)Cc2c(O)cccc2OC)cn1 769428972 XTKBKCVUYKXWJI-UHFFFAOYSA-N 275.352 2.249 10 20 CECD COCC1(NCc2cc(F)c(N(C)C)cc2F)CC1 1118800845 FJTZVPQTNFALTR-UHFFFAOYSA-N 270.323 2.299 10 20 CECD CCCOc1ccc(CN[C@@H](C)CS(C)(=O)=O)cc1C 873049687 KEPLIRKXDCYGBV-ZDUSSCGKSA-N 299.436 2.307 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC=CCC2)cc1 778650744 QYVYXVHFSAFLFQ-UHFFFAOYSA-N 259.353 2.224 10 20 CECD CC(C)COC(=O)CN[C@H](C)c1ccccc1O 879649408 QZDJWPRMQLWSHS-LLVKDONJSA-N 251.326 2.242 10 20 CECD Cc1ccc(O)c(CN[C@H](C)C[C@H]2CCCC(=O)N2)c1 877652495 INBRISMUZNGBOH-TZMCWYRMSA-N 276.380 2.238 10 20 CECD C[C@H](NC(=O)c1cnccn1)c1ccc(N(C)C)cc1 773012158 GDNKCTDSLBTVHS-NSHDSACASA-N 270.336 2.034 10 20 CECD C[C@@H]1C[C@H](NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CO1 898447922 NFCAIXKGMCTFRW-KMFMINBZSA-N 291.439 2.122 10 20 CECD CCOC(=O)[C@@H]1CCC[C@@H]1NCc1cc(F)cc(F)c1O 894914638 ODXOVYDHKFKTJU-YPMHNXCESA-N 299.317 2.492 10 20 CECD C[C@@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)CS1 397819816 DLXAKJUHAPULHC-PSASIEDQSA-N 267.350 2.105 10 20 CECD CC[C@H](NCc1c(O)cccc1Br)[C@@H](C)O 706831394 CKAVPEPDDAPNOQ-KCJUWKMLSA-N 288.185 2.404 10 20 CECD CCN(Cc1cc2c(cc1O)OC[C@H]2O)CC1CCC1 794688551 OTRNOAMEGFOZTJ-OAHLLOKOSA-N 277.364 2.440 10 20 CECD COc1ccc(CN[C@H](C)C[C@H]2CCOC2)c(O)c1OC 1335478347 GPCBZYKFRFMNTE-VXGBXAGGSA-N 295.379 2.314 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCCC[C@@H]1CN)c1ccccc1O 1332544900 VXBTXDRHSVYFHT-YRGRVCCFSA-N 291.395 2.270 10 20 CECD COc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C)c1O 217896953 LYPJUUAJMZOUJG-KGLIPLIRSA-N 276.380 2.069 10 20 CECD CC[C@H](C)N(C)CCNCc1ccc2c(c1)CCO2 217393709 XUIRBWGNNFFWMF-ZDUSSCGKSA-N 262.397 2.441 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCC[C@H](O)C2)c1 224866365 AVSDOPVGTILFLW-YPMHNXCESA-N 265.353 2.042 10 20 CECD C[C@@H]1O[C@H](C)[C@H](C(=O)NCc2ccccc2O)[C@@H]1C 228844670 IKJYWJHZRCCQHJ-FBKDDSFISA-N 263.337 2.068 10 20 CECD COc1ccc(CNc2cccc(C(=O)O)n2)c(O)c1 1594096198 RSLQFMTVVMREHV-UHFFFAOYSA-N 274.276 2.106 10 20 CECD O=C(O)c1cncc(NC(=O)N2Cc3cccc(O)c3C2)c1 1595271361 HCZGNNIHDYJHKW-UHFFFAOYSA-N 299.286 2.033 10 20 CECD O=C(Nc1ccc(O)cc1F)c1cccc(O)c1O 126576082 QXKROLGCOMTPDM-UHFFFAOYSA-N 263.224 2.195 10 20 CECD Cn1cc(Cl)c(CNCc2ccc3c(c2)CCO3)n1 35807666 XYYWOMXOWBQDNB-UHFFFAOYSA-N 277.755 2.298 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cnsn2)c1 846844001 JWWVRVDKZPLIAF-QMMMGPOBSA-N 265.338 2.103 10 20 CECD CN(C)c1ccc(CNC(=O)CCCCC(=O)O)cc1 37792150 RXXGDEJEFSNWAX-UHFFFAOYSA-N 278.352 2.014 10 20 CECD CCC[C@](C)(CO)NCc1cc(OC)ccc1O 305789671 SZPDXALMYRHBOZ-CQSZACIVSA-N 253.342 2.042 10 20 CECD C[C@@H](CNCc1ccccc1O)C(=O)OC(C)(C)C 320154114 JTGWYFQWVJHVQL-NSHDSACASA-N 265.353 2.460 10 20 CECD CO[C@@H](CNCc1cc(F)cc(F)c1O)C1CC1 708496511 LRKFLNLCBMJQDY-LBPRGKRZSA-N 257.280 2.185 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCC(C)C)c1 103504979 WLLFMVDTPPRMQE-SNVBAGLBSA-N 266.341 2.417 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](C)[C@H]2CO)c1O 305750708 YQHYVYJLSRPTFK-MEBBXXQBSA-N 295.354 2.327 10 20 CECD COCCN(C)CCN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 61375629 UGLTUSDSRGZVNA-ZIAGYGMSSA-N 292.423 2.417 10 20 CECD C[C@H]1CCCN(C(=O)CSc2nccs2)C1 60740542 RZHTZYIDVHEEIH-VIFPVBQESA-N 256.396 2.494 10 20 CECD COc1ccc(N(C)Cc2noc(C)n2)cc1F 121702827 AGYKTWVCLQYMEX-UHFFFAOYSA-N 251.261 2.162 10 20 CECD COCCCN(C)CCN[C@@H](C)c1cc(F)ccc1O 185554217 GBSNWUFLJYBKNE-LBPRGKRZSA-N 284.375 2.150 10 20 CECD Cc1ccc(C(=O)N[C@H]2CC(C)(C)OC2(C)C)c(O)c1O 183002857 XJLZSUIYQFJVFT-NSHDSACASA-N 293.363 2.482 10 20 CECD CCCOc1ccc(CN2CCC[C@@H]2CO)c(O)c1 92470984 JSJZHYKPWLJJDL-CYBMUJFWSA-N 265.353 2.138 10 20 CECD COc1cccc(CN2CCC[C@@H](N3CCCC3)C2)c1O 92047216 PFMSJEOBEZEAHJ-OAHLLOKOSA-N 290.407 2.461 10 20 CECD O=C1NC(=S)S/C1=C/c1c(Cl)nc2ccccn12 255140806 BPQMJQSUTWXVCF-FNORWQNLSA-N 295.776 2.477 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2C[C@@H]3[C@@H](C2)C3(C)C)c1O 278207388 JSIMOFRKTYIEDD-GHMZBOCLSA-N 292.335 2.397 10 20 CECD COc1cccc(CN2CCC[C@@H]2c2nc(C)no2)c1O 289762408 JXOXXCRQJOIYNX-GFCCVEGCSA-N 289.335 2.429 10 20 CECD Cc1noc(C(C)(C)NCc2cc(F)ccc2O)n1 284986313 IUQQXOMATXRMBJ-UHFFFAOYSA-N 265.288 2.248 10 20 CECD CC(=O)C(=O)COc1ccc(C(C)=O)cc1Cl 289530042 DRZVLINLRBHOIF-UHFFFAOYSA-N 254.669 2.080 10 20 CECD COCC[C@@H](CO)N[C@@H](C)c1cc2c(cc1O)CCCC2 281719270 UMIBUXRSBGOTPD-WFASDCNBSA-N 293.407 2.319 10 20 CECD CCO/C=C/C(=O)N(C)Cc1ccc(N(C)C)cc1 816822880 YWGPGFJKRZWBAK-ZHACJKMWSA-N 262.353 2.261 10 20 CECD COc1ccc(O)c(CNCCCC2(O)CCC2)c1 817414344 HYDUBBXVKZPZIS-UHFFFAOYSA-N 265.353 2.186 10 20 CECD C[C@H](N[C@@H]1CCN[C@H](C)C1)c1cc(F)ccc1O 817970712 CPXVZKNHNZINKO-JFGNBEQYSA-N 252.333 2.322 10 20 CECD CC[C@H](NC[C@H]1CCCN1CCCO)c1ccccc1O 824564304 IKGCEUZATPBFRM-ZBFHGGJFSA-N 292.423 2.280 10 20 CECD C[C@@H]1CCC[C@@H](C)N1NC(=O)/C=C\c1ccc(O)c(O)c1 907998126 VOQPIXKEJNSFKO-PGQSYZCXSA-N 290.363 2.405 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@H](C)c1cc(F)ccc1O 834881024 YFPNTPITQMQABI-JRPNMDOOSA-N 283.343 2.233 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCC[C@@H]2C(=O)O)c1 904268327 HFWZCAHWIHXCBH-QWHCGFSZSA-N 279.336 2.134 10 20 CECD O=C(NCC[C@]1(O)C[C@H]2CC[C@H]1C2)c1cc(O)cs1 832517566 LITVDBBMQFYMBD-BHDSKKPTSA-N 281.377 2.125 10 20 CECD O=C(NCCCCCN1CCCC1)c1cc(O)cs1 832884112 OLWFLHDDXJEXJN-UHFFFAOYSA-N 282.409 2.450 10 20 CECD CN(C)c1ccc(CN2CC[C@](C)(CN)C2)cc1F 843115597 HFHGQBLPVIBGRA-OAHLLOKOSA-N 265.376 2.062 10 20 CECD CCOc1cccc(CN2CC[C@@]3(CCCN3)C2)c1O 841105468 PFSCEIKWVZMHBG-INIZCTEOSA-N 276.380 2.119 10 20 CECD Oc1ccc2ccncc2c1CN1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 840126801 AUNTZIDAMCLQPI-CWLKWCNXSA-N 294.354 2.326 10 20 CECD C[C@@H](NCCNC(=O)C1CC1)c1ccc(Cl)cc1O 841744195 MUCVHFIUBMGQPD-SECBINFHSA-N 282.771 2.222 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)CC[C@@H]1N 843052026 OROTUMJYBITVGJ-CABZTGNLSA-N 254.761 2.215 10 20 CECD Oc1ccccc1CNC[C@H]1NCCc2ccccc21 841069319 UGEGKEDAZKGIAH-MRXNPFEDSA-N 268.360 2.369 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN[C@@H]2CCCNCC2)c1O 841056757 DBVJOVDXBXIJNY-LLVKDONJSA-N 299.758 2.186 10 20 CECD NC[C@@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 843047773 TWNPNMSCGGIMSV-VIFPVBQESA-N 272.751 2.355 10 20 CECD COc1cccc2c1O[C@@H](c1cc(F)ccc1O)NC2=O 917500314 AAGLQRAKQAUSEW-HNNXBMFYSA-N 289.262 2.361 10 20 CECD COc1cccc(CNCCNc2ccc(C)cn2)c1O 922925691 NGFHOORHXUUXMI-UHFFFAOYSA-N 287.363 2.306 10 20 CECD CC[C@@H](NC(=O)Nc1ccc(N)cc1)[C@H](O)C(F)(F)F 841297537 FRWXETYJEORBHU-ZJUUUORDSA-N 291.273 2.092 10 20 CECD CN(C)c1ccc(CNC(=O)NOCC2CCC2)cc1 853011526 HTBFLUBLHCLUDT-UHFFFAOYSA-N 277.368 2.284 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cnco1 759387630 MQFCZWDVODIKRO-UHFFFAOYSA-N 260.293 2.433 10 20 CECD CCOc1ccc(CNCc2cc(C)ncn2)c(O)c1 756989602 FCJPIKRMSHXBLI-UHFFFAOYSA-N 273.336 2.179 10 20 CECD Cc1ccncc1/C=C\C(=O)NCc1ccccc1O 752597519 XJQZJMPKTIJMOK-SREVYHEPSA-N 268.316 2.425 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC/C=C\Cl 759589815 UEOROGRYTDGZCO-MOAQZJEESA-N 254.669 2.407 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(N)cc1O 752465382 DKMGATKWTYNQNA-UHFFFAOYSA-N 299.374 2.313 10 20 CECD O=C(Cc1ccc2c(c1)COC2)NCc1ccccc1O 755517163 YGXRVCQQTYRZQQ-UHFFFAOYSA-N 283.327 2.281 10 20 CECD CO[C@H](C)CNCc1cc(F)c(N(C)C)cc1F 858189747 RJPFFTLALDDFFD-SECBINFHSA-N 258.312 2.155 10 20 CECD Oc1ccnc(/C=C\c2ccc(N3CCOCC3)cc2)n1 764434380 JPAACBZQRSQEDJ-UTCJRWHESA-N 283.331 2.189 10 20 CECD CCc1noc(C)c1C(=O)NCc1cccc(OC)c1O 769495788 JWRUSDKQEBMMSG-UHFFFAOYSA-N 290.319 2.190 10 20 CECD Cc1ccn(C[C@@H](C)C(=O)N(C)Cc2ccccc2O)n1 866596787 JYGUZWRODJBKGU-GFCCVEGCSA-N 287.363 2.192 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@@]12CCOC2 763478130 AJOHGRCGSGHMIN-DOTOQJQBSA-N 288.391 2.104 10 20 CECD CCC(=O)N1CCC[C@@H]1CNCc1ccc(OC)c(C)c1 1034832550 BAKFCNJCSWAAQO-OAHLLOKOSA-N 290.407 2.494 10 20 CECD Cc1cc(Br)cc(CNCCCCN)c1O 1118018695 ICAGPFNUZMOXSY-UHFFFAOYSA-N 287.201 2.292 10 20 CECD CC[C@H](NCCOCCN(C)C)c1ccc(N(C)C)cc1 774375414 AHKRINHXICHMGU-KRWDZBQOSA-N 293.455 2.372 10 20 CECD C[C@@H](NC(=O)Nc1ccncn1)c1ccc(N(C)C)cc1 770769188 VADKLAGHDKGFTI-LLVKDONJSA-N 285.351 2.425 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1C[C@@H](O)C1 874240058 MVOCKAYRLQPAGN-FZNQNYSPSA-N 288.391 2.064 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCC(F)(F)C1 779533326 JGIVWWVGHQHAKV-XCRNYIDWSA-N 283.274 2.415 10 20 CECD Cc1ccc(O)c(CN2CCN(CC(C)C)C(=O)[C@@H]2C)c1 779201081 AFDSVTOPULFBEY-AWEZNQCLSA-N 290.407 2.389 10 20 CECD Cc1n[nH]cc1S(=O)(=O)Nc1ccc(O)c(C(C)C)c1 882798800 DUBPQYQLFZZBOT-UHFFFAOYSA-N 295.364 2.348 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@H](C)c1c(O)cccc1F)CC2 886521134 VBHURTPQGNEDDV-KOLCDFICSA-N 290.342 2.097 10 20 CECD COc1ccc(CC(=O)NCc2ccc(N(C)C)cc2)nc1 789880333 PLASHFXNRJANOG-UHFFFAOYSA-N 299.374 2.015 10 20 CECD CC[C@@H](NCc1cc(Br)ccc1O)[C@H](C)O 386816554 SRQAISCJMMLULQ-GZMMTYOYSA-N 288.185 2.404 10 20 CECD C[C@H](N[C@H](C)CN1CCCC1=O)c1c(O)cccc1F 886509844 GCILWBMPNWQDDD-MNOVXSKESA-N 280.343 2.193 10 20 CECD COc1cccc(O)c1CNCc1ccc(CCO)cc1 898172728 WUWGOEGDDVKVIM-UHFFFAOYSA-N 287.359 2.225 10 20 CECD CCOc1cccc(CNCCN2CC[C@@H](C)C2)c1O 744450345 RYFWBMCPJDUIHJ-CYBMUJFWSA-N 278.396 2.222 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CC[C@H](O)CC1 708493986 BNOKDPJRJBSMKO-XYPYZODXSA-N 257.280 2.064 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@H]2C2CC2)c(O)c1 794387517 KDPRMSLVFBESLB-QWHCGFSZSA-N 261.321 2.063 10 20 CECD C[C@@H]1COCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1O 796498605 XSEVWSCJWJKBQM-GHMZBOCLSA-N 280.324 2.063 10 20 CECD COc1cccc(O)c1CN[C@@H]1C[C@H](OC)C1(C)C 753374249 RMNXYMPLMLASPT-KGLIPLIRSA-N 265.353 2.304 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@]2(C)CO)c1O 723023308 RMPAYJBJSRMIBV-OAHLLOKOSA-N 281.327 2.081 10 20 CECD CC1(C2CCN(Cc3ccc(N)cc3)CC2)OCCO1 1576502472 NLRFSHMELKFFBU-UHFFFAOYSA-N 276.380 2.244 10 20 CECD CCC[C@](C)(CO)NCc1ccc(OC)c(OC)c1O 1334955840 ITSONTLOQKFBNA-OAHLLOKOSA-N 283.368 2.050 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1C[C@H]1F 1346681146 LMFXRMLSSZDURC-NWDGAFQWSA-N 251.301 2.489 10 20 CECD CC[C@H](NC[C@@H](C)CNC)c1ccc(F)cc1O 1345481596 DPQJVBJVTLFKQI-GWCFXTLKSA-N 254.349 2.428 10 20 CECD CCOCCC1(CNC(=O)NCc2ccc(N)cc2)CC1 1357261741 LZRTVSQHMJIZDO-UHFFFAOYSA-N 291.395 2.275 10 20 CECD O=C(NCC1(C(=O)O)CCCCC1)c1cc(O)cs1 1601472191 PZSCIFXRGWQDGG-UHFFFAOYSA-N 283.349 2.219 10 20 CECD C[C@H]1[C@H](C(=O)O)CCN1Cc1cc2c(cc1O)CCC2 1604635153 FPRSGKRQCNWSJZ-IINYFYTJSA-N 275.348 2.176 10 20 CECD COc1cccc(CNCCc2csc(C)n2)c1O 227436621 BVQHPBVXQNAPLI-UHFFFAOYSA-N 278.377 2.498 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)Cc1cnnn1C 155240380 NDDRNUDJGZJDOL-UHFFFAOYSA-N 299.422 2.437 10 20 CECD CCOC[C@@H](NC(=O)Nc1ccc(N)cc1)C(C)C 233799586 YWGACETVXLSWMF-CYBMUJFWSA-N 265.357 2.451 10 20 CECD CCOc1cccc(CNC[C@@H]2CCCO2)c1O 19963568 MLYHXVQHBVONQZ-LBPRGKRZSA-N 251.326 2.060 10 20 CECD CC[C@H]1C[C@H](NCc2ccc(OC)cc2O)CCO1 824320395 HAKSOTMPBAUVTE-OLZOCXBDSA-N 265.353 2.448 10 20 CECD CCOCCOCCN[C@H](C)c1ccc(C)cc1O 927086486 GCBPOHFGZPJEMZ-CYBMUJFWSA-N 267.369 2.404 10 20 CECD CC[C@@H](N[C@@H]1CCCCNC1=O)c1ccccc1O 36976947 RSUDVEGYJVJYAW-CHWSQXEVSA-N 262.353 2.102 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)c2ncn(C)n2)c(O)c1 275745771 REHAIFVPOQNDRA-GHMZBOCLSA-N 260.341 2.241 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)c1ncn(C)n1 276140666 DBEPFSIWAXEONB-QMMMGPOBSA-N 266.732 2.025 10 20 CECD CC[C@@H]1CN(Cc2cc3c(cc2O)OCO3)[C@H](C)CO1 403787806 CVFIMELOHWOTKQ-ZYHUDNBSSA-N 279.336 2.120 10 20 CECD Cn1cc(CNCc2c(O)cccc2Br)cn1 706809141 NLKIASKDTMGDOO-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CC(C)CCNC(=O)[C@@H](C)N(C)Cc1ccccc1O 109769020 ALVBNYIEBQXMND-CYBMUJFWSA-N 278.396 2.375 10 20 CECD CCCCCN(CCO)Cc1cc(OC)ccc1O 179667849 ONDFQQZZMMTIMM-UHFFFAOYSA-N 267.369 2.385 10 20 CECD COc1ccc(N2CCCN(CCCC(=O)O)CC2)cc1 116366410 GPMPYFDQXJCUIY-UHFFFAOYSA-N 292.379 2.072 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCOC)cc1 171276320 KKLYCCCRNNIPJV-UHFFFAOYSA-N 264.369 2.186 10 20 CECD CN1CCCc2cc(CNC(=O)C3CCOCC3)ccc21 58769027 YSQAVLSHRHOJGS-UHFFFAOYSA-N 288.391 2.112 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)c1ncnc2[nH]ncc12 301754230 JUPAFAIZZMBRFW-UHFFFAOYSA-N 296.378 2.445 10 20 CECD O=C(O)CCCN(Cc1ccccc1O)C[C@H]1CCCO1 121042797 RNAOGPLEJVTHRW-CQSZACIVSA-N 293.363 2.238 10 20 CECD C[C@H]1COCC[C@H]1NCc1ccc(N(C)C)c(F)c1 191758013 CQFOHCNFTBNOBH-SMDDNHRTSA-N 266.360 2.406 10 20 CECD Cc1ccc(F)c(C(=O)NCc2ccc(O)c(O)c2)c1 130163697 NSPGDMNCNMVHCK-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CC[C@@]1(CO)CCCN(Cc2cc(OC)ccc2O)C1 190217188 WXWXYZWBWQMLIO-MRXNPFEDSA-N 279.380 2.385 10 20 CECD CCOc1cccc(CN[C@@H](CC)C(C)(C)O)c1O 293011473 NZOXHMFNZWWOGV-ZDUSSCGKSA-N 267.369 2.430 10 20 CECD C[C@@H]([C@H](C)S(C)(=O)=O)N(C)Cc1ccc(N(C)C)cc1 93420059 XLMIPUZVBNQINP-STQMWFEESA-N 298.452 2.006 10 20 CECD CC(C)[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C(C)(C)O 276817296 USUPNTRKDUKJPP-VFADXPBXSA-N 293.363 2.023 10 20 CECD Cc1nnc([C@@H](C)NC(=O)c2ccc(C)c(O)c2O)s1 274277779 YEJYTNZYQZQXEH-SSDOTTSWSA-N 293.348 2.057 10 20 CECD COC(=O)CN(Cc1cc(Cl)cc(OC)c1O)C1CC1 273766654 PYSLBAHTISNNGB-UHFFFAOYSA-N 299.754 2.192 10 20 CECD Cn1c2c(c3cc(OCCOCCO)ccc31)CCCC2 647164069 FTNVHWYQQGQSBY-UHFFFAOYSA-N 289.375 2.445 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCCc2occc2C1 296198308 VCZVEBZOIHYTLV-UHFFFAOYSA-N 291.278 2.419 10 20 CECD COC(=O)[C@H]1CCC[C@H](C(=O)Nc2ccc(N)cc2)C1 818556527 YQBUAZCZGWEPHB-QWRGUYRKSA-N 276.336 2.187 10 20 CECD O=C1CC[C@H]2CN(Cc3cc(Cl)ccc3O)CC[C@@H]2N1 827140146 IFXABRRMONNGTE-GWCFXTLKSA-N 294.782 2.146 10 20 CECD CC1CCN(c2ccc(CNC(=O)C[C@H](C)N)cc2)CC1 828988519 URSCJFGEAIZYNA-AWEZNQCLSA-N 289.423 2.276 10 20 CECD COC(=O)c1cc(COC(=O)c2cc(O)cs2)oc1C 732354068 ZCMRHJBOMOTOIN-UHFFFAOYSA-N 296.300 2.499 10 20 CECD C[C@H]1C[C@H](N[C@@H]2CC[C@H](C(N)=O)C2)c2c(O)ccc(F)c21 834905881 AFRZADDUQWHXMS-GUDRVLHUSA-N 292.354 2.323 10 20 CECD COCCC1(C)CN(Cc2c(O)cccc2OC)C1 839143403 QCJOZCLXPOFWAX-UHFFFAOYSA-N 265.353 2.259 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CCc3n[nH]cc3C1)CC2 834680700 GFKZBGWIPRITTR-GXTWGEPZSA-N 269.348 2.250 10 20 CECD COc1ccc(CNC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)c(O)c1 831033486 WLZYKFVKXAKRLH-COPLHBTASA-N 275.348 2.453 10 20 CECD C[C@@H](NC(=O)[C@]1(Cl)C[C@H]2CC[C@H]1O2)c1ccccc1O 913763511 IWIIIILQHNKCIQ-VWFAINMRSA-N 295.766 2.498 10 20 CECD C[C@@H]1CN(C(=O)Nc2ccc(N)cc2)C[C@H](C2CC2)O1 841294351 ACNLJNLJEGNVGU-QMTHXVAHSA-N 275.352 2.300 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843058313 RNUKOFMVILZBED-DTWKUNHWSA-N 299.758 2.123 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](O)c1ccco1 840928741 HTBKFHBLMGZPAN-HNNXBMFYSA-N 274.364 2.477 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@]2(C)C(=O)O)c1O 846273505 YFZPWDSABRNNFY-OAHLLOKOSA-N 295.310 2.173 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@@H](CO)COC(C)C 840945732 WMFTXBKKIXYHIJ-KRWDZBQOSA-N 294.439 2.279 10 20 CECD Cc1cc(CN(C)[C@H]2CCC(=O)N(C)C2)ccc1N(C)C 846920102 FPOPTQYJVNNULJ-HNNXBMFYSA-N 289.423 2.114 10 20 CECD Cc1ncc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)o1 840795414 ZILJLLRZBZWMPG-QMMMGPOBSA-N 277.280 2.448 10 20 CECD CCN(CC)C[C@H]1CCN(Cc2ccc(N)cc2)C1 1336285387 LXPBHEDAXIBFFA-OAHLLOKOSA-N 261.413 2.433 10 20 CECD CCOC(C)(C)C(=O)N[C@H](C)c1ccccc1O 827957369 VEXZWJGFASIGTD-SNVBAGLBSA-N 251.326 2.385 10 20 CECD CCC(=O)[C@H](C)OC(=O)/C=C\c1ccc(O)c(O)c1 759596200 OBNDEUPVSOUBOW-PGBBXKAQSA-N 264.277 2.022 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2C[C@H](C)O[C@H](C)C2)c1 858337532 JPMHIRUAPNSXJR-DABQJJPHSA-N 292.379 2.456 10 20 CECD CC(=O)N1CC[C@@H](N[C@H](C)c2ccc(Cl)cc2O)C1 857083977 DYBNFDCOIJNGNG-BXKDBHETSA-N 282.771 2.317 10 20 CECD CCC[C@@H](OCC)C(=O)NCc1ccc(N)cc1 859593982 MLIOBGCTUAFQNF-CYBMUJFWSA-N 250.342 2.090 10 20 CECD c1cnc2nc(NCc3ccc(N4CCCC4)cc3)nn2c1 1116827339 XUOIJEJSTSKNCO-UHFFFAOYSA-N 294.362 2.337 10 20 CECD Cc1cccc(O)c1CNCCCOC[C@H]1CCOC1 877060217 VJKNXPCRBRDSPD-CQSZACIVSA-N 279.380 2.233 10 20 CECD CC(C)N(C)Cc1ccc(N2CCN(C)CC2)cc1 775638276 HDLVMSFJDMTPOA-UHFFFAOYSA-N 261.413 2.279 10 20 CECD Cc1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cn1 779478156 GCWMTCNTYMAMAG-FNORWQNLSA-N 284.315 2.131 10 20 CECD Cc1cccc(O)c1CN1CCN(CC2CC2)CC1 876611041 PIMGGQSGRXFHOW-UHFFFAOYSA-N 260.381 2.228 10 20 CECD CO[C@@H](C)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773012102 FWGJZRSBMQAZBF-NWDGAFQWSA-N 264.369 2.355 10 20 CECD CCCn1cc(CN(C)c2ccc(OC)c(OC)c2)nn1 877342272 LDNUIXNYDZHXCA-UHFFFAOYSA-N 290.367 2.342 10 20 CECD CCN(CCS(C)(=O)=O)Cc1ccc(N(C)CC)cc1 773780871 AHABZGBXNPCIIX-UHFFFAOYSA-N 298.452 2.009 10 20 CECD CC[C@H](C)[C@](C)(O)CNCc1cc(OC)c(OC)cc1O 776173870 BXPMDJMVAZCXNZ-MEDUHNTESA-N 297.395 2.296 10 20 CECD Nc1ccc(CNC(=O)N2CCC(F)(F)CC2)cc1 1120676752 BJSLOIBWBYXHBL-UHFFFAOYSA-N 269.295 2.210 10 20 CECD CC(C)Cn1ccc(C(=O)NCc2ccccc2O)n1 896016259 ZBFUMESETJOECA-UHFFFAOYSA-N 273.336 2.175 10 20 CECD C[C@@H]1OCC[C@]1(O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 788623261 KNKPCVNYBWEDPA-IZXSPOQTSA-N 295.354 2.209 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1cc(C)ccc1O 186029817 ZMOCEMRNESHUQO-VXGBXAGGSA-N 285.409 2.174 10 20 CECD COc1cc(C)cc(CN2C[C@@H](CO)C[C@@H](C)C2)c1O 895033193 GYSZGFZUNXHJQR-OLZOCXBDSA-N 279.380 2.160 10 20 CECD CCOc1cccc(CNC[C@H]2CC(C)=NO2)c1O 895309526 CADHZWNGZABWIL-GFCCVEGCSA-N 264.325 2.045 10 20 CECD COc1ccc(CNC(=O)CCC(C)(F)F)c(O)c1 794378923 KRUKXHUPWPMNEC-UHFFFAOYSA-N 273.279 2.452 10 20 CECD CN(C)c1ccc(CN(C)[C@H]2C[C@@H](C(=O)O)C2)cc1 693027286 IBEKDFNLGZYNJP-XBXGTLAGSA-N 262.353 2.048 10 20 CECD COc1cccc(CN[C@@H]2CCCC[C@H]2N(C)C)c1O 1319832598 BMKAFSNIKSBLJS-ZIAGYGMSSA-N 278.396 2.363 10 20 CECD CC1=NO[C@](C)(C(=O)NCc2cc(Cl)ccc2O)C1 1337281398 KAOJZACWRZCQQX-ZDUSSCGKSA-N 282.727 2.217 10 20 CECD COC[C@](C)(CC(=O)O)NCc1ccc(Cl)cc1O 1606785260 JDTVXWLYTRPEOG-ZDUSSCGKSA-N 287.743 2.015 10 20 CECD COc1cc(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)c(O)cc1C 1594056726 WDYRYNSONZDAFD-WCQYABFASA-N 293.363 2.252 10 20 CECD CC[C@@H](NCc1ccc2c(c1)CCCN2CC)C(=O)O 1776722123 ODDLFBWHVRCBNV-CQSZACIVSA-N 276.380 2.412 10 20 CECD CC[C@H](C)[C@@H](NCc1ccc2c(c1)CCO2)C(=O)OC 37363456 ROGZPTOOBJGUIA-XHDPSFHLSA-N 277.364 2.299 10 20 CECD CN1CC[C@H](NCc2ccc(N3CCCCC3)cc2)C1 49084075 NVVPUYIAXULQBB-INIZCTEOSA-N 273.424 2.471 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]2CCO)c1O 312765358 CWBDCUAZWPINSR-CYBMUJFWSA-N 281.327 2.081 10 20 CECD Cc1ncccc1CNCc1cc2c(cc1O)OCO2 527793453 INIPCIWQYZCTJF-UHFFFAOYSA-N 272.304 2.114 10 20 CECD CCOc1cccc(CNCCC2(CO)CC2)c1O 395890546 RJYAXMBTDCWCCK-UHFFFAOYSA-N 265.353 2.043 10 20 CECD Oc1ccc(Br)cc1CNC[C@@H]1CCCO1 2554125 YQLSYWKUCIJCSI-NSHDSACASA-N 286.169 2.423 10 20 CECD Cc1cc(C(=O)O[C@H]2CCOC2)c(C)n1-c1ccccn1 107016032 FMUGPTCZVISQRL-ZDUSSCGKSA-N 286.331 2.435 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C1CCC1 173188122 IJIYBTHSCDMGCY-UHFFFAOYSA-N 260.337 2.278 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1cc(C)c(C)cc1O 128920053 XIEMIUBSZJHDRA-AWEZNQCLSA-N 276.380 2.110 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc(C)c(O)c2)c1 181225390 YRQXQVPGHCZXSV-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CCCCCS(=O)(=O)NCc1ccc(N(C)C)cc1 181397790 LKVMYZZHHHMFSG-UHFFFAOYSA-N 284.425 2.362 10 20 CECD CCOc1cccc(CN[C@H](CC(C)C)C(=O)OC)c1O 36980916 NTJULCKFPVFIPI-CYBMUJFWSA-N 295.379 2.468 10 20 CECD Cc1cc(NC(=O)CSc2nccs2)on1 48875512 GZULYTVNUBTBFX-UHFFFAOYSA-N 255.324 2.170 10 20 CECD O=C(CSc1nccs1)NCc1ccco1 47238769 CVCUCCSLYDGNJQ-UHFFFAOYSA-N 254.336 2.145 10 20 CECD COc1cccc(CNC(=O)OC(C)(C)C)c1O 161121023 WTEOPVVBKDVBSE-UHFFFAOYSA-N 253.298 2.426 10 20 CECD Oc1ccccc1CN(C[C@@H]1CCCO1)c1ncccn1 92926032 UZVUSGOYRCXJAN-AWEZNQCLSA-N 285.347 2.368 10 20 CECD C[C@@H](C(=O)NCCc1ccc(N)cc1)[C@@H](N)c1ccccc1 262583166 RJMFASYWBCUFBX-CXAGYDPISA-N 297.402 2.264 10 20 CECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCO)c2C)c1 269098717 NYMWQDKZANETGK-UHFFFAOYSA-N 286.375 2.433 10 20 CECD COC[C@@H](C)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273412856 QEOACELHXIYXJF-QWRGUYRKSA-N 281.352 2.112 10 20 CECD CC[C@H](N[C@@H](CCO)COC)c1ccc(C)cc1O 280018452 HECPOCHVENVTDQ-JSGCOSHPSA-N 267.369 2.139 10 20 CECD CCCN[C@@H](C)C(=O)NCc1c(O)ccc2c1CCCC2 295157559 KELBXRMUKKXYNN-LBPRGKRZSA-N 290.407 2.275 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H]2C[C@H]21 804294472 LXBSSLIGQXWPGS-WBIIUDBISA-N 259.305 2.122 10 20 CECD C[C@@H](NC[C@@H](N)C1CC1)c1cc(F)cc(F)c1O 817964530 BZXGQFBYDDZJLN-JMCQJSRRSA-N 256.296 2.058 10 20 CECD CCOc1ccc(CNCc2nn(CC)nc2C)c(O)c1 818220368 GFSUYRUWJVAHHC-UHFFFAOYSA-N 290.367 2.001 10 20 CECD Cc1cc(O)c(CN2C[C@@H](O)C[C@H]2C)cc1Cl 825666085 GWCKXIWNWMVLBU-KOLCDFICSA-N 255.745 2.309 10 20 CECD CCCONC(=O)NCc1c(O)ccc2c1CCCC2 828278176 QQTZYSVIYHFOEQ-UHFFFAOYSA-N 278.352 2.412 10 20 CECD CCn1nnc(C)c1CNCCCSc1nccs1 823937653 FNANONPSHUZMNF-UHFFFAOYSA-N 297.453 2.335 10 20 CECD Cc1ccncc1CNC[C@H](N)c1ccc(N(C)C)cc1 841042713 MQSNNCXPXVZFCI-KRWDZBQOSA-N 284.407 2.246 10 20 CECD Cc1ccc(O)c(CN[C@@H](CCN)C(F)(F)F)c1 841090544 KFRZPHYULFIHFW-NSHDSACASA-N 262.275 2.070 10 20 CECD COC1CCN(CCN[C@@H](C)c2cc(F)ccc2O)CC1 756643326 UDIITTRCSNSSDV-LBPRGKRZSA-N 296.386 2.293 10 20 CECD CC[C@@H](NCCN1CC[C@@H](O)C1)c1cccc(Cl)c1O 858549188 UNHMCWKLSXZDRE-BXUZGUMPSA-N 298.814 2.153 10 20 CECD CC[C@@H](NC[C@@](C)(O)COC)c1ccc(N(C)C)cc1 765934133 AEJSOKCIPLFTOE-HZPDHXFCSA-N 280.412 2.191 10 20 CECD CCOc1ccc(CN2C[C@@H](C)OC[C@H]2C)c(O)c1 768537661 RIQGHVZKIQCGOW-VXGBXAGGSA-N 265.353 2.400 10 20 CECD Cc1nonc1CNCc1cc(F)c(N(C)C)cc1F 862367421 IITRMACVMZHYSK-UHFFFAOYSA-N 282.294 2.012 10 20 CECD CN1CCc2cc(/C=C3\SC(=O)NC3=O)ccc21 874927469 CZHJCLRUYFKIRT-XFFZJAGNSA-N 260.318 2.003 10 20 CECD Cc1c[nH]cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c1=O 775412006 UAPFEWLNBOURKB-LBPRGKRZSA-N 299.374 2.240 10 20 CECD CC(C)[C@H](C(=O)N[C@H](C)c1ccccc1O)[C@@H](C)N 870987667 ABYMNZPBDCNQBV-GYSYKLTISA-N 264.369 2.189 10 20 CECD C[C@@H]1COCCN1Cc1cc(Cl)cc(F)c1O 775182396 TZNZPBMBYRKLRD-MRVPVSSYSA-N 259.708 2.405 10 20 CECD COC(=O)c1occc1CNCc1cc(OC)ccc1O 776174520 DAMUKUCFRSREHX-UHFFFAOYSA-N 291.303 2.070 10 20 CECD CCn1nccc1C(=O)NCc1ccc(N(C)C)c(F)c1 772946948 KFOAURJGBZMNQM-UHFFFAOYSA-N 290.342 2.038 10 20 CECD COc1ccc(CN[C@H](C)c2csnn2)c(O)c1OC 894926572 UFDHLOMCQJQTBE-MRVPVSSYSA-N 295.364 2.112 10 20 CECD COc1cccc(CN[C@@H](C)c2cnccn2)c1O 894764274 GSAAIUVGRNRKLB-JTQLQIEISA-N 259.309 2.042 10 20 CECD COc1cc(C)cc(CNC[C@@H](O)c2ccc(C)o2)c1O 894293025 IHMZKCNFYOKJPI-CYBMUJFWSA-N 291.347 2.434 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)CS(C)(=O)=O)cc1 78640517 GTQOWKXHRAFBOO-CYBMUJFWSA-N 298.452 2.056 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](CF)C1 1339816835 AUQNKLADZYQAQG-RNZFLTOJSA-N 279.311 2.319 10 20 CECD CCCN(Cc1ccccc1O)c1nnnn1C1CC1 1351024922 KHLTZHKFHBMWHR-UHFFFAOYSA-N 273.340 2.130 10 20 CECD Cc1ccc(O)c(CNCc2cccc(CO)c2)c1 226648006 MEGRHQFPKYTESP-UHFFFAOYSA-N 257.333 2.483 10 20 CECD O=C(O)c1ccc(C(=O)NCc2ccccc2O)c(F)c1 1610823362 JUDYKGNXSHLWGW-UHFFFAOYSA-N 289.262 2.160 10 20 CECD O=C(NCc1ccccc1O)c1ccc(F)cc1O 228309573 JQQHHQZFEHTWIG-UHFFFAOYSA-N 261.252 2.167 10 20 CECD CC(C)(C(=O)Nc1ccc(N)cc1)N1CCCCC1 1575096937 OVMGYXMIKIZRDU-UHFFFAOYSA-N 261.369 2.472 10 20 CECD COc1cc(CN[C@H](C)C(=O)O)c(O)c(C(C)(C)C)c1 1594059223 YSAQGVFIFAGAJB-SECBINFHSA-N 281.352 2.261 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@@H]2C(=O)O)cc1 1598320786 SONKRHOSLINDBE-KBPBESRZSA-N 262.353 2.096 10 20 CECD COC(=O)c1ccc(CNCc2ccccc2O)o1 134672308 ITCKVZWUVLCMJD-UHFFFAOYSA-N 261.277 2.062 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)OCC(N)=O)c2C)c1 5924940 SAPZLLPYRBGZBE-UHFFFAOYSA-N 286.331 2.045 10 20 CECD CCc1nc(CN(C)c2ccc(OC)c(F)c2)n[nH]1 158896680 NDAQVNSMTSRRRU-UHFFFAOYSA-N 264.304 2.151 10 20 CECD CCN(CC)C(=O)CN(C)Cc1cc(C)ccc1O 155105100 UGSHSTAIGCCGOC-UHFFFAOYSA-N 264.369 2.001 10 20 CECD COC(=O)CCCN[C@H](C)c1cc(OC)ccc1O 37416900 IBSPRCDUNNOARY-SNVBAGLBSA-N 267.325 2.005 10 20 CECD CCN1CC[C@H](N[C@H](C)c2ccc(N(C)C)cc2)C1=O 708678819 BOVLLJOATXZOBR-DOMZBBRYSA-N 275.396 2.024 10 20 CECD CCN1CC[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 708678821 BOVLLJOATXZOBR-SWLSCSKDSA-N 275.396 2.024 10 20 CECD CCO[C@H]1C[C@H]1C(=O)NCc1c(O)ccc2c1CCCC2 174519747 ACKGHCDMUAPIMZ-CJNGLKHVSA-N 289.375 2.312 10 20 CECD CN(C)c1ccc(CNC(=O)N(C)[C@@H]2CCSC2)cc1 129727541 MNEUBIGLYAKPKR-CQSZACIVSA-N 293.436 2.400 10 20 CECD Cc1cccn2c(/C=C3\SC(=S)NC3=O)cnc12 125218288 OSEZLZXHTPZHHU-UITAMQMPSA-N 275.358 2.132 10 20 CECD C[C@@]1(C(=O)O)CCN(Cc2c(O)cccc2Cl)C1 128822388 HPFOHWUJBVHMFL-CYBMUJFWSA-N 269.728 2.342 10 20 CECD Cc1cc([C@H]2CCCN2C(=O)Cc2ccc(N)cc2)on1 37820283 YNBCXAMVYMEMJC-CQSZACIVSA-N 285.347 2.471 10 20 CECD CC[C@](C)(CCO)NCc1cc(OC)ccc1O 182626674 JIBQKDDLWAFUHV-CQSZACIVSA-N 253.342 2.042 10 20 CECD C[C@H](C(=O)NCCc1ccc(N)cc1)[C@@H](N)c1ccccc1 262583177 RJMFASYWBCUFBX-SUMWQHHRSA-N 297.402 2.264 10 20 CECD NC(=O)[C@@H]1[C@@H]2CCC[C@@H]2CN1Cc1cccc(Cl)c1O 368974801 PEHTXSIPDAVFJP-XWIASGKRSA-N 294.782 2.131 10 20 CECD Cc1cc(C)c([C@@H](C)NCC2(C)OCCO2)c(O)c1 284937764 DSFJZNSTOOPKGG-GFCCVEGCSA-N 265.353 2.423 10 20 CECD CCCN[C@@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 295142362 IWNDVABVQXIMKT-ZDUSSCGKSA-N 289.423 2.073 10 20 CECD CC[C@@H](CS(=O)(=O)Nc1ccc(O)c(Cl)c1)OC 817356952 ZPOZMPSHGJXPKC-VIFPVBQESA-N 293.772 2.212 10 20 CECD C[C@@H](NC(=O)NC(C)(C)CCN)c1ccc(N(C)C)cc1 817875899 BCUBXFGGCLWFKH-GFCCVEGCSA-N 292.427 2.240 10 20 CECD C[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)[C@H]1CCCOC1 817942897 RHUPOXDBRBVTNB-JLJPHGGASA-N 291.439 2.157 10 20 CECD Cc1cccc(N(C)C(=O)/C=C\c2cnn(C)c2)c1 727093651 UTOFRNNXUUMFIE-FPLPWBNLSA-N 255.321 2.405 10 20 CECD CCn1nc(C)c(CN(C)c2ccc(OC)cc2OC)n1 828474459 LMFGKHSHHGDTCY-UHFFFAOYSA-N 290.367 2.260 10 20 CECD COc1ccc(O)c(CNCc2cccc(C(=O)O)c2)c1 820845762 BIBPNADLEZNINR-UHFFFAOYSA-N 287.315 2.389 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H](CC(=O)O)C2)c1 820387368 MHDCOKOSTWFGSZ-LBPRGKRZSA-N 293.363 2.478 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCOC[C@H]2OC)c1 824709451 QIWKLTSJDAZDOW-HWWQOWPSSA-N 295.379 2.103 10 20 CECD CCc1nocc1C(=O)N[C@H](C)c1ccccc1O 827952133 HBHGXTXFPQULGQ-SECBINFHSA-N 260.293 2.434 10 20 CECD C[C@H](NCC1(N)CC1)c1cc(Br)ccc1O 902414721 ZUZQXMOBMVVQMZ-QMMMGPOBSA-N 285.185 2.297 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1ncccn1 735847759 QXJIAAMIZJIXIO-UHFFFAOYSA-N 282.347 2.007 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)NC(CF)CF 836244170 OEBQKMZFDMGGNV-UHFFFAOYSA-N 297.349 2.394 10 20 CECD CC(C)CN(CCC(=O)O)Cc1cc(F)ccc1O 833486406 HNFXWZCPNUMQQZ-UHFFFAOYSA-N 269.316 2.464 10 20 CECD CCN(CC)CCNC(=O)c1ccc(CN=[N+]=[N-])o1 1537962818 FBOPODJMIKPACF-UHFFFAOYSA-N 265.317 2.162 10 20 CECD COc1cccc(CNCc2nc(C(C)(C)C)n[nH]2)c1O 839170724 OSSILHVBQYOMMT-UHFFFAOYSA-N 290.367 2.106 10 20 CECD C[C@@H]1CC(C)(C)CN1Cc1cc2c(cc1O)OC[C@H]2O 840179325 ALEDMKATFAEJNE-QMTHXVAHSA-N 277.364 2.438 10 20 CECD COCCNCCNCc1ccc(N2CCCCC2)cc1 841046501 CCTQBKPFDIWEOZ-UHFFFAOYSA-N 291.439 2.003 10 20 CECD COC(=O)NCc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1 918632661 AQQLZHNUOODOIQ-GHMZBOCLSA-N 296.342 2.295 10 20 CECD C[C@@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)CO1 842773542 ADBQDIBPCZIKAP-SFYZADRCSA-N 259.708 2.452 10 20 CECD Cc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)nn1C 746812694 GVNKITABKRTZLD-UHFFFAOYSA-N 298.390 2.041 10 20 CECD CC(C)[C@H](NC(=O)Nc1ccc(N)cc1)C(C)(C)O 841297942 VWTBNMWISIFZOB-LBPRGKRZSA-N 265.357 2.186 10 20 CECD COCC[C@@H](C)CNCc1cc(OC)c(OC)cc1O 840954480 FQXCIWHLFCGNGV-LLVKDONJSA-N 283.368 2.172 10 20 CECD C[C@H](NCCC(C)(C)S(C)(=O)=O)c1ccccc1O 840876545 NUJGHKHKKFRIED-NSHDSACASA-N 285.409 2.256 10 20 CECD C[C@H]1C[C@H](N)CCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 846699932 YHHCDUQXSWTDQQ-GZMMTYOYSA-N 299.758 2.265 10 20 CECD CN(C)c1ccc(CN[C@H]2CCNC2)c(C(F)(F)F)c1 841045280 ROJCHGQXZQSQDQ-NSHDSACASA-N 287.329 2.223 10 20 CECD CCc1cccc(CN2CC[C@@H](C(=O)OC)[C@@H]2C)c1O 848905015 FPZSMFCSBDODSS-SMDDNHRTSA-N 277.364 2.338 10 20 CECD CO[C@H](C)CNC(=O)NCc1c(O)ccc2c1CCCC2 852536575 YAFCZYPLPVBOCQ-LLVKDONJSA-N 292.379 2.105 10 20 CECD COc1ccc(N2CCN(CCOC3CC3)CC2)cc1F 929824943 ZNMRYQQAGGBYGE-UHFFFAOYSA-N 294.370 2.135 10 20 CECD COC1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCCC1 754678420 YGPSMSMNSMYWOK-LLVKDONJSA-N 293.363 2.104 10 20 CECD CC[C@@H](CN1CCCC1)NC(=O)NCc1ccccc1O 758739328 UBUXHRCWJCHJCX-AWEZNQCLSA-N 291.395 2.066 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](CO)CC2CC2)c1O 850546414 LRXZEBHZRGDWHP-YPMHNXCESA-N 279.380 2.460 10 20 CECD CSC[C@@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O 768464005 YTWMQEVAEFLGPZ-FZMZJTMJSA-N 295.404 2.145 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnc3ccccn23)cc1 761711876 LMJRPIIQIFRFKE-UHFFFAOYSA-N 294.358 2.330 10 20 CECD C[C@@H](NC(=O)C1(F)CCOCC1)c1ccc(N(C)C)cc1 867503254 JBRMSDIVBFDFPT-GFCCVEGCSA-N 294.370 2.449 10 20 CECD C[C@H]1C[C@@H](CO)CN(Cc2cc(F)c(N(C)C)cc2F)C1 862396068 GQIXRLRNOBHFNX-NWDGAFQWSA-N 298.377 2.481 10 20 CECD COc1cc(CN(C)CCc2cnccn2)c(O)cc1C 770662266 RNKLFFZLOBHFRK-UHFFFAOYSA-N 287.363 2.174 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 773021986 AGWQRLIAAAIVKG-UONOGXRCSA-N 280.412 2.455 10 20 CECD COc1cccc(O)c1CN[C@H](CO)CCC(C)C 883187878 YLMBTLITJVRRSH-LBPRGKRZSA-N 267.369 2.288 10 20 CECD CC(C)c1cc(NS(=O)(=O)C[C@@H]2CCCO2)ccc1O 882798742 BKDVFAAKNGRVBQ-LBPRGKRZSA-N 299.392 2.436 10 20 CECD CCn1ccc(CNCc2cc(F)cc(F)c2O)n1 883145645 IZBGXBIUPQCGQQ-UHFFFAOYSA-N 267.279 2.177 10 20 CECD C[C@@H](N[C@H](C)c1cc(F)cc(F)c1O)c1ncn(C)n1 783300779 XNMXFZGGWDMTSG-HTQZYQBOSA-N 282.294 2.211 10 20 CECD C[C@@H](Nc1ccc(N(C)CCO)cn1)c1ccccc1O 783524552 OTVNCONICZMHTG-GFCCVEGCSA-N 287.363 2.389 10 20 CECD CCOC(=O)CCCN[C@H](C)c1ccccc1O 81545518 SWHUHZPZRLVYAC-LLVKDONJSA-N 251.326 2.386 10 20 CECD Cn1ncc([N+](=O)[O-])c1NCc1ccc(N2CC=CC2)cc1 892644107 BAOWOCYVSOZBHJ-UHFFFAOYSA-N 299.334 2.317 10 20 CECD Cc1nc(CC(=O)N(C)Cc2ccccc2O)cs1 77258272 ZMAIGPXLAGEWDP-UHFFFAOYSA-N 276.361 2.358 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C1CC(O)C1 792174089 GJUAIAMMCZOYDX-UHFFFAOYSA-N 259.708 2.140 10 20 CECD COc1ccc(CNCCNC(=O)[C@@H](F)C(C)C)cc1C 1132556145 BHJCOEAYJJFMAV-HNNXBMFYSA-N 296.386 2.204 10 20 CECD O=C(NC[C@H]1CC1(Cl)Cl)c1cccc(O)c1O 790528483 QHTLGLCRCIVNGD-ZCFIWIBFSA-N 276.119 2.021 10 20 CECD C[C@@H](N[C@@H](C(N)=O)c1ccccc1)c1ccccc1O 775135860 GZUKVHLEEZHBKT-IAQYHMDHSA-N 270.332 2.269 10 20 CECD CCCC(=O)NCCC1=CCN(c2cc(C)ncn2)CC1 1089804356 FTIBDZMSVQOMJJ-UHFFFAOYSA-N 288.395 2.228 10 20 CECD C[C@@H]1CN(C(=O)NCc2ccc(N)cc2)CCC1(F)F 1338793682 RRWZRZPZFHECPH-SNVBAGLBSA-N 283.322 2.456 10 20 CECD Nc1ccc(CNC(=O)NCC[C@@H]2CCCC[C@@H]2O)cc1 1335737014 JRITZDHOJRNCGI-ZFWWWQNUSA-N 291.395 2.009 10 20 CECD CCC[C@@](C)(NCc1ccc(C)cc1O)C(=O)O 1595559255 GBFATOBPDJQNRZ-CQSZACIVSA-N 251.326 2.434 10 20 CECD Cc1cc(-c2nnc(N(C)Cc3ccccc3O)n2C)no1 1355662190 WFYHZSYYCCOPNE-UHFFFAOYSA-N 299.334 2.121 10 20 CECD O=C(O)c1ccc(/C=C\C(=O)N2Cc3cccc(O)c3C2)o1 1606482388 AJHBRORNHQPSQG-ALCCZGGFSA-N 299.282 2.239 10 20 CECD Cc1nnc([C@H](C)Sc2ncc(C(=O)O)s2)o1 1608012896 DPCBKRNFBMIAKR-BYPYZUCNSA-N 271.323 2.386 10 20 CECD CO[C@H]1CCN(Cc2cc(C)c(C)cc2O)[C@H](C(=O)O)C1 1610237945 QWMZEHBDPHYWKV-KBPBESRZSA-N 293.363 2.073 10 20 CECD CCN(CC(=O)O)Cc1c(O)cc(C)cc1Cl 1596225229 UWWWBKUVBXTAKS-UHFFFAOYSA-N 257.717 2.261 10 20 CECD C[C@H](Nc1cnc(C(=O)O)cn1)c1ccc(N(C)C)cc1 1776456505 DZOJIZWVCSQEFW-JTQLQIEISA-N 286.335 2.414 10 20 CECD CC[C@H](NCCS(=O)(=O)CC)c1ccc(N(C)C)cc1 163507170 GQLMVEFYWYPJDJ-HNNXBMFYSA-N 298.452 2.228 10 20 CECD CCCCOCCCNC(=O)c1cccc(O)c1O 126548175 LBCXMIBTJNFWRG-UHFFFAOYSA-N 267.325 2.034 10 20 CECD CN1CCC[C@H](CNCc2ccc3c(c2)CCCO3)C1 921716705 JOKJTWQFAVPZEE-OAHLLOKOSA-N 274.408 2.443 10 20 CECD COc1cccc(CNC[C@H](C)N2CCCCC2)c1O 38028512 NGKBZBRGZRRKPZ-ZDUSSCGKSA-N 278.396 2.365 10 20 CECD CC(C)[C@@H](CO)CN[C@@H](C)c1ccc(F)cc1O 394044446 HXLJACSHLFCPRM-WDEREUQCSA-N 255.333 2.446 10 20 CECD CCOc1cccc(CN2CCCOCC2)c1O 134192340 DXFPXZMGPUECQH-UHFFFAOYSA-N 251.326 2.013 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccn1C 115281231 ZLSLDTNMSDAZEF-UHFFFAOYSA-N 271.364 2.330 10 20 CECD C[C@@H]1CCN[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 126567383 QJQUTXNVHFJQCX-CJNGLKHVSA-N 289.423 2.099 10 20 CECD CC(C)N1CC[C@@H](N[C@H](C)c2ccc(F)c(F)c2O)C1=O 187784450 VREDKPUJCTVFGL-BXKDBHETSA-N 298.333 2.330 10 20 CECD Oc1c(Br)cccc1CN1CCC[C@H](O)C1 127987928 LRZXUHHRIQUTRA-JTQLQIEISA-N 286.169 2.111 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)CO[C@H]2CCOC2)c1 185673437 CFPTUJKDTYMSCH-DYEKYZERSA-N 295.379 2.245 10 20 CECD CCCC[C@@H](COC)NC(=O)/C=C/c1ccc(O)c(O)c1 181102056 HCZQZVULTFINTF-XOVSCCBYSA-N 293.363 2.432 10 20 CECD CCC(CC)[C@@H](O)CNCc1cc(F)ccc1O 226609924 UYYNHWZHBBGVMY-AWEZNQCLSA-N 255.333 2.418 10 20 CECD CCOC(=O)[C@@](C)(O)CN(C)c1ccc(OC(C)C)cc1 277253026 QKHILXSFJXDCJS-INIZCTEOSA-N 295.379 2.224 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@@H](C2CC2)C1 368049407 VIAFGBUVPOVHQX-ZABGRMTBSA-N 273.332 2.370 10 20 CECD CCCCN(Cc1ccccc1O)[C@H](CC)C(N)=O 282379709 FXBYTITVXWUXGO-CYBMUJFWSA-N 264.369 2.258 10 20 CECD CC(C)[C@@H](CO)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 806169250 JPVRVGNYWHNNRB-WDEREUQCSA-N 282.340 2.216 10 20 CECD CN(C)[C@@]1(CN[C@@H]2CCc3cccc(O)c32)CCSC1 297507179 CIXRNGJQIVTLAC-CZUORRHYSA-N 292.448 2.406 10 20 CECD Cc1ccc(O)c(CN2CCC(F)(F)[C@@H](CO)C2)c1 291028388 BBDTXAPKIAGHQU-GFCCVEGCSA-N 271.307 2.150 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@H](n3ccnn3)C2)c1 819897038 NUJKQTRDAOPYQG-HNNXBMFYSA-N 286.379 2.438 10 20 CECD C[C@H](NC(=O)CCc1ncccn1)c1ccc(N(C)C)cc1 812545102 WZHZXAJEQHQNEM-ZDUSSCGKSA-N 298.390 2.353 10 20 CECD O=C1OC[C@@H]2CN(Cc3ccc4ccccc4c3O)CCN12 816515183 RMUXWJCWKDHTFT-AWEZNQCLSA-N 298.342 2.182 10 20 CECD C[C@H](NC[C@@H]1CCCNC1)c1ccc(N(C)C)cc1 817946162 SRKYJKAKMOZYEQ-UONOGXRCSA-N 261.413 2.403 10 20 CECD CCC[C@@](C)(N)C(=O)N[C@@H](C)c1cc(OC)ccc1O 828668213 ZKYHZOXIQTVMEW-ZUZCIYMTSA-N 280.368 2.096 10 20 CECD CCN1CC[C@H](N(C)C(=O)c2cc(O)cs2)C[C@@H]1C 828491264 XWYWDELAZHTDRN-QWRGUYRKSA-N 282.409 2.399 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCc2ncncc2C1)c1ccccc1O 827951973 BBOAMVYXPSBJKX-VXGBXAGGSA-N 297.358 2.165 10 20 CECD C[C@@]1(O)CCN(Cc2ccc(Br)cc2O)C1 824905815 DZSQZPVMYTYPKM-GFCCVEGCSA-N 286.169 2.111 10 20 CECD COc1c(C)cnc(CNC(=O)c2cc(O)cs2)c1C 731872755 QBBNSXUJUUKZBC-UHFFFAOYSA-N 292.360 2.404 10 20 CECD CCn1ccnc1[C@@H](C)NC(=O)c1ccc(C)c(O)c1O 836948327 GRDCFSYZBNRGSE-SNVBAGLBSA-N 289.335 2.114 10 20 CECD O=C(NCCCO[C@H]1CCCCO1)c1cc(O)cs1 839749242 DPUSGCUWURUPHH-LBPRGKRZSA-N 285.365 2.117 10 20 CECD Cc1nnc([C@@H](C)OC(=O)c2cc(O)cs2)o1 732353724 SXUKGZOFMMAXJL-RXMQYKEDSA-N 254.267 2.063 10 20 CECD C[C@H](NC[C@@H](CO)[C@@H]1CCOC1)c1ccc(Cl)cc1O 841754080 YSWRIPQNIYDVLS-TUAOUCFPSA-N 299.798 2.341 10 20 CECD Nc1ccc(Cc2noc(COCC3CC3)n2)cc1 843160457 YJKGDEKPXDNUJZ-UHFFFAOYSA-N 259.309 2.169 10 20 CECD CC(F)(F)CCC(=O)NCc1ccc(O)cc1O 910951638 JUBSGTTYZUNWBI-UHFFFAOYSA-N 259.252 2.149 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](N)C2)c(C(F)(F)F)c1 843045587 VRXXHGMEBBEQES-LLVKDONJSA-N 287.329 2.304 10 20 CECD COc1ccc(N(C)CC(=O)N(C)CC(F)(F)F)cc1 844352657 AVGBLSCCMALRKD-UHFFFAOYSA-N 290.285 2.152 10 20 CECD CN[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843048593 JIGRADKGQISKMD-CYBMUJFWSA-N 265.376 2.076 10 20 CECD CCSCCOC(=O)c1ccc(C)c(O)c1O 744911426 YTZYWILPVKFXRT-UHFFFAOYSA-N 256.323 2.316 10 20 CECD CCN(C)c1ccc(CN2CCn3cncc3C2)cc1 852066904 VFGUZOVLRDINNQ-UHFFFAOYSA-N 270.380 2.355 10 20 CECD CC[C@H]1COC[C@@H]1NCc1ccc(N2CCOCC2)cc1 850382102 NJHXVVDRCDMCHH-RDJZCZTQSA-N 290.407 2.038 10 20 CECD CN(C)c1ccc(CN(C[C@H]2CCC(=O)O2)C2CC2)cc1 851732239 MGKGXKUAYXAONX-MRXNPFEDSA-N 288.391 2.423 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)CC)cc2)C[C@H]1O 773827156 VYKAUAKKVHZSNY-GDBMZVCRSA-N 262.397 2.345 10 20 CECD CC(C)(C)NC(=O)N1CCN(Cc2ccccc2O)CC1 775985469 ZUWDRHHMQUNKOM-UHFFFAOYSA-N 291.395 2.018 10 20 CECD CO[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 775702286 NLKMLUOZKVJBPG-SNVBAGLBSA-N 259.708 2.405 10 20 CECD Cc1ccc(CN2CCN(C(=O)C(C)(C)C)CC2)c(O)c1 876566826 URAXONSKLUEKKS-UHFFFAOYSA-N 290.407 2.391 10 20 CECD CCO[C@@H]1C[C@@](CO)(NCc2ccc(C)cc2O)C1(C)C 877459827 LURRYBVYEYLBPF-WBVHZDCISA-N 293.407 2.356 10 20 CECD C[C@H](NC(=O)CCn1ccnc1)c1ccc(N(C)C)cc1 773005965 DTEVNPFQJDQEHZ-ZDUSSCGKSA-N 286.379 2.217 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1c2ccccc2C[C@H]1O 882960273 FKSWKNCFRWXFTN-CABCVRRESA-N 291.297 2.418 10 20 CECD CN(C)c1ccc(Cn2cc([C@@H](N)C(C)(C)C)nn2)cc1 881272176 PGHIHZJNUNZZDH-OAHLLOKOSA-N 287.411 2.438 10 20 CECD CC(C)(C)CNC(=O)C(C)(C)NCc1ccc(N)cc1 1120371358 WUIBWHPIMOLXJS-UHFFFAOYSA-N 277.412 2.299 10 20 CECD CN(Cc1ccco1)C(=O)c1c(F)ccc(O)c1O 789939389 LQTSTVIQEQCQQX-UHFFFAOYSA-N 265.240 2.102 10 20 CECD CC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCCC1 782231296 JPASTAKGMWALRK-UHFFFAOYSA-N 278.304 2.404 10 20 CECD CCN(CC)CCCNCc1ccc(OC)c(OC)c1O 893322442 UEQASTQDXWQAHF-UHFFFAOYSA-N 296.411 2.231 10 20 CECD Cc1cccc(O)c1CNCc1cc(N(C)C)ccn1 896299252 YCGIHBGDBBFBMY-UHFFFAOYSA-N 271.364 2.451 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H](O)COC(C)C 797722508 MEVLBKVLUAVPAP-CQSZACIVSA-N 279.380 2.234 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H]3C[C@@]32C(=O)O)cc1 903936948 ZSNJRVIKDJXIRC-CJNGLKHVSA-N 274.364 2.192 10 20 CECD Cc1noc(C)c1[C@@H](C)C(=O)NCc1ccc(N)cc1 1342020289 IVIQOIFSOWSJBZ-SECBINFHSA-N 273.336 2.294 10 20 CECD Cc1noc(C)c1[C@@H](C)NC(=O)NCc1ccc(N)cc1 1353338897 JHDZCSNSPBIIPD-SECBINFHSA-N 288.351 2.434 10 20 CECD CCC(CC)[C@H](O)CNCc1cccc(OC)c1O 225818838 RYYGXGNVFDYTBX-CYBMUJFWSA-N 267.369 2.288 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@@H](C)c1cc(F)ccc1O 228943722 YLCIWZVHQKIAKW-VHSXEESVSA-N 268.332 2.095 10 20 CECD COc1cc(Cl)cc(CN2CCCC[C@@H]2C(=O)O)c1O 229118094 JUOJMEACYUMHIL-LLVKDONJSA-N 299.754 2.493 10 20 CECD CCn1nc(C)c(CSc2ncc(C(=O)O)s2)n1 1597938780 APDAKQOVMWUUJI-UHFFFAOYSA-N 284.366 2.053 10 20 CECD C[C@@H](NCc1cnsn1)c1ccc(N(C)C)cc1 846861210 PBLNBOFVBKGQTK-SNVBAGLBSA-N 262.382 2.455 10 20 CECD CCc1cccc(CN2CCN(CC)C[C@H]2C)c1O 848910753 PNOXNHQZUXEYRO-CYBMUJFWSA-N 262.397 2.481 10 20 CECD C[C@@H](NC[C@@]1(O)CCSC1)c1ccc(N(C)C)cc1 158175245 NCFRNPSSJVVGBQ-DOMZBBRYSA-N 280.437 2.271 10 20 CECD CN1CCC(NCc2ccc3c(c2)CCCN3C)CC1 50286468 KIBFYWSGUFNNLS-UHFFFAOYSA-N 273.424 2.253 10 20 CECD Cc1ccc([C@H](C)NCCS(=O)(=O)C(C)C)c(O)c1 289820358 AEMZYGKRXVXRFL-LBPRGKRZSA-N 285.409 2.174 10 20 CECD COC(=O)CN(C)Cc1ccc(N2CCCCC2)cc1 53139074 GIJOLPFWHFZWFD-UHFFFAOYSA-N 276.380 2.282 10 20 CECD COc1ccc(O)c(CNS(=O)(=O)CC2CCCC2)c1 178759780 AJGMAEPFWJBJAH-UHFFFAOYSA-N 299.392 2.010 10 20 CECD CC[C@@H](CO)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 188666190 PZZCORSIGQERLK-OCCSQVGLSA-N 296.386 2.084 10 20 CECD Cc1ccc(C(=O)NC[C@@H](C)c2nccs2)c(O)c1O 186018756 AVQGZGVKKMBUOH-SECBINFHSA-N 292.360 2.396 10 20 CECD C[C@@H]1CC(NC(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H](C)O1 181300685 CDQKHWSWWJWMOO-JYBZGJHDSA-N 291.347 2.183 10 20 CECD CC(C)[C@H](O)CN[C@@H](C)c1ccc(F)c(F)c1O 187722796 NFCOUHCNHADLGC-GZMMTYOYSA-N 259.296 2.338 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cn[nH]c2)cc1 193936269 KOVOHJFPCLNFRE-UHFFFAOYSA-N 272.352 2.186 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1cc(Cl)ccc1O 93771541 XQLXIGLZALLIRJ-GFCCVEGCSA-N 282.771 2.146 10 20 CECD C[C@H]1CN(C(=O)/C=C\c2cncc(F)c2)c2cccnc2O1 255438945 LYUSTINKYLALIX-WYGGZMRJSA-N 299.305 2.443 10 20 CECD CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)CC)cc1 268739545 RETFCABGMJFRJS-STQMWFEESA-N 277.412 2.318 10 20 CECD CCOc1cccc(CN2CC[C@H]3CCN(C)C[C@@H]32)c1O 272700952 YQMGXUFWANMAGS-HIFRSBDPSA-N 290.407 2.317 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC(C)(C)O)cc1 279392182 APJJCAHZUYQGJZ-UHFFFAOYSA-N 278.396 2.310 10 20 CECD CCOc1cccc(CN2CC[C@](O)(C3CC3)C2)c1O 373321607 GLKZITBUBQLQKD-MRXNPFEDSA-N 277.364 2.138 10 20 CECD CN(CC1CCCC1)C(=O)c1c(F)ccc(O)c1O 276632203 SVZCIACGVCXGNN-UHFFFAOYSA-N 267.300 2.499 10 20 CECD Cc1ccc([C@@H](C)N[C@H]2CC(=O)N(C3CC3)C2)c(O)c1C 273540966 YIPTZGTWRIKXCB-OLZOCXBDSA-N 288.391 2.423 10 20 CECD Cc1cc(C)c([C@@H](C)NCc2nnc3n2CCC3)c(O)c1 283846034 AZSVDYXVPVZADX-GFCCVEGCSA-N 286.379 2.398 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1ccccc1O 281402561 XRCBALWLMNVJPF-LLVKDONJSA-N 251.326 2.166 10 20 CECD CCNC(=O)C[C@H]1CCCCN1Cc1cccc(F)c1O 285303781 VZRCNXPIRRHFLG-CYBMUJFWSA-N 294.370 2.412 10 20 CECD CC[C@H](NC1CN(C(=O)OC)C1)c1ccc(C)cc1O 280083175 LWIZDPLVAHIVQY-ZDUSSCGKSA-N 278.352 2.192 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)c(F)c2)n(C)n1 284138354 YPSIQUMOZRQJOU-UHFFFAOYSA-N 276.359 2.223 10 20 CECD CC[C@H](CSC)NC(=O)c1c(F)ccc(O)c1O 297344395 BAVHAFRURMRYRJ-SSDOTTSWSA-N 273.329 2.108 10 20 CECD CC(C)[C@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 291393626 CRUALWCVDGANPD-INIZCTEOSA-N 290.407 2.261 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC(=O)NCC(F)F 393675369 WAIDVUFBLMVMHI-VHSXEESVSA-N 298.333 2.220 10 20 CECD CC[C@@H](NC[C@H]1CNCCCO1)c1ccc(C)cc1O 817982468 SSIJGZIHVRKEEZ-UKRRQHHQSA-N 278.396 2.120 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@](C)(O)C2CCC2)cc1F 813429631 ILRHPEQGYJCUQD-INIZCTEOSA-N 294.370 2.059 10 20 CECD C[C@@H]1CCN[C@@H](C(=O)NCCCSc2nccs2)C1 817940731 KFVHONIOZJEUOA-GHMZBOCLSA-N 299.465 2.130 10 20 CECD COC[C@@]1(CN[C@@H](C)c2ccc(N(C)C)cc2)CCCN1 817974210 JKIWGHGFFOIEOQ-YOEHRIQHSA-N 291.439 2.172 10 20 CECD CCOc1ccc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(O)c1 824836850 CMAFQRZZHNVPPQ-MUIFIZLQSA-N 287.359 2.176 10 20 CECD C[C@@H](O)CN(Cc1ccc(N(C)C)cc1)CC(F)F 825099077 UFZJNRHGLDHDGV-LLVKDONJSA-N 272.339 2.201 10 20 CECD CC(C)CN(C(=O)COC(=O)c1cc(O)cs1)C1CC1 732354115 PBVPNYZJELQULN-UHFFFAOYSA-N 297.376 2.258 10 20 CECD COC[C@@H]1CCCCN1C(=O)c1cc(O)cs1 839794666 ZQTDXBPCGYIWJP-VIFPVBQESA-N 255.339 2.095 10 20 CECD O=C(Nc1nc2c(s1)COCC2)c1cc(O)cs1 732285178 VMMQDDLYFMZDRS-UHFFFAOYSA-N 282.346 2.235 10 20 CECD CCc1cccc(CN2CCC(CNC(C)=O)CC2)c1O 848882806 BRQKOPYIFGWGBN-UHFFFAOYSA-N 290.407 2.303 10 20 CECD CNC(=O)C[C@@H](C)N[C@H](C)c1ccc(Cl)cc1O 841752542 BGLJSQAZIPRVQS-RKDXNWHRSA-N 270.760 2.221 10 20 CECD CCN(CC(=O)NCc1cc(Cl)ccc1O)C1CC1 846475783 JFOGRMZJRUUFEG-UHFFFAOYSA-N 282.771 2.146 10 20 CECD C[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)CS1 840957373 AGDISSKUPMVEJO-PSASIEDQSA-N 268.338 2.284 10 20 CECD CC[C@H]1CN(C(=O)c2cc(O)cs2)[C@@H](CC)CO1 846660667 YXSHUOXJOUGFDV-ONGXEEELSA-N 269.366 2.483 10 20 CECD Cc1ccc(C(=O)N2CCOC[C@@H]2C2CCC2)c(O)c1O 844039930 XOHVJLRKPIHOMC-CYBMUJFWSA-N 291.347 2.047 10 20 CECD C[C@H]1C[C@@H](C)CN(C(=O)NCCc2ccc(N)cc2)C1 841961725 GUFRMLBDFYTWAX-BETUJISGSA-N 275.396 2.499 10 20 CECD COCC[C@@H](C)CNCc1ccc(N2CCOCC2)cc1 840954711 IROZAYYDDKMFLO-OAHLLOKOSA-N 292.423 2.285 10 20 CECD C[C@@H]1COCC[C@H]1CNC(=O)Nc1ccc(N)cc1 841300647 YPJBWOKBOXEVML-MNOVXSKESA-N 263.341 2.063 10 20 CECD COc1cccc([C@H](C)NCCC[C@@H](C)CO)c1O 846158347 WUZCLKQHHBOMIC-NEPJUHHUSA-N 267.369 2.460 10 20 CECD CN1CC[C@@]2(CCCN(C(=O)c3cc(O)cs3)C2)C1 854735512 RDCRQOBALKWYKK-AWEZNQCLSA-N 280.393 2.012 10 20 CECD C[C@]1(C(=O)NCCCSc2nccs2)CCOC1 755315389 FQLXPELDGCCXRN-LBPRGKRZSA-N 286.422 2.168 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H]1C1CC1)[C@@H](O)CO2 768452754 SJDYXEHMSAXQGJ-ZFWWWQNUSA-N 275.348 2.192 10 20 CECD COC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)C(C)C 868307558 GFQIQNIEAAXFGB-DGCLKSJQSA-N 280.368 2.423 10 20 CECD NC[C@@H](NCc1ccc(N2CCCC2)cc1)C1CC1 1117954018 XFGFHURYQAPGJF-MRXNPFEDSA-N 259.397 2.114 10 20 CECD CC(C)[C@@H](CO)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773623603 LCIUUIJMCQLJKS-SWLSCSKDSA-N 293.411 2.130 10 20 CECD COCC[C@@H](C)NCc1cc(C)cc(OC)c1O 894212135 YSPDVHFQWDLJQY-LLVKDONJSA-N 253.342 2.224 10 20 CECD COCCN(C)Cc1ccc(Br)cc1O 700859875 DOQLCHBNQZSZHU-UHFFFAOYSA-N 274.158 2.233 10 20 CECD Oc1ccc(-c2csc(Cn3cccn3)n2)cc1O 782197821 YXNXIZIXEZAGFJ-UHFFFAOYSA-N 273.317 2.466 10 20 CECD CC[C@@](C)(CO)NCc1c(O)cccc1Br 706883145 FJNGLWMCAYFGTF-LBPRGKRZSA-N 288.185 2.405 10 20 CECD CC[C@@H](CCO)CN[C@@H](C)c1cc(OC)ccc1O 94948703 MPQOIBJNDFCXKU-RYUDHWBXSA-N 267.369 2.460 10 20 CECD CC(C)N(CCc1cnn[nH]1)Cc1ccc(N(C)C)cc1 1327499197 NRNOYOXHORTOQL-UHFFFAOYSA-N 287.411 2.324 10 20 CECD CCn1nc(C)c(CNCc2ccc(N3CCCC3)cc2)n1 1327854650 AJMIJKFAFRLWLW-UHFFFAOYSA-N 299.422 2.496 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCC[C@@H]2OC)c1 1338905044 OEMWICYSCFDDOH-NVBFEUDRSA-N 293.363 2.393 10 20 CECD CC(C)[C@@H]1C[C@H](NC(=O)NCc2ccc(N)cc2)CCO1 1335546100 MPEIAGTWKNPMAG-CABCVRRESA-N 291.395 2.272 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1CC=CC1 1349333551 XYIRMMNNQPPAMY-UHFFFAOYSA-N 259.353 2.142 10 20 CECD C[C@@H](C[S@](C)=O)N(C)Cc1ccc(N2CCCC2)cc1 1343004214 GSJJUNXDDILDDJ-XOBRGWDASA-N 294.464 2.486 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C)C[C@@H]2C(=O)O)c1 1610042956 MAJWTTFRVPFGSE-SMDDNHRTSA-N 293.363 2.476 10 20 CECD C[C@H](CC(=O)NCc1ccccc1O)[C@H]1CCCNC1 228423537 ZQGSEDRNSQLXEA-OLZOCXBDSA-N 276.380 2.034 10 20 CECD Nc1ccc(CNC(=O)N2CCC23CCCC3)cc1 1580445470 FRTGNIYORJGSHH-UHFFFAOYSA-N 259.353 2.497 10 20 CECD Cc1ccc(CN(C)[C@@H]2CCN(C)C[C@@H]2C)c(O)c1 877530982 HFDWRDIIQHJVIZ-DZGCQCFKSA-N 262.397 2.473 10 20 CECD CCN(CC)CCCNCc1ccc2c(c1)CCO2 37362641 AMNCJZJRAXOJPT-UHFFFAOYSA-N 262.397 2.443 10 20 CECD COc1ccc(CN[C@@H](C)C(=O)OC(C)(C)C)c(O)c1 158050345 MDAQRAPTVXXHEA-JTQLQIEISA-N 281.352 2.221 10 20 CECD CC(=O)N1CCC(N[C@@H](C)c2cc(C)ccc2O)CC1 37138521 RXJZIGFOENZNCX-LBPRGKRZSA-N 276.380 2.362 10 20 CECD COc1ccc(O)c(CN2CC(C)(C)OC[C@@H]2C)c1 754155923 LRXLXFAZAZPMKK-NSHDSACASA-N 265.353 2.400 10 20 CECD CCC(O)(CC)CNC(=O)NCc1ccc(N(C)C)cc1 58213792 JCOFBSDNXMZNIP-UHFFFAOYSA-N 293.411 2.103 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(F)cn2)c1 183652603 DUQMBRAIRCGKEX-SECBINFHSA-N 290.294 2.426 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCC[C@@H](N)C1 70575987 QXJMDWHQBLJTAJ-HUUCEWRRSA-N 289.423 2.229 10 20 CECD C[C@]1(NCc2cc(Cl)cc([N+](=O)[O-])c2O)CCOC1 120117231 GJIMRHATTPJMGZ-LBPRGKRZSA-N 286.715 2.222 10 20 CECD CC(C)CCOCCNC(=O)/C=C/c1ccc(O)c(O)c1 180715805 IFDNCXFKXMCYMD-GQCTYLIASA-N 293.363 2.290 10 20 CECD C[C@@H](NCCOCC(F)F)c1cc(F)ccc1O 188746777 SLIOEHLOUCXRRO-MRVPVSSYSA-N 263.259 2.464 10 20 CECD CCCOc1ccc(CN2CCO[C@H](COC)C2)c(O)c1 93529177 KNCDDASYDMEMDB-HNNXBMFYSA-N 295.379 2.028 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@@H]2C(=O)O)c1O 236653066 ZEWNEJPOPFQXQI-GFCCVEGCSA-N 297.738 2.297 10 20 CECD Cc1ccc(O)c(CN(C)[C@H](C)C(=O)OC(C)C)c1 93773279 UKSKAGRCWYVHDM-GFCCVEGCSA-N 265.353 2.473 10 20 CECD COc1cccc(CN[C@H](C)c2nnc3ccccn23)c1O 237419158 MAUGGFQVKOSSEN-LLVKDONJSA-N 298.346 2.294 10 20 CECD COc1cccc(CNC(=O)/C=C\c2cccnc2)c1O 255115061 UBOPHYLNPKCAMR-FPLPWBNLSA-N 284.315 2.125 10 20 CECD C[C@H](NCC1(C(N)=O)CCCC1)c1ccc(N(C)C)cc1 268919249 OSSLQDRBZYYISC-ZDUSSCGKSA-N 289.423 2.449 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@H](OC)C(C)C)c1O 278304517 DHFRDOJMLHNVQN-LBPRGKRZSA-N 298.339 2.070 10 20 CECD Cc1ccc([C@@H](C)NCC2(C)OCCO2)c(O)c1C 273536984 XOXOSNYEHHOLCD-GFCCVEGCSA-N 265.353 2.423 10 20 CECD C[C@H]1CN(C2CCOCC2)CCN1Cc1ccccc1O 278666486 MZWQTSNCRQSSEE-AWEZNQCLSA-N 290.407 2.077 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCCOCC2)c1 273519301 TYYSIDLWWUFKIZ-DGCLKSJQSA-N 293.363 2.399 10 20 CECD CC[C@H](N[C@H](CO)c1cnn(C)c1)c1ccc(F)cc1O 285957144 FIZMGABQIJXNLV-UONOGXRCSA-N 293.342 2.039 10 20 CECD OC[C@@H]1CN(Cc2cc3c(cc2O)OCO3)c2ccccc21 293981897 RIXZZTRBFQVXTN-LBPRGKRZSA-N 299.326 2.217 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NOCCOC 802308855 IDGQSILEEMRROU-UHFFFAOYSA-N 296.367 2.282 10 20 CECD CCNC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 298705850 GGBFNKDUTGXCRE-UHFFFAOYSA-N 261.369 2.447 10 20 CECD COc1cccc(O)c1CN1C[C@H](N2CCCC2)C[C@H]1C 809703908 RRYCHNBJOLYPPD-ZIAGYGMSSA-N 290.407 2.459 10 20 CECD O=C(NCCCOCC1CC1)NCc1ccccc1O 299468897 CIDWBDXGSFOGAI-UHFFFAOYSA-N 278.352 2.008 10 20 CECD CCOc1ccc(O)c(CN(C)[C@@H]2CC(C)(C)OC2=O)c1 814180447 OKQJLLSZTZUWDK-CYBMUJFWSA-N 293.363 2.317 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CC2(CCOC2)C1 816668930 BZDGVNBSJLWPTH-UHFFFAOYSA-N 271.719 2.407 10 20 CECD CO[C@@H](C1CC1)[C@@H](C)NCc1cc([N+](=O)[O-])ccc1O 825099099 UPJITDFXJMKOAR-YMTOWFKASA-N 280.324 2.204 10 20 CECD Cc1ncc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1C 907491136 AYSCOIIOFNKXEX-LLVKDONJSA-N 286.379 2.286 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCO 902783286 NTIVZYPFZGNIGN-UHFFFAOYSA-N 276.380 2.018 10 20 CECD Cc1ncsc1CN(C)C(=O)c1cc(O)cs1 732290272 MBCJGBSHSQGSIE-UHFFFAOYSA-N 268.363 2.491 10 20 CECD COc1ccc(O)c(CNc2ccc(-c3nn[nH]n3)cc2)c1 737107005 YARHSUZOSZZNML-UHFFFAOYSA-N 297.318 2.193 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(=O)O 833630329 RONPZFSGTHBFRZ-CMPLNLGQSA-N 280.343 2.044 10 20 CECD CCCCCC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832293150 QIKILDVQYYGKIP-HNNXBMFYSA-N 277.412 2.449 10 20 CECD CCc1c(C(=O)NCc2cc(Cl)ccc2O)cnn1C 846472793 MTNYJYWBCCTRRJ-UHFFFAOYSA-N 293.754 2.272 10 20 CECD Oc1c(F)cccc1CNCCC[C@H]1CCCN1 841072409 JNUYVZLIYQJFOD-LBPRGKRZSA-N 252.333 2.153 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@H](C)CO1 846434962 UISMORBYEUHCNE-MNOVXSKESA-N 279.336 2.046 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H]1CC[C@@H](O)C1 840942205 VMQDFZVGCXSLPN-XJKSGUPXSA-N 262.397 2.312 10 20 CECD C[C@H]1CN(CCN[C@@H](C)c2cc(Cl)ccc2O)CCO1 756544548 KDTYWIQAEJZKIF-RYUDHWBXSA-N 298.814 2.417 10 20 CECD CCC1(C(=O)N(C)Cc2ccc(N(C)C)cc2)COC1 755086168 NOFLEUGUXJHZOK-UHFFFAOYSA-N 276.380 2.138 10 20 CECD O=C(NCc1ccccc1O)NC[C@H]1CCCCS1 753151101 NAUBPAZYKXWFPN-GFCCVEGCSA-N 280.393 2.477 10 20 CECD CCOC(=O)CN(CC)Cc1c(O)cccc1Cl 769006809 QVMYVOYMEJHMPR-UHFFFAOYSA-N 271.744 2.431 10 20 CECD CC[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768440110 SQUNGPIHHUTTGV-ABAIWWIYSA-N 277.364 2.440 10 20 CECD CCC[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)OCC 862418493 MBUYEPCCVGBQRL-BUUCAEBMSA-N 293.363 2.432 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1C2CCC1CC2 779493231 KZVNHPICNVZVBU-WAPJZHGLSA-N 259.305 2.264 10 20 CECD CC[C@@]1(CO)CCCN(Cc2c(O)cccc2OC)C1 779216165 ALYMVAMQEWGOCS-MRXNPFEDSA-N 279.380 2.385 10 20 CECD CCOCCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773007333 GZYFHUZGISCAOU-GFCCVEGCSA-N 264.369 2.356 10 20 CECD Nc1cc(C(=O)NCCCSc2nccs2)ccn1 1119295759 NKHUHCFNDKXUNH-UHFFFAOYSA-N 294.405 2.033 10 20 CECD CC(=O)CCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773986953 GSDYIVGUEYNSEQ-LBPRGKRZSA-N 262.353 2.299 10 20 CECD CCCCCN(CC(N)=O)Cc1ccc(C)cc1O 877181338 APJFLNUOBOWVIQ-UHFFFAOYSA-N 264.369 2.178 10 20 CECD Cc1ccc(C(=O)OCCCCCCO)c(O)c1O 776381277 DFZBYHHATKTTRT-UHFFFAOYSA-N 268.309 2.116 10 20 CECD C[C@H](O)CCCN[C@@H](C)c1cc(F)cc(F)c1O 788606717 XOFITZHPJKYWDZ-IUCAKERBSA-N 259.296 2.482 10 20 CECD COC(=O)CCC(C)(C)NCc1cc(F)cc(F)c1O 894471052 ZNVDTQKAPDNBDV-UHFFFAOYSA-N 287.306 2.492 10 20 CECD CCc1ncc(C(=O)NCc2ccc(OC)cc2O)s1 794386927 BFKJPSXWMRMNAU-UHFFFAOYSA-N 292.360 2.350 10 20 CECD Cc1ccc(CNCc2cc3c(cc2O)OCO3)cn1 60942084 TWHDXWHGDIFQOV-UHFFFAOYSA-N 272.304 2.114 10 20 CECD CCOC(=O)C[C@@H](C)Sc1ncc([N+](=O)[O-])s1 799937789 GEGYMUPTFVVIBF-ZCFIWIBFSA-N 276.339 2.485 10 20 CECD CCn1ncnc1CN[C@H](C)c1ccc(C)cc1O 794842102 PSVVAIPAHLTSTR-LLVKDONJSA-N 260.341 2.163 10 20 CECD COC(=O)N1CCCN(Cc2cc(C)c(C)cc2O)CC1 1318130763 MBLORYGSCIRQRR-UHFFFAOYSA-N 292.379 2.283 10 20 CECD O=C(O)[C@@H]1CCCN1Cc1ccc(Cl)cc1O 1606382405 GVBNXEKDEIOYHS-JTQLQIEISA-N 255.701 2.095 10 20 CECD CCOC(=O)C[C@@H]1CCCN1C(=O)c1cc(O)cs1 1329210075 SKOMROVNHQXBPN-VIFPVBQESA-N 283.349 2.012 10 20 CECD NC(=O)CCc1ccc(NC(=O)c2cc(O)cs2)cc1 1261666797 BAJHGVZBYPLGKL-UHFFFAOYSA-N 290.344 2.124 10 20 CECD CCCN1CCC[C@@H](C(=O)NCCc2ccc(N)cc2)C1 1356626531 CRVHRQMNXITRKE-OAHLLOKOSA-N 289.423 2.050 10 20 CECD COc1cccc(CN[C@H](CC(C)(C)C)C(=O)O)c1O 1599672937 AUQZUQHVLDVZDY-LLVKDONJSA-N 281.352 2.380 10 20 CECD CC(C)(NCc1ccc(N2CCCC2)cc1)C(=O)O 1590872734 PBOFGYDQWJZODZ-UHFFFAOYSA-N 262.353 2.240 10 20 CECD CN(C)c1ccc(CN2CCC(F)(F)C[C@@H]2C(=O)O)cc1 1777039449 ULOINDXKLRHSCE-CYBMUJFWSA-N 298.333 2.437 10 20 CECD COCCC1(CNC(=O)N(C)Cc2ccccc2O)CC1 161100184 QKUGABIISWEOIF-UHFFFAOYSA-N 292.379 2.350 10 20 CECD COc1cccc(CNC(=O)Cc2cccs2)c1O 155564260 TUJCIHHNRZIACC-UHFFFAOYSA-N 277.345 2.321 10 20 CECD C[C@@H]1CCCN1CC(=O)N(C)Cc1ccc(N(C)C)cc1 154699169 WGNIKLUYFOZAGH-CQSZACIVSA-N 289.423 2.195 10 20 CECD COCc1cccc(NC(=O)c2cccc(O)c2O)c1 126311439 WVPLQRXYRWZUHW-UHFFFAOYSA-N 273.288 2.497 10 20 CECD O=C(NCC(C1CC1)C1CC1)c1cccc(O)c1O 126459128 RFDBRAJXWUOGBC-UHFFFAOYSA-N 261.321 2.264 10 20 CECD Cn1cnc(NCc2ccc(N3CCCC3)cc2)n1 1117734243 YSYGFLDSRZYAIB-UHFFFAOYSA-N 257.341 2.027 10 20 CECD Cc1ccc(CN2CC[C@H](N3CCCC3)C2)c(O)c1 876660733 ZLFIXXPFOSSJPR-HNNXBMFYSA-N 260.381 2.371 10 20 CECD O=C(O)[C@H]1CC12CCN(Cc1cc(F)ccc1O)CC2 405314550 HXZOPDRXDFLEFB-GFCCVEGCSA-N 279.311 2.218 10 20 CECD Cc1nc(CN[C@H](C)c2ccc(N(C)C)cc2)n[nH]1 392379236 KLMAEHDNUQTZRI-SNVBAGLBSA-N 259.357 2.030 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCS1 171606457 RAKQFHNCULYSNI-SECBINFHSA-N 267.350 2.058 10 20 CECD CN(C)c1ccc(CNC(=O)c2cn3c(n2)CCCC3)cc1 65231738 GVIFEIMEPKGABF-UHFFFAOYSA-N 298.390 2.215 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](C3OCCO3)C2)cc1 179365675 BHKUWECRHPNSHP-HNNXBMFYSA-N 290.407 2.338 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1c1ccncc1 186847458 KNTFHGNONHDVGQ-ZDUSSCGKSA-N 284.315 2.470 10 20 CECD Cc1ccc(C(=O)Nc2cccc(O)c2)c(O)c1O 181765207 HBZCXGOCPOYMFP-UHFFFAOYSA-N 259.261 2.364 10 20 CECD CC(C)N(C)S(=O)(=O)Nc1ccc(O)c(Cl)c1 85204667 PIZKAYPYRYBHHI-UHFFFAOYSA-N 278.761 2.043 10 20 CECD CC[C@H](C)C(=O)NCc1ccc(N2CCOCC2)cc1 48944313 COIJJNOEWQAETL-ZDUSSCGKSA-N 276.380 2.186 10 20 CECD CC(=O)N[C@H]1CCN(Cc2c(O)ccc3ccccc23)C1 228356725 QNOVSXVZGFDKBT-AWEZNQCLSA-N 284.359 2.256 10 20 CECD CN(Cc1ccccc1O)C[C@@H](O)COc1ccccc1 264695639 IHRSGELUUGZSKG-OAHLLOKOSA-N 287.359 2.264 10 20 CECD C[C@H](NC(=O)NCc1ccccc1O)[C@@H]1CCCCO1 272006230 PDNKSRQXGYXRTB-FZMZJTMJSA-N 278.352 2.149 10 20 CECD CC[C@@]1(C)NC(=O)N(Cc2ccc(N(C)C)c(F)c2)C1=O 277874645 ONYNMCDIHRIVBW-OAHLLOKOSA-N 293.342 2.112 10 20 CECD CCONC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 275131152 OPRAVVRHWSUQQF-UHFFFAOYSA-N 277.368 2.378 10 20 CECD CCNC(=O)[C@@H](C)N[C@@H](C)c1cc(Cl)ccc1O 273407098 ORFPYTFZRLAYES-DTWKUNHWSA-N 270.760 2.221 10 20 CECD COC(=O)[C@@H]1CC12CCN(Cc1cc(C)ccc1O)CC2 271160626 DBAYGBRXJCBZLA-AWEZNQCLSA-N 289.375 2.476 10 20 CECD CC(C)Oc1ccc(N(C)C[C@@H]2CCS(=O)(=O)C2)cc1 279684434 GYWRAYCGNOBMNJ-ZDUSSCGKSA-N 297.420 2.345 10 20 CECD CCC[C@](C)(O)CNCc1cc(OC)c(OC)cc1O 271872497 NBDFVFCPWLSLBM-HNNXBMFYSA-N 283.368 2.050 10 20 CECD COc1cccc(CN2CC(C(=O)OC(C)(C)C)C2)c1O 297315606 CGHACNYSWQNHFS-UHFFFAOYSA-N 293.363 2.174 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](n2cc(Cl)cn2)C1 812392831 XUCZJKVCDNZCJB-VIFPVBQESA-N 297.767 2.391 10 20 CECD CC[C@@H](NCC(F)(F)CN)c1ccc(C)cc1O 817968134 PRAGMROLHHFTAI-LLVKDONJSA-N 258.312 2.335 10 20 CECD C[C@@H](NCCC[C@H]1CCCN1)c1cc([N+](=O)[O-])ccc1O 817981852 VVYIAMJOJYMVKB-NEPJUHHUSA-N 293.367 2.483 10 20 CECD Cc1cc(C)c([C@H](C)NCCCCS(C)(=O)=O)c(O)c1 818350665 MNWCUZNZLLMAHI-ZDUSSCGKSA-N 299.436 2.484 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2cccc(Cl)c2O)C1 827500966 PMAUSRPSMOIBQR-AOOOYVTPSA-N 269.728 2.087 10 20 CECD COC(=O)c1cnc(SC[C@@H]2CC3(CC3)C(=O)O2)s1 829677725 JIWXPKCIVUREAP-ZETCQYMHSA-N 299.373 2.118 10 20 CECD CN(Cc1cnc[nH]1)Cc1cc(Cl)ccc1O 826769455 NFQZLPBXLSHUGJ-UHFFFAOYSA-N 251.717 2.401 10 20 CECD CCCc1cc(C(=O)NCc2ccc(OC)cc2O)no1 831032671 HOXQQMYHJUTGHN-UHFFFAOYSA-N 290.319 2.271 10 20 CECD CCC(CC)(C(=O)O)C(=O)N[C@@H](C)c1ccccc1O 902516965 OUGSIJRDSKOLSA-JTQLQIEISA-N 279.336 2.460 10 20 CECD CCn1cncc1CN(C)c1ccc(OCC(=O)O)cc1 902017941 ZQCKKANOQRRICJ-UHFFFAOYSA-N 289.335 2.003 10 20 CECD O=C(c1cc(O)cs1)N1C[C@]2(CCCO2)[C@H]1C1CC1 832926973 JQYSRXKAXDCMBC-TZMCWYRMSA-N 279.361 2.237 10 20 CECD CNC(=O)C[C@@H](C)N[C@@H](C)c1cc2c(cc1O)CCCC2 834898690 BLSXIJLGJQVTKA-NEPJUHHUSA-N 290.407 2.446 10 20 CECD S=C(NNc1ncccn1)Nc1ccc(Cl)cc1 912973208 KSWPHNTWKDFPKC-UHFFFAOYSA-N 279.756 2.444 10 20 CECD C[C@H](NC(=O)O[C@H]1CCOC1)c1ccc(N(C)C)cc1 914390977 ALJKPXQQVPYXKI-FZMZJTMJSA-N 278.352 2.329 10 20 CECD NCC1CCN(Cc2cc(Cl)ccc2O)CC1 44511743 DTVMLEDSTVTOND-UHFFFAOYSA-N 254.761 2.216 10 20 CECD COC[C@H](O)CCN[C@@H](C)c1ccc(Cl)cc1O 841748150 HQHOYUNUGQBVMP-GXSJLCMTSA-N 273.760 2.094 10 20 CECD Nc1ccc(Cc2noc([C@@H]3CCCOC3)n2)cc1 843158692 HBIDBKHQEFNRNB-LLVKDONJSA-N 259.309 2.137 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H](c3ccncc3)C2)c(O)c1O 848100248 AWBPVUAEWKMSME-CYBMUJFWSA-N 298.342 2.431 10 20 CECD CN(Cc1c(O)cccc1Cl)C1CCNCC1 843046142 OJMVZJRPPSWHLB-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CCc1ocnc1C(=O)N[C@H](C)c1cc(OC)ccc1O 740082951 YRXRFOHNLSVDGG-SECBINFHSA-N 290.319 2.442 10 20 CECD C[C@@H](N[C@@H]1CCc2c(nnn2C)C1)c1ccc(N(C)C)cc1 848563996 GKWZWYMDUCOYIS-TZMCWYRMSA-N 299.422 2.089 10 20 CECD C[C@H](N[C@@H]1CCCN(C)C1=O)c1cc(Cl)ccc1O 756638373 OSSZWAZKOSYZCJ-JOYOIKCWSA-N 282.771 2.317 10 20 CECD COc1ccc2nc(CN(C)Cc3ccccc3O)[nH]c2n1 760861327 PQHOWCUZEXGIBX-UHFFFAOYSA-N 298.346 2.304 10 20 CECD CC[C@](COC)(NCc1ccc(OC)c(C)c1)C(=O)OC 930684125 LXPCHCQOGMPXLU-MRXNPFEDSA-N 295.379 2.061 10 20 CECD C[C@@H](NC(=O)C(=O)C1CCSCC1)c1ccccc1O 866160502 BGEXIBGLJPYASF-SNVBAGLBSA-N 293.388 2.282 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c1 862757627 AEJSLCZVRITNEU-SMDDNHRTSA-N 275.348 2.322 10 20 CECD COC[C@@H](C)n1ccc(NC(=O)c2cc(O)cs2)n1 779504988 AOGMPNKVOFWIEK-MRVPVSSYSA-N 281.337 2.110 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc2c(c1)OCO2 779473203 LBAJNUKYAFJZFO-QHHAFSJGSA-N 299.282 2.478 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCC[C@@H]1CCO)c1ccccc1O 875516391 VUQSRZCKHTWHSX-YRGRVCCFSA-N 292.379 2.304 10 20 CECD COc1cc(O)c(CN[C@H]2CCSC2)cc1OC 776222881 MOKVWBJRQOIQAE-JTQLQIEISA-N 269.366 2.005 10 20 CECD Cc1nc(CNC(=O)/C=C\c2ccc(O)c(O)c2)cs1 779501048 QOHGUXOSCWZGGD-HYXAFXHYSA-N 290.344 2.192 10 20 CECD O=C(NCc1ccccc1O)c1ccc2c(c1)CCO2 133758185 AHQUAXDEUGEDIX-UHFFFAOYSA-N 269.300 2.257 10 20 CECD CCCc1n[nH]cc1C(=O)N(C)Cc1ccccc1O 1116667692 KDJJJWPHQMVESK-UHFFFAOYSA-N 273.336 2.340 10 20 CECD CC[C@](C)(O)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881378292 LUQFNVCBMZQJHW-INIZCTEOSA-N 288.395 2.318 10 20 CECD C[C@H](NC[C@@](C)(O)C1CC1)c1c(O)cccc1F 886526022 CQTOCNYYTFBADO-LKFCYVNXSA-N 253.317 2.343 10 20 CECD C[C@H](N[C@@H](C)c1ncnn1C)c1cc(F)cc(F)c1O 788983941 PDIGLSXGYMHENW-YUMQZZPRSA-N 282.294 2.211 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(C)ccc2O)[C@@H]1C 787420923 NEKGHHDINHGEJG-YPMHNXCESA-N 263.337 2.084 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2C[C@H](OC)C2)c1 706491279 HUOJZMHSDSFFMO-NHCYSSNCSA-N 251.326 2.229 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1CCC[C@@H](O)C1 708517045 NOIRTWLDRGIDNR-JOYOIKCWSA-N 271.307 2.311 10 20 CECD CC[C@@H]1CN(C(=O)c2cc(O)cs2)CCCO1 799199213 SYAQZWSMGAOKIA-SNVBAGLBSA-N 255.339 2.095 10 20 CECD COc1ccc(CNC(=O)CCc2cccnc2)c(O)c1 794379800 WQWCWHMQLFLTNX-UHFFFAOYSA-N 286.331 2.045 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CCC[C@@H]2C(=O)O)cc1 89448459 ZMYLFRAJQNUKCM-ZFWWWQNUSA-N 276.380 2.343 10 20 CECD COc1ccc(O)c([C@@H](C)NCCN2CC[C@@H](C)C2)c1 775370590 XAHZYVGHEBKTBZ-CHWSQXEVSA-N 278.396 2.393 10 20 CECD c1cc(N2CCOCC2)ccc1CNC[C@H]1CCSC1 226375177 NJGORIMHNVBWSC-OAHLLOKOSA-N 292.448 2.366 10 20 CECD CCCC[C@@H](OC(=O)c1cc(O)cs1)C(=O)O 1605252701 ZQUPKCDNJFVFHU-MRVPVSSYSA-N 258.295 2.254 10 20 CECD NCc1ccc2c(c1)CCCN2CC1(CC(=O)O)CC1 1610645051 NAFCGCIWJYJFPK-UHFFFAOYSA-N 274.364 2.153 10 20 CECD C[C@@](CO)(NCc1ccccc1O)c1ccccc1 227212836 HHJYSRVBVHFATJ-INIZCTEOSA-N 257.333 2.390 10 20 CECD O=C(O)CN(Cc1cc(Cl)ccc1O)C1CCC1 848640375 QZYGIPWDCWPAPX-UHFFFAOYSA-N 269.728 2.485 10 20 CECD C[C@](CO)(Cc1ccccc1F)NCc1ccc(N)cc1 1576036814 LOJBDXVJBYGVEU-QGZVFWFLSA-N 288.366 2.491 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](CCO)C(C)C)c1 230664179 NLTIHQNIFIVZBM-RISCZKNCSA-N 267.369 2.458 10 20 CECD C[C@H](NC[C@H]1C[C@@H](N(C)C)C1)c1cc(C(=O)O)ccc1O 1593286492 UKGJXWXODXNTNP-GMXVVIOVSA-N 292.379 2.081 10 20 CECD CC[C@@H](NCC[C@@H](C)F)c1cccc(-c2nn[nH]n2)c1O 1590468141 SWPSFSPKHGHQLP-BXKDBHETSA-N 293.346 2.361 10 20 CECD CCN1CCCc2cc(CN[C@H]3C[C@H](C(=O)O)C3)ccc21 1776876380 MFRNDIVFPVWBCV-SHTZXODSSA-N 288.391 2.412 10 20 CECD CCOc1ccc(CNCc2ccc(C(=O)O)cc2O)o1 1776930776 XECOMUGOFWLJMV-UHFFFAOYSA-N 291.303 2.372 10 20 CECD CCOc1ncccc1C(=O)NCc1ccc(N(C)C)cc1 18215124 YVMHZWQCBKJGJE-UHFFFAOYSA-N 299.374 2.476 10 20 CECD COc1ccc(N2CCN(C(=O)C(C)(C)F)CC2)cc1F 159261753 XVCYJPNHHUHQSH-UHFFFAOYSA-N 298.333 2.231 10 20 CECD COc1ccc(N(C)CCCS(=O)(=O)C(C)C)cc1 844353607 ZYDPHPPTIHFZPF-UHFFFAOYSA-N 285.409 2.345 10 20 CECD CCc1cccc(CNCCN2CC[C@@H](C)C2)c1O 848899753 JWPIODFXSKYCSN-CYBMUJFWSA-N 262.397 2.386 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)C(=O)N1CCCC1 136421294 LWWFFURTCGFQTQ-NEPJUHHUSA-N 262.353 2.054 10 20 CECD COc1cccc(CN[C@@H](C)CN2CCCCC2)c1O 37154044 HWWRTCGRPHDZGZ-ZDUSSCGKSA-N 278.396 2.365 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)Cn2cccn2)c1 37155341 PYSBDYJKCMVGAY-NEPJUHHUSA-N 275.352 2.337 10 20 CECD CC(C)=CC(=O)NCc1ccc(N(C)C)c(F)c1 58730620 BQZLEWHLOWODPV-UHFFFAOYSA-N 250.317 2.474 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cc[nH]n2)cc1F 66841360 UTZHZPBTXIKMGZ-UHFFFAOYSA-N 290.342 2.325 10 20 CECD CCCOC(=O)[C@@H](C)N(C)Cc1ccccc1O 119529761 XMRAXGOKWTXHOF-LLVKDONJSA-N 251.326 2.166 10 20 CECD O=C(c1cccc(O)c1O)N1CCn2c1nc1ccccc12 188995405 XCIHRJUZFCKWMX-UHFFFAOYSA-N 295.298 2.108 10 20 CECD Cc1nc(C(=O)N(C)Cc2ccc(N(C)C)cc2)co1 186786807 XUMIGINCZZPJAW-UHFFFAOYSA-N 273.336 2.321 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC[C@H]1CCCCO1 183223025 QOQDAVNOLCQEHJ-VUDGCMKMSA-N 291.347 2.186 10 20 CECD CCOC(=O)N1CCN(Cc2cc(C)cc(C)c2O)CC1 125391247 HDJNFRBDYOXUNQ-UHFFFAOYSA-N 292.379 2.283 10 20 CECD COc1cccc(CNC(=O)C(C)(Cl)Cl)c1O 180735624 VQOITRXMXGMESO-UHFFFAOYSA-N 278.135 2.211 10 20 CECD O=C(O)CCCCCCCNC(=O)c1cccc(O)c1O 39174508 HZJLOOXLIJDQNY-UHFFFAOYSA-N 295.335 2.253 10 20 CECD C[C@@H]1COCCN1Cc1cccc(Br)c1O 132607326 CEEMIRWBNGSXDQ-SECBINFHSA-N 286.169 2.375 10 20 CECD Oc1ccccc1CNC[C@H]1CSCCS1 131148515 YNIFQIIJFZYYJI-NSHDSACASA-N 255.408 2.330 10 20 CECD COCCCCN1CCOc2cc(N(C)C)ccc21 175028200 FMGZQFJRRJVQLC-UHFFFAOYSA-N 264.369 2.378 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@H]2CCCS(=O)(=O)C2)c1 287166522 UHBWVHZTIOZGKJ-CHWSQXEVSA-N 297.420 2.176 10 20 CECD COc1cccc(CNCc2ccnn2C(C)C)c1O 289471824 PPHKWCDYXIPCSA-UHFFFAOYSA-N 275.352 2.468 10 20 CECD C[C@@H]1CCSCCN1C(=O)/C=C/c1ccc(O)c(O)c1 190063920 NHQLSYIOCANGGA-JOAKQRRISA-N 293.388 2.465 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(O)cc2O)cc1 195329093 MONGYUMGSFMANJ-UHFFFAOYSA-N 286.331 2.094 10 20 CECD Cc1c(C)n(C)c2ccc(OCC(=O)N(C)C)cc12 334995223 SXPWJJNQAFVZCN-UHFFFAOYSA-N 260.337 2.262 10 20 CECD C[C@@]1(C(N)=O)CCN(Cc2c(O)ccc3ccccc23)C1 235395894 YGRDAZCVMFRGOB-QGZVFWFLSA-N 284.359 2.243 10 20 CECD CCCN(CC(=O)NCC1CC1)Cc1ccccc1O 299593440 FFIHTFWIBYUWHC-UHFFFAOYSA-N 276.380 2.130 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 268802956 DZXNSTASFIFWFY-ZFWWWQNUSA-N 275.396 2.024 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1C 368963202 IOSZHQATWLYBJD-NOLJZWGESA-N 288.391 2.095 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)Cc1cnnn1C 271052695 BBUDYDFYKCCYAS-UHFFFAOYSA-N 287.411 2.292 10 20 CECD CC1(C)CN(Cc2cccc(Cl)c2O)C[C@@H]1O 280379347 FFGFTUMHNLVSEJ-NSHDSACASA-N 255.745 2.248 10 20 CECD Cc1nccnc1CCN[C@H]1CCc2cccc(O)c21 297475495 YVEQPZJMRLXMHO-AWEZNQCLSA-N 269.348 2.310 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H](O)CN(C)C1CC1 290066068 TVDSVLDHLBJKKZ-INIZCTEOSA-N 292.423 2.059 10 20 CECD COC(=O)c1cnc(SC[C@@H]2CCOC2)s1 295397803 VXULUHGELQFGKN-SSDOTTSWSA-N 259.352 2.058 10 20 CECD CC(C)NCCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 817952249 CXSRYLCBSSWQJY-NSHDSACASA-N 281.356 2.339 10 20 CECD CN1CCCc2cc(CN[C@@H]3CCC[C@H]3N)ccc21 817901448 VSRUNXDXCWLXGT-HUUCEWRRSA-N 259.397 2.038 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CC[C@@H]3CNC[C@H]3C1)CC2 817985575 FPCIBZVLIUYVMA-KBUPBQIOSA-N 272.392 2.357 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(F)c[nH]2)c1 815835102 KAUIBHMSVMWSLJ-QMMMGPOBSA-N 278.283 2.359 10 20 CECD C[C@@H](NCCCc1cnn(C)n1)c1cc(F)cc(F)c1O 815639773 GWFIPQKFHXCFLF-SECBINFHSA-N 296.321 2.082 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@](C)(O)C1CCC1 813386331 MJTFHPPXOROQIL-QGZVFWFLSA-N 290.407 2.262 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](CCCO)C2)cc1F 825339070 ZRCSZUHBVQCVCZ-CYBMUJFWSA-N 280.387 2.486 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C\[C@@H]1CCOC1 822265524 REDTUXPXSPBVST-WUKHSURWSA-N 288.391 2.304 10 20 CECD C[C@H](NC[C@]1(C)CCC(=O)N1)c1cc(Cl)ccc1O 834909562 SKKQPOAJKCSXLN-XPTSAGLGSA-N 282.771 2.365 10 20 CECD CC[C@@H](C)[C@@](C)(O)CNCc1c(O)cccc1OC 732820584 LVPQROYIDYPNMT-ABAIWWIYSA-N 267.369 2.288 10 20 CECD C[C@@H]1CCCCN1NC(=O)/C=C/c1ccc(O)c(O)c1 912147766 NWACGTGRBNPTNY-LXSSAFMLSA-N 276.336 2.017 10 20 CECD CCOc1ccc(CNC[C@](C)(O)c2ccco2)c(O)c1 742375770 VVYPBHATWNOSKE-INIZCTEOSA-N 291.347 2.381 10 20 CECD COc1ccc(CNc2cc(NC3CC3)ncn2)c(O)c1 840296646 YZIAFUGULIBXQO-UHFFFAOYSA-N 286.335 2.377 10 20 CECD Nc1ccc(Cc2noc(CC[C@H]3CCCO3)n2)cc1 843159529 SCHVSLCFBANCBX-CYBMUJFWSA-N 273.336 2.354 10 20 CECD C[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)[C@@H]1C 841959279 WPMOAKBCLGYWQL-NWDGAFQWSA-N 261.369 2.251 10 20 CECD Cc1ccc(C(=O)N2CCC(=O)CC23CCC3)c(O)c1O 911999506 WMRQPMPTXZKLHH-UHFFFAOYSA-N 289.331 2.134 10 20 CECD Cc1noc([C@H](C)N(C)Cc2cc3c(cc2O)OCO3)n1 848925480 DXQKZFWMVFEMDR-QMMMGPOBSA-N 291.307 2.005 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H](N)[C@H](C)C2)cc1F 843120453 LAVBBSXTXKCARD-IUODEOHRSA-N 279.403 2.451 10 20 CECD CN(Cc1ccccc1O)[C@@H]1C[C@@H]2CCCC[C@@H]2NC1=O 851841451 SHOPSRWBEUNGJU-AEGPPILISA-N 288.391 2.271 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccc(F)n1 935948820 QOKHIXTYMIPYKQ-UHFFFAOYSA-N 295.310 2.342 10 20 CECD CCOc1ccc(O)c(CN2CCc3c[nH]nc3C2)c1 769469131 TYNKJYZRNYSHNL-UHFFFAOYSA-N 273.336 2.072 10 20 CECD O=C(CCCCN1CCCC1)NCc1ccccc1O 769365772 SBUVRVAKLVIYHH-UHFFFAOYSA-N 276.380 2.275 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](CC)NC(C)=O 866598536 HKQQLHOADRLBPY-CQSZACIVSA-N 292.379 2.046 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Cc1ccncc1 779666569 NCYCBPVTMIDHSF-UHFFFAOYSA-N 283.375 2.315 10 20 CECD CCn1cc(-c2cn(Cc3ccc(N(C)C)cc3)nn2)cn1 881270856 CMZUAYNSUPAZGM-UHFFFAOYSA-N 296.378 2.276 10 20 CECD O=C(O)[C@@H](CC1CC1)NCc1ccc2c(c1)CCCO2 1120000702 BNSVFWWJULGEBR-CQSZACIVSA-N 275.348 2.355 10 20 CECD COc1ccc2c(c1)CCCN2CC(OC)OC 781884567 JFRHRCUHGSAXHX-UHFFFAOYSA-N 251.326 2.067 10 20 CECD Cc1ccc(C(=O)N2C[C@H]3CCC[C@H]2C3)c(O)c1O 890315013 DBIUUWIVDZRMOL-QWRGUYRKSA-N 261.321 2.421 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CC[C@H](C)C2)c1 780461666 NFKYLRJBLDDSHV-CMPLNLGQSA-N 278.352 2.389 10 20 CECD COc1cc(C)cc(CNCc2conc2C)c1O 894887110 VKIQNGBSWRPDQE-UHFFFAOYSA-N 262.309 2.295 10 20 CECD COc1cc(C)cc(CNC[C@H](CO)C(C)C)c1O 894761873 RACZPHUJPQKAJA-CYBMUJFWSA-N 267.369 2.063 10 20 CECD COc1ccc(CN2CCC(C)(CO)CC2)c(O)c1OC 893606294 VKKCLFQQCWMJOR-UHFFFAOYSA-N 295.379 2.004 10 20 CECD CCCN1CCC[C@H]1CNCc1c(O)cccc1OC 796521697 OQCKYPHWSDAWHA-ZDUSSCGKSA-N 278.396 2.365 10 20 CECD CC[C@@H](NC[C@H]1COCCO1)c1ccc(C)cc1O 794798810 YTKPCXNXOGTBKN-GXTWGEPZSA-N 265.353 2.157 10 20 CECD Cc1ccc(O)c(CN2CCO[C@H](C(F)(F)F)C2)c1 698954000 VWUICFJHYPAUAQ-LBPRGKRZSA-N 275.270 2.464 10 20 CECD CC[C@H](NCc1ncnn1CC)c1ccccc1O 785789925 WHTXPWIOOJAIRW-LBPRGKRZSA-N 260.341 2.245 10 20 CECD CC[C@@H](CCC(=O)O)NCc1cc(F)cc(F)c1O 1331983242 POWYWKLDJKUSSS-JTQLQIEISA-N 273.279 2.403 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1cc(F)cc(F)c1O 1332005150 RQSBGDCRDRRPNJ-VIFPVBQESA-N 287.306 2.444 10 20 CECD CCCC[C@H](NCc1cc(F)cc(F)c1O)C(=O)O 1334841184 KESPIXDWLMRWDJ-NSHDSACASA-N 273.279 2.403 10 20 CECD COc1ccc(CN[C@@H]2CC[C@H](OC)C2)c(O)c1OC 1333716891 HGKJNXWOFRVRNR-NEPJUHHUSA-N 281.352 2.067 10 20 CECD COCc1nocc1C(=O)NCc1cc(Cl)ccc1O 1348022011 YUNNZCXEKTZQMG-UHFFFAOYSA-N 296.710 2.110 10 20 CECD C[C@@H]1CN(c2nnc(-c3sccc3O)n2C)C[C@@H]1C 1519508128 OXRRMTJLQDGHER-DTORHVGOSA-N 278.381 2.341 10 20 CECD Cc1cc(O)c(CN2CC[C@](F)(C(=O)O)C2)cc1Cl 1600285586 FOEQKEGJCDNDHB-CYBMUJFWSA-N 287.718 2.353 10 20 CECD C[C@@H](NCC(=O)N1CCCC1)c1ccc(N(C)C)cc1 228796284 BJHGUZBANGYKPC-CYBMUJFWSA-N 275.396 2.026 10 20 CECD CC1(C)NCC[C@@H]1NCc1cc(Cl)c(F)cc1O 1576489130 LLMFTNCCYNUFES-LBPRGKRZSA-N 272.751 2.415 10 20 CECD Cc1cc(Br)c(O)c(CN2CCC23CNC3)c1 1579551492 MADIXHFHEKANFI-UHFFFAOYSA-N 297.196 2.011 10 20 CECD CC(C)(C)C[C@@H](NC(=O)c1cc(O)cs1)C(=O)O 1589751105 IFWGECWXKJQOMQ-MRVPVSSYSA-N 271.338 2.073 10 20 CECD CCOC(=O)N[C@H]1CCCN(Cc2cc(C)ccc2O)C1 154010361 XRPTWACNSOSLQL-AWEZNQCLSA-N 292.379 2.411 10 20 CECD C[C@@H](CCNCc1ccc2c(c1)CCCO2)N(C)C 922255630 VKRRESOBHMUEPV-ZDUSSCGKSA-N 262.397 2.441 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H](C(=O)O)C(C)(C)C 852947006 DCLNOIZXCCLYSW-LBPRGKRZSA-N 279.336 2.098 10 20 CECD Cc1ccc(CNC2C[C@@H]3CC[C@H](C2)N3C)c(O)c1 877569822 ALLXPOMULSHRLK-GOOCMWNKSA-N 260.381 2.415 10 20 CECD CN(CCCS(=O)(=O)C(C)(C)C)Cc1ccccc1O 878241684 IHXALBDWDHDCFY-UHFFFAOYSA-N 299.436 2.427 10 20 CECD Cc1c(CN[C@H](C)c2ccc(F)cc2O)cnn1C 186188095 DGIBCHPQEQZONR-SECBINFHSA-N 263.316 2.424 10 20 CECD C[C@H]1C[C@H](NCc2cccc(Br)c2O)CO1 402323153 RXKCXNWPYRFNTA-WPRPVWTQSA-N 286.169 2.422 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@@H]1CCCC[C@H]1O 708502231 KENOEIVRZVZMMV-TVQRCGJNSA-N 271.307 2.311 10 20 CECD COC(=O)C1CCN(Cc2cc(C)c(C)cc2O)CC1 125715897 RWVJVIIGTDAWMK-UHFFFAOYSA-N 277.364 2.394 10 20 CECD Cc1cccc2c1N[C@H](c1cc3c(cc1O)OCO3)NC2=O 121389599 ARVXYZLQILROHP-HNNXBMFYSA-N 298.298 2.283 10 20 CECD C[C@H](NCCc1cccc(C(N)=O)c1)c1ccccc1O 183596027 GFJHCBYUTBJBBD-LBPRGKRZSA-N 284.359 2.384 10 20 CECD COc1cccc(CN(C[C@H]2CCOC2)C2CC2)c1O 130008671 HMWWVZCWHQNRGI-GFCCVEGCSA-N 277.364 2.402 10 20 CECD CCC[C@](C)(NCc1cc(F)ccc1O)C(=O)O 233394738 DTXHRORDVZKNGP-ZDUSSCGKSA-N 255.289 2.264 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)Cc1ccc(N)cc1 237136378 KVPWZMAABNVZON-NSHDSACASA-N 264.369 2.131 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1ccc(N(C)C)cc1 183838106 DXGCDLANVUSYNQ-LBPRGKRZSA-N 277.412 2.175 10 20 CECD COCc1cccc(/C=C2/SC(=S)NC2=O)c1 255603103 PLLSBPKYSUSMKU-UXBLZVDNSA-N 265.359 2.322 10 20 CECD CCc1ocnc1C(=O)NCc1ccc(N(C)C)cc1 265735358 ZBVVYDLJJRJWRV-UHFFFAOYSA-N 273.336 2.233 10 20 CECD CCN(CC(F)F)C(=O)/C=C/c1ccc(O)c(O)c1 273426041 UDLCGJUDKLOQNW-GQCTYLIASA-N 271.263 2.225 10 20 CECD Oc1c(Cl)cccc1CN1CCOC[C@@H]1c1ncon1 374837188 QBDFUEQCYIMKRC-LLVKDONJSA-N 295.726 2.002 10 20 CECD CCOCC(C)(C)NCc1cc([N+](=O)[O-])ccc1O 293143688 DBQOERKBHSBCJU-UHFFFAOYSA-N 268.313 2.205 10 20 CECD Cc1cc(O)c(CN2CCn3cncc3C2)cc1C 291554380 MOAYLIVURJOMAE-UHFFFAOYSA-N 257.337 2.221 10 20 CECD CCCOC(=O)[C@H](C)Sc1ncc(C(=O)OC)s1 295422813 YJMICTBHNQIPFU-ZETCQYMHSA-N 289.378 2.364 10 20 CECD CCNC(=O)[C@@H](NCc1cccc(OCC)c1O)C(C)C 293013848 PYEHTXSOPRFXOS-AWEZNQCLSA-N 294.395 2.041 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccnn1C 299642749 QKMPAWJQCJWRFN-UHFFFAOYSA-N 286.379 2.148 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2ncn(C)n2)cc1 816745961 BHOKUWSGLIDRDJ-UHFFFAOYSA-N 295.346 2.475 10 20 CECD C[C@H](NC[C@@H]1CCCCN1)c1ccc(F)cc1O 817949367 JWHPXMIDSRLWTH-JQWIXIFHSA-N 252.333 2.324 10 20 CECD CNC(=O)[C@H](C)CN(C)Cc1ccc2ccccc2c1O 816520459 PYMGELPYOUMPCH-GFCCVEGCSA-N 286.375 2.359 10 20 CECD CCOc1ccc(N(C)CC(=O)N[C@H](C)CC)cc1 739924807 ZIXXMEZDGQSWDW-GFCCVEGCSA-N 264.369 2.436 10 20 CECD CN(CC1CCC1)C(=O)/C=C\c1ccc(O)c(O)c1 588404990 CQBAKDTYARHTDR-VURMDHGXSA-N 261.321 2.370 10 20 CECD CN(C)c1nccc(CN[C@H]2CCc3cccc(O)c32)n1 834702704 STSXEVJOEPHPFN-ZDUSSCGKSA-N 284.363 2.025 10 20 CECD C[C@@H](C(=O)NCc1ccc(O)cc1O)C(C)(C)C 910951046 OECFUQBMDMALJA-VIFPVBQESA-N 251.326 2.396 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H]1CCCN1 841035670 JOUZKZSOZRCADJ-SNVBAGLBSA-N 258.724 2.026 10 20 CECD CCc1cccc(CN[C@@H](C)[C@@H](C)N2CCOCC2)c1O 848894952 ITYNSGJPHARXOJ-UONOGXRCSA-N 292.423 2.153 10 20 CECD CCc1cccc(CN2CCOCC(F)(F)C2)c1O 848911310 FTRDYXAZCUPGBO-UHFFFAOYSA-N 271.307 2.422 10 20 CECD C[C@@H]1C[C@H](NCc2cc(Br)ccc2O)CCN1 841062821 YBAQWEMDUFOMEY-BXKDBHETSA-N 299.212 2.385 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCCN[C@@H]1C 841063148 IWFXHLGXXHBPLH-CZUORRHYSA-N 261.413 2.291 10 20 CECD CCN(CC)c1ccc(CNC(=O)NCC[C@H](C)N)cc1 841720317 UZBWFRCQBDLANM-ZDUSSCGKSA-N 292.427 2.069 10 20 CECD CO[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)[C@H](C)C1 841958632 HIYXOBNAYHWBGE-IUODEOHRSA-N 291.395 2.020 10 20 CECD CCON(C(=O)/C=C\c1ccc(O)c(O)c1)C(C)C 844077757 NWLGZRDLUBTHOG-VURMDHGXSA-N 265.309 2.300 10 20 CECD COc1ccc(N(C)CCN(C)CC[C@@H]2CCOC2)cc1 844401897 PPFJKDQVTLBUJA-OAHLLOKOSA-N 292.423 2.490 10 20 CECD Cc1cnc(CCNC(=O)c2cccc(O)c2O)c(C)c1 848293894 CZOVPPIBPDXGTO-UHFFFAOYSA-N 286.331 2.082 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2C[C@H]2C2CCC2)cc1 846666940 XLIVFPMGSWIFIP-LSDHHAIUSA-N 258.365 2.364 10 20 CECD CNC[C@H](C)NCc1cc(Cl)cc(Cl)c1O 853249365 QCLAAEYIPKWGDN-ZETCQYMHSA-N 263.168 2.397 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1cccnc1O 862536950 ZAQLMKUHHAFWMZ-UHFFFAOYSA-N 271.364 2.451 10 20 CECD CCOc1ccc(CN[C@H]2CCO[C@H](C)C2)c(O)c1 769709734 JKALBZAACSABLZ-YPMHNXCESA-N 265.353 2.448 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](OC)C(C)C 935948530 OLPOFNKFWGYXRU-CQSZACIVSA-N 286.368 2.165 10 20 CECD CN(Cc1c(O)cccc1Br)C1(CO)CC1 862417731 HLBJWVSRTAPOTH-UHFFFAOYSA-N 286.169 2.111 10 20 CECD Cc1ncc([N+](=O)[O-])n1CCSc1nccs1 871650340 VXBHHNHBADWXLD-UHFFFAOYSA-N 270.339 2.349 10 20 CECD CSCCCNCc1ccc(N2CCC(O)CC2)cc1 877053220 GZFPGBHGZWTNRD-UHFFFAOYSA-N 294.464 2.490 10 20 CECD C[C@@H]1O[C@H](C)C[C@@H]1NC(=O)N(C)Cc1ccccc1O 875988839 NJXCBGALKNWOCR-MDZLAQPJSA-N 278.352 2.100 10 20 CECD CC[C@H]1COCCN1CCNCc1c(O)cccc1Cl 873187850 BGPZUSJOWZQMBC-LBPRGKRZSA-N 298.814 2.246 10 20 CECD CCOCCOCCN(C)Cc1ccc(C)cc1O 877466301 HPRSPFCBJFSGHQ-UHFFFAOYSA-N 267.369 2.186 10 20 CECD CCOc1ccc(CNC2(CO)CCCC2)c(O)c1 777486413 LHLZJFMFXHKJNJ-UHFFFAOYSA-N 265.353 2.186 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CC(F)(F)C1 773750070 UAMDGFBALMNLKZ-MRVPVSSYSA-N 285.290 2.190 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H](CO)C2)cc1 773734253 NTRNAJZHAQJOEL-OAHLLOKOSA-N 262.397 2.347 10 20 CECD CC[C@H](C)[C@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423486 XNSPQZBEFGHCGO-FZMZJTMJSA-N 264.369 2.342 10 20 CECD CC[C@H](C)N1CCN(Cc2cc(OC)ccc2O)CC1 133822062 HUVPOMRJNBDBQX-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD CO[C@H]1CN(Cc2ccc3ccccc3c2O)CCO1 895962160 HRSBVAOXDWTHKX-OAHLLOKOSA-N 273.332 2.350 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2C)C1 896957901 FONIBSLSPUBEEQ-OAHLLOKOSA-N 290.407 2.446 10 20 CECD CCOCCOCCNCc1cc(Cl)c(F)cc1O 897203833 FMAKRCNFOPBDNG-UHFFFAOYSA-N 291.750 2.327 10 20 CECD COc1cc(C)cc(CN[C@H](C)Cc2cnn(C)c2)c1O 894915990 XZGTUGFRDZQWEM-GFCCVEGCSA-N 289.379 2.164 10 20 CECD CCC1=C(C(=O)NCc2ccc(OC)cc2O)CCCO1 794376119 CDEVRLRVSLLVQP-UHFFFAOYSA-N 291.347 2.492 10 20 CECD COc1ccc(CNC(=O)C2[C@@H]3CCC[C@@H]23)c(O)c1 794378486 VZCTZJGURBJDRO-VXGBXAGGSA-N 261.321 2.063 10 20 CECD CN(C)c1ccc(CNCC2(C(=O)O)CCCC2)cc1 756305910 DCPYQYQPFJXMNM-UHFFFAOYSA-N 276.380 2.487 10 20 CECD C[C@@H](N[C@@H](CCO)C1CC1)c1ccc(F)cc1O 756741954 ZCNAHPBJGXSIAD-RNCFNFMXSA-N 253.317 2.343 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CC(=O)O)C2)cc1 86756827 FXTLJQUWPUFVBO-AWEZNQCLSA-N 276.380 2.439 10 20 CECD CN(C)[C@@H]1CCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 1327676394 WYXSPCRBLKUMRD-ZIAGYGMSSA-N 293.367 2.263 10 20 CECD Cc1cc(O)c(CNC[C@@]2(C)CCC(=O)N2)cc1Cl 1330807713 GYSRSRYCXIECJI-CQSZACIVSA-N 282.771 2.112 10 20 CECD CO[C@@H]1CCC[C@@H]1C(=O)NCc1cc(Cl)ccc1O 1337284888 XULUWBIUETUKBW-WCQYABFASA-N 283.755 2.477 10 20 CECD C[C@H](CN(C)Cc1cccc(Cl)c1O)C(=O)O 1603155598 PTBYVKZAXRVXKW-MRVPVSSYSA-N 257.717 2.198 10 20 CECD CN1CCC(C)(CNCc2cc(F)ccc2O)CC1 227520966 BWHWGOVPDAKKHX-UHFFFAOYSA-N 266.360 2.353 10 20 CECD CN(C)c1cc(F)c(CN[C@@](C)(C(=O)O)C2CC2)cc1F 1777038079 TYTRCVDJXZWJRJ-OAHLLOKOSA-N 298.333 2.374 10 20 CECD CCN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 34837390 UUYRQJRGLNIDFD-NSHDSACASA-N 252.333 2.333 10 20 CECD Oc1cccc2c1[C@H](NCCOC[C@H]1CCCO1)CC2 834588336 AXOJEIMKPIMJRZ-ZIAGYGMSSA-N 277.364 2.165 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CCC1)c1ccc(F)cc1O 281172008 WIHDNIAFVVVNGP-GIGQVBGESA-N 285.384 2.483 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1ccon1 67291452 CCLBRRQMJLPNJX-UHFFFAOYSA-N 271.320 2.205 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1CCCS1 180858415 UBPAOLFKLINJKX-DUMNWFOQSA-N 279.361 2.123 10 20 CECD C[C@@H](CNC(=O)Cc1ccc(N)cc1)CN1CCCCC1 38042232 NYCFPIBZWVQKON-AWEZNQCLSA-N 289.423 2.050 10 20 CECD Cc1ccc(C(=O)NCCNCc2ccccc2O)cc1 37902782 JAAZHPWJZZIVBT-UHFFFAOYSA-N 284.359 2.220 10 20 CECD COc1cc(O)c(CN2CCC(C)(CO)CC2)cc1OC 184068725 RQXNKPQAJKCJSJ-UHFFFAOYSA-N 295.379 2.004 10 20 CECD CCC1(CO)CCN(C(=O)c2ccc(C)c(O)c2O)CC1 182956029 ABWDUPCXZVJBPW-UHFFFAOYSA-N 293.363 2.031 10 20 CECD CCN(Cc1cc(Br)ccc1O)C(=O)NC 80660137 SIMGHBVFJCLOGD-UHFFFAOYSA-N 287.157 2.316 10 20 CECD COC(=O)CN(Cc1cc(C)c(C)cc1O)C(C)C 93287093 PBIWDGCTYBLVPH-UHFFFAOYSA-N 265.353 2.392 10 20 CECD CC[C@H](C)[C@H](N)C(=O)NCc1ccc2c(c1)CCCN2C 236893905 PCFOCCFBHSPRLE-LRDDRELGSA-N 289.423 2.059 10 20 CECD COc1ccc(N2CCCN(Cc3cnc[nH]3)CC2)cc1 92380721 ZSVAXGFVSJUCNA-UHFFFAOYSA-N 286.379 2.131 10 20 CECD CN(C)c1ccc(CN2CC[C@@]3(CCOC3)C2)cc1 93819884 GMRWFENRWWELMH-MRXNPFEDSA-N 260.381 2.365 10 20 CECD C[C@H](NCc1nc(C2CC2)n[nH]1)c1ccccc1O 273213411 GYYHMVOMIZCHPH-VIFPVBQESA-N 258.325 2.239 10 20 CECD COc1ccc(CNC(=O)[C@@H]2Cc3ccccc3O2)c(O)c1 373662119 YSOOSZJBNOESEA-INIZCTEOSA-N 299.326 2.021 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC1CCSCC1 272434311 LUXZGWIHQUJPCL-DUXPYHPUSA-N 293.388 2.370 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)C[C@H](C)[S@]1=O 289699227 ONRKAKPFMRWWQT-SZZPBAKOSA-N 297.420 2.132 10 20 CECD COc1ccc(O)c(CN(C(C)C)C2COC2)c1 296196595 YWNGMYGLFGFIKY-UHFFFAOYSA-N 251.326 2.010 10 20 CECD COc1cccc(CNc2ccnc3c2cnn3C)c1O 804425113 SEYKKLXDLQAUKO-UHFFFAOYSA-N 284.319 2.295 10 20 CECD C[C@@H]1C[C@H](CCNC(=O)c2c(F)ccc(O)c2O)CCO1 828292754 GZZHDQNEEPUFOF-NXEZZACHSA-N 297.326 2.172 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@](C)(C(=O)O)C2)c1O 825946668 KDTVOLGRAVBBCK-HNNXBMFYSA-N 295.310 2.031 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C3CC3)nn2C)c1 827165925 CVJQTIQOJPRUKY-UHFFFAOYSA-N 285.347 2.242 10 20 CECD C[C@H](N[C@@H]1COC[C@H]1C)c1ccc(N2CCOCC2)cc1 903400231 NJSRZTPBDVTWIP-JKIFEVAISA-N 290.407 2.209 10 20 CECD C[C@H]1CCCN(C[C@@H](C)NC(=O)c2cc(O)cs2)C1 731870017 HVWYFBYIDGDIAR-WDEREUQCSA-N 282.409 2.304 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1c[nH]c(C(=O)O)c1 830830881 NXXAVUWZUWNRHR-UHFFFAOYSA-N 287.363 2.411 10 20 CECD CC(C)(C)[C@@H](O)C(=O)NCc1ccc(N2CCCC2)cc1 735847585 OYESEHVKFFWZPB-HNNXBMFYSA-N 290.407 2.310 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCCCCCN 831256478 ACKGFZYOARKXQD-UHFFFAOYSA-N 279.384 2.053 10 20 CECD CCc1cccc(CN2CCC[C@H](CCC(N)=O)C2)c1O 848884090 WZZDSTQWOQZGMC-CYBMUJFWSA-N 290.407 2.432 10 20 CECD COc1ccc(N(C)CC(=O)N(C)c2nccs2)cc1 844353729 XUQKZKORPFNSRG-UHFFFAOYSA-N 291.376 2.251 10 20 CECD CC[C@H](NC[C@H]1CCCNC1=O)c1ccc(N(C)C)cc1 840827205 GCQBNFCARLXHBL-ZBFHGGJFSA-N 289.423 2.320 10 20 CECD c1cc(N2CCCCC2)ccc1CN[C@@H]1CCNC1 841044380 DOMGWXCOIGNUQW-OAHLLOKOSA-N 259.397 2.128 10 20 CECD NC[C@H]1CC[C@@H](NCc2cccc(Br)c2O)C1 841085051 SVYIYKRXSMRIKO-GXSJLCMTSA-N 299.212 2.372 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1ccc2c(c1)CCCN2C 925530902 HPJJBTVRUIKOJV-BBRMVZONSA-N 273.424 2.299 10 20 CECD Cc1nnc(C(=O)NCc2cc(Cl)ccc2O)s1 857548615 QJFJPWNHZXHHOZ-UHFFFAOYSA-N 283.740 2.136 10 20 CECD Cc1cncc(NCc2ccc(N3CCC(O)CC3)cc2)n1 853955407 NODQKBCSWYOIAE-UHFFFAOYSA-N 298.390 2.358 10 20 CECD C[C@H]1C[C@H](N[C@H]2C[C@H](O)C2)c2c(O)ccc(F)c21 850577579 ANMUZPOEPFPZJQ-KBIXCLLPSA-N 251.301 2.193 10 20 CECD CN(C[C@@H]1COC(C)(C)O1)c1ccc2c(c1)OCO2 851868803 VIFLACGMBWHHAZ-LLVKDONJSA-N 265.309 2.003 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@@H](C)c1cc(F)cc(F)c1O 756450963 WWRLDNHOQXPOOA-UWVGGRQHSA-N 298.333 2.332 10 20 CECD COc1ccc(C)nc1NC(=O)NCc1ccccc1O 765293783 YIKBBPVYOCCWAL-UHFFFAOYSA-N 287.319 2.426 10 20 CECD C[C@H]1COCCN(Cc2cc(F)c(N(C)C)cc2F)C1 862246626 LNNNMJJJJSTDBM-LLVKDONJSA-N 284.350 2.499 10 20 CECD CN(Cc1cc(F)c(N(C)C)cc1F)CC(C)(C)O 862245535 RODUNWFCQMUCFG-UHFFFAOYSA-N 272.339 2.234 10 20 CECD CCOc1ccc(CN2CCC(OC(C)=O)CC2)c(O)c1 769427816 YUPVQZGHWIMVNT-UHFFFAOYSA-N 293.363 2.318 10 20 CECD C[C@H](NC(=O)C[C@@H](C)CC(=O)O)c1ccc(N(C)C)cc1 872859757 SCBBPUVYCZAPOK-NEPJUHHUSA-N 292.379 2.431 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@@H](N)C1(C)C 876767148 CFQCTILSIRQLNS-HUUCEWRRSA-N 289.423 2.051 10 20 CECD C[C@@H](NC(=O)c1cocn1)c1ccc(N(C)C)cc1 773022208 VFRZQMOBWWOBSD-SNVBAGLBSA-N 259.309 2.232 10 20 CECD Cc1ccc(CN2CCC(CC(=O)N(C)C)CC2)c(O)c1 877189946 WXZDHRQDYLPNKT-UHFFFAOYSA-N 290.407 2.391 10 20 CECD Cc1ccc(C(=O)N[C@H](C)c2ccc[nH]2)c(O)c1O 780997223 CDBMNCXGDDFJFM-SECBINFHSA-N 260.293 2.225 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(Cl)ccc2O)[C@H]1C 787420670 KIVASMJBJVRQBP-CABZTGNLSA-N 283.755 2.429 10 20 CECD C[C@H]1CN(C2CC2)C[C@@H]1NCc1cc(F)cc(F)c1O 883039258 IVIGNEBABPVJEX-XPTSAGLGSA-N 282.334 2.243 10 20 CECD Cc1c(CN[C@@H](C)c2c(O)cccc2F)cnn1C 886557072 QWNUATOOGUTJBJ-VIFPVBQESA-N 263.316 2.424 10 20 CECD CCOC(=O)C[C@@H](Sc1nccs1)C(=O)OCC 893625412 QHDNYHCKEGSACT-MRVPVSSYSA-N 289.378 2.120 10 20 CECD COc1ccc(CN2CCC[C@H](OC)C2)c(O)c1OC 891692946 URNVKECRFKNOKD-LBPRGKRZSA-N 281.352 2.020 10 20 CECD CC(C)OC(=O)C(C)(C)NCc1cc(F)cc(F)c1O 898506921 YSXVLINBYVTZRI-UHFFFAOYSA-N 287.306 2.490 10 20 CECD CC[C@@H](C)[C@H](O)CNCc1cc(C)cc(OC)c1O 894250051 CZKBWGALAGSRLS-DGCLKSJQSA-N 267.369 2.206 10 20 CECD C[C@H](N[C@@H](C)c1ncnn1C)c1ccc(F)cc1O 276642051 OWOAHINPMHRDGC-IUCAKERBSA-N 264.304 2.072 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2c(O)cccc2Cl)C1 896961854 GBGJRJNGMOWBBU-JTQLQIEISA-N 283.755 2.431 10 20 CECD CN(CCCCCO)Cc1cc(F)cc(F)c1O 894592937 MBQACUXYLBXEKW-UHFFFAOYSA-N 259.296 2.265 10 20 CECD CC[C@@H](CCO)CNCc1ccc(N(C)C)cc1 94949090 QBDJLLZTJFWWQA-ZDUSSCGKSA-N 250.386 2.251 10 20 CECD C[C@H](NCCOCCF)c1ccc(N(C)C)cc1 705781263 RZZLXHGSQBHMBM-LBPRGKRZSA-N 254.349 2.389 10 20 CECD COc1ccc(O)c(CNC[C@@H](C)CN2CCCC2)c1 62077262 FUNWYIXMRDVXGT-CYBMUJFWSA-N 278.396 2.222 10 20 CECD CN(C)c1ccc(CN[C@H](CO)CC(F)(F)F)cc1 717748753 HIGHSQBQNFFPNP-NSHDSACASA-N 276.302 2.156 10 20 CECD CCN1CCC[C@@H](N[C@@H](C)c2ccccc2O)C1=O 722344739 CXZBUSSCMZOZGW-WCQYABFASA-N 262.353 2.054 10 20 CECD CC(C)C1(O)CN(Cc2ccc(N3CCCC3)cc2)C1 1325484131 GCJQEFITVSODLL-UHFFFAOYSA-N 274.408 2.490 10 20 CECD Oc1ccc(F)cc1CNCCc1nccs1 226588584 NJPASQDGNMNAHR-UHFFFAOYSA-N 252.314 2.320 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C(=O)O)[C@@H]1C 1600236816 MXUJLJPTOWEZQQ-SWLSCSKDSA-N 276.380 2.356 10 20 CECD CCc1cccc(CNC2(CCOC)CCNCC2)c1O 1578266288 GTIOMQZMFFZIDM-UHFFFAOYSA-N 292.423 2.203 10 20 CECD C[C@@H]1CCN(Cc2ccc(F)c(F)c2O)C[C@@H]1C(=O)O 1589355119 NAQQDAAAJVLRNR-SCZZXKLOSA-N 285.290 2.213 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C)[C@@H]2C(=O)O)c1O 1776210716 PFRBHJOEQDCOCH-AMIZOPFISA-N 295.310 2.029 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)[C@@H]2CCOC2)c1 168800037 HBFOFZVAXVUPNA-SDDRHHMPSA-N 265.353 2.476 10 20 CECD COc1cccc(CNC[C@H]2CCO[C@H](C)C2)c1O 271259446 AJXZIYVRVQDTRB-NEPJUHHUSA-N 265.353 2.306 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC(C)(C)OCCO)c1 287144170 AUYJURBQZQDIAM-GFCCVEGCSA-N 267.369 2.139 10 20 CECD COc1cccc(CNC[C@@H]2CCCCN(C)C2)c1O 700819772 TXGKXKKPEVKBNO-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD CN1CC=C(CN[C@@H]2CCc3cccc(O)c32)CC1 392248005 RREZQRCDPMSUSI-CQSZACIVSA-N 258.365 2.231 10 20 CECD C[C@H](Nc1ccnc(C(N)=O)c1)c1ccc(N(C)C)cc1 302458949 UYWGDWDXHSUQPB-NSHDSACASA-N 284.363 2.420 10 20 CECD Cc1ccc(C(=O)NCCc2ccccc2)c(O)c1O 177658802 SCNXLULKODDKRM-UHFFFAOYSA-N 271.316 2.379 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)c2nnnn2C2CC2)c1 189132748 DJNDFIKQGKLQBA-MNOVXSKESA-N 287.367 2.434 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCC[C@H]2C)c1O 74126054 HGVJQKRXATUURN-ZYHUDNBSSA-N 278.352 2.389 10 20 CECD COc1ccc(N2CCN(CC[C@H]3CCCO3)CC2)cc1 188601245 TZDKLRMNVCKYBQ-QGZVFWFLSA-N 290.407 2.386 10 20 CECD CS[C@@H](C)CC(=O)N(C)Cc1ccccc1O 128693440 XHWFFYNRAMBGBD-JTQLQIEISA-N 253.367 2.492 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1O 183447219 OABZPUZUQYWSTC-JTQLQIEISA-N 287.315 2.164 10 20 CECD COc1ccc(CNCCNC(=O)c2ccco2)cc1C 43628848 KKXBCWKJWAPLQI-UHFFFAOYSA-N 288.347 2.116 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](CC(=O)O)C2)cc1 89716060 GFFVHLGGSXINKQ-ZDUSSCGKSA-N 262.353 2.049 10 20 CECD Cc1ccc(C(=O)NCC(F)(F)C(F)F)c(O)c1O 192024889 LODNOHJAAJIIBU-UHFFFAOYSA-N 281.205 2.036 10 20 CECD Cc1ccc(C(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)c(O)c1O 248411094 HXVJNIOGZKCQFE-GAIPPQHRSA-N 273.332 2.181 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1cocn1 264157253 IULKBODLTSRTNF-UHFFFAOYSA-N 271.320 2.205 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCOC3(CCC3)C2)c(O)c1O 272731174 KBCUMBYUWISBSZ-NSHDSACASA-N 291.347 2.238 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)CC[S@](=O)C1 277361997 FHFZDAFSIHIBNN-MGNBDDOMSA-N 287.812 2.246 10 20 CECD Cc1cccc(CCNC(=O)c2ccc(C)c(O)c2O)n1 280217125 WXDTWHLHIAJUCA-UHFFFAOYSA-N 286.331 2.082 10 20 CECD CC[C@H](N[C@H](C)C[S@](C)=O)c1ccc(F)cc1O 286272482 VOYPFZPDVGEYFN-ZMDDKVTMSA-N 273.373 2.339 10 20 CECD CCCOc1ccc(CN[C@H]2CC[C@@H](CO)C2)c(O)c1 294931785 BQVCXWJFMMQSFX-OCCSQVGLSA-N 279.380 2.432 10 20 CECD CC(C)(CO)[C@@H](NCc1cc(F)ccc1O)C1CC1 290897600 LVEWKRVUAKQNTA-AWEZNQCLSA-N 267.344 2.418 10 20 CECD COC(=O)c1cnc(Sc2cc(C)nc(C)n2)s1 294970270 OADUWICHAPQSBE-UHFFFAOYSA-N 281.362 2.488 10 20 CECD CC(C)c1nnc(CN[C@@H]2CCc3cccc(O)c32)[nH]1 296595188 VFIVVLBHYTXKAF-LLVKDONJSA-N 272.352 2.411 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCc3cccnc32)cc1 819810141 ZHIPWLRBQKZAIM-INIZCTEOSA-N 295.386 2.494 10 20 CECD C[C@H](N[C@H]1CCC[C@@H](N)C1)c1cc(F)ccc1O 817969635 FPDCXBWGTHHLSK-WCQGTBRESA-N 252.333 2.452 10 20 CECD Cc1ccnc(CNC(=O)c2ccc(C)c(O)c2O)c1 818439725 MJYADCSOSPSEPF-UHFFFAOYSA-N 272.304 2.040 10 20 CECD CSC[C@@H](CCO)NCc1cc(Cl)c(F)cc1O 816552290 HVYAELSHKHLYJI-SECBINFHSA-N 293.791 2.388 10 20 CECD CCN(CC(F)(F)F)C(=O)c1cc(O)cs1 824907039 UXQGRCZHUVLKHX-UHFFFAOYSA-N 253.245 2.478 10 20 CECD Cc1ccncc1/C=C/C(=O)N1C[C@H](O)Cc2ccccc21 493632918 PXQUASZPCLHUHS-FYCOFBDGSA-N 294.354 2.353 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2ccccc2O)n1 828656460 YKNHLGHJHARGAZ-SNVBAGLBSA-N 260.341 2.163 10 20 CECD CO[C@@H]1COCC[C@@H]1CNCc1cc(Cl)ccc1O 824708396 GCLBFIPHHSRGFR-QMTHXVAHSA-N 285.771 2.187 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC[C@@H]2C[C@H]3CC[C@H]2O3)c1 839162861 DDVAGMCJSZFZEQ-WDBKCZKBSA-N 292.335 2.348 10 20 CECD CC(C)c1ocnc1C(=O)NCc1ccc(O)cc1O 910953865 HGCQDKPNXYNMIK-UHFFFAOYSA-N 276.292 2.139 10 20 CECD CN(C)c1ccc(CN(C(=O)c2cn[nH]c2)C2CC2)cc1 917094924 OCZSJRGVNIQWDC-UHFFFAOYSA-N 284.363 2.281 10 20 CECD COc1cc2c(c(OC)c1)N(Cc1noc(C)n1)CCC2 839653893 JDWRFQUXLNCASA-UHFFFAOYSA-N 289.335 2.348 10 20 CECD CCO/C=C/C(=O)NCc1cc(Cl)ccc1O 848242423 GEFQRDZSGXBIRS-AATRIKPKSA-N 255.701 2.212 10 20 CECD CCCN(C)CC(=O)NCc1c(O)ccc2c1CCCC2 743719287 VSZZNQCEVPGCJY-UHFFFAOYSA-N 290.407 2.229 10 20 CECD COc1cccc([C@H](C)N[C@H](C)Cn2cccn2)c1O 846146775 LLENTPHDJSUDAF-NEPJUHHUSA-N 275.352 2.337 10 20 CECD COc1ccc(N2CCN(Cc3nccc(C)n3)CC2)cc1 756482229 PZFGJGPOJXSJPQ-UHFFFAOYSA-N 298.390 2.116 10 20 CECD CC(C)C(=O)NCCN[C@H](C)c1cc(F)cc(F)c1O 756374104 XWTAVYZZDDAPQC-SECBINFHSA-N 286.322 2.093 10 20 CECD O=C(CNC(=O)c1cc(O)cs1)OC1CCCCC1 752817193 SFCRRNQUKCMYLW-UHFFFAOYSA-N 283.349 2.059 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCn3c(cnc3C)C2)c1 862756137 QYWUUVOEWQCMAT-CYBMUJFWSA-N 299.374 2.084 10 20 CECD CC[C@H](OC)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773006708 FHBYZSNZKBXSGS-FZMZJTMJSA-N 264.369 2.355 10 20 CECD Cc1ccc(CN(C)C(C)(C)CN2CCOCC2)c(O)c1 877593556 VXHNNMQDUSMZOE-UHFFFAOYSA-N 292.423 2.243 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2nccn3cnnc23)c1 771196747 KQDZULQGEYUDRK-SECBINFHSA-N 285.307 2.012 10 20 CECD C[C@@H](N[C@@H](CO)CC1CC1)c1c(O)cccc1F 886554926 GZSMCJXMCJPRCA-MWLCHTKSSA-N 253.317 2.343 10 20 CECD C[C@H](O)CCCNCc1cc(Cl)cc(F)c1O 789757089 KYQPTMDZXBWSBN-QMMMGPOBSA-N 261.724 2.435 10 20 CECD CC1(C)CCN(CCNCc2ccc3c(c2)CCO3)C1 898035751 ZOKCRBAXNPDBTM-UHFFFAOYSA-N 274.408 2.443 10 20 CECD COc1cc(C)cc(CN[C@H](C)C(=O)NC(C)(C)C)c1O 894205294 WPSSDBSWIDZPGL-LLVKDONJSA-N 294.395 2.102 10 20 CECD COc1ccc(CN(C)CC(F)F)c(O)c1OC 891811862 IAERAQDDLJKOFF-UHFFFAOYSA-N 261.268 2.106 10 20 CECD COc1cc(C)cc(CN[C@H]2CN(C3CC3)C[C@@H]2C)c1O 894344341 QJDGXGFBYXPVBP-WFASDCNBSA-N 290.407 2.282 10 20 CECD C[C@@H]1COCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 796498606 XSEVWSCJWJKBQM-MNOVXSKESA-N 280.324 2.063 10 20 CECD C[C@@H]1CCN(CCNC(=O)N[C@H](C)c2ccccc2O)C1 897468877 ASBMYYCYSBDKGR-CHWSQXEVSA-N 291.395 2.094 10 20 CECD CCO[C@H]1CCN(Cc2cc(C)cc(OC)c2O)C1 897061230 GOXFJXNUVOHPLX-ZDUSSCGKSA-N 265.353 2.320 10 20 CECD Cc1ccc(S(=O)(=O)NCc2ccccc2O)cc1F 751149373 URXGQVQJNQIRFJ-UHFFFAOYSA-N 295.335 2.318 10 20 CECD COc1ccc(CNCc2cn(C(C)(C)C)nn2)c(O)c1 793388067 KIBSTWFPXKITTM-UHFFFAOYSA-N 290.367 2.037 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)OCCC(C)C)c(O)c1 794377009 KGBMDLQNHCTNQO-GFCCVEGCSA-N 295.379 2.468 10 20 CECD CC[C@H](N[C@@H](C)[C@H]1CN(C)CCO1)c1ccc(F)cc1O 796839544 QUSSHLYYCVIQMO-HZUKXOBISA-N 296.386 2.291 10 20 CECD COc1cccc(CNC[C@@H](OC)C(F)(F)F)c1O 733330137 OWXPYIMHOJIPBL-SNVBAGLBSA-N 279.258 2.068 10 20 CECD O=C(O)CCCCCCNCc1cc([N+](=O)[O-])ccc1O 1320867445 WIRKYZWXMBOQSJ-UHFFFAOYSA-N 296.323 2.425 10 20 CECD CCCOC(=O)NCc1ccc(N2CCOCC2)cc1 1194130452 PZQTYEDQWJFPBV-UHFFFAOYSA-N 278.352 2.159 10 20 CECD CN1CCN(Cc2c(O)ccc3ccncc23)CC1(C)C 1349939349 SMYWFMGWWYQKJQ-UHFFFAOYSA-N 285.391 2.466 10 20 CECD Nc1ccnc(C(=O)NCCCSc2nccs2)c1 1345746167 BJFFDIOBZAUUCM-UHFFFAOYSA-N 294.405 2.033 10 20 CECD CCC[C@@H](CCO)CNCc1cc(F)ccc1O 226612314 UKCCKZYSQLQKRX-NSHDSACASA-N 255.333 2.420 10 20 CECD CC(=O)OCCCCSc1ncc(C(=O)O)s1 1603087482 DVEIUWYFJSAMFI-UHFFFAOYSA-N 275.351 2.277 10 20 CECD COc1ccc(N(C)Cc2cnc(N)cn2)cc1Cl 1579224596 RGSRVDJIJHVMIG-UHFFFAOYSA-N 278.743 2.357 10 20 CECD C[C@@H](NCCCC1CC1)c1cccc(-c2nn[nH]n2)c1O 1589962929 VHNCDVBGJWGIOF-SNVBAGLBSA-N 287.367 2.413 10 20 CECD CN(CC(=O)N1CCCC1)Cc1cccc(Cl)c1O 124520737 JBGOKMXNVWZXCQ-UHFFFAOYSA-N 282.771 2.100 10 20 CECD CCN1CCc2cc(CNC[C@@H](C)CC(=O)O)ccc21 1776877593 WMZGTCJAMJTSLH-LBPRGKRZSA-N 276.380 2.269 10 20 CECD CCCOc1ccc(CNCCCOCC(=O)O)cc1C 1776820998 SOYOXMMTQOJCND-UHFFFAOYSA-N 295.379 2.365 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(F)nc2)cc1 70083921 XATGSPWBGKPIFN-UHFFFAOYSA-N 273.311 2.217 10 20 CECD C[C@@H](N[C@H](CO)CC(F)F)c1ccc(F)cc1O 717768260 MTOPEPDLVDHPJW-APPZFPTMSA-N 263.259 2.198 10 20 CECD CCOCCCNC(=O)N[C@@H](C)c1cc(OC)ccc1O 103506776 VAFZXKFZJYGABB-NSHDSACASA-N 296.367 2.188 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cc(OC)c(C)cc2O)C1 179447315 RUVANYNPRPFZBH-INIZCTEOSA-N 293.363 2.094 10 20 CECD CC[C@H](C)NC(=O)CN(C)c1ccc(OC)cc1OC 179005594 OOZCNCGLXZVECY-NSHDSACASA-N 280.368 2.055 10 20 CECD C[C@H](N[C@H]1CCc2[nH]ncc2C1)c1ccccc1O 183618750 VPSKQOYSNMYJQB-JQWIXIFHSA-N 257.337 2.323 10 20 CECD COc1ccc(N2CCN(c3ccnc(C#N)c3)CC2)cc1 315045032 ONQZTMKXAQLCNE-UHFFFAOYSA-N 294.358 2.288 10 20 CECD Nc1ccc(NC(=O)N2CCN(c3ccccn3)CC2)cc1 217313688 CIGUPQOGCMIKAJ-UHFFFAOYSA-N 297.362 2.018 10 20 CECD CC[C@H](C)OCC(=O)N(C)Cc1ccccc1O 124583482 NLEQJJGJAYJKLX-NSHDSACASA-N 251.326 2.166 10 20 CECD Cc1ccc(C(=O)N2CCSC[C@H](C)C2)c(O)c1O 191569261 QVMKCMDURQPQRH-SECBINFHSA-N 281.377 2.231 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(OC)c(C)c2)[C@H]1OC 274846219 AGZSXSAASOBENG-FVQBIDKESA-N 279.380 2.286 10 20 CECD COC(=O)C(C)(C)CCNCc1cc(F)ccc1O 289343953 IGECBPLIDLACGM-UHFFFAOYSA-N 269.316 2.210 10 20 CECD Cc1cc(C(=O)N2CCC(O)CC2)c(C)n1-c1ccccn1 298327042 NDNAMDAWRBEALZ-UHFFFAOYSA-N 299.374 2.086 10 20 CECD CC(C)[C@@H]1NCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1 290158704 LTMAFXWMRVIMGF-CVEARBPZSA-N 289.423 2.003 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCC[C@H](OC)C2)c(O)c1 816550666 XUPKEKKNLNEVIR-YPMHNXCESA-N 293.363 2.222 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2c(C)noc2C)c1 729278704 STFLVYUIVLTAIM-QMMMGPOBSA-N 290.319 2.497 10 20 CECD CN(Cc1cnc[nH]1)Cc1c(O)cccc1Cl 826768488 ANWPGOBLLCOWSM-UHFFFAOYSA-N 251.717 2.401 10 20 CECD Cc1cc(O)c(CN2CCN(C(C)C)C(=O)C2)cc1Cl 825475235 MTXFXYCUCUFTAZ-UHFFFAOYSA-N 296.798 2.407 10 20 CECD O=C(NCc1ccccc1O)Nc1ccccc1C(=O)O 821446285 HPFFRCDXCNIJIB-UHFFFAOYSA-N 286.287 2.412 10 20 CECD COCC(COC)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 834894085 YYJMFGCWXPDMHJ-JOYOIKCWSA-N 283.343 2.331 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CCCCO1 837521086 UMQPBGUJUVOMQN-ZBEGNZNMSA-N 293.363 2.104 10 20 CECD CCc1nocc1C(=O)N(C)Cc1ccccc1O 830141192 OFVCCBVMSCFJOL-UHFFFAOYSA-N 260.293 2.215 10 20 CECD CN(C)c1ccc(CN(c2nccn(C)c2=O)C2CC2)cc1 742395419 UKLSKDROUHEZGV-UHFFFAOYSA-N 298.390 2.015 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[S@](=O)[C@@H](C)[C@@H]1C 840917412 JXYRZYAGYHGHSZ-YRVVQQKDSA-N 294.464 2.402 10 20 CECD CCc1cccc(CN2CCOC[C@@H]2[C@H]2CCCO2)c1O 848910160 HLEDPOZKDFLBJP-HZPDHXFCSA-N 291.391 2.334 10 20 CECD COc1ccc(O)c(CN[C@H]2CCCC[C@@H]2CN)c1 841028661 BXEDWBOFQGUJGG-RISCZKNCSA-N 264.369 2.008 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)C(C)(C)O)c1O 846162553 LEGOGUHCNGITIN-ZJUUUORDSA-N 253.342 2.211 10 20 CECD CO[C@@H]1COC[C@H]1N[C@H](C)c1ccc(C)c(C)c1O 842909516 IFDXOJKMGPXKFG-MRVWCRGKSA-N 265.353 2.073 10 20 CECD C[C@@H](C1CC1)N(C(=O)CN(C)c1ccc(N)cc1)C1CC1 863557201 JMJPOLMXHUVWFB-LBPRGKRZSA-N 287.407 2.495 10 20 CECD COc1cc(C)cc(CN(C)CC2(C)COC2)c1O 863299294 GWWAUKZNKGXPHC-UHFFFAOYSA-N 265.353 2.178 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCNC(C)(C)C 932943135 HTDKEDROZABZGT-UHFFFAOYSA-N 291.439 2.455 10 20 CECD CCC1(CNCc2ccc(N(C)C)c(F)c2)COC1 761963266 DFXZFDDMMUSORY-UHFFFAOYSA-N 266.360 2.408 10 20 CECD COc1cccc(CNC(=O)c2cnc(C3CC3)o2)c1O 878666496 COOKZPHAMHVEOL-UHFFFAOYSA-N 288.303 2.196 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCC[C@H]1OC 774828508 CQLDPMDJIWFPLN-BXUZGUMPSA-N 265.353 2.306 10 20 CECD COCn1ncc(C)c1CN(C)c1ccc(OC)cc1 1119972059 RLVYHZPGOKWPBO-UHFFFAOYSA-N 275.352 2.440 10 20 CECD C[C@H](N[C@H]1CCN(C2CC2)C1)c1c(O)cccc1F 886522282 GKFHVNNRLHUGCV-QWRGUYRKSA-N 264.344 2.419 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H]2C[C@@H](N)C2(C)C)c1O 883442912 VWHJRZDGMIUNNC-CHWSQXEVSA-N 296.798 2.464 10 20 CECD CCCN(CCO)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776246766 UKGZJHKEQACGAX-ZDUSSCGKSA-N 293.411 2.228 10 20 CECD O=C(NCc1ccccc1O)c1nc2cccnc2s1 773597312 FZAYNAMFMCIFQV-UHFFFAOYSA-N 285.328 2.327 10 20 CECD C[C@H](NC(=O)N(C)Cc1ccccc1O)[C@@H]1CCCOC1 780858788 ARQULESNPIGTNZ-GXTWGEPZSA-N 292.379 2.349 10 20 CECD CCOC1CC(O)(CN[C@@H](C)c2c(O)cccc2F)C1 886601400 RUBJGMYZCMJTFP-NLTNOIMHSA-N 283.343 2.112 10 20 CECD COc1cc(C)cc(CN2CCC(C)(CO)CC2)c1O 894469029 IFFZDYLHYLZTSL-UHFFFAOYSA-N 279.380 2.304 10 20 CECD C[C@@H](O)[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 780891980 FQTKSJZEJRFALO-OCCSQVGLSA-N 280.387 2.485 10 20 CECD CN(CCCF)Cc1ccc(N2CCOCC2)c(F)c1 895897607 DENFKWPGNMRWSP-UHFFFAOYSA-N 284.350 2.454 10 20 CECD COc1ccc(CN[C@@H](C)[C@H]2CCCOC2)c(O)c1OC 893471017 BMCMWAKXCITAHS-AAEUAGOBSA-N 295.379 2.314 10 20 CECD COc1cc(C)cc(CN2CC(O)(c3ccccc3)C2)c1O 894790815 WFFIRPVSIJPHHQ-UHFFFAOYSA-N 299.370 2.413 10 20 CECD C[C@H](CO)NCc1cc(Cl)cc(Br)c1O 708159549 YTOCZFGWIYBMMQ-ZCFIWIBFSA-N 294.576 2.279 10 20 CECD C[C@@H](NCc1cc(F)cc(F)c1O)C(=O)NC(C)(C)C 708393905 LRPNPOZTSCNIQV-MRVPVSSYSA-N 286.322 2.063 10 20 CECD CCN1CCC[C@@H](N[C@@H](C)c2cc(F)ccc2O)C1=O 722355837 HFARTLFKRFEZTR-GXFFZTMASA-N 280.343 2.193 10 20 CECD CNc1ccc(C(=O)N(C)Cc2ccccc2O)cn1 788283981 RCXDZONGVBXZHX-UHFFFAOYSA-N 271.320 2.101 10 20 CECD COc1ccc(CN[C@H]2CCCN(C(C)=O)C2)cc1C 998336545 HIJPFQVXBORZIO-HNNXBMFYSA-N 276.380 2.104 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@](O)(C2CC2)C1 1321080133 QOLCLSGZEVPVON-CQSZACIVSA-N 267.756 2.392 10 20 CECD CN(C)[C@@H]1CCCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 1327676393 WYXSPCRBLKUMRD-UONOGXRCSA-N 293.367 2.263 10 20 CECD C[C@@H](C(=O)NCc1ccc(N)cc1)N1CCCCCC1 1515331993 GTGDDHCOJTVGCH-ZDUSSCGKSA-N 275.396 2.150 10 20 CECD O=C(O)[C@@H](CC(F)(F)F)NCc1cccc(F)c1O 1608530119 NCMFRZUMZNQLEE-MRVPVSSYSA-N 281.205 2.027 10 20 CECD CCN(CC)C(=O)CN[C@H](C)c1cc(F)ccc1O 228794848 RGSLBUHZMBSYNR-SNVBAGLBSA-N 268.332 2.050 10 20 CECD COc1ccc(CN(CCC(=O)O)C(C)C)c(O)c1OC 1599558517 GFFVRMGUCDYWJW-UHFFFAOYSA-N 297.351 2.095 10 20 CECD Nc1ccc(CCNC(=O)c2ncoc2C2CC2)cc1 1263062707 BKIXYALMBQIOSN-UHFFFAOYSA-N 271.320 2.107 10 20 CECD COCCOCCCCNCc1ccc(C)cc1O 876996813 FBZQNFYMXHGGAW-UHFFFAOYSA-N 267.369 2.233 10 20 CECD CC(C)c1nccn1CC(=O)N(C)c1ccc(N)cc1 37274017 ABWDIGDNLSTGHN-UHFFFAOYSA-N 272.352 2.252 10 20 CECD CO[C@@H]1[C@H]2C[C@@H]3CN(Cc4cc(F)ccc4O)[C@H]1[C@H]3C2 289777715 RNLBQEWWDFBERV-GMXFZRDWSA-N 277.339 2.387 10 20 CECD C[S@](=O)C1(CN[C@H]2CCc3cccc(O)c32)CCC1 296240953 AUUXTQBWMRWVEP-BUXKBTBVSA-N 279.405 2.270 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)F)c1ccc(F)cc1O 717768268 MTOPEPDLVDHPJW-VXNVDRBHSA-N 263.259 2.198 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCCN1 386111698 LOBGNYIJJXMDJT-CJNGLKHVSA-N 261.413 2.373 10 20 CECD C[C@@H](NCCCO)c1ccc(Br)cc1O 134904092 HLKSODSMQCIHKO-MRVPVSSYSA-N 274.158 2.188 10 20 CECD Cc1nnc(COc2ccc(N3CCCC3)cc2)n1C 183262946 XCYNFAWGINZYEA-UHFFFAOYSA-N 272.352 2.303 10 20 CECD Cc1cc(C(=O)NCC2(O)CCC2)c(C)n1-c1ccccn1 304282369 KDYMRGJMTJDZHT-UHFFFAOYSA-N 299.374 2.134 10 20 CECD Cc1ccc(O)c(CNC2CCC(C(=O)O)CC2)c1 86735538 SKKAMAWISGGUQU-UHFFFAOYSA-N 263.337 2.434 10 20 CECD Cc1cc(C(=O)NCc2cc[nH]n2)c(C)n1-c1ccccn1 193428378 LJTMWVONTHMEOY-UHFFFAOYSA-N 295.346 2.142 10 20 CECD COc1cccc(CNc2ncc(C)c(C)n2)c1O 270684707 IPJYTSJDPYSLSS-UHFFFAOYSA-N 259.309 2.420 10 20 CECD O=C1N[C@@H](C2CC2)C(=O)N1Cc1ccc(N2CCCC2)cc1 277257311 IJXQSVGHEHZQMB-HNNXBMFYSA-N 299.374 2.117 10 20 CECD COC[C@H](N[C@@H](C)c1ccccc1O)[C@@H]1CCCO1 278659757 FHZYLGQBHUXCRL-WHOFXGATSA-N 265.353 2.237 10 20 CECD CCN(Cc1oncc1C(=O)OC)c1ccc(OC)cc1 286221402 BMOVKVUPLVRAKK-UHFFFAOYSA-N 290.319 2.496 10 20 CECD OC[C@@]1(NCc2ccccc2O)CCOc2ccccc21 282285863 IOMXYHMPOLNWMK-KRWDZBQOSA-N 285.343 2.152 10 20 CECD COC(=O)[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@H]1C 280191537 HJEXRYYCTDKAES-MWLCHTKSSA-N 283.755 2.287 10 20 CECD CC(=O)C(=O)COC(=O)c1ccc(OCC(C)C)cc1 808485051 WXLPXNKZORGPBP-UHFFFAOYSA-N 278.304 2.036 10 20 CECD Cc1cccc(CN2CC(O)(c3ccccc3)C2)c1O 290992865 ABZVSGGWLCHAPF-UHFFFAOYSA-N 269.344 2.404 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](C)CN(C)C)c1 293651304 LHVCMJMHDKWDNB-NEPJUHHUSA-N 294.395 2.027 10 20 CECD CNC(=O)COc1ccc2c(c1)c1c(n2C)CCCC1 647164108 HGCKGTBOZRIPNQ-UHFFFAOYSA-N 272.348 2.182 10 20 CECD CCc1nc(CNCc2ccc(N3CCCC3)cc2)n[nH]1 392423733 UAIWQVRHHMLWID-UHFFFAOYSA-N 285.395 2.257 10 20 CECD COC(=O)CN(Cc1ccc(N(C)C)c(C)c1)C(C)C 815066193 XOGSFWBKGWRUQO-UHFFFAOYSA-N 278.396 2.444 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CC[C@H]3CNC[C@@H]3C1)CC2 817985571 FPCIBZVLIUYVMA-BYNSBNAKSA-N 272.392 2.357 10 20 CECD CCOc1ccc(CN[C@@H](C)Cc2cnccn2)c(O)c1 725848860 AECCLPNJWZMRJD-LBPRGKRZSA-N 287.363 2.302 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)/C=C\[C@H]2CCOC2)c1 827303199 CBCBSDWJRTZIOD-QGILPKKRSA-N 291.347 2.171 10 20 CECD Cc1cc(Cn2cc(CNC(C)C)nn2)ccc1N(C)C 905812901 JIBIYIBMCDEVTJ-UHFFFAOYSA-N 287.411 2.199 10 20 CECD CC(C)c1cc(CNC(=O)c2cc(O)cs2)on1 734026212 QWIPXOIVDKWXAQ-UHFFFAOYSA-N 266.322 2.495 10 20 CECD C[C@H]1C(=O)CCCN1C(=O)NCc1ccc(N(C)C)cc1 913927122 VHLYMPNDEWKXQR-LBPRGKRZSA-N 289.379 2.016 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)Cc2cnn(C)c2)c1O 846168836 MOVCUBPQSLTABO-RYUDHWBXSA-N 289.379 2.416 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCN[C@H](C)C2)c1O 841061227 HCBSJSHTXICCGT-SKDRFNHKSA-N 284.787 2.284 10 20 CECD CCc1cccc(CN[C@H]2CC(=O)N(C(C)(C)C)C2)c1O 848897841 NCRZJQXYCALTDX-AWEZNQCLSA-N 290.407 2.444 10 20 CECD COc1cc(O)c(CN[C@H]2CCCC[C@H]2CN)cc1OC 841028524 ASFFIYTUAGYKFB-AAEUAGOBSA-N 294.395 2.017 10 20 CECD CN[C@@H]1CCCN(Cc2cccc(Br)c2O)C1 843048829 ZQQSOJAVSWKCAC-LLVKDONJSA-N 299.212 2.339 10 20 CECD Oc1c(Br)cccc1CNC[C@H]1CCCCN1 841033618 XWTOPNCMRLHULG-LLVKDONJSA-N 299.212 2.386 10 20 CECD CO[C@@H]1[C@H](C)[C@H](NC(=O)Nc2ccc(N)cc2)C1(C)C 841296838 ZTORSGNBAVXYGX-JIMOISOXSA-N 277.368 2.450 10 20 CECD CNC[C@H]1CCCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 843054998 CFMCDWQKXWLAIH-LLVKDONJSA-N 299.758 2.138 10 20 CECD NCC[C@H](NCc1cccc(Cl)c1O)C(F)F 841072899 CHVIBKFYCOOXMT-VIFPVBQESA-N 264.703 2.118 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCCCCCO 759595335 QHIJNTSLVBETPY-SOFGYWHQSA-N 280.320 2.207 10 20 CECD Cn1nc(CC(=O)NCc2ccccc2O)c2ccccc21 857472753 ZBBIMWVLTWNXQR-UHFFFAOYSA-N 295.342 2.138 10 20 CECD COC1CC(C(=O)NCCCSc2nccs2)C1 859351859 JBJMHTYTTCTHCV-UHFFFAOYSA-N 286.422 2.167 10 20 CECD Cc1ccc([C@H](C)NCCN2CCO[C@H](C)C2)c(O)c1C 756544474 ISDYYOKZPGSMFO-HIFRSBDPSA-N 292.423 2.380 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](O)C2)c1O 50152800 DOPIHYGCZPKYAM-GFCCVEGCSA-N 283.755 2.205 10 20 CECD C[C@H](NC(=O)/C=C/c1cn(C)cn1)c1ccc(N(C)C)cc1 935465360 QJRRJRGOVPKAEJ-RSPDNQDQSA-N 298.390 2.377 10 20 CECD O=C(NCc1ccccc1O)c1ccc(O)c(F)c1 768287163 PULKVEJELQPPIR-UHFFFAOYSA-N 261.252 2.167 10 20 CECD CCn1cc(CCOC(=O)c2ccc(C)c(O)c2O)cn1 1119397538 JJSKDRUCDLONKD-UHFFFAOYSA-N 290.319 2.022 10 20 CECD CC(C)(C)NCC(=O)NCc1cc(Cl)ccc1O 1118334141 NMAUNRPFVZRPGD-UHFFFAOYSA-N 270.760 2.050 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCC[C@H](C)NC 1117966143 CDCIIHVCRWXEPO-ZDUSSCGKSA-N 293.411 2.312 10 20 CECD C[C@H](NC(=O)N[C@H](C)CCCO)c1ccc(N(C)C)cc1 776159485 QNIALFVJMRNEEZ-OLZOCXBDSA-N 293.411 2.274 10 20 CECD CC[C@H](C)C[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1C 1122003723 GBTDTSCCOGKYKE-BLLLJJGKSA-N 291.439 2.441 10 20 CECD Nc1ccc(CN2CC[C@]3(C2)C(=O)Nc2ccccc23)cc1 1120370946 KMMPKJCGAQKMKG-GOSISDBHSA-N 293.370 2.365 10 20 CECD CC(C)c1cc(NS(=O)(=O)c2cnn(C)c2)ccc1O 882798403 JSVDOLLEWMBCCO-UHFFFAOYSA-N 295.364 2.050 10 20 CECD CCOCCN1CCCN(c2ccc(OC)cc2)CC1 76851348 HJPODUBTNOOOLW-UHFFFAOYSA-N 278.396 2.244 10 20 CECD COC(=O)C1CCN(Cc2cc(F)cc(F)c2O)CC1 893877977 OLYFFZFMSKIUFU-UHFFFAOYSA-N 285.290 2.055 10 20 CECD COc1ccc(CNC(=O)c2ccc(F)cc2O)c(O)c1 794378440 SVYKWHNTYDBIEN-UHFFFAOYSA-N 291.278 2.176 10 20 CECD O=[N+]([O-])c1cnc(NCCc2ccc(O)c(O)c2)s1 190333270 OFHCXICHUKPPIK-UHFFFAOYSA-N 281.293 2.117 10 20 CECD C[C@H](O)CN[C@H](C)c1cccc(C(F)(F)F)c1O 798179742 LXWQBQVEYSHASD-JGVFFNPUSA-N 263.259 2.442 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@H](O)C(F)(F)F 792192469 OLKDQTBBMMLONX-MRVPVSSYSA-N 287.640 2.198 10 20 CECD Cn1nc(Br)cc1CNCc1ccccc1O 691592976 QBWJCUGDQXPCIV-UHFFFAOYSA-N 296.168 2.178 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](CCO)C2CC2)c1 756740595 SAPXDQBSRZZMIR-YGRLFVJLSA-N 265.353 2.212 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(Cl)nc1 98076898 ZSVSWJSHPBETJU-UHFFFAOYSA-N 292.722 2.119 10 20 CECD CNC[C@H](C)CN[C@@H](C)c1cc(F)cc(F)c1O 1329022574 FTBTWLSYHKCHMO-IUCAKERBSA-N 258.312 2.177 10 20 CECD COC1CC(C(=O)Nc2c(Cl)ccc3nonc23)C1 1330472485 TVOTTZMOKJGXHX-UHFFFAOYSA-N 281.699 2.240 10 20 CECD CN(Cc1ccccc1O)C(=O)NC/C=C\C1CC1 1344550856 ACLPAFZXGPONKI-PLNGDYQASA-N 260.337 2.500 10 20 CECD CCCN1CCC[C@H](C(=O)NCc2ccc(N)cc2)C1 1342698211 BJNASCQXTJJEMK-AWEZNQCLSA-N 275.396 2.007 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@]12C[C@H]1CCCN2 1353495263 LHVJGNBSFCREAF-QAPCUYQASA-N 299.418 2.045 10 20 CECD CC1(C(=O)O)CCN(Cc2cc(F)c(F)cc2O)CC1 1603306955 VJIOORSZQKRSQC-UHFFFAOYSA-N 285.290 2.357 10 20 CECD CO[C@]1(C(=O)O)CCN(Cc2cc(C(C)C)ccc2O)C1 1599079642 VGEKPQHBKQRBDV-MRXNPFEDSA-N 293.363 2.191 10 20 CECD COc1ccc(CN(C)C(C)(C)CC(=O)O)c(O)c1OC 1599559284 UYYFKXPNGFWTNR-UHFFFAOYSA-N 297.351 2.095 10 20 CECD CCN1CCc2cc(CN[C@H]3C[C@@H](C(=O)O)C3)ccc21 1776877982 FDFOEXLYCRVRNX-OKILXGFUSA-N 274.364 2.022 10 20 CECD COc1cc(O)c(CN2CCO[C@@H](C)[C@@H]2C)cc1OC 160431920 BCNOQCBPZBMSJE-QWRGUYRKSA-N 281.352 2.019 10 20 CECD COc1cccc(O)c1CN[C@H]1CC[C@H](CO)CC1 824006404 BKSGQLROWWKDSK-HAQNSBGRSA-N 265.353 2.042 10 20 CECD CC(C)(CCO)CNCc1cc(F)cc(F)c1O 708452706 ABHWHHABBPBSIL-UHFFFAOYSA-N 259.296 2.169 10 20 CECD C[C@H](NC[C@H]1CCCCS1(=O)=O)c1ccccc1O 694515735 QUEGGZPVRODAIP-NWDGAFQWSA-N 283.393 2.010 10 20 CECD O=Cc1ccc(C(=O)NCCCSc2nccs2)[nH]1 175218533 QSCJXQIMGAGQHJ-UHFFFAOYSA-N 295.389 2.196 10 20 CECD CCC(CC)(CO)NCc1ccc(N2CCOCC2)cc1 53065712 ANHHRNAFFGNTMB-UHFFFAOYSA-N 292.423 2.164 10 20 CECD Cc1csc(NC(=O)NCCc2ccc(O)c(O)c2)n1 115633624 USMVDEPRAJWOQM-UHFFFAOYSA-N 293.348 2.227 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](OC)C2)c1 179749711 HLNDBLJIVRGLST-ZDUSSCGKSA-N 251.326 2.012 10 20 CECD CCOc1ccc(O)c(CNC[C@@H]2CC[C@H](O)C2)c1 188828702 NUQQIBWYSALXNZ-YPMHNXCESA-N 265.353 2.042 10 20 CECD CCCOc1ccc(CN(CC)CC(=O)NCC)c(O)c1 133624970 WNNZAUTUGLINJF-UHFFFAOYSA-N 294.395 2.139 10 20 CECD CCN(CCC(=O)OC)Cc1c(O)cccc1Cl 130498299 KLSYMGUQAKXTCV-UHFFFAOYSA-N 271.744 2.431 10 20 CECD Cc1c(CNC(=O)NCCF)n(C)c2ccccc12 437860227 GAZGHSBJBPWZRT-UHFFFAOYSA-N 263.316 2.255 10 20 CECD O=C(O)[C@H]1CCCCCN1Cc1cc(F)ccc1O 236453514 RPOQFGNDBQRNGK-GFCCVEGCSA-N 267.300 2.361 10 20 CECD COc1cccc(CNC(C)(C)c2noc(C)n2)c1O 264414130 QXMRNJJZZRIACL-UHFFFAOYSA-N 277.324 2.117 10 20 CECD C[C@H](NCCC[C@@H](C)O)c1ccc(N2CCOCC2)cc1 278876894 SFRBBHOMJYDPDM-CABCVRRESA-N 292.423 2.335 10 20 CECD Oc1cc(F)c(Cl)cc1CN[C@@H]1CCC[C@H]1O 293696202 SSFGCKXNAFWVLY-GHMZBOCLSA-N 259.708 2.188 10 20 CECD C[C@@H](CCCCO)NCc1ccc(N2CCOCC2)cc1 398399329 ALEZIBXTNFCETN-HNNXBMFYSA-N 292.423 2.164 10 20 CECD Cc1cc(NC(=O)c2cccc(O)c2O)cn2ccnc12 818043413 DGFLNYBLSNAPCP-UHFFFAOYSA-N 283.287 2.306 10 20 CECD Cc1cc(CN(CC(N)=O)C2CCCC2)ccc1N(C)C 815037127 FNOYPXWFMDPITP-UHFFFAOYSA-N 289.423 2.291 10 20 CECD C[C@@H]1C[C@H](CO)CN(Cc2cc(Cl)ccc2O)C1 817412873 PYLOVZPLEBUADB-MNOVXSKESA-N 269.772 2.496 10 20 CECD C[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)[C@@H]1CCCOC1 817942898 RHUPOXDBRBVTNB-LXZKKBNFSA-N 291.439 2.157 10 20 CECD CCN(C)C(=O)c1csc(Cc2ccc(N)cc2)n1 817930860 HGHBTZDXTUZRAW-UHFFFAOYSA-N 275.377 2.408 10 20 CECD Oc1c(CN2CCN3CCOC[C@H]3C2)ccc2ccccc12 816568248 BCPIGCHYYPEGCL-MRXNPFEDSA-N 298.386 2.062 10 20 CECD COc1cccc(O)c1CNC[C@@H](c1ccco1)N(C)C 725841779 ZKQYHWKQEMNFCM-ZDUSSCGKSA-N 290.363 2.386 10 20 CECD C[C@@H](NC(=O)CCCn1ccnc1)c1ccccc1O 827930334 GYFDLFQGJNIPFU-GFCCVEGCSA-N 273.336 2.246 10 20 CECD C[C@@H](NC(=O)c1cnc2n1CCC2)c1ccccc1O 827952317 NMWCMKANWVYNBG-SNVBAGLBSA-N 271.320 2.026 10 20 CECD CN(C)[C@H]1CCCN(Cc2c(O)ccc3ccncc23)C1 738143184 JTOXUVUUOGHSDB-AWEZNQCLSA-N 285.391 2.466 10 20 CECD COc1ccc(O)c([C@H](C)NC/C=C(/C)C(=O)O)c1 833733169 AXPGVAXJJFCZMA-MBACFSSFSA-N 265.309 2.082 10 20 CECD CCc1cc(CN[C@H]2CCc3cccc(O)c32)n[nH]1 834585169 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COc1ccc(O)c(CNC(=O)C2SCCCS2)c1 841406993 UXUKGMHNZXECRO-UHFFFAOYSA-N 299.417 2.213 10 20 CECD C[C@@H]1C[C@H]1[C@@H]1C[C@H]1NCc1cc([N+](=O)[O-])ccc1O 922513009 YVAPTNJHNRSSJH-WRSRJMLGSA-N 262.309 2.435 10 20 CECD Cc1cc(O)c(CNCc2cccnc2O)cc1C 858304572 UFZMVGAJTVOIQC-UHFFFAOYSA-N 258.321 2.399 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](O)COCC2CC2)c(O)c1C 756511026 KXBPDMOFEYEBQY-DZGCQCFKSA-N 293.407 2.447 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1ccc(N(C)C)c(F)c1 759173952 SCHLYNMGHGYLJV-ZBFHGGJFSA-N 296.386 2.175 10 20 CECD Cc1cc(O)c(CN(C)[C@H]2CCNC2=O)cc1C(C)C 758403105 WZPGKYUPLULEHS-AWEZNQCLSA-N 276.380 2.144 10 20 CECD C[C@@H](NC(=O)NC[C@@H]1CCCN(C)C1)c1ccccc1O 868367155 GBXPGMGWTPCFKF-OLZOCXBDSA-N 291.395 2.094 10 20 CECD CCN(CC)Cc1ccc(N2CCC(O)CC2)cc1 876523333 SBFOKHQULAFXME-UHFFFAOYSA-N 262.397 2.490 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c(O)c1 877487041 UBSHXDBPRRLSAR-ZQIUZPCESA-N 291.391 2.469 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H](C)C[S@@](C)=O)cc1 773839842 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C[C@H](NC(=O)[C@@H]1CO[C@H](C)C1)c1ccc(N(C)C)cc1 784163263 MTRNVXQGXHTVIK-DYEKYZERSA-N 276.380 2.355 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CCCCS1 272833514 FSTGKNDYYXYJQW-CYBMUJFWSA-N 281.377 2.042 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2cc(C)ccc2O)C1 93770583 YQYUJWOLBHSIRM-AWEZNQCLSA-N 262.397 2.474 10 20 CECD CCc1cnc(CN(C)C(=O)c2cccc(O)c2O)s1 193120485 CJHXPNLRSUHMTG-UHFFFAOYSA-N 292.360 2.389 10 20 CECD c1cc2c(cc1CN[C@@H]1CCCC13OCCO3)CCO2 715636770 VCJAXBKDHJVLIU-OAHLLOKOSA-N 275.348 2.007 10 20 CECD CCCCOCCCNCc1cc2c(cc1O)OCO2 134224954 QYEVMDSNHYUTMX-UHFFFAOYSA-N 281.352 2.417 10 20 CECD CN(C)c1ccc(CN2[C@H](C(=O)O)[C@H]3CC[C@@H]2C3)cc1 1777039628 BNMNXRNZVOIIHZ-CFVMTHIKSA-N 274.364 2.190 10 20 CECD Nc1ccc(CN2CCC[C@@H]([C@H]3CCNC3)C2)cc1 1352791073 TYLNBWOHFOCITE-LSDHHAIUSA-N 259.397 2.090 10 20 CECD Cc1ccc(CN2C[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c(O)c1 1600413121 PPOCLLBFWCYRAR-YUTCNCBUSA-N 275.348 2.386 10 20 CECD O=C(O)c1cc(F)cc(C(=O)NCc2ccccc2O)c1 1602270958 FITMGOBPINTBME-UHFFFAOYSA-N 289.262 2.160 10 20 CECD CCC[C@H](CC(=O)O)NCc1ccc2c(c1)CCO2 1776829797 BSUWKEOGCVULEN-CYBMUJFWSA-N 263.337 2.355 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C/c2cccnc2)c1 155929123 QUAXYWYIIAERGE-QPJJXVBHSA-N 284.315 2.125 10 20 CECD Cc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1 159037564 TZTXICAXUJVAOH-UHFFFAOYSA-N 257.289 2.336 10 20 CECD N[C@@H]1CCC[C@H](NCc2ccc3c(c2)CCCO3)C1 904355627 PXCUKVVLEFAQAP-CABCVRRESA-N 260.381 2.371 10 20 CECD CC(C)NC(=O)[C@H](C)NCc1ccc2c(c1)CCCO2 922183187 ARABCGYWFJGFKT-LBPRGKRZSA-N 276.380 2.014 10 20 CECD CNc1cc(NCc2ccc(N(C)C)cc2)ncn1 891579230 USSRULPJJZMRRI-UHFFFAOYSA-N 257.341 2.196 10 20 CECD CC[C@@H](NC1CCN(C(C)=O)CC1)c1ccccc1O 37138361 ITTVTAZEGLOACK-OAHLLOKOSA-N 276.380 2.444 10 20 CECD OCCCCN(Cc1ccccc1O)C[C@@H]1CCCO1 264647751 ZFCCZHPEUDGWTC-HNNXBMFYSA-N 279.380 2.146 10 20 CECD CC[C@H](NC[C@](C)(O)CCOC)c1ccccc1O 186195977 FRPGZODYRGWMFZ-DZGCQCFKSA-N 267.369 2.220 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2CCc3cccc(O)c32)CCN1C 312064494 DXMDSHBESRGEOI-XBFCOCLRSA-N 260.381 2.452 10 20 CECD C[C@@H](NCc1ncccn1)c1ccc(N(C)C)cc1 702342759 WCUSROAMMZJYCZ-GFCCVEGCSA-N 256.353 2.393 10 20 CECD C[C@H]1N(C(=O)Nc2ccc(N)cc2)CCOC1(C)C 707264656 NXPNAPJFGOFSNV-SNVBAGLBSA-N 263.341 2.300 10 20 CECD CC1(C(=O)NCc2ccccc2O)CC(F)(F)C1 720520791 MZQFBKFMQBKBIG-UHFFFAOYSA-N 255.264 2.444 10 20 CECD C[C@@H]1CNCCN1Cc1cc(Cl)cc(Cl)c1O 722381432 CONFQYXOZPYEJV-MRVPVSSYSA-N 275.179 2.493 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1cncc(O)c1 174516917 PZAXDVIINWODNK-UHFFFAOYSA-N 298.342 2.302 10 20 CECD C[C@@H](Cn1cccn1)NCc1ccc(N(C)C)c(F)c1 113320681 SIQJNXLRTGMIQC-LBPRGKRZSA-N 276.359 2.267 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc2c1OCCO2 63467602 GEADTIAGGPGENE-UHFFFAOYSA-N 299.326 2.436 10 20 CECD CO[C@@H](C)CNC(=O)c1cc(C)n(-c2ccccn2)c1C 189091027 DYWDSGXAJJEJRI-LBPRGKRZSA-N 287.363 2.254 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCCCO1 131760203 QBXGRWBPFWDXBL-CQSZACIVSA-N 290.363 2.047 10 20 CECD CC(C)(CNC(=O)c1cccc(O)c1O)c1ccncc1 193151653 KVLIUHJVFBFTED-UHFFFAOYSA-N 286.331 2.200 10 20 CECD CCOC(=O)[C@@H](C)N(Cc1cc(OC)ccc1O)C1CC1 191714612 YSWGCAGYAWOWEU-LLVKDONJSA-N 293.363 2.317 10 20 CECD Cc1nnc(NC(=O)N(C)Cc2ccccc2O)s1 47938864 VHYGAKSIEQRWIH-UHFFFAOYSA-N 278.337 2.216 10 20 CECD CC(C)O[C@@]1(C)C[C@H]1NC(=O)NCc1ccccc1O 528275650 XZZKSAFWJQVDOK-HIFRSBDPSA-N 278.352 2.147 10 20 CECD COCCN1CC[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1 268966082 YMWHPEMLZUMHCZ-GOEBONIOSA-N 291.439 2.124 10 20 CECD CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@H](C)[S@@]1=O 289953791 YSRZXTRWTPDJKC-CFZJUORYSA-N 281.421 2.432 10 20 CECD CCOC1(C(=O)NCc2ccc(O)c(O)c2)CCCC1 286871023 YWFPDHSMIISZJT-UHFFFAOYSA-N 279.336 2.063 10 20 CECD CCCNC(=O)CN[C@H](CC)c1ccc(F)cc1O 285492315 CDVWANTURVIDDE-GFCCVEGCSA-N 268.332 2.098 10 20 CECD CC[C@H](N[C@@H](C)c1cc(C(=O)OC)ccc1O)C(C)(C)O 294982585 KSTKVORORXLEND-HZMBPMFUSA-N 295.379 2.379 10 20 CECD OCCc1ccc(NCc2cc(F)ccc2O)cn1 809779982 GZHLMYIHYAHHCD-UHFFFAOYSA-N 262.284 2.073 10 20 CECD CCn1c(SCC(=O)C(C)=O)nnc1-c1cccs1 808010240 PQJGYVVPBHJEER-UHFFFAOYSA-N 295.389 2.277 10 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COc1cc(CN2CCC[C@@H]2C2OCCO2)c(O)cc1C 902624278 HPBJOPLVJQZGQT-CYBMUJFWSA-N 293.363 2.047 10 20 CECD C[C@H]1CN(Cc2c(O)ccc3ccncc23)C[C@@H](C)N1C 840090998 XOYKHWGGBTZPRI-BETUJISGSA-N 285.391 2.465 10 20 CECD CCOCc1cc(CNC2(C)CCNCC2)ccc1OC 841064522 HKAKYJYCYFGJQY-UHFFFAOYSA-N 292.423 2.463 10 20 CECD CCOc1ccc(CN2CCC[C@H](C)[C@H]2CN)c(O)c1 843051956 NDEPWYXZZKBUHU-SWLSCSKDSA-N 278.396 2.350 10 20 CECD CCc1cccc(CN2CC([C@@H]3CCOC3)C2)c1O 848908445 UPBIWBKMYTWUFZ-CQSZACIVSA-N 261.365 2.423 10 20 CECD COc1cccc([C@H](C)NCCCCCO)c1O 846166607 AWZZSDPYGYPTBW-NSHDSACASA-N 253.342 2.214 10 20 CECD CCN1CCC[C@H](NCc2cc(C)c(C)cc2O)C1=O 922639463 MHQAAQOTWWARJL-AWEZNQCLSA-N 276.380 2.110 10 20 CECD CCc1cccc(CN2CCN(CC(C)C)C(=O)C2)c1O 848904351 RDFKWCMBIYJQEP-UHFFFAOYSA-N 290.407 2.255 10 20 CECD FCCn1ncnc1COc1ccc(N2CCCC2)cc1 853675696 WTAPFHRABBCLRK-UHFFFAOYSA-N 290.342 2.427 10 20 CECD Cc1ccc(O)c(CNC(=O)NCC(C)(C)C(C)(C)O)c1 858525045 XMTBPKQONJNMAS-UHFFFAOYSA-N 294.395 2.297 10 20 CECD C[C@H]1CCN(Cc2cccc(Cl)c2O)C[C@@H]1CO 857061309 OGTNMWXQUPEDFZ-CMPLNLGQSA-N 269.772 2.496 10 20 CECD Cc1ccc([C@H](C)N[C@H](CO)C2CCOCC2)c(O)c1C 757656448 AAOVNZDMLQIUAL-XJKSGUPXSA-N 293.407 2.447 10 20 CECD CCOc1cccc(CN2CC[C@H](C)[C@@H](CO)C2)c1O 857061970 XESQPEPROHZYGH-GXTWGEPZSA-N 279.380 2.241 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C3CC3)on2)c1 862759817 LPDVKRCBGQOZNZ-UHFFFAOYSA-N 272.304 2.496 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCSC2)c1 762536342 NBEXSUSCTSJYHQ-UWVGGRQHSA-N 281.377 2.331 10 20 CECD CN(C(=O)c1cc(C2CC2)[nH]n1)c1ccc(N)cc1 877081318 YCXCCUJIRSEUNW-UHFFFAOYSA-N 256.309 2.146 10 20 CECD C[C@@H](NC(=O)Nc1ccn(C)n1)c1ccc(N(C)C)cc1 775586514 RMLHCXSKIWYBMC-LLVKDONJSA-N 287.367 2.369 10 20 CECD O=C(N[C@H](CO)c1ccc(F)cc1)c1cc(O)cs1 778511761 RPDIATJSWBKSAF-LLVKDONJSA-N 281.308 2.056 10 20 CECD OC1CCN(c2ccc(CNC(CF)CF)cc2)CC1 877556642 VIWDZSWOFMBBGG-UHFFFAOYSA-N 284.350 2.045 10 20 CECD CCOC(=O)[C@@H]1CSCCN1Cc1cccc(C)c1O 775648750 WLLLXYWHNPRXOD-ZDUSSCGKSA-N 295.404 2.181 10 20 CECD CCCCNC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 775829941 BEJRNYZDOUJQTN-ZDUSSCGKSA-N 277.412 2.320 10 20 CECD COCc1noc(CN[C@H](C)c2ccc(N(C)C)cc2)n1 775833923 HRYVMZZRDHELRF-LLVKDONJSA-N 290.367 2.133 10 20 CECD C[C@@H]1OCC[C@@]1(O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 788623264 KNKPCVNYBWEDPA-XPQXIITISA-N 295.354 2.209 10 20 CECD C[C@@H](Cc1cnccn1)N[C@@H](C)c1ccccc1O 783506584 YMDXVPKJKNECDE-RYUDHWBXSA-N 257.337 2.464 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)N(C)C[C@@H]2C)c1O 894487277 HTUSTQLWBBVADF-OLZOCXBDSA-N 278.396 2.234 10 20 CECD C[C@H](CN1CCOCC1)N(C)Cc1cccc(Cl)c1O 789763881 ACKJPEKFLVRQFV-GFCCVEGCSA-N 298.814 2.198 10 20 CECD CN(C)c1ccc([C@H](CNCC2CC2)N(C)C)cc1 898451647 MMRVBPRUHBXYKF-INIZCTEOSA-N 261.413 2.355 10 20 CECD CC1(NCc2cc(Br)cc(F)c2O)COC1 895444429 SXTDMXIJLCIYBZ-UHFFFAOYSA-N 290.132 2.172 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)NCc1ccc(OC)cc1O 794382486 XUVBZMQMLNTWEZ-IINYFYTJSA-N 281.352 2.078 10 20 CECD C[C@H]1COC[C@@H]1NCc1ccc(N2CCCC2)cc1 710990977 VIYGBVYPZFPTBW-BBRMVZONSA-N 260.381 2.411 10 20 CECD COc1ccc(CN[C@@H](CO)CC(F)(F)F)cc1C 717751822 YSFDFDYOCMHQCH-LLVKDONJSA-N 277.286 2.407 10 20 CECD CC(C)c1ocnc1C(=O)NCc1ccccc1O 731878683 LQIREJQBDQTOAN-UHFFFAOYSA-N 260.293 2.434 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCO[C@@H](C)C1 769710565 NCEJNOWWMOYAQI-WDEREUQCSA-N 251.326 2.058 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H]3CCNC[C@@H]3C2)c1O 904420502 QUCPSTXINOYJNY-CMPLNLGQSA-N 296.798 2.096 10 20 CECD CN(C)c1ccc(CN[C@H](Cc2ccco2)C(=O)O)cc1 1320748791 KNOORDWABBONMT-OAHLLOKOSA-N 288.347 2.131 10 20 CECD CCc1cnc(CNC(=O)NCc2ccc(N)cc2)s1 1335686681 GVAUUEPQUGPJFL-UHFFFAOYSA-N 290.392 2.287 10 20 CECD COc1cc(C)cc(CN2CC[C@](O)(C3CC3)C2)c1O 1332003922 IBODIMDJLXSMNX-MRXNPFEDSA-N 277.364 2.056 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCO[C@@H](C3CC3)C2)cc1 1335666613 RZOOTTHAUOHWBC-HUUCEWRRSA-N 289.379 2.026 10 20 CECD O=C(O)[C@@H](C[C@@H]1CCCO1)NCc1cc(Cl)ccc1O 1601641171 IDVZZLUWKRQTSC-NWDGAFQWSA-N 299.754 2.158 10 20 CECD O=C(O)CC1(NCc2cc(Cl)ccc2O)CC1 1608688072 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C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C[C@H]1C 297299877 YMEWILQHJZGTDF-DTWKUNHWSA-N 267.300 2.355 10 20 CECD CCOc1ccc(O)c(CN(C)CCN2CCCC2)c1 809738048 QJLCGLMLVUVLCQ-UHFFFAOYSA-N 278.396 2.319 10 20 CECD Cc1c(C(=O)NCc2ccc(N)cc2)cnn1C(C)(C)C 297296741 VHHIPADCHMMACL-UHFFFAOYSA-N 286.379 2.459 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1COc3ccccc3[C@H]1O)CC2 297217559 HBEICNJLIOQONH-HBUWYVDXSA-N 297.354 2.464 10 20 CECD CN(CCC(N)=O)Cc1cc(-c2ccccc2)ccc1O 809713748 LAQGJQPWQFOKBB-UHFFFAOYSA-N 284.359 2.366 10 20 CECD C[C@H](N)C[C@@H](C)NCc1ccc2c(c1)CCCN2C 817901702 XBUSXGJDFGHRBE-QWHCGFSZSA-N 261.413 2.284 10 20 CECD COCCNCCN[C@H](C)c1cc2c(cc1O)CCCC2 817964385 AKVPLYHUCHPARG-CYBMUJFWSA-N 292.423 2.158 10 20 CECD CC[C@H](N[C@H](CN)C1CC1)c1ccc(F)cc1O 817959609 DIXCFWLTUAJYIB-QWHCGFSZSA-N 252.333 2.309 10 20 CECD Oc1c(F)cccc1CNCc1ccc(-c2nn[nH]n2)cc1 826510933 SNLJCLCEEKXKNP-UHFFFAOYSA-N 299.309 2.001 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1CC1(F)F 823297841 JCFCYOAZNVRAET-ZETCQYMHSA-N 278.349 2.397 10 20 CECD CC(C)[C@@H](NCc1ccc(N(C)C)c(F)c1)C(=O)O 820043776 IDCKLICVBOPQKQ-CYBMUJFWSA-N 268.332 2.091 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(OC)c(C)c1 824701806 CDUQXYYDMBPTKD-KGLIPLIRSA-N 277.364 2.435 10 20 CECD O=C(O)CC1(NCc2ccc3c(c2)CCO3)CCC1 901707713 UKKDWHJLUBMHSS-UHFFFAOYSA-N 261.321 2.109 10 20 CECD CC(C)[C@H](NC1CCOCC1)C(=O)Nc1ccc(N)cc1 832250694 YLZHQXYJZLVYJI-HNNXBMFYSA-N 291.395 2.001 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2cc(Cl)c(F)cc2O)C1 840998468 CYJVZMAOJQGXFT-ZDUSSCGKSA-N 287.718 2.481 10 20 CECD CCCN(C(=O)c1cc(O)cs1)[C@H]1CCN(C)C1 844146949 TVGRNMDNCZEJOZ-JTQLQIEISA-N 268.382 2.010 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@H](C)CCO 846111025 MBXRTAYWFQGFGZ-CYBMUJFWSA-N 250.386 2.264 10 20 CECD Cc1cnc(CCNC(=O)Cc2ccc(N)cc2)c(C)c1 848432059 RWWHOYOTBCDIAL-UHFFFAOYSA-N 283.375 2.182 10 20 CECD C[C@@H]1C[C@@H](NCCN2CCCC2=O)c2c(O)ccc(F)c21 846205119 FAVAIJPBWWLUNQ-ZYHUDNBSSA-N 292.354 2.292 10 20 CECD CS[C@H](C)CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 844163325 YZIXQPUVHOVVDC-BXUZGUMPSA-N 295.452 2.010 10 20 CECD C[C@@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)CS1 840243319 COKNYDLVCQWISB-YPMHNXCESA-N 293.436 2.446 10 20 CECD CC[C@@]1(C(=O)N[C@H](C)c2cc(OC)ccc2O)CCCN1 843489465 PIRCSKKSPKCJJO-BZNIZROVSA-N 292.379 2.110 10 20 CECD Cc1cc(CN2C[C@@H]3CCC[C@]3(N)C2)ccc1N(C)C 923398930 OSHCPQQPELHNPU-RDJZCZTQSA-N 273.424 2.374 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](CO)C2CCOCC2)c1 757656651 BVWYKHNKXSOZPK-SWLSCSKDSA-N 279.380 2.139 10 20 CECD Cc1ccc(C(=O)N[C@@H]2C[C@H]2[C@@H]2C[C@H]2C)c(O)c1O 928043351 ZUKPMKHZKCIFTR-KXGXSXBTSA-N 261.321 2.181 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2COCCO2)c(O)c1C 756435135 WNKUTFGQWWDSAB-CHWSQXEVSA-N 265.353 2.075 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@](C)(O)C1CCC1 935945728 IPYUWYVNIFAIFR-INIZCTEOSA-N 298.379 2.045 10 20 CECD CCOc1ccc(CN2CC[C@]3(CCOC3)C2)c(O)c1 769531540 GSJCQVYCBQJAKV-INIZCTEOSA-N 277.364 2.403 10 20 CECD CCCCOC(=O)[C@@H](C)N(C)c1ccc(N)cc1 863558225 ANIBOCMJTLCJQY-LLVKDONJSA-N 250.342 2.437 10 20 CECD CCOC(=O)CN(CC)Cc1ccc(N(C)C)c(F)c1 769008521 ZKSHKFHFJKEJJQ-UHFFFAOYSA-N 282.359 2.277 10 20 CECD CCOC(=O)CN(Cc1ccc(C)cc1O)C1CC1 876609668 QXCMSTZHMSCSPQ-UHFFFAOYSA-N 263.337 2.228 10 20 CECD COc1ccc(CNC2CC(C)C2)c(O)c1OC 1119954751 UAQMFBMDAVDMJH-UHFFFAOYSA-N 251.326 2.298 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1ccc2c(c1)COC2 776746284 VAWIXKAVUJXPGC-UHFFFAOYSA-N 291.328 2.223 10 20 CECD CN1CCc2cc(/C=C3/SC(=O)NC3=O)ccc21 874927473 CZHJCLRUYFKIRT-YRNVUSSQSA-N 260.318 2.003 10 20 CECD CCN(C)c1ccc(CN(C)C2(CO)CCOCC2)cc1 773889600 YITCBUNGIAQFJU-UHFFFAOYSA-N 292.423 2.116 10 20 CECD COC(=O)CC1(CN[C@H](C)c2ccccc2O)CC1 879649393 PYSYKEOKJYFFAC-LLVKDONJSA-N 263.337 2.386 10 20 CECD C[C@@H](NCC(=O)Nc1ccccn1)c1ccc(N(C)C)cc1 878455003 MPMBPACQJMVBLQ-CYBMUJFWSA-N 298.390 2.437 10 20 CECD CC(C)c1ocnc1C(=O)NCc1ccc(O)c(O)c1 778930741 ZFMARTQAPNQIGM-UHFFFAOYSA-N 276.292 2.139 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CC1OCCCO1 788656815 WAIGRHRGMHZKNQ-UHFFFAOYSA-N 293.363 2.284 10 20 CECD CN(C)CCn1ccc(NCc2cc(F)cc(F)c2O)n1 883037575 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VMVKCKNENCBGPB-UHFFFAOYSA-N 267.383 2.110 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCC[C@H](N)C1)c1ccccc1O 1341541096 NUCWETRAOAJEPM-UTUOFQBUSA-N 262.353 2.087 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(OC)c1O)C(=O)O 1345944009 IIEKZMVKWIPSDN-SECBINFHSA-N 273.716 2.007 10 20 CECD COc1cccc(CN(C)[C@@H](CC(C)C)C(=O)O)c1O 1607322585 YXPIWIPXMJLCMA-LBPRGKRZSA-N 281.352 2.332 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)NCc2ccccc2O)[C@@H]1C 228424861 IKJYWJHZRCCQHJ-DEKYYXRVSA-N 263.337 2.068 10 20 CECD COc1ccc(CN[C@@H](C)C(=O)NC(C)C)cc1C 228941847 VKDHVIDGTWFWJR-LBPRGKRZSA-N 264.369 2.006 10 20 CECD COc1ccc(O)c([C@@H](C)NCC[C@@H]2CCOC2)c1 230672491 AWKNSDHXVJRQOJ-VXGBXAGGSA-N 265.353 2.478 10 20 CECD CC(C)(C)CCS(=O)(=O)NCCc1ccc(N)cc1 232507620 ZERUORAMAPHYPT-UHFFFAOYSA-N 284.425 2.167 10 20 CECD CN(C)c1ccc(CN[C@H](C(=O)O)c2ccns2)cc1 1777039596 VXIMGUZLVMNKMX-ZDUSSCGKSA-N 291.376 2.125 10 20 CECD CCC[C@@H]1CNCCN1Cc1ccc(N(C)C)cc1 107092181 ZADFMKOYODUUMG-MRXNPFEDSA-N 261.413 2.327 10 20 CECD COc1cccc(O)c1CN[C@H]1CC[C@@H](CO)CC1 824006405 BKSGQLROWWKDSK-TXEJJXNPSA-N 265.353 2.042 10 20 CECD CCC1(NCc2cccc(OC)c2O)CCOCC1 389500205 VPPQLQMSKOJECI-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Cc1nccn1CCN[C@H]1CCc2cccc(O)c21 389076828 ZGUXPZVQCRZTIO-ZDUSSCGKSA-N 257.337 2.174 10 20 CECD CCN1CC[C@@H](N(C)C(=O)Cc2ccc(N)cc2)[C@H](C)C1 178813973 PRKORDDKENWPCD-CZUORRHYSA-N 289.423 2.000 10 20 CECD COc1ccc(O)c(CN(C)Cc2cscn2)c1 179865516 UDHSWUKXTHZRST-UHFFFAOYSA-N 264.350 2.489 10 20 CECD CCC[C@]1(C)C(=O)NCCN1Cc1ccc(N(C)C)cc1 189039244 XJHHAIJXCJRBSW-QGZVFWFLSA-N 289.423 2.243 10 20 CECD CCc1nnc(NC(=O)N(C)Cc2ccccc2O)s1 47345623 JFHBHJWSTQAZRF-UHFFFAOYSA-N 292.364 2.470 10 20 CECD CC(C)c1ncncc1C(=O)NCc1ccccc1O 269147634 ONJQCGPHMCTUGS-UHFFFAOYSA-N 271.320 2.236 10 20 CECD COc1ccc(CNC[C@H]2CCCN(C(C)=O)C2)cc1C 279656095 FTVNJGAYZWROBT-MRXNPFEDSA-N 290.407 2.352 10 20 CECD C[C@@H](NC[C@@H](O)c1cnn(C)c1)c1cc(Cl)ccc1O 273464220 DIAOWOVZGVCLMI-YMTOWFKASA-N 295.770 2.163 10 20 CECD COc1cccc(CNC(=O)NCCC(C)(F)F)c1O 297591594 MTSSSWOVFRNAIC-UHFFFAOYSA-N 288.294 2.245 10 20 CECD C[C@@H](NC[C@@H](N)C1CC1)c1cc(Cl)ccc1O 817964919 JGSLEFWURCMBGK-PRHODGIISA-N 254.761 2.434 10 20 CECD CSc1cncc(NCCc2ccc(O)c(O)c2)n1 811811650 ZNFSXTAQOJNSKS-UHFFFAOYSA-N 277.349 2.264 10 20 CECD Cc1cnc(C(=O)NCc2ccc(N(C)C)cc2C)o1 813812854 ZERDARCICXEYOM-UHFFFAOYSA-N 273.336 2.287 10 20 CECD C[C@H](CN)N[C@H](C)c1ccc(N2CCOCC2)cc1Cl 817966951 ZZTNMZHXVGYIAY-VXGBXAGGSA-N 297.830 2.174 10 20 CECD O=C(O)[C@@H]1CCN(Cc2cc3c(cc2O)CCCC3)C1 821511869 UKSZAAFLTOJNSA-CYBMUJFWSA-N 275.348 2.178 10 20 CECD Cc1cc(O)c(CN(C)C2(CO)CCOCC2)cc1Cl 827908641 PQOSFACBCNOVMG-UHFFFAOYSA-N 299.798 2.327 10 20 CECD CN(C(=O)/C=C\c1ccc(Cl)nc1)c1ccn(C)n1 492701091 DXALFNXVBFJXRY-XQRVVYSFSA-N 276.727 2.145 10 20 CECD Cc1ccc(CCNC(=O)/C=C\c2ccc(O)c(O)c2)cn1 588406529 RPPMISKCFCFDGR-ALCCZGGFSA-N 298.342 2.173 10 20 CECD CCOc1ccc(N(CC)CC[S@](C)=O)cc1 828194688 RBOKLJJRTMWPBZ-KRWDZBQOSA-N 255.383 2.290 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@H]3CC3(F)F)ccc21 822867822 MQOPETDHOTZUMZ-LBPRGKRZSA-N 280.318 2.340 10 20 CECD Cc1nnc(CN(C)Cc2cc(F)ccc2O)s1 827805337 ITPOAUQPXDMCCR-UHFFFAOYSA-N 267.329 2.323 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncnc2c1cnn2C 734483136 MIHKOJHHOZDQIE-UHFFFAOYSA-N 296.378 2.350 10 20 CECD COCc1cc(CNCc2ccc(N(C)C)cc2C)no1 838951259 QITFWCZCQLTYOM-UHFFFAOYSA-N 289.379 2.485 10 20 CECD Cc1ccc(C(=O)N[C@H](C)c2c(C)n[nH]c2C)c(O)c1O 910067369 CEKXBYYGDVZXHT-MRVPVSSYSA-N 289.335 2.237 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(CC)C1)c1ccc(F)cc1O 834888607 BHFMROHXCXVTSH-DGCLKSJQSA-N 280.343 2.193 10 20 CECD COc1ccc(N2CCN(CC3CC3)CC2)c(OC)c1 846748361 NDBQIJOSGWILBP-UHFFFAOYSA-N 276.380 2.236 10 20 CECD CCOCc1cc(CN[C@H]2CCCNC2)ccc1OC 841043454 RNCUQCOHKVHDQR-HNNXBMFYSA-N 278.396 2.073 10 20 CECD C[C@]1(CNCc2cc(F)ccc2O)CCCNC1 841056942 KJEYCUALPTZQDY-AWEZNQCLSA-N 252.333 2.011 10 20 CECD CN(C)c1ccc([C@@H](N)CNC[C@@H]2CCSC2)cc1 841046261 YQKPPYSBDZGIAR-WFASDCNBSA-N 279.453 2.095 10 20 CECD CC[C@@H](NC(=O)Nc1ccc(N)cc1)[C@@H]1CCCO1 841297809 IITXZLLJNFUKHA-OLZOCXBDSA-N 263.341 2.348 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCS2)c1 743334607 BSEUXUJGHWOTGP-ZANVPECISA-N 281.377 2.474 10 20 CECD CCN1C(=O)C(C)(C)N[C@H]1c1cc(Cl)cc(F)c1O 840838688 RREVSMRAWJNLNJ-LLVKDONJSA-N 286.734 2.414 10 20 CECD C[C@@H]1C[C@@H](CNCc2cc([N+](=O)[O-])ccc2O)[C@@H](C)O1 840964657 UHUGBQMMZMBYDT-MXWKQRLJSA-N 280.324 2.204 10 20 CECD C[C@@H](NCCCn1cncn1)c1cc(Cl)ccc1O 756830019 NWRSZPRAVGLGAG-SNVBAGLBSA-N 280.759 2.378 10 20 CECD Cc1ccccc1OC[C@H](O)CN(C)c1ccc(N)cc1 923401852 YEKXIHXTUKKPJB-MRXNPFEDSA-N 286.375 2.453 10 20 CECD Cc1cnccc1CNC[C@H](N)c1ccc(N(C)C)cc1 863641427 BRPGGGNSUHPVJL-KRWDZBQOSA-N 284.407 2.246 10 20 CECD O=C(NCc1ccccc1O)c1cc(F)c(O)c(F)c1 762621188 FVFJNWPOYUUSNG-UHFFFAOYSA-N 279.242 2.306 10 20 CECD CCC[C@@H](CNC(=O)c1cc(O)cs1)OCC 862416047 LKUARPHBUPOCMS-JTQLQIEISA-N 257.355 2.389 10 20 CECD COc1ccc(C(=O)NCc2ccccc2O)nc1Cl 768287844 VMEYHJLTBTWBKK-UHFFFAOYSA-N 292.722 2.379 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](O)CCc2ccccc2)c1 862757859 GTLLLLVVNQBYIU-QGZVFWFLSA-N 299.370 2.311 10 20 CECD CCN(C)c1ccc(CN[C@H](CCO)C2CC2)cc1 773834980 CVAZPBXFAZGAPS-MRXNPFEDSA-N 262.397 2.393 10 20 CECD Cc1cccc(O)c1CN1CCO[C@@H](C(F)F)C1 877502861 UUIKDVRDHDBCKW-GFCCVEGCSA-N 257.280 2.167 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H](CCC(N)=O)C1 876650433 SGDHKGRCBJGYEM-CYBMUJFWSA-N 276.380 2.178 10 20 CECD CCN(C)C(=O)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 775586843 PRTAFHCSDOPOCE-GXSJLCMTSA-N 280.343 2.148 10 20 CECD COc1cccc(CNC[C@@H]2CCC[C@@H]2OC)c1O 774831724 YAGORTNXCFWRGP-AAEUAGOBSA-N 265.353 2.306 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H]2CCO)c1 779203154 ZXGSXPLHJBSUDK-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD Cc1nc([C@@H]2CCCN(Cc3ccc(N)cc3)C2)n[nH]1 1120263821 WIIUEIKFPBKYEO-CYBMUJFWSA-N 271.368 2.075 10 20 CECD C[C@@H](CC(=O)NCc1cccc(O)c1O)n1cccc1 1123978993 ZAQPVGBQQCRIRY-NSHDSACASA-N 274.320 2.167 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@H](CO)C2)cc1Cl 897355292 LXILXOFRHGGYFI-HOMQSWHASA-N 255.745 2.215 10 20 CECD COC(=O)C[C@@H](NCc1cccc(OC)c1O)C(C)(C)C 897889253 PKQJIVRBOIDDFF-CYBMUJFWSA-N 295.379 2.468 10 20 CECD CN(C)c1ccc(CNC(=S)NC2(C)CC2)cc1 789178910 VOGYXXJDYGRJOB-UHFFFAOYSA-N 263.410 2.269 10 20 CECD CC[C@]1(C)COCCN1C(=O)c1ccc(C)c(O)c1O 781012833 HAAWADPIGGSEOG-OAHLLOKOSA-N 279.336 2.047 10 20 CECD COc1ccc(CN[C@H]2CCC[C@H]2CCO)c(O)c1OC 893721540 SVWPEPUMAUCUKR-AAEUAGOBSA-N 295.379 2.050 10 20 CECD CCc1cccc(CN2CC[C@H](C3OCCO3)C2)c1O 896379406 YJGMWUORQWBEJC-AWEZNQCLSA-N 277.364 2.149 10 20 CECD COc1ccc(CNC(=O)CCc2nccs2)c(O)c1 794371036 WPKPKCGVJHICFW-UHFFFAOYSA-N 292.360 2.106 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 793794984 AMXAEBRSAQVVRB-FIXISWKDSA-N 295.379 2.206 10 20 CECD COc1cccc(O)c1CN[C@@H](C)C(=O)OC(C)(C)C 769556995 PJRLCPXIDYOGCJ-JTQLQIEISA-N 281.352 2.221 10 20 CECD CN(CCC(F)(F)F)Cc1cc2c(cc1O)OC[C@H]2O 1319798810 MUZMZOMJHXVEDL-LLVKDONJSA-N 291.269 2.202 10 20 CECD CCOc1ccc(CN(CC(=O)OC)CC(C)C)c(O)c1 1319964223 SOZKFZIVQQJQRU-UHFFFAOYSA-N 295.379 2.422 10 20 CECD CCOc1ccc(N2CCN(Cc3ccno3)CC2)cc1 1336435520 MYMSNNKSWCFLMM-UHFFFAOYSA-N 287.363 2.396 10 20 CECD C[C@@H](Nc1cncc(C(=O)O)n1)c1ccc(N(C)C)cc1 1609786107 PQMXHXCQHNJEOH-SNVBAGLBSA-N 286.335 2.414 10 20 CECD C[C@H](NC(=O)[C@@H]1CC[C@@H]1C(=O)O)c1ccc(N(C)C)cc1 1603234360 MXUWYDZONPXSHB-GDLCADMTSA-N 290.363 2.041 10 20 CECD O=C(O)CN(Cc1cccc(Cl)c1O)C1CCOCC1 1602059182 TTYUBSGCJMEKEB-UHFFFAOYSA-N 299.754 2.111 10 20 CECD c1cc(N2CCCCC2)ccc1CN1CCNCC1 19726889 AEYILIHOKFBOFZ-UHFFFAOYSA-N 259.397 2.082 10 20 CECD CNC(=O)Nc1ccc(C(=O)Nc2ccc(N)cc2)cc1 1578557503 IWULFSLYGJVIIT-UHFFFAOYSA-N 284.319 2.272 10 20 CECD CCN1CCc2cc(CN[C@@H]3C[C@@]4(C(=O)O)C[C@@H]34)ccc21 1776877630 LVCQHFUNPJRHKS-VBQJREDUSA-N 286.375 2.022 10 20 CECD CCC[C@@H](NCc1ccc2c(c1)CCN2CC)C(=O)O 1776760434 BEFJTIQPYJNKEY-CQSZACIVSA-N 276.380 2.412 10 20 CECD Cc1cccc(CC(=O)NCc2ccc(O)c(O)c2)c1 158943178 UJECNWXKQMEWMO-UHFFFAOYSA-N 271.316 2.265 10 20 CECD CC(C)[C@@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CCO1 831505991 NGVMAMUMTNGBKJ-CABCVRRESA-N 276.380 2.131 10 20 CECD c1cc2c(cc1CNC[C@@H]1CCN(C3CC3)C1)CCO2 37649482 FUNXFYLJHBBFAL-AWEZNQCLSA-N 272.392 2.195 10 20 CECD CN(CC(=O)N(C)c1ccc(N)cc1)CC(C)(C)C 45065118 YYVUILGRHSLBKS-UHFFFAOYSA-N 263.385 2.210 10 20 CECD CC[C@@](C)(CNCc1cc2c(cc1O)OCO2)OC 322793858 OKSOXRVIEUHWIJ-AWEZNQCLSA-N 267.325 2.026 10 20 CECD Cn1ncc(CNCc2ccccc2O)c1Cl 712429197 GHAGCTVKWVUFCM-UHFFFAOYSA-N 251.717 2.069 10 20 CECD Cc1ccsc1CNC(=O)Cc1ccc(N)cc1 110398391 ZYHDULUQKAOKAW-UHFFFAOYSA-N 260.362 2.498 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1cnn(C)c1 170732339 MUBLWCZIMLJQGO-UHFFFAOYSA-N 287.363 2.107 10 20 CECD N[C@H]1CC[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 178710435 DDKPTMYUAYKWHA-CABCVRRESA-N 287.407 2.030 10 20 CECD COc1cc(O)c(CN(C)C[C@H]2CCC[C@@H]2O)cc1OC 180700923 FRMZVGRFCXCLKT-YPMHNXCESA-N 295.379 2.002 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cccs1 183471320 SFBLCJATOQFUDN-SNVBAGLBSA-N 291.372 2.449 10 20 CECD COc1cccnc1N(C)C(=O)/C=C/c1cccnc1 121444815 AQSSOBFORWENJM-BQYQJAHWSA-N 269.304 2.161 10 20 CECD CN1c2ccccc2C(=O)N[C@@H]1c1cc(F)ccc1O 77472034 GIFXXNVVYVHEQU-AWEZNQCLSA-N 272.279 2.410 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccco2)c(O)c1O 181777109 XYAPHDXYMHRKIZ-UHFFFAOYSA-N 261.277 2.271 10 20 CECD CCn1ncnc1CN(C)c1ccc(OC)c(F)c1 193388654 UIAFZMSDRNEATR-UHFFFAOYSA-N 264.304 2.082 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H]3CC[C@@H](C2)N3C)c1 130349063 JUYJUIMVTZDTDQ-GJZGRUSLSA-N 290.407 2.459 10 20 CECD CCOc1cccc(CN2CCC[C@@H](CC(=O)O)C2)c1O 86757580 VYWZLFDUOPPILO-LBPRGKRZSA-N 293.363 2.478 10 20 CECD Cc1nc2n(n1)CCN(Cc1c(O)ccc(Cl)c1F)C2 365235446 VVONHDSDXFQUMI-UHFFFAOYSA-N 296.733 2.100 10 20 CECD C[C@H](NCc1nnc2n1CCC2)c1cc(Cl)ccc1O 273361414 DCEFCDYFQLTTFA-VIFPVBQESA-N 292.770 2.434 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)CC[S@](=O)C1 277384594 GNGLUBFNBMYDSV-MGNBDDOMSA-N 287.812 2.246 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H]2[C@@H]2CCCO2)c(O)c1O 375976000 SPTALUMAVYUMSQ-OLZOCXBDSA-N 291.347 2.190 10 20 CECD O=C(c1cccc(O)c1O)N1CC(C2CCCC2)C1 373759342 RYLHARPCCANHGZ-UHFFFAOYSA-N 261.321 2.360 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CC2(F)F)cc1F 294822702 WKJGDECCSZEQFU-VIFPVBQESA-N 272.270 2.163 10 20 CECD COc1ccncc1COC(=O)c1cc(O)cs1 805450274 UBDIBLYCFXAASM-UHFFFAOYSA-N 265.290 2.214 10 20 CECD Cc1cc(CN2CC[S@@](=O)C[C@@H](C)C2)ccc1N(C)C 294121138 NIBXQJUDRCDAGG-RNODOKPDSA-N 294.464 2.261 10 20 CECD C[C@@H]1C[C@H](CO)CN(Cc2c(O)cccc2Cl)C1 817413328 WKPKYSJEJLZCIT-MNOVXSKESA-N 269.772 2.496 10 20 CECD COC(=O)[C@]1(F)CCN(Cc2ccc(N(C)C)c(C)c2)C1 815055935 UEUNZLRYQXFUTL-INIZCTEOSA-N 294.370 2.148 10 20 CECD CON1CCC(NCc2cc(Cl)cc(F)c2O)CC1 817419797 YCVKMSBRNLDZAR-UHFFFAOYSA-N 288.750 2.300 10 20 CECD Cc1ccncc1/C=C\C(=O)N1CCc2ccncc21 492549074 KNIWBLZNASQOEH-IHWYPQMZSA-N 265.316 2.388 10 20 CECD CCOc1ccc(CN2CCC[C@H]3CN(C)C[C@H]32)c(O)c1 822520459 CDNGZGKAPLBAOR-XJKSGUPXSA-N 290.407 2.317 10 20 CECD CN(Cc1cccc(Cl)c1O)C1(CO)CCC1 827903982 RYGCRDXQQIEBMX-UHFFFAOYSA-N 255.745 2.392 10 20 CECD COc1cccc(CN[C@H](C(=O)OC(C)C)C(C)C)c1O 824847144 WPUBGQULDVDMRA-AWEZNQCLSA-N 295.379 2.467 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@H]1C(=O)O 828456686 NAWPPQNXQWABOC-IINYFYTJSA-N 275.348 2.033 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCC1CC1 734518188 CSDRCYTYWALYJR-UHFFFAOYSA-N 261.369 2.270 10 20 CECD O=C(NCCOCC1CCCC1)c1cc(O)cs1 839792037 MLUIFUVNJORPIM-UHFFFAOYSA-N 269.366 2.390 10 20 CECD CC[C@@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(C)cc1O 834907530 VPLFDPMKJJIZKQ-OUCADQQQSA-N 276.380 2.395 10 20 CECD CC(=O)CCCCCNC(=O)/C=C/c1ccc(O)c(O)c1 909099195 POAULYKAMYGCAR-VQHVLOKHSA-N 291.347 2.377 10 20 CECD CN(C)c1ccc(CNc2nc3n(n2)CCCC3)cc1F 834482379 ICQYBTXUXKGEBL-UHFFFAOYSA-N 289.358 2.432 10 20 CECD O=C(CC[C@H]1CCCCO1)NCc1ccc(O)cc1O 910954830 MOUUIKJFMWNXSW-CYBMUJFWSA-N 279.336 2.063 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)NCCc1ccc(N)cc1 841837429 JYKGURYLQDMLPI-LBPRGKRZSA-N 293.411 2.314 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CO[C@@H](C)C2)c1 842775287 LYAJEGROQJHUSB-JQWIXIFHSA-N 251.326 2.058 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1(CO)CCC1 840938412 DOHJKOHUVGRPCK-UHFFFAOYSA-N 262.397 2.313 10 20 CECD CCc1cccc(CN2CC[C@H](COCCOC)C2)c1O 848890670 TYINGAJXHDTXPS-AWEZNQCLSA-N 293.407 2.440 10 20 CECD COC[C@@H](C)CN[C@@H](C)c1cccc(OC)c1O 846147064 VIDNGIXKICSSIG-QWRGUYRKSA-N 253.342 2.334 10 20 CECD CN(Cc1ccccc1O)C(=O)CCCn1cccn1 748839813 BZPNZBKHQZWBPB-UHFFFAOYSA-N 273.336 2.028 10 20 CECD CCOc1ccc(CN2CCC(CNC)CC2)c(O)c1 843049769 SZYGVZXMDBXHIT-UHFFFAOYSA-N 278.396 2.222 10 20 CECD CCO/C=C/C(=O)NCCCSc1nccs1 847488107 TZIUAUZAWTYJJG-QPJJXVBHSA-N 272.395 2.292 10 20 CECD CCCOc1ccc(CN2CCN(CC)CC2)c(O)c1 131710571 HVQXKLFGTGIUTG-UHFFFAOYSA-N 278.396 2.319 10 20 CECD C[C@H](C[C@@H]1CCC(=O)N1)NCc1ccc(N(C)C)c(F)c1 924861662 KROYXFNNOVMPET-YPMHNXCESA-N 293.386 2.039 10 20 CECD O=C(NC[C@H]1C[C@H]2C=C[C@H]1C2)c1cccc(O)c1O 1335225179 ABNGARKCTCFKJN-GARJFASQSA-N 259.305 2.040 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCN2C)c1cnn(C)n1 924869701 IPCNXGJWUFMXMJ-GFCCVEGCSA-N 285.395 2.048 10 20 CECD Cc1ccc2nc(COC(=O)c3cccc(O)c3O)cn2c1 758563664 YWBODUCMWYKUIU-UHFFFAOYSA-N 298.298 2.411 10 20 CECD COCCCCCOC(=O)/C=C\c1ccc(O)c(O)c1 759598878 ZJJBZITWYBEPGG-VURMDHGXSA-N 280.320 2.471 10 20 CECD O=C(N[C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1cc(O)cs1 754498877 OULAHLHDFFVGAP-YUSALJHKSA-N 279.361 2.141 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1ccc(F)cc1O 756734263 VJOIPLWAQNQHPR-WDEREUQCSA-N 271.332 2.233 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756732041 GATRKNBTKQTKMJ-QWRGUYRKSA-N 298.339 2.003 10 20 CECD C[C@@H](NC(=S)NC1CCOCC1)c1ccccc1O 865269515 PFXCFTBGKUPVHH-SNVBAGLBSA-N 280.393 2.096 10 20 CECD CCCOc1ccc(CN[C@@H]2CCS(=O)(=O)C2)cc1C 873008766 CLXQPOMSWAHSIK-CQSZACIVSA-N 297.420 2.061 10 20 CECD CCOC(=O)[C@@H](C)[C@@H](C)NCc1c(C)cccc1O 877322714 CCHBKYJHWDKALZ-NWDGAFQWSA-N 265.353 2.378 10 20 CECD CC(C)[C@](C)(O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775402677 FSLNWLXCQSQPRB-LRDDRELGSA-N 278.396 2.337 10 20 CECD CO[C@@]1(C)CCCN(C(=O)NCc2ccc(N)cc2)CC1 1120677173 MCTLJMJLIZJAJN-INIZCTEOSA-N 291.395 2.369 10 20 CECD Cc1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nn1C 773020103 NRTKGTATBDLQHK-LBPRGKRZSA-N 286.379 2.286 10 20 CECD O=C(Nc1cnn(C2CCC2)c1)c1cccc(O)c1O 889056474 AEPVHLJOXIRTQL-UHFFFAOYSA-N 273.292 2.272 10 20 CECD COc1ccc(CN(C)CC(C)C)c(O)c1OC 891578917 PZGAFSTXYGPHOM-UHFFFAOYSA-N 253.342 2.497 10 20 CECD COc1ccc(CN2CCCOC(C)(C)C2)c(O)c1OC 892076392 XRYLIODINZDFDC-UHFFFAOYSA-N 295.379 2.410 10 20 CECD CCn1cc(CNCCCSc2nccs2)nn1 893045266 OMGNHEJIGVBLCD-UHFFFAOYSA-N 283.426 2.027 10 20 CECD CN(C)c1ccc(CNc2ccc(-n3cncn3)cn2)cc1 790244378 GEFRXHWUAXIPIW-UHFFFAOYSA-N 294.362 2.340 10 20 CECD CC1(C)CNCCN1Cc1cc(Cl)ccc1O 88138004 ULDVGIGFJRWXHK-UHFFFAOYSA-N 254.761 2.229 10 20 CECD Oc1cccc(Br)c1CNC[C@@H]1CCCO1 706871487 AFEDUBJAPVJNRI-VIFPVBQESA-N 286.169 2.423 10 20 CECD CN(Cc1ccccc1O)C(=O)c1csc2cncn12 735850059 SWMIQJDHFGXBTG-UHFFFAOYSA-N 287.344 2.374 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@@](O)(C2CC2)C1 1321080132 QOLCLSGZEVPVON-AWEZNQCLSA-N 267.756 2.392 10 20 CECD CCc1nn(C)cc1NCc1cc2c(cc1O)OCO2 222948567 PUBHIACDTKBEEQ-UHFFFAOYSA-N 275.308 2.029 10 20 CECD O=C(O)[C@@H](CC(F)F)NCc1c(O)ccc(Cl)c1F 1601639393 RPHHVCNCYZIDEU-SSDOTTSWSA-N 297.660 2.383 10 20 CECD C[C@@H](NCCc1ccn(C)n1)c1ccc(N(C)C)cc1 230898443 FHSRXIRGMOEOEO-CYBMUJFWSA-N 272.396 2.379 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCC[C@@H]2CO)c1O 230935027 DVUVYYHTPKLIHA-BXKDBHETSA-N 285.771 2.305 10 20 CECD Cc1ccc(OCC(=O)NCc2ccc(O)c(O)c2)cc1 158934835 PWXHHXDFQWPETB-UHFFFAOYSA-N 287.315 2.101 10 20 CECD OCC1(CNCc2ccc3c(c2)CCCO3)CCC1 258905791 FIRLCCGXBQAHIY-UHFFFAOYSA-N 261.365 2.264 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCN(C(C)(C)C)C1 850351468 NCEBFWXQHWHHJO-GFCCVEGCSA-N 278.396 2.363 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1CCN2CCCC[C@H]12 272488701 UFWVRASPCQNIPZ-ZIAGYGMSSA-N 264.344 2.248 10 20 CECD Nc1ccc(CCNC(=O)CCc2ccco2)cc1 40675669 YZYXGQVJVAKTTB-UHFFFAOYSA-N 258.321 2.153 10 20 CECD CCc1nnc(CNCc2cccc(C)c2O)s1 290842857 IKYUXWAWQTYNQX-UHFFFAOYSA-N 263.366 2.404 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1ccc(C)cc1O 185467669 QNZIWECOGNTLQQ-IUODEOHRSA-N 267.369 2.139 10 20 CECD CCO[C@H]1CCN(Cc2cc(OC)ccc2O)C1 701661668 OLUUJRWWLKPMJE-ZDUSSCGKSA-N 251.326 2.012 10 20 CECD COc1cccc(CN2CCCCC[C@@H]2C(=O)O)c1O 86814532 IXSOBVDPLMJBAH-GFCCVEGCSA-N 279.336 2.230 10 20 CECD CC[C@H](C)NC(=O)CCN[C@H](C)c1cc(F)ccc1O 94617748 AAVGUNQUIHHKLH-WDEREUQCSA-N 282.359 2.487 10 20 CECD CCC[C@](C)(O)CNCc1cc(F)cc(F)c1O 708453818 KKZOVSCOHJDVJL-ZDUSSCGKSA-N 259.296 2.311 10 20 CECD CC[C@H](C)NCCN1CCN(c2ccc(OC)cc2)CC1 57868796 RGLWBZOWUKATMC-HNNXBMFYSA-N 291.439 2.205 10 20 CECD CCOC(=O)CN(Cc1cc(OC)ccc1O)C(C)C 179800192 VOEXIWOPFCKRAI-UHFFFAOYSA-N 281.352 2.174 10 20 CECD C[C@H](NCCO)c1ccc(Cl)c(Cl)c1O 134910995 MDRUCCCGAKLEOV-LURJTMIESA-N 250.125 2.342 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncnc2nn(C)cc12 119532435 FBRVHZXRUKMUGR-UHFFFAOYSA-N 296.378 2.350 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)NCCC(N)=O)c1C 175425335 HPWGMWWGCAHZNW-UHFFFAOYSA-N 299.374 2.008 10 20 CECD COc1ccc(O)c(CNC2(C3CC3)CCOCC2)c1 376385233 KOALVURLJZJODZ-UHFFFAOYSA-N 277.364 2.450 10 20 CECD CC(C)N1CC[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)C1=O 89729018 ROMNGQXXKAVRHQ-CZUORRHYSA-N 289.423 2.413 10 20 CECD Cc1ccc(O)c(CN2CCC(C)(C(=O)O)CC2)c1 86776938 UQOWHESCOQPGBT-UHFFFAOYSA-N 263.337 2.387 10 20 CECD CC[C@H]1COCCN1Cc1ccc(N2CCOCC2)cc1 91980817 OMZJMFIEOJLNEJ-INIZCTEOSA-N 290.407 2.134 10 20 CECD COCCCOCCN(C)Cc1cc(C)cc(OC)c1O 91026167 MMLBTTVVHRYLEV-UHFFFAOYSA-N 297.395 2.194 10 20 CECD CC[C@H](CO)NCc1cccc(Br)c1O 42411836 NEMOJMLBZBLUID-SECBINFHSA-N 274.158 2.015 10 20 CECD Cc1ccc([C@H](C)NCCC(=O)N(C)C)c(O)c1C 273364179 AXXOQCKIHYFSJW-LBPRGKRZSA-N 264.369 2.138 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@@H]2CCC[C@H]2C1 276546032 GSZDOEZSVBLIBR-IUCAKERBSA-N 265.284 2.109 10 20 CECD COc1ccc(O)c(CN2CCO[C@H](COC(C)C)C2)c1 372117238 RBBYPXULJZEPNV-HNNXBMFYSA-N 295.379 2.027 10 20 CECD CC[C@@H](N[C@@H]1CCCCNC1=O)c1ccc(F)cc1O 285489985 CBGIPHRMMODYDU-CHWSQXEVSA-N 280.343 2.241 10 20 CECD CC[C@H](NCCCN1CCOCC1)c1ccc(C)cc1O 280272603 YAMOBBPEIGBZOE-INIZCTEOSA-N 292.423 2.464 10 20 CECD CN(Cc1n[nH]c(C(C)(C)C)n1)Cc1ccccc1O 292478173 AEEJDEAAVYYCLP-UHFFFAOYSA-N 274.368 2.440 10 20 CECD C[C@@H](NC[C@@H](N)c1ccc(N(C)C)cc1)c1cccnc1 817941820 LBOKTBOSLFEVOX-CXAGYDPISA-N 284.407 2.498 10 20 CECD C[C@H](N[C@@H]1CCC[C@H](N)C1)c1cc(F)ccc1O 817969636 FPDCXBWGTHHLSK-ZMLRMANQSA-N 252.333 2.452 10 20 CECD CN(C)c1ccc(CNC(=O)NOC2CCC2)cc1F 836563934 BBLNPVQAPRRJLQ-UHFFFAOYSA-N 281.331 2.175 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC1(C(F)(F)F)CC1 837679825 ZEQNNXQHRYLGKZ-RQOWECAXSA-N 287.237 2.322 10 20 CECD Cc1cccc(C)c1NC(=O)C(=O)NCc1ccccc1O 748486269 OMAWNFNAWVKMGR-UHFFFAOYSA-N 298.342 2.264 10 20 CECD C[C@H]1CN(Cc2c(O)ccc(Cl)c2F)[C@H](C)CN1 843119703 CSLOZJINESPPBT-DTWKUNHWSA-N 272.751 2.367 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCN(C(C)C)C(=O)C1 840935879 BOBPYUOWSBQMLO-UHFFFAOYSA-N 289.423 2.114 10 20 CECD CCOCCCNC(=O)[C@@H](C)Sc1nccs1 919677035 WAFVBMMWDQYNKV-SECBINFHSA-N 274.411 2.167 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@H]3CCN(C)[C@H]3C2)c1 840134463 WTUBFPLOPNEXRY-HIFRSBDPSA-N 260.381 2.145 10 20 CECD Nc1ccc(CCNC(=O)NC[C@@H]2CCCSC2)cc1 841906516 RVZQFKVDJFSOAC-ZDUSSCGKSA-N 293.436 2.254 10 20 CECD COc1cc(N(C)C[C@@H]2CCCNC2)cc(OC)c1OC 843065119 DIFBTWAVULWSOT-GFCCVEGCSA-N 294.395 2.148 10 20 CECD CC(C)CN1CC(=O)N[C@@H]1c1cc(Cl)c(F)cc1O 840800304 LOHCSSHEIXVQGW-ZDUSSCGKSA-N 286.734 2.271 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@@H]2C=CCC2)c1 852510163 QXTLRXZHPYEMQX-GHMZBOCLSA-N 276.336 2.480 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)N(C)C)cc1 750609943 XJBZKXGAIMXTQR-ZDUSSCGKSA-N 277.412 2.099 10 20 CECD COc1cc(O)c(CN[C@]2(C)CCO[C@H]2C)cc1OC 753575207 GRSVXSHKGBNXKK-ZUZCIYMTSA-N 281.352 2.067 10 20 CECD Cc1ccc([C@H](C)N[C@@H](CO)C2CCOCC2)c(O)c1 757660052 ZFYCLKMMDBKIJW-WFASDCNBSA-N 279.380 2.139 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@]2(C)CCCO2)c1 756645408 JDIWHSTWPFQIOR-ZBEGNZNMSA-N 293.363 2.399 10 20 CECD CC(C)(C)OCCOC(=O)/C=C/c1ccc(O)c(O)c1 759595323 PYMCWTDTVHYNKX-FNORWQNLSA-N 280.320 2.469 10 20 CECD CC[C@@]1(C)NC(=O)N(Cc2ccc(N(C)C)cc2C)C1=O 761358988 SXIGWSFCJNDVML-MRXNPFEDSA-N 289.379 2.282 10 20 CECD C[C@H](NC(=O)C1(F)CCOCC1)c1ccc(N(C)C)cc1 867503255 JBRMSDIVBFDFPT-LBPRGKRZSA-N 294.370 2.449 10 20 CECD O=C(N[C@H]1CCO[C@]2(CCSC2)C1)c1cc(O)cs1 769385035 NJOAGBUUICAZSP-TVQRCGJNSA-N 299.417 2.238 10 20 CECD CCN(CCOC)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 776245865 OYBCIVQOVJBHJH-CYBMUJFWSA-N 293.411 2.492 10 20 CECD CO[C@@H]1CCC[C@H]1CNC(=O)N(C)Cc1ccccc1O 775459905 PKJZEIWQOHNXOY-SWLSCSKDSA-N 292.379 2.349 10 20 CECD Cc1cccc(O)c1CNC[C@@H](CO)Cc1ccco1 877093080 NNTNQJPJDYCABQ-ZDUSSCGKSA-N 275.348 2.234 10 20 CECD Oc1ccccc1CN1CCCN(C[C@H]2CCCO2)CC1 778995837 KASDYOAUYCZTLE-MRXNPFEDSA-N 290.407 2.079 10 20 CECD CCCOc1ccnc(NCCc2ccc(O)c(O)c2)n1 882055525 CBVVWNMNJAXTAF-UHFFFAOYSA-N 289.335 2.331 10 20 CECD COc1ccc(CNCCCSC)c(O)c1OC 893007819 DVXUXWBWHYCGME-UHFFFAOYSA-N 271.382 2.252 10 20 CECD CCC[C@@H](NCc1cc(OCC)ccc1O)C(=O)OC 897835628 WQSMWNJZKBEJRH-CYBMUJFWSA-N 281.352 2.222 10 20 CECD C[C@@H](CCS(C)(=O)=O)N[C@H](C)c1cc(F)ccc1O 185791825 AJFVKUYWZVEZAR-VHSXEESVSA-N 289.372 2.005 10 20 CECD COc1ccc(CNC[C@H]2C[C@H]2C)c(O)c1OC 892569723 BBUJYDQRQPRKIO-MWLCHTKSSA-N 251.326 2.155 10 20 CECD COc1ccc(CN[C@H]2C[C@@H](OC)C2(C)C)c(O)c1OC 893096529 MWPZUSAZIUTTFF-QWHCGFSZSA-N 295.379 2.313 10 20 CECD COc1ccc(CNCCN2CC[C@H](C)C2)cc1C 744450237 PDCKIMCNYDFXLR-ZDUSSCGKSA-N 262.397 2.435 10 20 CECD CCc1cccc(CNC[C@@H](C)C[C@@H](C)O)c1O 709492900 VSGHLGCSONIPOC-NWDGAFQWSA-N 251.370 2.451 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1c(O)ccc(Cl)c1F 793324706 LFZYSWCARQNZGT-SSDOTTSWSA-N 275.707 2.178 10 20 CECD CC[C@@H](F)C(=O)N[C@H](C)c1cc(OC)ccc1O 1335820780 PCGDUVSCCJRUMS-LDYMZIIASA-N 255.289 2.326 10 20 CECD CC[C@@H](F)C(=O)NCc1ccc2c(c1)CCCN2C 1337096828 TYFHVAJNBYTBKB-CYBMUJFWSA-N 264.344 2.433 10 20 CECD Cn1ccnc1CCC(=O)NCc1cc(Cl)ccc1O 1352324980 HVDLBZUCJLOAMV-UHFFFAOYSA-N 293.754 2.028 10 20 CECD Nc1ccc(CNC(=O)c2ccc(C3CC3)nc2O)cc1 1356240392 XYVSBDGAAVUQQB-UHFFFAOYSA-N 283.331 2.177 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCOC(C)(C)C2)c(O)c1O 163697519 JQHZBYFZONQCAH-JTQLQIEISA-N 279.336 2.094 10 20 CECD C[C@H](NC[C@@H](C)CN(C)C)c1cc(F)ccc1O 310777875 DZGUYMCKWAZKBY-MNOVXSKESA-N 254.349 2.380 10 20 CECD COc1cccc(CN2CCC[C@@H](CC(=O)O)C2)c1O 86757130 COXUZENQRCDAEY-NSHDSACASA-N 279.336 2.088 10 20 CECD COc1ccc(O)c(CN[C@@H](C)C2CCOCC2)c1 89725900 FDHOVMJGGUQABM-NSHDSACASA-N 265.353 2.306 10 20 CECD CCc1cccc(CN[C@@H]2CCN(C(C)C)C2=O)c1O 708695496 PAZQTHUCJJKUAD-CQSZACIVSA-N 276.380 2.054 10 20 CECD C[C@H](N[C@@H](CO)C[C@@H]1CCCO1)c1ccc(F)cc1O 886669585 AVHBTRTVKUJMJT-UHTWSYAYSA-N 283.343 2.112 10 20 CECD CCOc1cccc(CN(C)Cc2cnn(C)c2)c1O 119690126 KDRWHDKYJUYFQN-UHFFFAOYSA-N 275.352 2.156 10 20 CECD COc1cccc(CNC(=O)c2ccnn2C(C)C)c1O 119641428 RUJBZRANTWNNKD-UHFFFAOYSA-N 289.335 2.108 10 20 CECD CN(Cc1ccccc1O)C(=O)CCc1cscn1 171258301 KSNAWABPHQAMFC-UHFFFAOYSA-N 276.361 2.440 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1ccccc1O 183523614 UPOCURAGKFBPOV-GBIKHYSHSA-N 255.383 2.155 10 20 CECD C[C@H](N[C@@H](C)[C@@H](C)N1CCOCC1)c1cc(F)ccc1O 185376515 YGBFPSJMJKAGQU-RWMBFGLXSA-N 296.386 2.291 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1cc(Cl)ccc1O 124776877 SGGQFPMKLBAVCU-NSHDSACASA-N 269.728 2.183 10 20 CECD Cc1ccc(C(=O)N2C[C@H]3[C@@H](C2)C3(C)C)c(O)c1O 182509935 GNZJHGVHVIRLIS-PHIMTYICSA-N 261.321 2.134 10 20 CECD CCOc1cccc(CN(C)[C@@H](C)COC)c1O 132682368 VCHJIMQHXYGXRV-NSHDSACASA-N 253.342 2.258 10 20 CECD CN(C)c1ccc(CN2CCC(C3OCCO3)CC2)cc1 130040169 KOGDKHODTPKTFF-UHFFFAOYSA-N 290.407 2.338 10 20 CECD COc1cc(Cl)cc(CN(CC(=O)O)C(C)C)c1O 229118238 XRQDYYJAQTYDDG-UHFFFAOYSA-N 287.743 2.349 10 20 CECD NC1(C(=O)NCc2ccc(N3CCCC3)cc2)CCCC1 195171768 MNEVUNCOFNSVRI-UHFFFAOYSA-N 287.407 2.175 10 20 CECD CCOC(=O)CN(CC)Cc1cc(OCC)ccc1O 92399689 KVBZRHTXICDIRD-UHFFFAOYSA-N 281.352 2.176 10 20 CECD CO[C@H](C)CCNC(=O)NCc1ccc(N(C)C)c(F)c1 263736200 CTSIRNNVBHCXIU-LLVKDONJSA-N 297.374 2.116 10 20 CECD COCc1nsc(NCc2ccccc2O)n1 271623169 MOPZHQFMUYRIOO-UHFFFAOYSA-N 251.311 2.002 10 20 CECD Cn1cc(C(=O)NCc2ccccc2O)c(C(C)(C)C)n1 271153745 MAGVSWOTHHWZCQ-UHFFFAOYSA-N 287.363 2.353 10 20 CECD Cc1cc(NS(=O)(=O)c2cn[nH]c2C)c(C)c(C)c1O 274748874 DWAYWCYFLVIOFJ-UHFFFAOYSA-N 295.364 2.150 10 20 CECD Cc1c[nH]nc1CNCc1ccc(N(C)C)c(F)c1 289968635 RBDOYXXHUZVYRY-UHFFFAOYSA-N 262.332 2.213 10 20 CECD CC1(C)[C@H]2CC[C@@]1(C(=O)NCc1ccccc1O)C(=O)C2 295405166 ZUVOCTQMPMAGTQ-SJCJKPOMSA-N 287.359 2.404 10 20 CECD CCOC1(C(=O)NCc2cc(OC)ccc2O)CCCC1 802783243 KLXUTGWVBJOSHH-UHFFFAOYSA-N 293.363 2.366 10 20 CECD CCN(CC)C(=O)C[C@H](C)NCCc1ccc(N)cc1 817955629 DDAPIGWWGRLCPG-ZDUSSCGKSA-N 277.412 2.048 10 20 CECD C[C@@H](N)[C@H](Cc1ccccc1)NCCc1ccc(N)cc1 817958469 WHMWMAGYRYSTJE-KDOFPFPSSA-N 283.419 2.359 10 20 CECD CN(C)[C@H](CN[C@@H]1CCc2cccc(O)c21)C1CC1 834518686 MGNUFBIWZVKZNR-ZIAGYGMSSA-N 260.381 2.309 10 20 CECD CC[C@@H](NC(=O)NCc1ccc(N(C)C)cc1C)[C@@H](C)O 838480646 ZIRKTMGOMCZYKR-IUODEOHRSA-N 293.411 2.020 10 20 CECD C[C@H]1CCCN(C[C@H](C)NC(=O)c2cc(O)cs2)C1 731870016 HVWYFBYIDGDIAR-QWRGUYRKSA-N 282.409 2.304 10 20 CECD CCOc1ccc(O)c(CNC[C@@H]2CCCCN2)c1 841033614 XSPNCIQHADYEQD-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD COc1cc(Cl)cc(CNC[C@@H]2CCCCN2)c1O 841033382 SKCFCNYLJAQWLA-LBPRGKRZSA-N 284.787 2.286 10 20 CECD CCc1cccc(CN2CCN(C(C)=O)C[C@@H]2C)c1O 848887061 MPGNCNRBBFDBSE-LBPRGKRZSA-N 276.380 2.007 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H](CC(C)C)OC)c1 841407328 XXSTZFIZBROVQJ-AWEZNQCLSA-N 281.352 2.078 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@H]2NCC[C@@H]2C1 843127713 SIYWXYIARAGREP-ZWNOBZJWSA-N 266.772 2.229 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN[C@H]1[C@@H]2CNC[C@@H]21 841077266 GWXSKQQCGQLRFP-JZYVYDRUSA-N 273.163 2.006 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)N(C)C)cc1 750601209 OTXLAPFZLIRVDI-AWEZNQCLSA-N 291.439 2.441 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)OCCF 858886934 PIJGCQKENKGDTM-UHFFFAOYSA-N 296.342 2.061 10 20 CECD COc1ccc(O)c(CNCc2c(C3CC3)cnn2C)c1 850136970 HOFBDWQXIOXCRS-UHFFFAOYSA-N 287.363 2.302 10 20 CECD Cc1ccncc1/C=C/C(=O)NCc1ccccc1O 752597522 XJQZJMPKTIJMOK-VOTSOKGWSA-N 268.316 2.425 10 20 CECD CC(C)C[C@H]1CN(C)CCN1C(=O)Nc1ccc(N)cc1 926146530 ZYLPNLDMJRYTGJ-HNNXBMFYSA-N 290.411 2.463 10 20 CECD Cc1ccc([C@@H](C)NCCOC[C@@H]2CCOC2)c(O)c1 756564171 QQITVXULXPJXBM-ZIAGYGMSSA-N 279.380 2.404 10 20 CECD Cc1nc(CN(C)c2ccc3c(c2)OCO3)[nH]c1C 862306419 KRMBFZUMOZNBTC-UHFFFAOYSA-N 259.309 2.392 10 20 CECD C[C@@H](NC(=O)N[C@H]1CCSC1)c1ccccc1O 868322531 KCRBNGFWGOOLMG-ZJUUUORDSA-N 266.366 2.258 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@H](C)N)cc1F 863652434 STDKSUOIGHMJON-LBPRGKRZSA-N 267.392 2.451 10 20 CECD C[C@@H](N[C@H]1CCC[C@@H]1O)c1cc(F)cc(F)c1O 866489865 XYXVDEOYZUZFSF-MKCWBWRRSA-N 257.280 2.234 10 20 CECD COC[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862244234 KNPRLVUWEXECAM-NSHDSACASA-N 284.350 2.499 10 20 CECD Cc1nccn1CCCC(=O)N(C)c1ccc(N)cc1 877077798 UTTMYXCDBURWPD-UHFFFAOYSA-N 272.352 2.217 10 20 CECD Cc1cc(NC(=O)N[C@H](C)c2ccccc2O)nn1C 879000139 ZWXUIXZDHWDQHG-SNVBAGLBSA-N 274.324 2.317 10 20 CECD CN(C)c1cc(F)c(/C=C2\SC(=O)NC2=O)cc1F 874929909 SNWXSFLBXWGAJP-WMZJFQQLSA-N 284.287 2.355 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2cccc(OC)c2O)C[C@@H]1C 877667551 YRWQJXKGZFKSOU-ZBEGNZNMSA-N 293.363 2.032 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2CCO[C@@H]2C)cc1 878406798 DABGKPLZASLKIV-OLZOCXBDSA-N 293.363 2.100 10 20 CECD Cc1cccc(O)c1CN1CC(OCC(F)F)C1 877581052 WYZDJZWIBYFAIY-UHFFFAOYSA-N 257.280 2.167 10 20 CECD C[C@H](NC(=O)c1ccc(O)nc1)c1ccc(N(C)C)cc1 773013060 ZLRHMJRSYZRXEH-NSHDSACASA-N 285.347 2.344 10 20 CECD OC[C@H](NCc1cc(F)ccc1O)c1ccc(F)cc1 779081326 REGAVIUMVFALEL-AWEZNQCLSA-N 279.286 2.494 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@]12CCC[C@@H]1C2 887036008 GISKPSWZFGHTQT-RAPKHVKHSA-N 259.305 2.170 10 20 CECD C[C@H](CC(=O)NCc1cccc(O)c1O)n1cccc1 1123978991 ZAQPVGBQQCRIRY-LLVKDONJSA-N 274.320 2.167 10 20 CECD CN(CCc1nccs1)C(=O)c1c(F)ccc(O)c1O 789993483 DPOKXDJOPQEFFY-UHFFFAOYSA-N 296.323 2.008 10 20 CECD COC(=O)[C@@H]1CC[C@H](N[C@@H](C)c2ccccc2O)C1 895459734 HNBOMDFUJUJMDN-TUAOUCFPSA-N 263.337 2.385 10 20 CECD CCc1nnc(N(C)Cc2ccccc2O)nc1CC 276966333 FBFFGIKRLUKFMA-UHFFFAOYSA-N 272.352 2.338 10 20 CECD C[C@@H](NCc1cnc[nH]1)c1ccc(N2CCOCC2)cc1 796451234 UPQSJCPOEAZJML-CYBMUJFWSA-N 286.379 2.097 10 20 CECD CCN(CC)CCSCC(=O)N(C)c1ccc(N)cc1 88733766 JODLGNBRGJQTCU-UHFFFAOYSA-N 295.452 2.307 10 20 CECD CN(C)[C@@H]1CCCC[C@@H]1NCc1cc(F)ccc1O 1320161968 ULOFAQRLEYEJHJ-UONOGXRCSA-N 266.360 2.494 10 20 CECD COc1ccc2c(c1)CCCCN2C[C@H]1CN(C)C(=O)O1 1324941531 SDXUOWVJIKIUHC-CQSZACIVSA-N 290.363 2.289 10 20 CECD Cc1c([C@H](C)NCc2cc(F)ccc2O)cnn1C 226584578 FXXGIUWLVYKBKW-VIFPVBQESA-N 263.316 2.424 10 20 CECD C[C@@H](CC(=O)NCc1ccccc1O)[C@@H]1CCCNC1 228423516 ZQGSEDRNSQLXEA-QWHCGFSZSA-N 276.380 2.034 10 20 CECD C[C@H](NCc1cccnc1)c1cc(C(=O)O)ccc1O 1593305642 ZHLTUJDWJJBIGB-JTQLQIEISA-N 272.304 2.336 10 20 CECD Cc1cnccc1CCNC(=O)N(C)Cc1ccccc1O 163937402 ANUWCZKZDSRCRI-UHFFFAOYSA-N 299.374 2.480 10 20 CECD Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)oc1C 45373754 WJDKMPMCRDGFHG-UHFFFAOYSA-N 275.304 2.280 10 20 CECD COc1cccc(CN[C@@H]2CSC[C@H]2C)c1O 285375260 CMKCZLQYFQKBHU-MWLCHTKSSA-N 253.367 2.242 10 20 CECD CC[C@@H](CN[C@H](C)c1cc(OC)ccc1O)OC 290036187 DFJISMDBSDWOHG-MNOVXSKESA-N 253.342 2.476 10 20 CECD CCOCC(C)(C)CNC(=O)Nc1ccc(N)cc1 311413273 CONVBYAJYMXDRU-UHFFFAOYSA-N 265.357 2.453 10 20 CECD CCc1cccc(CNCCN(C)C(C)C)c1O 691483727 QXNVUJDXNLLPSO-UHFFFAOYSA-N 250.386 2.384 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@]2(C)CCOC2)c1 397117926 JYCGYJHRZLWNEQ-ABAIWWIYSA-N 265.353 2.478 10 20 CECD OC[C@@H](C[C@@H]1CCCO1)NCc1cc(Cl)ccc1O 886229734 VBCQTNPMWJNZAJ-OLZOCXBDSA-N 285.771 2.065 10 20 CECD CC[C@H](C)[C@@](C)(O)CNCc1cc2c(cc1O)OCO2 112380128 VFVSSMSWRNQPDJ-BONVTDFDSA-N 281.352 2.008 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N[C@H]3CCNC3)c2C)c1 127220009 UTXYHCDWZZENCO-HNNXBMFYSA-N 297.402 2.494 10 20 CECD Cc1ccc(NC(=O)NCCc2ccc(O)c(O)c2)nc1 184320040 FJQIXNSGARQFOV-UHFFFAOYSA-N 287.319 2.165 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2ccc(F)cc2O)C1 185787820 KPJTWTIUUOIADM-PWSUYJOCSA-N 280.343 2.193 10 20 CECD Cc1ccc(-n2cc(C(=O)Nc3ccc(N)cc3)nn2)cc1 237833671 OZVVVCUONYBBPF-UHFFFAOYSA-N 293.330 2.410 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccccc2O)cc(O)n1 180603136 OAUPBHOHHDKHRL-UHFFFAOYSA-N 272.304 2.073 10 20 CECD Cc1ccc(C(=O)N2C[C@H](C3CC3)O[C@H](C)C2)c(O)c1O 279590390 APEJMQNADILVOF-ZWNOBZJWSA-N 291.347 2.046 10 20 CECD CCCN(CC)CC(=O)NCc1ccc(N(C)C)cc1 270675874 BIJQFXLHBQLMQB-UHFFFAOYSA-N 277.412 2.101 10 20 CECD CC[C@@H](NC[C@H](O)COC)c1cccc(Cl)c1O 287854333 WYYXHHFUTZBPCL-JOYOIKCWSA-N 273.760 2.094 10 20 CECD CC(=O)C(=O)COC(=O)c1cc2cc(F)ccc2s1 808490145 BOLSDOUVGHVAIK-UHFFFAOYSA-N 280.276 2.355 10 20 CECD Oc1ccc(Cl)cc1CN1CCC[C@H]2CNC[C@H]21 299919364 MEZLLTDIJYJICK-GXFFZTMASA-N 266.772 2.229 10 20 CECD C[C@@H](NC[C@H]1CNC(=O)C1)c1ccc2ccccc2c1O 398338356 JLCRFZYAPUBQCZ-NEPJUHHUSA-N 284.359 2.332 10 20 CECD CCNC(=O)CN(C)Cc1ccc2ccccc2c1O 816494100 YGCBZFVYKFKTPB-UHFFFAOYSA-N 272.348 2.113 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)[C@@H](O)c1ccccc1 811539567 RDKDMQOZLMTXJV-TVQRCGJNSA-N 277.345 2.306 10 20 CECD COC[C@](C)(O)CNCc1ccc2ccccc2c1O 816549059 BQSRJWKVKWXLCZ-MRXNPFEDSA-N 275.348 2.032 10 20 CECD CCn1ncnc1CNCc1cc(Cl)c(F)cc1O 816596811 ROOJSIISHXAVBG-UHFFFAOYSA-N 284.722 2.086 10 20 CECD CCN(CC)c1ccc(CN(C)CC[S@@](C)=O)cc1 827336584 JUFNBKQLGNDLBU-LJQANCHMSA-N 282.453 2.343 10 20 CECD Cc1ccc(CNCc2cc([N+](=O)[O-])ccc2O)o1 725851873 ZQKNTMACZLHAQF-UHFFFAOYSA-N 262.265 2.492 10 20 CECD C[C@@H](NC[C@H]1CCNC(=O)CC1)c1ccc(N(C)C)cc1 828960332 UGDJWVNCQHFCLL-ZIAGYGMSSA-N 289.423 2.320 10 20 CECD CC(C)CCN(C)C(=O)c1c(F)ccc(O)c1O 825432625 MTMIAENSJVNENW-UHFFFAOYSA-N 255.289 2.355 10 20 CECD O=C(c1cc(O)cs1)N1C[C@]2(CCCO2)[C@@H]1C1CC1 832926970 JQYSRXKAXDCMBC-GXTWGEPZSA-N 279.361 2.237 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnc(C3CC3)nc2O)c1 913000882 YSGJNTUALGQSJI-UHFFFAOYSA-N 299.330 2.004 10 20 CECD CCc1cccc(CN2C[C@H](C)O[C@@H](COC)C2)c1O 848905153 HVTVLUBQZGOPQU-SWLSCSKDSA-N 279.380 2.190 10 20 CECD CCOc1cccc(CN[C@@H](CCN)C(F)(F)F)c1O 841089856 AYSLQXMBXYJHJB-NSHDSACASA-N 292.301 2.160 10 20 CECD N[C@H]1Cc2ccccc2N(Cc2ccccc2O)C1 841106650 NJSWNYFMLZZDAW-AWEZNQCLSA-N 254.333 2.282 10 20 CECD CCN(C(=O)/C=C/c1cnc(C)s1)c1cnn(C)c1 848342974 WUKARQBTYBQRRH-AATRIKPKSA-N 276.365 2.251 10 20 CECD Oc1cc2c(cc1CNC[C@@H]1C[C@H]3C=C[C@H]1C3)OCO2 1335133303 GZIJIGLODKIBOW-SRVKXCTJSA-N 273.332 2.423 10 20 CECD CN1CC[C@@H]2CN(Cc3cc4c(cc3O)CCCC4)C[C@@H]21 840133836 UIMKFCQDTGZGIT-WBVHZDCISA-N 286.419 2.407 10 20 CECD c1cc2c(cc1CNCCOC[C@@H]1CCOC1)CCCO2 921721445 IRFVEXKPAATITR-OAHLLOKOSA-N 291.391 2.154 10 20 CECD COCC[C@](C)(O)CN[C@@H](C)c1cc(F)cc(F)c1O 756585604 KZTRVYOBLXVCBB-XPTSAGLGSA-N 289.322 2.109 10 20 CECD CCOc1ccc(CNC2COC(C)(C)OC2)c(O)c1 758010905 WJNBYTDAMOUZEW-UHFFFAOYSA-N 281.352 2.032 10 20 CECD C[C@@H](NC1CCN(C)CC1)c1cc(F)cc(F)c1O 756360230 GMXVKHADTRQXAF-SECBINFHSA-N 270.323 2.415 10 20 CECD C[C@H]1C[C@H]1C(=O)NCc1cccc(Br)c1O 765754799 WRFQPSXVZUWNDO-IONNQARKSA-N 284.153 2.427 10 20 CECD Nc1ccc(CC(=O)Nc2cc(CC3CC3)[nH]n2)cc1 871018048 ASKBYXUCKLNICE-UHFFFAOYSA-N 270.336 2.126 10 20 CECD CC[C@@H](NCc1nonc1C)c1ccc(F)cc1O 872137806 WTTLFBBUSHPNTG-LLVKDONJSA-N 265.288 2.464 10 20 CECD CN(C)c1ccc(CN=c2cc[nH]cc2F)cc1F 775484449 WYHVUMURYUETHH-UHFFFAOYSA-N 263.291 2.460 10 20 CECD O=C(Cc1cccnc1)Nc1c(Cl)ccc2nonc12 1117507600 QQKDWTMEBDAESP-UHFFFAOYSA-N 288.694 2.452 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CCC[C@@H]1OC 774828511 CQLDPMDJIWFPLN-FZMZJTMJSA-N 265.353 2.306 10 20 CECD C[C@H](CCC(=O)O)NCc1cc(F)c(N(C)C)cc1F 1118920287 OOEPHXZKVWEPNJ-SECBINFHSA-N 286.322 2.374 10 20 CECD CC(=O)NC[C@@H]1CCCCN1Cc1cc(C)ccc1O 877676074 XVFHZKVEZXJMCC-HNNXBMFYSA-N 276.380 2.191 10 20 CECD COCc1ccccc1S(=O)(=O)Nc1ccc(O)cc1 778557219 VKYGLCZGYRYGSE-UHFFFAOYSA-N 293.344 2.339 10 20 CECD C[C@@H](N[C@H]1CC[C@H](O)CC1)c1c(O)cccc1F 886554718 AURVVORFDSDSRN-GMTAPVOTSA-N 253.317 2.485 10 20 CECD COc1ccc(O)c(CNCCCn2ccnc2C)c1 271971977 CJYLUOLFYIUMER-UHFFFAOYSA-N 275.352 2.086 10 20 CECD Cc1coc(C)c1C(=O)NCc1ccc(O)c(O)c1 786408271 HLQHXHYSTWOVGE-UHFFFAOYSA-N 261.277 2.238 10 20 CECD C[C@@H]1NC(=O)[C@H](C)N(Cc2cc(Cl)ccc2O)[C@@H]1C 895113739 KDCPPPUASINNGI-AEJSXWLSSA-N 282.771 2.143 10 20 CECD CCOc1cccc(NC(=O)c2cccc(O)c2O)n1 790838029 BXKCVJAKAHIQQD-UHFFFAOYSA-N 274.276 2.144 10 20 CECD O=C(O)[C@H]1[C@@H](CNCc2cc(Cl)ccc2O)C1(F)F 715276166 APCCOTDWIASCOD-PSASIEDQSA-N 291.681 2.101 10 20 CECD CC[C@@H]1CN(C(C)=O)[C@H](CC)CN1Cc1ccc(N)cc1 1336116963 JJOANUVVXQRVEU-IAGOWNOFSA-N 289.423 2.490 10 20 CECD COCCC1(NC(=O)NCc2ccc(N)cc2)CCC1 1262603674 QZDYUAHBVDVRBY-UHFFFAOYSA-N 277.368 2.027 10 20 CECD Cc1cccc(CN2C[C@@H](C)[C@H](CC(=O)O)C2)c1O 1600533420 QNOLURRCECPJHP-DGCLKSJQSA-N 263.337 2.243 10 20 CECD COc1ccc(O)c(CNCC[C@@H]2CCCCO2)c1 227521978 GXHUUAQQXUMHTH-ZDUSSCGKSA-N 265.353 2.450 10 20 CECD CCOc1cccc(CNCCC[C@@H](C)CO)c1O 230159852 XSICSHWPOXDXNU-GFCCVEGCSA-N 267.369 2.289 10 20 CECD COc1ccc(CNc2ccc(C(=O)O)cn2)c(O)c1 1599573966 UEFYMXOOOINHHC-UHFFFAOYSA-N 274.276 2.106 10 20 CECD CC(=O)c1cc(F)cc(CN2CCO[C@@H](C)[C@@H]2C)c1O 156367534 RFURAEGLFNIJKG-ONGXEEELSA-N 281.327 2.343 10 20 CECD CCOC(=O)[C@@H](C)N[C@H](C)c1cc(OC)ccc1O 49368150 WDZZJJUFHLWWDS-NXEZZACHSA-N 267.325 2.003 10 20 CECD COc1ccc(CNCCN(C)C(C)C)cc1C 54111358 LJYNRKFENUKGTJ-UHFFFAOYSA-N 250.386 2.433 10 20 CECD Cc1cccc(CN2CCC[C@H](Cn3ccnn3)C2)c1O 180773503 HSRSUXHMHMKIME-AWEZNQCLSA-N 286.379 2.204 10 20 CECD COc1ccc(C)nc1NC(=O)c1cccc(O)c1O 187161325 MKTXGCBMGAOPBJ-UHFFFAOYSA-N 274.276 2.062 10 20 CECD CCN(CC)c1ccc(CNCCCC(=O)O)cc1 37417322 VWGVKDKVPRFURY-UHFFFAOYSA-N 264.369 2.487 10 20 CECD CCN(Cc1cc(C)ccc1O)C[C@H](O)C(F)(F)F 189880866 NFBDIZHDAOYGSU-LBPRGKRZSA-N 277.286 2.446 10 20 CECD CN(C)C1(CNC(=O)Cc2ccc(N)cc2)CCCCC1 40803309 WLODXOKPUXOPLM-UHFFFAOYSA-N 289.423 2.192 10 20 CECD CC(=O)CC(C)(C)CC(=O)NCc1ccc(O)c(O)c1 191923633 OFZAZPVYNGPETO-UHFFFAOYSA-N 279.336 2.109 10 20 CECD CC(C)C(=O)NCCN[C@H](C)c1ccc(F)c(F)c1O 191184852 KYBLXYPBJSAVTJ-SECBINFHSA-N 286.322 2.093 10 20 CECD CCN(CC)c1ccc(CNC(=O)NCCCCO)cc1 194273038 IYZWRSKWNWPJLO-UHFFFAOYSA-N 293.411 2.105 10 20 CECD Cc1ccc(O)c(CN(CCCO)CC(F)(F)F)c1 93044607 RTKQAXYMRPTNBU-UHFFFAOYSA-N 277.286 2.447 10 20 CECD Nc1ccc(NC(=O)c2cn(Cc3ccccc3)nn2)cc1 238036594 FHCIXAJSDPDAKN-UHFFFAOYSA-N 293.330 2.161 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cc(F)ccc2O)C1 180225235 OAZOTJRRSGBDTF-GFCCVEGCSA-N 266.360 2.305 10 20 CECD CCOc1ccc(O)c(CN2CCO[C@H](C)[C@@H]2C)c1 93418580 JRWBECZBIGKORI-NWDGAFQWSA-N 265.353 2.400 10 20 CECD CCN1CCCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 267437016 AMKOCFWCKITIQT-UHFFFAOYSA-N 294.370 2.262 10 20 CECD COC[C@H](CN[C@H](C)c1cc(Cl)ccc1O)OC 273478233 TXKLIWMSBLXKRB-KOLCDFICSA-N 273.760 2.358 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)[C@H]2CCOC2)c1 271842462 RDZBTHDBFOTLBM-RYUDHWBXSA-N 265.353 2.306 10 20 CECD C[C@@H]1[C@@H](C)[S@](=O)CCN1Cc1ccc(N(C)C)cc1 271196723 OAABMCWMIRXIPT-VLXJIEOASA-N 280.437 2.094 10 20 CECD Oc1cccc(Cl)c1CNCCC1(O)CCOCC1 285642310 XWBXAUYQVSDQSL-UHFFFAOYSA-N 285.771 2.067 10 20 CECD Oc1cccc2c1[C@H](NCCCO[C@@H]1CCOC1)CC2 297540145 DYWBIMHDKVUDBG-ZIAGYGMSSA-N 277.364 2.165 10 20 CECD C[C@H](C(=O)O)N(C)Cc1cc(C(C)(C)C)cc(O)c1O 817779116 AIEXGWLAZQBTDV-SECBINFHSA-N 281.352 2.300 10 20 CECD C[C@@H](NC[C@]1(C)CCCNC1)c1cc([N+](=O)[O-])ccc1O 817965792 CISCEAJOBLOGJQ-IAQYHMDHSA-N 293.367 2.341 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CC[C@H]3CNC[C@H]3C1)CC2 817985573 FPCIBZVLIUYVMA-GBJTYRQASA-N 272.392 2.357 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H]2CNCCCO2)c(O)c1 817981905 OIUGOSWZPSSULL-KBPBESRZSA-N 278.396 2.038 10 20 CECD Cc1noc(C2CN(Cc3ccc(N(C)C)cc3)C2)n1 839130992 LGHVHENTCGKVHM-UHFFFAOYSA-N 272.352 2.043 10 20 CECD O=C1CCC[C@H]1[C@H]1CCCN1C(=O)c1cc(O)cs1 831433367 FXIAAIXJNBOVSY-WDEREUQCSA-N 279.361 2.428 10 20 CECD CC(C)[C@@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841095324 DRZYZIHXAULIHS-GFCCVEGCSA-N 289.379 2.102 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@H]1CC12CCNCC2 841079239 KGZBFHRLGNFYBT-LBPRGKRZSA-N 284.762 2.416 10 20 CECD CCN(Cc1ccccn1)C(=O)NCCc1ccc(N)cc1 841957430 JVAPBZHHRNPJSR-UHFFFAOYSA-N 298.390 2.438 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)C[C@@H](C)O 840936506 KKXZDKFMQNWTMY-CHWSQXEVSA-N 250.386 2.310 10 20 CECD COC(=O)COc1ccc(N(C)CCNC(C)(C)C)cc1 841020027 HUNCABNWMHODIX-UHFFFAOYSA-N 294.395 2.063 10 20 CECD CCOC1CC(O)(CNCc2ccc(N(C)C)cc2C)C1 840940527 DPRAYZMMTLJNNT-UHFFFAOYSA-N 292.423 2.081 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@](C)(CN)C(C)C)c1O 843355931 NBNNAHNEGAVLMJ-HNNXBMFYSA-N 282.359 2.197 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)c2ccco2)c1 743412709 LOHGUGQKAFWEJT-JTQLQIEISA-N 275.304 2.414 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CS[C@H](C)C2)c(O)c1 840413291 GQBVRTYWPVSFRV-KOLCDFICSA-N 296.392 2.094 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](CCO)C1CC1 840934885 XIYGFKVIKBPNQX-INIZCTEOSA-N 262.397 2.312 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)[C@@H](C)CN)cc1 841717873 NSFMWLZYLIILFX-ZDUSSCGKSA-N 292.427 2.021 10 20 CECD Nc1ccc(CCNC(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)cc1 841860086 AEHARNBJYMJSJE-DDHJSBNISA-N 285.391 2.155 10 20 CECD Cc1cc(C(=O)N[C@H]2COC[C@H]2C)c(C)n1-c1ccccn1 928891259 FMDNBNKOEQLCOY-ABAIWWIYSA-N 299.374 2.254 10 20 CECD Clc1cnc(SC[C@@H]2COCCO2)s1 850000095 JGDILIBTFVLXEU-LURJTMIESA-N 251.760 2.304 10 20 CECD CC(C)OCCOC(=O)/C=C\c1ccc(O)c(O)c1 759598770 YGPFUWRFBCKSAS-XQRVVYSFSA-N 266.293 2.079 10 20 CECD CCC[C@H](O)C(=O)N(CCC)Cc1ccccc1O 934706924 UQIXAVRLOFKUBR-AWEZNQCLSA-N 265.353 2.292 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1CSC1 865904239 LASIATFLZXUFCU-UHFFFAOYSA-N 264.394 2.040 10 20 CECD CCC[C@@H](OCC)C(=O)NCc1cccc(OC)c1O 860241470 RSFYVUPCKIWHOE-CYBMUJFWSA-N 281.352 2.222 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(C)CC1 760492836 UIOLFCXIAKEAQB-SNVBAGLBSA-N 263.337 2.335 10 20 CECD CCOC(=O)CCN(Cc1c(O)cccc1OC)C1CC1 769121197 DQIPYQCDBAUDKF-UHFFFAOYSA-N 293.363 2.318 10 20 CECD CC(C)C[C@H](CN)CC(=O)N(C)c1ccc(N)cc1 877074825 SPTAQYIFNXFVGM-LBPRGKRZSA-N 263.385 2.243 10 20 CECD Cc1cnn(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)c1 773013152 JCCBVSAYAKAGFA-CYBMUJFWSA-N 286.379 2.135 10 20 CECD CC(C)COC[C@@H](O)CN[C@@H](C)c1c(O)cccc1F 886511018 GMXYSTMOYSUIHT-RYUDHWBXSA-N 285.359 2.215 10 20 CECD C/C=C(\CC)C(=O)OCC(=O)c1ccc(O)c(O)c1 784907392 ZGMQHEBMEGWUTC-YCRREMRBSA-N 264.277 2.180 10 20 CECD COc1cc(C)cc(CN(C[C@H](C)O)C2CC2)c1O 895193396 XLFFZIKIFLUOAL-NSHDSACASA-N 265.353 2.054 10 20 CECD COc1ccc(CNC[C@@H]2CCC[C@@H]2OC)c(O)c1OC 893285321 NATCHUWBJIPYSX-AAEUAGOBSA-N 295.379 2.314 10 20 CECD C[C@@H]1CC[C@@H](C)N1CC(=O)N(C)c1ccc(N)cc1 706291738 SAEMOLVLXQAZOH-VXGBXAGGSA-N 261.369 2.104 10 20 CECD COc1ccc(CNC(=O)NCCC2CCC2)c(O)c1 792992645 QDJRVTHUBNKWAH-UHFFFAOYSA-N 278.352 2.390 10 20 CECD COc1ccc(CNC(=O)N[C@H](C)CCSC)c(O)c1 792952332 XYEKDSTTYMIZOT-SNVBAGLBSA-N 298.408 2.342 10 20 CECD CN1CCN(c2ccc(CN3CC[C@@H](F)C3)cc2F)CC1 1324661592 FQFFUDDIZISJFF-CQSZACIVSA-N 295.377 2.121 10 20 CECD O=C(NC1CC1)[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 1320720888 LWTPSTMGYPQSOQ-LLVKDONJSA-N 292.354 2.022 10 20 CECD CCC[C@H](C)S(=O)(=O)NCc1cc(C)ccc1O 1348157161 PLOGJWFUAARTFQ-NSHDSACASA-N 271.382 2.309 10 20 CECD Cc1cnn(CC(=O)Nc2c(Cl)ccc3nonc23)c1 1342953151 UGWDPHJOFSMACX-UHFFFAOYSA-N 291.698 2.020 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)Cc1cn(C)nn1 1347344895 HOYGAMUVFBYSPJ-UHFFFAOYSA-N 285.395 2.047 10 20 CECD CC[C@@H]1CN(C(=O)NCc2ccc(N)cc2)CCS1 1357791007 HFNSVSVPAPGWNZ-CYBMUJFWSA-N 279.409 2.306 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CO[C@H](C)C2)c1 402305798 KFDIEAYTLJVPEN-OUAUKWLOSA-N 251.326 2.229 10 20 CECD Cc1noc(C)c1CCC(=O)N(C)c1ccc(N)cc1 702126451 PLDQIPBCIWNMFL-UHFFFAOYSA-N 273.336 2.469 10 20 CECD CC[C@H]1CCCCN1C(=O)CN(C)c1ccc(N)cc1 702068723 CMTNPTPMCLZJIC-AWEZNQCLSA-N 275.396 2.496 10 20 CECD OC[C@H](CC1CC1)NCc1cc(Cl)ccc1O 754835808 WUGUEHHQMKFSCS-LBPRGKRZSA-N 255.745 2.296 10 20 CECD CCn1ccnc1CN1CCOc2cc(N(C)C)ccc21 175026165 QJGLLBHLGCYVST-UHFFFAOYSA-N 286.379 2.368 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CCC[C@@H]2C)c1 114596464 ALFPHOOLWTZXSO-GWCFXTLKSA-N 278.352 2.389 10 20 CECD CC[C@@H](C)[C@@H](C)C(=O)NCc1ccc(O)c(O)c1 182838027 SWCRKBDFZGXISP-NXEZZACHSA-N 251.326 2.396 10 20 CECD CSC[C@@H](CCO)N[C@H](C)c1ccc(C)cc1O 185530671 SANWJUCVFRHXRJ-VXGBXAGGSA-N 269.410 2.465 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)Nc1ncc(F)cn1 184147795 PEODLZSLQVFFKT-MRVPVSSYSA-N 263.272 2.070 10 20 CECD CC(C)[C@H](N)CCN(C)Cc1cc(F)ccc1O 220327229 DUQLOBMURDJFMV-CYBMUJFWSA-N 254.349 2.337 10 20 CECD CNC(=O)C(C)(C)CNCc1ccc(N2CCCC2)cc1 227604797 GYTLIIIVLHEOQH-UHFFFAOYSA-N 289.423 2.149 10 20 CECD CCc1noc(CC)c1CNC(=O)Cc1ccc(N)cc1 237082150 HAWKSGXKAMIKOD-UHFFFAOYSA-N 287.363 2.241 10 20 CECD C[C@H](O)[C@H]1CCCCN1Cc1ccc(N(C)C)cc1 92971143 QXEVBMPBHNAJEH-XJKSGUPXSA-N 262.397 2.488 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC1(C)CCOCC1 267862280 STKOYLXKCNNUAK-UHFFFAOYSA-N 292.379 2.350 10 20 CECD Cn1ccnc1[C@H]1CCN(Cc2ccccc2O)C1 368131663 BDWKAAXSXKARIE-ZDUSSCGKSA-N 257.337 2.115 10 20 CECD COC(=O)N1CCC(N[C@H](C)c2cc(F)ccc2O)CC1 273376081 HHUBEUWUENHTAY-SNVBAGLBSA-N 296.342 2.413 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CCO1 271039946 MGVZVLWHGOICEW-LLVKDONJSA-N 252.333 2.112 10 20 CECD OC[C@@]1(NCc2cc(F)ccc2O)CCc2ccccc21 378489873 CRHDMQJXFBNBFX-KRWDZBQOSA-N 287.334 2.455 10 20 CECD CC[C@@H](NC[C@@H](O)CN1CCCC1)c1ccc(C)cc1O 280117720 OCLLFHRNMZWVNN-GDBMZVCRSA-N 292.423 2.198 10 20 CECD CCOc1ccc(N(CC)C[C@@H](O)CN(C)C2CC2)cc1 289402690 SUAFLRLJSGTPJY-INIZCTEOSA-N 292.423 2.367 10 20 CECD COc1ccc(O)c(CNC[C@H](O)Cc2ccccc2)c1 289973043 ZHFLZJGSZQMACO-OAHLLOKOSA-N 287.359 2.094 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@](F)(CO)C2)cc1 802660782 WGXCVVNVGKLYDQ-INIZCTEOSA-N 280.387 2.439 10 20 CECD Cc1cc(C)c([C@H](C)NCCCc2cnn(C)n2)c(O)c1 293646158 HOCZWHVAJHKCEB-ZDUSSCGKSA-N 288.395 2.421 10 20 CECD CC(C)(C)N1C[C@@H](N[C@H]2CCc3cccc(O)c32)CC1=O 296275282 CARHCBOTSOTCSF-STQMWFEESA-N 288.391 2.369 10 20 CECD COCCN1CCC(N[C@H]2CCc3cccc(O)c32)CC1 296224413 ZYDBFXKJJGOWGL-HNNXBMFYSA-N 290.407 2.080 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)NOCC1CC1 297200948 DHSISTSUZUSVSZ-UHFFFAOYSA-N 290.363 2.412 10 20 CECD C[C@H](NC[C@H]1CCCNC1)c1ccc(N(C)C)cc1 817946159 SRKYJKAKMOZYEQ-KBPBESRZSA-N 261.413 2.403 10 20 CECD CCNCCCNC1CCN(c2ccc(OC)cc2)CC1 817944124 XXHIJRYCUMVMEZ-UHFFFAOYSA-N 291.439 2.253 10 20 CECD CC(C)(O)c1cnc(NC(=O)c2cc(O)cs2)s1 811617242 BRECSEOROVAECR-UHFFFAOYSA-N 284.362 2.390 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)cc1 817977089 AVEBVDBYBXQOHH-DANNLKNASA-N 259.397 2.011 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCO[C@H](C)C1 819761688 ZIEAGLHXBIDFEL-VXGBXAGGSA-N 298.379 2.309 10 20 CECD CN(C)C(=O)CNCc1cc(-c2ccccc2)ccc1O 725841999 VJKZKLFSISTYDK-UHFFFAOYSA-N 284.359 2.237 10 20 CECD CN1CCCc2cc(CN[C@@H]3CCC[C@H]3CN)ccc21 817901872 YWHFYHJHDXSUFA-JKSUJKDBSA-N 273.424 2.286 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C)n2cccn2)c1 729534992 HGDGDRZLCNNYRH-WDEREUQCSA-N 289.335 2.036 10 20 CECD CCN(CCC(=O)O)Cc1cc(F)cc(C(C)=O)c1O 829701511 AKWOTWVSUDBDKW-UHFFFAOYSA-N 283.299 2.031 10 20 CECD CN(C)c1ccc(/C=C/CN[C@@H](CC(F)F)C(=O)O)cc1 901811775 HKEBFYOLRDTGIX-OOPCZODUSA-N 298.333 2.464 10 20 CECD Cc1cc(O)c(CN2CCCN(C=O)CC2)cc1Cl 827867411 HRGUPVLSQOTMSM-UHFFFAOYSA-N 282.771 2.018 10 20 CECD CCOc1ccc(CN(CC(F)F)C[C@@H](C)O)c(O)c1 825098289 FWVPLCKJAAWUFK-SNVBAGLBSA-N 289.322 2.239 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)[C@@H](C)N)cc1 826020705 WYQXXMWUWIGVKB-ZIAGYGMSSA-N 291.439 2.475 10 20 CECD Cc1cccc(CN(CCOCCO)C2CCC2)c1O 827204309 QUYBXPOPNMYKPL-UHFFFAOYSA-N 279.380 2.064 10 20 CECD C[C@@H]1NCCN(Cc2cc(Cl)cc(F)c2O)[C@H]1C 843056846 AUHINIGQPNBLSY-IUCAKERBSA-N 272.751 2.367 10 20 CECD C[C@@H]1CN=C(NCc2cc(Cl)cc(Cl)c2O)N1 849028163 DAXHSSZLNQDYQF-ZCFIWIBFSA-N 274.151 2.136 10 20 CECD N[C@H]1CCCO[C@H]1C1CCN(Cc2ccccc2O)CC1 841100093 UKZHDDCFTGYOLX-RDJZCZTQSA-N 290.407 2.111 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C2CCC(N)CC2)c1O 843354225 ZUBDTIKBQZRJLG-UHFFFAOYSA-N 294.370 2.436 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cccnc1C1CC1 752595949 IWHXVIHJJJCSEZ-UHFFFAOYSA-N 298.342 2.343 10 20 CECD C[C@H]1CN(CCN[C@H](C)c2cc(Cl)ccc2O)CCO1 756544547 KDTYWIQAEJZKIF-NWDGAFQWSA-N 298.814 2.417 10 20 CECD CCc1nc(C(=O)NCc2cc(C)ccc2O)co1 862757272 NKZORODJVLMGCY-UHFFFAOYSA-N 260.293 2.181 10 20 CECD CCCCN(CCOC)Cc1cc2c(cc1O)OC[C@H]2O 768450550 KGKMNPVRMWXIGG-OAHLLOKOSA-N 295.379 2.067 10 20 CECD CC[C@H](C)CN(C)Cc1cc2c(cc1O)OC[C@H]2O 768444401 AUOSGEKOHYULEF-IINYFYTJSA-N 265.353 2.296 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccccn1 779493282 MTYJSDUOINOALO-ALCCZGGFSA-N 256.261 2.145 10 20 CECD OCC1(NCc2cc(Cl)cc(F)c2O)CCC1 777441477 SXMWBCZUIXSVKH-UHFFFAOYSA-N 259.708 2.189 10 20 CECD CC(C)Cn1ncnc1CN[C@H](C)c1ccccc1O 879649010 HEAHVHGFZHONLR-GFCCVEGCSA-N 274.368 2.491 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)CC(C)(C)N 1118380175 RQKIOIVMHZBJRN-UHFFFAOYSA-N 261.413 2.456 10 20 CECD CO[C@]1(C)C[C@H](NC(=O)NCc2ccc(N)cc2)C1(C)C 1120611342 QVCBSMQPPCCOHT-XJKSGUPXSA-N 291.395 2.272 10 20 CECD CCC[C@H](N)c1cn(Cc2ccc(N(C)C)cc2)nn1 881272151 ODQYKKCBXBFJHH-AWEZNQCLSA-N 273.384 2.192 10 20 CECD CCN(Cc1ccncc1)C(=O)c1ccc(C)c(O)c1O 780918166 XZTSONFAGXHQJC-UHFFFAOYSA-N 286.331 2.464 10 20 CECD COc1cccc(CNCc2cccc(OC)c2O)n1 105460054 UYRUDIXOCSHGNP-UHFFFAOYSA-N 274.320 2.094 10 20 CECD Cc1cccc(C[C@@H](CO)NC(=O)c2cc(O)cs2)c1 788006073 RIUYWSGTICZMNB-LBPRGKRZSA-N 291.372 2.096 10 20 CECD CCOc1ccc(CN[C@H](C)c2n[nH]c(C)n2)c(O)c1 894771426 ISQNRLBNHBWKIH-SECBINFHSA-N 276.340 2.068 10 20 CECD Oc1ccc(Cl)cc1CN1CCOC2(CCOCC2)C1 91895199 ZXJUZPDHCFEAHS-UHFFFAOYSA-N 297.782 2.427 10 20 CECD CN(CCN(C)C1CC1)Cc1cc(F)cc(F)c1O 894777923 WNHRRZKHHQMACX-UHFFFAOYSA-N 270.323 2.196 10 20 CECD C[C@H](N[C@H]1CCCN(C)C1=O)c1ccc(N(C)C)cc1 704370987 JFLJFPXRXNYNAY-WFASDCNBSA-N 275.396 2.024 10 20 CECD CC(C)(C)c1cc(O)c(O)c(CN2CCO[C@H]3C[C@@H]32)c1 793620165 NPGXJTQUTJCLDV-JSGCOSHPSA-N 277.364 2.368 10 20 CECD OCC[C@H](NCc1c(O)ccc(Cl)c1F)C1CC1 790971055 JUNMRFXPWGITQO-NSHDSACASA-N 273.735 2.435 10 20 CECD C[C@H](CCO)N(C)Cc1ccc(N2CCCC2)cc1 1329630636 JSUFJRZBYOBVGA-CQSZACIVSA-N 262.397 2.490 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@@H](CCC(=O)O)C2)cc1 1601216460 BXIMYPVRFHKXIE-NSHDSACASA-N 291.351 2.378 10 20 CECD Cc1oncc1CSc1ncc(C(=O)O)s1 1608058427 MBKWSAQQSWMAAQ-UHFFFAOYSA-N 256.308 2.430 10 20 CECD Cc1nc(N2Cc3cccc(O)c3C2)sc1C(=O)O 1594456748 JYLQLRFVMBJFIT-UHFFFAOYSA-N 276.317 2.376 10 20 CECD Cc1nc(CNCc2ccc(C(=O)O)cc2O)cs1 1777502353 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2.163 10 20 CECD C[C@@H]1SCC[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 825602884 OHJWREXXECQWIX-SMDDNHRTSA-N 293.436 2.446 10 20 CECD Cc1ncc2n1CC[C@@H](C(=O)N[C@H](C)c1ccccc1O)C2 827946459 IOFRUYDBVNYJAY-DGCLKSJQSA-N 299.374 2.337 10 20 CECD CC[C@@](C)(CNC(=O)/C=C\c1ccc(O)c(O)c1)OC 836824410 YGZKAKOTOMJVFH-LYASGUKUSA-N 279.336 2.042 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H]2CC(=O)O)cc1C 832900261 VRTJISBDJSGXOQ-CYBMUJFWSA-N 263.337 2.448 10 20 CECD N[C@H]1CCC[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 841055736 VJBOLBNDSODDHK-QWRGUYRKSA-N 299.758 2.313 10 20 CECD CCOc1ccc(O)c(CN(CC(=O)O)C2CCC2)c1 848640574 SDBLRPCPAYCOCS-UHFFFAOYSA-N 279.336 2.230 10 20 CECD COc1cccc(O)c1CN[C@@H](C)CCCCN 841080527 SBCRUHQBQDBLON-NSHDSACASA-N 252.358 2.008 10 20 CECD C[C@@H](N[C@H](CO)CCF)c1ccc(Cl)cc1O 846209984 VEPJRASIVAFROI-SCZZXKLOSA-N 261.724 2.417 10 20 CECD C(=C/c1cnccn1)\c1ccc(N2CCOCC2)cc1 849247100 ZAHRSANMIMKSMB-DAFODLJHSA-N 267.332 2.484 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC(CN)CC2)c1O 843345158 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Cc1cc(O)c(CNC[C@H](C)CCO)cc1Cl 825320348 JDZAXYUUVQIMBX-SECBINFHSA-N 257.761 2.462 10 20 CECD O=C(O)[C@@H]1CN(Cc2cccc(F)c2O)C[C@H]1C1CC1 904429852 PEJVZQWRQGPUJP-NWDGAFQWSA-N 279.311 2.074 10 20 CECD O=C(O)[C@@H](C(=O)NCc1c(O)cccc1F)C1CCCC1 902854263 ZYVFTQGPZORKAZ-CYBMUJFWSA-N 295.310 2.039 10 20 CECD Cc1ccc(C(=O)OC[C@@H]2C[C@H]3CC[C@H]2O3)c(O)c1O 837491157 XFRIGJRRCLSYLC-HOSYDEDBSA-N 278.304 2.131 10 20 CECD CCCn1cc(NC(=O)c2cc(O)cs2)ccc1=O 732273708 AIAAISWHJPDHBD-UHFFFAOYSA-N 278.333 2.278 10 20 CECD C[C@H](CC(=O)N(C)Cc1ccccc1O)c1cnn(C)c1 839541939 JTEJIGSFRZVPDN-GFCCVEGCSA-N 287.363 2.278 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cncnc1 839920235 NWPGREKBQGOPGT-ZDUSSCGKSA-N 298.390 2.212 10 20 CECD N[C@@H]1CCCO[C@@H]1C1CCN(Cc2ccccc2O)CC1 841100092 UKZHDDCFTGYOLX-NVXWUHKLSA-N 290.407 2.111 10 20 CECD CC(C)NC(=O)CN[C@H](C)c1ccc(Cl)cc1O 841743816 KHZUITIWECCVIK-SECBINFHSA-N 270.760 2.221 10 20 CECD CCCCN(C)CCNC(=O)Nc1ccc(N)cc1 841299667 HNNUWDMJMUMYHV-UHFFFAOYSA-N 264.373 2.122 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCSC[C@H]1CCO 840919836 POBXYGJWLKMEEL-MRXNPFEDSA-N 294.464 2.361 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNC[C@@H]2CCCNC2)c1O 841033594 WRSQDWCNKBALNI-SECBINFHSA-N 299.758 2.043 10 20 CECD NC[C@@H]1CC[C@H](NCc2c(O)cccc2Cl)C1 841084975 RCQLMGGVADRJTK-ZJUUUORDSA-N 254.761 2.263 10 20 CECD CC[C@@](C)(O)CN[C@H](C)c1cccc(OC)c1O 846148221 YDSRANTUMRSIPH-QMTHXVAHSA-N 253.342 2.212 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC(=O)N(C(C)C)C1 840934160 MXRCVXYPQFVLKO-HNNXBMFYSA-N 289.423 2.160 10 20 CECD C[C@H](NCc1nc([C@@H]2CCCO2)n[nH]1)c1ccccc1O 848557408 JSOCVNZBEIDQRM-GWCFXTLKSA-N 288.351 2.213 10 20 CECD CCN(CC)c1ccc(CNC[C@H](N)C2CC2)cc1 841049285 JBTMFBPEAYXBPO-INIZCTEOSA-N 261.413 2.360 10 20 CECD Cc1cc(S(=O)(=O)NCc2ccccc2O)ccc1F 751150610 JGXIDCZKZBNXMV-UHFFFAOYSA-N 295.335 2.318 10 20 CECD CCCOc1ccc(CN2CCOC[C@@H]2C)c(O)c1 132179848 QVCQWBLMXPLVLK-LBPRGKRZSA-N 265.353 2.402 10 20 CECD C[C@@H](NCC1CC2(C1)OCCO2)c1c(O)cccc1F 926999584 KYKRLFYEAFEEHR-SNVBAGLBSA-N 281.327 2.335 10 20 CECD CC(C)N1CC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 761364948 VEFAWJYNHLEKOS-UHFFFAOYSA-N 299.374 2.235 10 20 CECD CN(C)c1cc(F)c(CN(CCO)C2CCC2)cc1F 862336546 GLNDPVOMJCKBCV-UHFFFAOYSA-N 284.350 2.378 10 20 CECD COc1cc(Cl)cc(CN2Cc3cnn(C)c3C2)c1O 877633096 ZECSFCWJSKKIHS-UHFFFAOYSA-N 293.754 2.304 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1Cc2ccccc21 773747627 CMHOTJRETPMEHT-ABAIWWIYSA-N 297.354 2.485 10 20 CECD Cc1cccc(O)c1CN1CC[C@H](C)[S@@](=O)CC1 877476271 AALRMHOFMHEIFO-SGTLLEGYSA-N 267.394 2.044 10 20 CECD O=C(NCc1ccccc1O)c1c[nH]c2cccnc12 774066888 VFZBBYQKLCIKRD-UHFFFAOYSA-N 267.288 2.199 10 20 CECD C[C@@H](OC[C@H]1CCCCO1)C(=O)N(C)c1ccc(N)cc1 877078517 SFRZHYYKUQIAJV-IUODEOHRSA-N 292.379 2.206 10 20 CECD CCC1(O)CCC(NCc2cc([N+](=O)[O-])ccc2O)CC1 771874512 LAEHDTXCGGVIIB-UHFFFAOYSA-N 294.351 2.474 10 20 CECD NC(=O)[C@H](Cc1ccc(F)cc1)Sc1nccs1 783895941 VLQCGJNLHGTOPZ-JTQLQIEISA-N 282.365 2.471 10 20 CECD C[C@H]1COC[C@@H]1NCc1c(O)cccc1Br 706805242 TXSTZJIDCJATPI-KWQFWETISA-N 286.169 2.279 10 20 CECD CC1(C)OCC(NCc2c(O)ccc(Cl)c2F)CO1 790986725 UIVFRKJJRZCUNU-UHFFFAOYSA-N 289.734 2.426 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1O[C@H](C)C[C@H]1C 799938025 NNXPWRIDYNYKKA-XJKCOSOUSA-N 290.407 2.491 10 20 CECD COc1cccc(O)c1CN1CCOC(C)(C)C1 768843285 WLQFSYQXMJWBMK-UHFFFAOYSA-N 251.326 2.012 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CCC[C@@H](F)C2)c(O)c1 1349078220 YEUWXDDGZZZTLN-NEPJUHHUSA-N 296.342 2.481 10 20 CECD Nc1ccc(CNC(=O)N2CCC3(CCC3)C2)cc1 1353539014 GZTUMSRSKQNUMD-UHFFFAOYSA-N 259.353 2.354 10 20 CECD CCc1cccc(CNCC(C)(C)C(=O)O)c1O 1605829057 XNCJKNMQSSECMG-UHFFFAOYSA-N 251.326 2.155 10 20 CECD O=C(O)[C@H](CC1CC1)NCc1ccc(F)c(F)c1O 1601639713 NPFGUJAPSQEKII-JTQLQIEISA-N 271.263 2.013 10 20 CECD C[C@H](NCCc1ccn(C)n1)c1ccc(F)cc1O 230897547 MFBQOUBWKNNHTA-JTQLQIEISA-N 263.316 2.158 10 20 CECD Nc1ccc(CNC(=O)Nc2cnn3ccccc23)cc1 1580445428 CKVVKGMJXALPOV-UHFFFAOYSA-N 281.319 2.238 10 20 CECD COC(=O)/C=C(/C)CSc1ncc(C(=O)O)s1 1598832110 SIPFFCBKZLOPCY-UTCJRWHESA-N 273.335 2.053 10 20 CECD C[C@H](NCCC[C@@H](C)CO)c1cc(C(=O)O)ccc1O 1592758588 SXAQBCYWESPZAG-MNOVXSKESA-N 281.352 2.150 10 20 CECD C[C@@H](C[C@@H](C)O)NCc1cccc(Br)c1O 164498783 JRKIYGVWWQLXSL-DTWKUNHWSA-N 288.185 2.404 10 20 CECD Cc1cnc(C(=O)NCCc2ccc(N)cc2)c(C)c1 911782243 FZGKTWLQDYHZHC-UHFFFAOYSA-N 269.348 2.253 10 20 CECD COc1ccc(N(C)Cc2nc([C@@H](C)OC)no2)cc1 844352990 MLYFQOFGMBPPFL-SNVBAGLBSA-N 277.324 2.422 10 20 CECD CC[C@H](C)NC(=O)CCNCc1ccc(C)cc1O 876946728 PZWWWFPPKXLJPB-LBPRGKRZSA-N 264.369 2.095 10 20 CECD CCOc1cccc(CNCC[C@H](C)OC)c1O 263787531 GVVUPTYFAJZKBK-NSHDSACASA-N 253.342 2.306 10 20 CECD COC1(CNC(=O)Nc2ccc(N)cc2)CCCC1 388995280 DBGLHXPLYBVKMF-UHFFFAOYSA-N 263.341 2.350 10 20 CECD O=C(NCCOCc1ccccc1)c1cc(O)cs1 746893921 JDPPWNKXGQDJGV-UHFFFAOYSA-N 277.345 2.400 10 20 CECD COc1cccc(CN2CC[C@H]3OCCC[C@H]3C2)c1O 245735185 KORRKFBCILBXLX-GXTWGEPZSA-N 277.364 2.402 10 20 CECD O=C(NCCc1cccs1)c1cccc(O)c1O 126225167 QJKBGYGTNGTGRL-UHFFFAOYSA-N 263.318 2.132 10 20 CECD Cc1ccc2oc(C(=O)NCc3ccc(O)c(O)c3)cc2n1 182545474 FYLABEGNLDQXFQ-UHFFFAOYSA-N 298.298 2.477 10 20 CECD COc1ccc(O)c([C@@H](C)NC2CCN(C(C)=O)CC2)c1 37138393 IJBUBSVJLBAXDC-LLVKDONJSA-N 292.379 2.062 10 20 CECD C[C@@H](CO[C@H]1CCOC1)N[C@@H](C)c1ccc(F)cc1O 185673330 GTIMKYCCURZICH-GVXVVHGQSA-N 283.343 2.376 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)NCC1CC1 48464171 WZCWXMIAZHMTPW-UHFFFAOYSA-N 273.380 2.496 10 20 CECD CN(C)c1ccc(CNC(=O)[C@]2(C)CCCCN2)cc1F 237085586 XUZLYFRRVRPKIH-INIZCTEOSA-N 293.386 2.040 10 20 CECD CN1CCC[C@@H]2CN(Cc3cc(F)ccc3O)CC[C@@H]21 180280389 SGRJFCSVXHKMJN-DOMZBBRYSA-N 278.371 2.447 10 20 CECD COc1ccc(O)c([C@H](C)NCC[C@H](C)CCO)c1 295106744 LBHJMICZHBFLJH-RYUDHWBXSA-N 267.369 2.460 10 20 CECD C[C@H]1OCC[C@@]12CN(Cc1cc(Cl)ccc1O)CCO2 377274181 WNSLEDALAUGYPI-IAQYHMDHSA-N 297.782 2.425 10 20 CECD c1cc2c(cc1CNC[C@H]1COC3(CCCC3)O1)CCO2 376803206 FGMVHCBBTZATOR-HNNXBMFYSA-N 289.375 2.397 10 20 CECD CN(C)C(=O)O[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1 295181775 VVLRQUAMYFEKKC-OAHLLOKOSA-N 291.395 2.025 10 20 CECD C[C@H]1C[C@H](CCNC(=O)c2cccc(O)c2O)C[C@@H](C)O1 802196942 BOCCQQBIJSGUPN-ZSBIGDGJSA-N 293.363 2.421 10 20 CECD Cc1nonc1CNCc1c(O)ccc(Cl)c1F 809744538 PQOPDKXBUIDILE-UHFFFAOYSA-N 271.679 2.166 10 20 CECD CCc1nc(CSc2ncc(C(=O)OC)s2)no1 295396462 VSAAZGITYZCREX-UHFFFAOYSA-N 285.350 2.167 10 20 CECD COc1ccc2c(c1)C[C@H](C(C)C)CN2CCOCCO 817299390 ZCWWEPGFIXOYPA-HNNXBMFYSA-N 293.407 2.339 10 20 CECD CC[C@H]1C[C@@H](C(=O)NCCc2ccc(N)cc2)CCO1 818545238 QXRUVCJPJQNYSC-ZFWWWQNUSA-N 276.380 2.133 10 20 CECD Cc1ccncc1N(C)C(=O)/C=C/c1cccnc1 492594246 RVRHCJMCZGKOBI-AATRIKPKSA-N 253.305 2.461 10 20 CECD COc1cc(C)cc(CN2CCC[C@H](CC(=O)O)C2)c1O 820759463 UDIZIRXPBXWXBJ-GFCCVEGCSA-N 293.363 2.396 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@](F)(C(=O)O)C1 901513724 BRZALSBZOSMZOC-OAHLLOKOSA-N 280.343 2.060 10 20 CECD CC[C@@H](NC(=O)Cc1ccc(N)cc1)C1CCOCC1 830950010 SMHKNWJETRHRMR-OAHLLOKOSA-N 276.380 2.133 10 20 CECD CO[C@H]1C[C@H](NC(=O)c2cc(O)cs2)C12CCC2 839796899 FUTSQNGWAJYVRG-QWRGUYRKSA-N 267.350 2.141 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)C(=O)N2CCCC2)c1O 846169029 XHDFKORJEVPOGZ-RYUDHWBXSA-N 292.379 2.062 10 20 CECD CCOc1ccc(N(CC)C[C@@H]2CCC(=O)N2)cc1 844306361 VSHVNCUEXOJTKW-LBPRGKRZSA-N 262.353 2.190 10 20 CECD C[C@@H]1SCC[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 844106849 LFUMBOVADTYDJV-CNDXBVBGSA-N 279.361 2.121 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CCN)cc1F 841049755 GXAYVWPXLUYWAJ-LBPRGKRZSA-N 267.392 2.499 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)NCc1cc(Cl)ccc1O 846471917 DLQMZGWRZOPQNR-ZYHUDNBSSA-N 269.728 2.087 10 20 CECD CO[C@H](CC(C)C)C(=O)NCc1ccccc1O 841403779 HTOOQTNESJIFKQ-CYBMUJFWSA-N 251.326 2.070 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CCCN(C)C2)c1O 846147747 VIPDQCYIWSDLIL-QWHCGFSZSA-N 278.396 2.393 10 20 CECD CCOCc1cc(CNC[C@H]2CCCNC2)ccc1OC 841033011 MBRYQJIMUVGVLO-HNNXBMFYSA-N 292.423 2.321 10 20 CECD CCN(Cc1cc(C(=O)OC)no1)c1ccc(OC)cc1 929905733 ZKPZNJAFDWMILD-UHFFFAOYSA-N 290.319 2.496 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](CNC)C2)c1 843044981 OPJPWRYAMLMMRF-CYBMUJFWSA-N 278.396 2.222 10 20 CECD C[C@H](CN)NCc1ccc(N(C)C)cc1C(F)(F)F 841061265 WKBJGCCHJPPBIS-SECBINFHSA-N 275.318 2.208 10 20 CECD CCNC(=O)CN(C)Cc1ccc(N(CC)CC)cc1 759641637 DEUCRMQGOBUOTE-UHFFFAOYSA-N 277.412 2.101 10 20 CECD CCN(CC[C@H]1CCOC1=O)c1ccc(OC)c(OC)c1 753843053 AXULKOUHFDTVCL-LBPRGKRZSA-N 293.363 2.483 10 20 CECD Oc1cc2c(cc1CN[C@H]1Cc3cccc(O)c3C1)OCO2 758545120 MEKDCRHKZLKHAH-LBPRGKRZSA-N 299.326 2.084 10 20 CECD COc1cccc(CNC(=O)[C@@]23CCC[C@@H]2C3)c1O 934940140 IXQORBOBJXTZPN-IAQYHMDHSA-N 261.321 2.207 10 20 CECD CCN(CC1CC1)S(=O)(=O)N[C@H](C)c1ccccc1O 867835344 XHUGPVDXIHZPIY-LLVKDONJSA-N 298.408 2.020 10 20 CECD CCOC(=O)[C@@H](C)NCc1cc(C)c(C)cc1O 763271043 CZPZJXUKNGHZML-LLVKDONJSA-N 251.326 2.050 10 20 CECD Oc1ccccc1CN(Cc1cn[nH]c1)C[C@H]1CCCO1 768161536 GTVKIBYNZZBHEI-OAHLLOKOSA-N 287.363 2.297 10 20 CECD COC1CC(c2nc(Cc3ccc(N)cc3)no2)C1 863656356 PCVKINIQXOGYSW-UHFFFAOYSA-N 259.309 2.135 10 20 CECD CCc1noc(C)c1C(=O)NCc1cc(OC)ccc1O 769529598 IKGKOQXTYNOQCT-UHFFFAOYSA-N 290.319 2.190 10 20 CECD CC[C@H](NCc1nnc(C)n1C)c1ccc(C)cc1O 1116890589 ZFTPUUPRTYNFQS-ZDUSSCGKSA-N 274.368 2.378 10 20 CECD CCCOc1ccc(CNCC[S@](C)=O)cc1C 873053103 FDCNSJRXJKBRIX-SFHVURJKSA-N 269.410 2.252 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@H](C)c1cc(F)ccc1O 760886887 OTPJDYHDOLMNGW-RIEGTJTDSA-N 283.343 2.376 10 20 CECD Cc1n[nH]cc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773018887 JCIJMVGIEPSXPX-JTQLQIEISA-N 272.352 2.275 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CCn3ccnc3C2)c1 779064236 HPJYTHKFDUHKRK-NEPJUHHUSA-N 287.363 2.263 10 20 CECD COC(=O)[C@H](COC(C)C)N(C)Cc1cc(C)ccc1O 770355352 MARWOPLUUCQPIL-AWEZNQCLSA-N 295.379 2.099 10 20 CECD C[C@@H](NC1CCN(C)CC1)c1c(O)cccc1F 886493523 OUHNKJXIYCTXSJ-SNVBAGLBSA-N 252.333 2.276 10 20 CECD CCC(O)(CC)CCNC(=O)c1cc(O)cs1 788592896 XCSGMAUAQFIPRM-UHFFFAOYSA-N 257.355 2.125 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@H]2C[C@H]2C1 888295818 WXXVZJVJYZVYBH-OKILXGFUSA-N 273.380 2.222 10 20 CECD CC[C@H]1CN(Cc2ccc(OC)c(OC)c2O)C[C@@H](C)O1 891806057 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CC[C@H](CN(C)c1ccc(OCC(=O)O)cc1)OC 846279414 CTNGOGOVXXNGHY-GFCCVEGCSA-N 267.325 2.011 10 20 CECD CC[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)C1 841047601 RJWPNYJYGOLOMD-RISCZKNCSA-N 289.379 2.292 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@H]2C2CCC2)c1O 845835127 ZDVNJWANSGTXMU-QWHCGFSZSA-N 275.348 2.453 10 20 CECD CO[C@H]1CCC[C@H]1CNC(=O)Nc1ccc(N)cc1 841295618 CSMRETHOACJJSY-GWCFXTLKSA-N 263.341 2.205 10 20 CECD CC[C@H](COC(=O)/C=C\c1ccc(O)c(O)c1)OC 842086389 CRERATNUHLYVEB-JPVGGKMYSA-N 266.293 2.079 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@@H](C)c1ccc(F)cc1O 756775754 SMZXVZOWZUCGDC-ZWKOPEQDSA-N 280.343 2.097 10 20 CECD Cn1ncc(C2CC2)c1C(=O)Nc1ccc(N)cc1 851633477 KTXBCMXXJFZYQY-UHFFFAOYSA-N 256.309 2.132 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2C[C@H](OC)C2)c1 858584598 TVSBDOWNCFBUCT-YUSALJHKSA-N 279.336 2.007 10 20 CECD CCN(CC)C(=O)CN[C@H](C)c1cc(F)cc(F)c1O 756455183 IHUQDBHUFAPCPI-SECBINFHSA-N 286.322 2.189 10 20 CECD CO[C@@H](C1CC1)[C@H](C)NC(=O)NCc1cc(C)ccc1O 858521277 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CCC1(O)CCC(NC(=O)c2cc(O)cs2)CC1 772934051 OYMOAJFCNDEWRJ-UHFFFAOYSA-N 269.366 2.267 10 20 CECD C[C@H](NCC(=O)Nc1ccon1)c1ccc(N(C)C)cc1 775832683 AABDCHMSLOCMDC-NSHDSACASA-N 288.351 2.030 10 20 CECD COCCN(Cc1c(C)cccc1O)CC(F)F 876678552 NUCYXDKKWQVGOS-UHFFFAOYSA-N 259.296 2.414 10 20 CECD CC[C@@H](NCCc1nncn1CC)c1ccccc1O 775522842 BXFMHOSCYKVATD-CYBMUJFWSA-N 274.368 2.287 10 20 CECD CC[C@H]1C(=O)N(CC)CCN1Cc1cc(Cl)ccc1O 779215109 IJKFDELBSOHBHC-ZDUSSCGKSA-N 296.798 2.488 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCCC(C)(C)N 892860028 IDSMPRRKOOEPOD-UHFFFAOYSA-N 292.427 2.021 10 20 CECD CN1CCC[C@H](CNCc2cc(F)cc(F)c2O)C1 708501078 ASMOQKSFEYDFNS-SNVBAGLBSA-N 270.323 2.102 10 20 CECD CC(C)CO[C@@H](C)C(=O)NCc1ccccc1O 748347121 VZPWAAOBDNEWKS-NSHDSACASA-N 251.326 2.070 10 20 CECD COCCC1(NCc2cc([N+](=O)[O-])ccc2O)CCC1 793330277 VKYUGKCUIMUZBG-UHFFFAOYSA-N 280.324 2.349 10 20 CECD Oc1ccccc1CN1CCCC2(CCNCC2)C1 1326236134 DBPRHRZEPKUMHJ-UHFFFAOYSA-N 260.381 2.358 10 20 CECD Oc1ccc(-c2csc([C@H]3CCNC3)n2)cc1O 1331705804 JGRDJCBQEOHXMI-VIFPVBQESA-N 262.334 2.298 10 20 CECD Nc1ccc(CNc2ccc(N3CCOCC3)cn2)cc1 1356082907 HLEHZJHMWKGVMO-UHFFFAOYSA-N 284.363 2.113 10 20 CECD Cc1cc(CN(C)Cc2ccccc2O)[nH]c1C(=O)O 1607635493 BKENIVINQNSXKL-UHFFFAOYSA-N 274.320 2.359 10 20 CECD CN1CCC[C@@H]2CN(Cc3ccc(N)cc3)CC[C@H]21 227328272 GDRLRKQZJWBIHM-GDBMZVCRSA-N 259.397 2.185 10 20 CECD CCC(CC)(CN)C(=O)NCc1cccc(Cl)c1O 1577050749 BSNBMDWGPKUBHN-UHFFFAOYSA-N 284.787 2.427 10 20 CECD C[C@@H](NCCC1(CO)CCC1)c1cc(C(=O)O)ccc1O 1593261116 KPEMEPRAYDXKGD-LLVKDONJSA-N 293.363 2.294 10 20 CECD CC[C@H](C)NC(=O)CCN[C@H](C)c1ccccc1O 38013800 WBNQLECLHJQAIT-NWDGAFQWSA-N 264.369 2.348 10 20 CECD CC[C@H](C)[C@H](CNC(=O)Nc1ccc(N)cc1)OC 381175103 CYACWFYXMKFRAQ-GWCFXTLKSA-N 265.357 2.451 10 20 CECD Oc1c(Cl)cccc1CN1[C@H]2CC[C@H]1COC2 695062204 ZWMFJOXRAARDEI-QWRGUYRKSA-N 253.729 2.409 10 20 CECD NCC[C@@H]1CCN(Cc2cc(Br)ccc2O)C1 723674923 KPXSAFVHPVPJRI-SNVBAGLBSA-N 299.212 2.325 10 20 CECD 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2.051 10 20 CECD Cc1nc(CN(C)Cc2cc(Cl)ccc2O)no1 827891521 KVXCBZUQSMPBOQ-UHFFFAOYSA-N 267.716 2.369 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CC2(F)F)c1 825736551 CFOYGNQAZVBWMB-GMSGAONNSA-N 271.263 2.233 10 20 CECD CN(Cc1cc(Cl)c(F)cc1O)C[C@@H]1COCCO1 827139390 ACSWCVWADXOGLO-SNVBAGLBSA-N 289.734 2.032 10 20 CECD CN(CC[S@@](C)=O)Cc1ccc(N2CCCCC2)cc1 827337371 VVWYZNAWZBIXHL-HXUWFJFHSA-N 294.464 2.487 10 20 CECD Cc1c(NCc2ccccc2O)cccc1-c1nn[nH]n1 826242134 BIEJXGMMJRWJII-UHFFFAOYSA-N 281.319 2.493 10 20 CECD Cc1cc(C(=O)COC(=O)c2cc(O)cs2)c(C)[nH]1 731910223 PEESFNLMSYJIIZ-UHFFFAOYSA-N 279.317 2.438 10 20 CECD C[C@H]1CC[C@@H](CNC(=O)c2c(F)ccc(O)c2O)C1 831005843 QRKWDQYGCXLNRR-DTWKUNHWSA-N 267.300 2.403 10 20 CECD COC(=O)c1occc1COC(=O)c1cc(O)cs1 731909678 IXYROPKCYTXNAW-UHFFFAOYSA-N 282.273 2.190 10 20 CECD CN(CCCN1CCCC1)C(=O)c1cc(O)cs1 839753082 BFULGHGLAZDRBI-UHFFFAOYSA-N 268.382 2.012 10 20 CECD COc1cc2c(c(OC)c1)N(C[C@H](O)CSC)CCC2 839656481 NAAYDCRDPPBDQY-LBPRGKRZSA-N 297.420 2.180 10 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CCOC(=O)[C@H](NCc1ccc2c(c1)CCO2)C1CC1 1320677340 SPBPRUOHPWBSKS-OAHLLOKOSA-N 275.348 2.053 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2CCC[C@H](F)C2)cc1 1332141846 JVOZMJTWTLZSMM-GXTWGEPZSA-N 279.359 2.391 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2C=C[C@@H](C(=O)O)C2)cc1F 1330275638 VPMPELAUOYLTFD-MWLCHTKSSA-N 296.317 2.150 10 20 CECD COc1ccc(CNC(=O)c2cnoc2C2CC2)c(O)c1 1344406426 QSDOEQIIZMGQLI-UHFFFAOYSA-N 288.303 2.196 10 20 CECD Cc1cc(CCC(=O)N(C)c2ccc(N)cc2)no1 1340726585 JKUOQTMLCJVAIC-UHFFFAOYSA-N 259.309 2.161 10 20 CECD CN(CCC1CC1)c1nnc(-c2sccc2O)n1C 1355345543 XLDWODCTYQDITE-UHFFFAOYSA-N 278.381 2.486 10 20 CECD C[C@@H](NC[C@H]1C[C@@H](N(C)C)C1)c1cc(C(=O)O)ccc1O 1593286493 UKGJXWXODXNTNP-WZRBSPASSA-N 292.379 2.081 10 20 CECD CO[C@@H](C)CCN[C@H](C)c1cc(C(=O)O)ccc1O 1599040573 TUBVAKCMDUZLNG-VHSXEESVSA-N 267.325 2.166 10 20 CECD COc1cc(O)c(CN2CCC[C@H]2C)cc1OC 160322258 DYJDQJOQFOIDKQ-SNVBAGLBSA-N 251.326 2.394 10 20 CECD CCN(C)c1ccc([C@H](C)NCc2nncn2C)cc1 152299160 HSBJNLMUFMAHNO-LBPRGKRZSA-N 273.384 2.122 10 20 CECD CCC[C@](C)(O)C(=O)N[C@H](C)c1cc(OC)ccc1O 153888906 IBUMTOKVLACGOW-BMIGLBTASA-N 281.352 2.129 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)[C@H](C)CO1 403841965 STRMGJFQZCWEBI-DGCLKSJQSA-N 265.353 2.400 10 20 CECD COCC1(CNC(=O)Nc2ccc(N)cc2)CCC1 311623576 HTNOWKHWSNRJQI-UHFFFAOYSA-N 263.341 2.207 10 20 CECD Cc1nnc(CNCc2cc(F)cc(F)c2O)s1 708536283 YJDXQGXXJLBPMJ-UHFFFAOYSA-N 271.292 2.120 10 20 CECD OC[C@@H](CC(F)(F)F)N[C@H]1CCc2cccc(O)c21 717745484 QOIFSXOMQAVMJY-ZJUUUORDSA-N 275.270 2.282 10 20 CECD Cn1cnnc1CN(Cc1ccco1)Cc1ccccc1O 111232718 RUYWWHRWTJXFRI-UHFFFAOYSA-N 298.346 2.316 10 20 CECD CCCOc1ccc(CN2CCN3CCC[C@@H]3C2)c(O)c1 179952969 ZLPBHGBMTRLPAY-OAHLLOKOSA-N 290.407 2.461 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)c2nnnn2C2CC2)c(O)c1 189114147 VBIDRMAAWCUABO-MNOVXSKESA-N 287.367 2.434 10 20 CECD C[C@H](N[C@@H]1CCO[C@H]1C)c1ccc(N2CCOCC2)cc1 120533960 RGOGXEUQFWRWQE-GRDNDAEWSA-N 290.407 2.351 10 20 CECD Cc1ccncc1NC(=O)/C=C/c1ccc(O)c(O)c1 180754556 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CC(=O)N1CCC[C@@H](CN[C@H](C)c2ccc(F)cc2O)C1 281170822 PXFHMKAIQSMHIA-YPMHNXCESA-N 294.370 2.440 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c1O 280370269 DJSZNYLNNUBOJE-JJRVBVJISA-N 291.391 2.469 10 20 CECD CC[C@@H](NCCC1(O)CCOCC1)c1ccccc1O 287308378 DWIWNAICPGEOSX-CQSZACIVSA-N 279.380 2.365 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CN(C)C 282424782 HAQKHVKTQVDLGX-UHFFFAOYSA-N 264.369 2.083 10 20 CECD COc1cccc(CN[C@H](c2nncn2C)C(C)C)c1O 285606154 VNTSHHRRVSLTOF-ZDUSSCGKSA-N 290.367 2.016 10 20 CECD CC(=O)C(=O)COC(=O)c1ccc(Cl)cc1Cl 808487797 IBBNSNUISJRWFO-UHFFFAOYSA-N 275.087 2.308 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@@H](C)CC(N)=O)c1O 808703597 PCDWQEKDINWNNQ-IUCAKERBSA-N 270.760 2.269 10 20 CECD CO[C@](C)(C(=O)NCc1ccc(N(C)C)cc1)C1CC1 290988455 RICAHDRIPIDQPD-INIZCTEOSA-N 276.380 2.184 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@](C)(O)C1CCC1 813455064 HYFNFWUAUGTRDD-QGZVFWFLSA-N 290.407 2.228 10 20 CECD COC[C@@H](C)[C@@H](C)C(=O)N[C@H](C)c1ccccc1O 827946882 UEVIPKOXHBPSDH-IJLUTSLNSA-N 265.353 2.488 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCCC[C@@]2(C)N)cc1 825973929 TUVLFSZMPNLRNX-NVXWUHKLSA-N 289.423 2.276 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCCOCCF 824330401 BWXZHSQUHUUCRF-UHFFFAOYSA-N 298.358 2.300 10 20 CECD CCO[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C)c(O)c1O 837144959 UVKRIMKGYAGNQF-CHWSQXEVSA-N 293.363 2.484 10 20 CECD COc1ccc(CN[C@@]2(CC(=O)O)CCCOC2)cc1C 901523464 CNORJVJCIIDNAK-MRXNPFEDSA-N 293.363 2.117 10 20 CECD COC[C@@H]1CCN(Cc2c(O)ccc3ccncc23)C1 739872462 PRPIPMYHJMCZCN-GFCCVEGCSA-N 272.348 2.409 10 20 CECD CCO[C@@H]1C[C@H](NCc2cc(OC)ccc2O)[C@@H]1SC 838948542 UDVCEJSMYQOADF-CFVMTHIKSA-N 297.420 2.399 10 20 CECD Cc1cccc2c1C(=O)N[C@@H](c1cccc(O)c1O)N2 917419759 CKAFLJARQPPLMW-AWEZNQCLSA-N 270.288 2.260 10 20 CECD Cc1cnc(CNC(=O)NCc2ccccc2O)s1 743668306 VNIYGWNJJPWFSY-UHFFFAOYSA-N 277.349 2.157 10 20 CECD Oc1ccc(Cl)cc1CNCC[C@@]1(O)CCCOC1 846112273 YYPWLFATAPVKAW-AWEZNQCLSA-N 285.771 2.067 10 20 CECD C[C@H]1NCCC[C@H]1NCc1c(O)ccc(Cl)c1F 841064574 YTMKFNHHYSBEFR-LDYMZIIASA-N 272.751 2.415 10 20 CECD NC1CCN(Cc2cccc(Br)c2O)CC1 843047725 XYJJLIWSKZVSCM-UHFFFAOYSA-N 285.185 2.078 10 20 CECD CO[C@H](C)CCNC(=O)NCc1cc(Cl)ccc1O 844946919 VBOHVYDUVZVLDL-SECBINFHSA-N 286.759 2.270 10 20 CECD CCCC[C@@H](CN)NCc1ccc(N(C)C)c(F)c1 841029810 SKZDWKZEOCDTGF-ZDUSSCGKSA-N 267.392 2.499 10 20 CECD CNC[C@H]1CCCN1Cc1ccc(N(C)C)c(F)c1 843054986 BRHFXBAGRAECCE-CYBMUJFWSA-N 265.376 2.076 10 20 CECD Cc1ccc(C(=O)NCCCc2ccco2)c(O)c1O 856224087 UVVPLLPOUDQVEC-UHFFFAOYSA-N 275.304 2.362 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C/c2cnccc2C)c1 752598509 BHKPBBSGOWMGPR-ZZXKWVIFSA-N 298.342 2.434 10 20 CECD Oc1ccc(Cl)cc1CN[C@@H]1CCCC[C@H]1O 51991987 MKZZKCWSHOHZHN-DGCLKSJQSA-N 255.745 2.439 10 20 CECD CC(C)(C)N1C[C@H](CNCc2ccccc2O)CC1=O 850397378 WXIBIGFIIKQNKO-LBPRGKRZSA-N 276.380 2.129 10 20 CECD Cc1ccccc1CCNC(=O)CN(C)c1ccc(N)cc1 863557087 HQEYOLOBHMWHSM-UHFFFAOYSA-N 297.402 2.372 10 20 CECD O=C(NCc1cccc(Br)c1O)c1cc[nH]c1 765746002 BOKVWLAHXNOFED-UHFFFAOYSA-N 295.136 2.413 10 20 CECD COc1ccc2c(c1)CCCN2CN1C[C@@H](C)CC1=O 766342630 YFAGESXNXMEYPZ-LBPRGKRZSA-N 274.364 2.274 10 20 CECD CN(CCOC(C)(C)C)Cc1cc2c(cc1O)OC[C@@H]2O 768463751 WPEPGTJBPQKSGY-AWEZNQCLSA-N 295.379 2.065 10 20 CECD COc1cc(CN2CC[C@@H](N3CC=CC3)C2)c(O)cc1C 768465790 LHVJNGUBGBMEJG-OAHLLOKOSA-N 288.391 2.155 10 20 CECD CCCOc1ccc(CN[C@@H]2COCC[C@H]2O)cc1C 873150178 YZLFQCRNEPQFRB-HUUCEWRRSA-N 279.380 2.023 10 20 CECD Cc1ccc(CN[C@@H]2C[C@H](C)N(C3CC3)C2)c(O)c1 877095508 ZXBOYBBPAKJSCX-GXTWGEPZSA-N 260.381 2.415 10 20 CECD CC(C)C1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 779536187 WPJRJJAFHYSJAO-GQCTYLIASA-N 261.321 2.225 10 20 CECD CCOc1ccc(CNc2nncs2)c(O)c1 777506203 JXGKFALLIFHKFG-UHFFFAOYSA-N 251.311 2.255 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)CCCO 779066236 UKVSUKYAAJLFRY-CYBMUJFWSA-N 250.386 2.312 10 20 CECD Cc1ccc([C@H](C)C(=O)NCc2ccc(O)c(O)c2)o1 778929749 MUVKMOWZYUNVEE-JTQLQIEISA-N 275.304 2.419 10 20 CECD CCc1cnccc1CNC(=O)NCc1ccccc1O 779344280 VMSMBIMSNGCJRM-UHFFFAOYSA-N 285.347 2.349 10 20 CECD Oc1ccc(Cl)c(F)c1CN1C[C@H]2COC[C@H]2C1 872267282 XDUHOACDHKXZNS-DTORHVGOSA-N 271.719 2.263 10 20 CECD COC(=O)N1CCC(CNCc2c(C)cccc2O)CC1 877518577 KHDMFCXIHCCVBP-UHFFFAOYSA-N 292.379 2.269 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1CCn2ncnc2C1 770664444 NKBLPNNNOOZXIP-UHFFFAOYSA-N 299.161 2.306 10 20 CECD Oc1c(F)cc(F)cc1CNCCCC1(O)CCC1 883146892 CRHBYRVHLRMHTG-UHFFFAOYSA-N 271.307 2.455 10 20 CECD O=C(NCC[C@H]1CCCCO1)c1cc(O)cs1 780813781 QWZHXFDYQLWFKQ-SNVBAGLBSA-N 255.339 2.143 10 20 CECD O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCc1cccc(O)c1O 1123889282 OEOYPZJXHNVBCO-SCVCMEIPSA-N 261.321 2.150 10 20 CECD C[C@@H](N[C@H](C)c1ncnn1C)c1cc(F)cc(F)c1O 788983938 PDIGLSXGYMHENW-HTQZYQBOSA-N 282.294 2.211 10 20 CECD CCc1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)no1 896163371 LXVUNZYDCFYULE-SECBINFHSA-N 290.319 2.442 10 20 CECD Cc1ccc(CN2[C@H](C)C(=O)N(C)[C@H](C)[C@H]2C)c(O)c1 895923590 WZKKJAPNBFMTAW-JHJVBQTASA-N 276.380 2.140 10 20 CECD CN(C(=O)c1cc(C2CC2)on1)c1ccc(N)cc1 702103035 BOQLHQUNWHRMNL-UHFFFAOYSA-N 257.293 2.411 10 20 CECD Cn1cnc(CNCc2cc(Cl)c(F)cc2O)c1 898043130 FVMWCQHCNKNNRS-UHFFFAOYSA-N 269.707 2.208 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC[C@H]3C[C@@H]32)cc1 796590932 QOVWCEGDNSPGPC-ZFWWWQNUSA-N 273.380 2.447 10 20 CECD CN1CCCc2cc(CNC(=O)NOCC(F)F)ccc21 793186810 QMVGONPNPBWFEV-UHFFFAOYSA-N 299.321 2.065 10 20 CECD C[C@H](N)[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 70171805 KMYLCFWXEKEZOZ-DZGCQCFKSA-N 261.413 2.312 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C1CC(N)C1 1327006432 YYSCVOONOCNPNW-UHFFFAOYSA-N 259.397 2.208 10 20 CECD C[C@]1(CNC(=O)c2cccc(O)c2O)CC1(Cl)Cl 1324573903 DKHJYNQQENLXKY-LLVKDONJSA-N 290.146 2.412 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1C[C@H]1C1CCC1 1528771617 RKFSSVRRKJZZFC-NWDGAFQWSA-N 261.321 2.150 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)N2CCCC2)c1 228093745 MCXGQESLBHNQGV-OLZOCXBDSA-N 276.380 2.362 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@@H](C)N)c1 1579656565 ZKTIQPPNAHZVRA-GFCCVEGCSA-N 285.391 2.480 10 20 CECD CCc1nc2c(C(=O)N(C)c3ccc(N)cc3)ccnc2[nH]1 1578294596 DOQOUNGLADCBOO-UHFFFAOYSA-N 295.346 2.379 10 20 CECD Oc1cc(F)c(Cl)cc1CN[C@H]1C[C@H]2CN[C@@H](C2)C1 1580887906 AUZGYTPMYGIASQ-LSJOCFKGSA-N 284.762 2.415 10 20 CECD CN(C)c1ccc(CN2C[C@H](C(=O)O)C3(CCC3)C2)cc1 1777039414 YMNFWTHVDKUMFE-OAHLLOKOSA-N 288.391 2.439 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](CC)c2ccccc2O)C1 156376905 NQZLHCSBDXBHEU-TZMCWYRMSA-N 276.380 2.444 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](C)[C@@H]2C(=O)O)c1 818631630 LQKRPPRBQAKOMF-IINYFYTJSA-N 279.336 2.086 10 20 CECD COc1ccc(N(C)CC(=O)N2CCCCC2)cc1 844353466 OUTYBZCYJMHQCZ-UHFFFAOYSA-N 262.353 2.144 10 20 CECD C[C@@H](NCc1cnn(C)c1)c1ccc(N(C)C)cc1 41159271 SBVKDNDLBSFNCU-GFCCVEGCSA-N 258.369 2.337 10 20 CECD CCN(CCNCc1cc(F)cc(F)c1O)C1CC1 708505062 XDXPYYIEHJNQPS-UHFFFAOYSA-N 270.323 2.244 10 20 CECD COC[C@](C)(O)CN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 382546802 GASHOSLJJGDMNU-MQIPJXDCSA-N 279.380 2.236 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@]2(C)CCOC2)c1 397117932 JYCGYJHRZLWNEQ-NHYWBVRUSA-N 265.353 2.478 10 20 CECD CN(CC(F)F)C(=O)NCc1ccc(N(C)C)cc1 103502032 RTCJAXZYVDOURS-UHFFFAOYSA-N 271.311 2.159 10 20 CECD CN(CCc1ccncc1)C(=O)/C=C/c1ccc(O)c(O)c1 180716322 MXZXKPDACLRABW-HWKANZROSA-N 298.342 2.207 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2cccc(C)c2O)C1 183378736 VLAXYFBGMHCZEF-CQSZACIVSA-N 276.380 2.049 10 20 CECD COc1ccc(O)c([C@H](C)NCCC[C@@H](C)O)c1 228044688 WMACOPKNVDSJBC-MNOVXSKESA-N 253.342 2.212 10 20 CECD C[C@H](N)[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 220210800 PQRUVNYRNFZSGE-WDEREUQCSA-N 252.333 2.091 10 20 CECD CCOc1cccc(CN2CC[C@H](N)C[C@@H]2C)c1O 131431959 LDKVJQVRXNNYJJ-AAEUAGOBSA-N 264.369 2.103 10 20 CECD C[C@]1(C(=O)NCCCSc2nccs2)CCCNC1 237755798 VVVYVKBHAOCDQU-ZDUSSCGKSA-N 299.465 2.131 10 20 CECD CC[C@H](NCC[C@@H](O)COC)c1ccc(N(C)C)cc1 90951327 AYRHNWSCECDKID-CVEARBPZSA-N 280.412 2.191 10 20 CECD COCCNCc1cc(Br)cc(C)c1O 162823147 UDYGQOPVHIBBBM-UHFFFAOYSA-N 274.158 2.199 10 20 CECD Nc1ccc(CC(=O)NCCCCNc2ccccn2)cc1 262632384 FZGBWDVTTOYCST-UHFFFAOYSA-N 298.390 2.215 10 20 CECD Cc1cccc(CN2CCCC[C@@H](S(C)(=O)=O)C2)c1O 278819560 ZGRUFBSOPUOBOH-CQSZACIVSA-N 297.420 2.100 10 20 CECD COCCN1CC[C@@H](N[C@@H](C)c2cc(Cl)ccc2O)C1 273599709 RRKKIAYNCBUYTI-WCQYABFASA-N 298.814 2.417 10 20 CECD CN1CC[C@@H]2CCN(Cc3cc(F)ccc3O)[C@@H]2C1 272611754 KMDFKDDCTRXLOP-BXUZGUMPSA-N 264.344 2.057 10 20 CECD CN(C)C1(CNC(=O)c2cccc(O)c2O)CCCCC1 279122372 LVZQOCXFYOZKTM-UHFFFAOYSA-N 292.379 2.092 10 20 CECD CC[C@@H](NCC(=O)NCC(F)F)c1ccc(N(C)C)cc1 280836601 LMQZRDKUNONSFF-CYBMUJFWSA-N 299.365 2.175 10 20 CECD CC[C@@H](NCCC(=O)N(C)C)c1ccc(C)cc1O 280089960 MIKTZQKBDTVYRH-CYBMUJFWSA-N 264.369 2.220 10 20 CECD CCCOc1ccc(CN(C)CCOCCOC)c(O)c1 290073298 FXOISFFSSANYQA-UHFFFAOYSA-N 297.395 2.276 10 20 CECD CCN(C)C(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 299376197 HYTXKCIBOLEUDD-UHFFFAOYSA-N 289.423 2.195 10 20 CECD CC[C@H](NC1CNC1)c1cc(Br)ccc1O 817956183 SSDCPZQZZHAIOO-NSHDSACASA-N 285.185 2.167 10 20 CECD CCOc1ccc(CN2CC[C@@]3(CCN(C)C3)C2)c(O)c1 814178080 BDIADBRDGCSSPR-QGZVFWFLSA-N 290.407 2.319 10 20 CECD CCO[C@@H]1COC[C@H]1NCc1cc(Cl)c(F)cc1O 825196972 RJILZUKCUBROGR-DGCLKSJQSA-N 289.734 2.078 10 20 CECD CCC[C@@](C)(N)C(=O)NCc1ccc(N(C)C)cc1C 829764728 VLIFOHZOSVAAQF-MRXNPFEDSA-N 277.412 2.195 10 20 CECD C[C@@H](NCc1ccc(N2CCCC2)cc1)c1cn(C)nn1 902742467 QPNMMGISJGPJKO-CYBMUJFWSA-N 285.395 2.266 10 20 CECD COc1ccc(N(CCOCCO)CC(C)C)cc1 739912558 NHXNEQBEDUIPPS-UHFFFAOYSA-N 267.369 2.167 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc3c(c2)COC3)c1 734016164 DCLOYXUIRWFVLU-UHFFFAOYSA-N 299.326 2.361 10 20 CECD C[C@H](Nc1cc(C(=O)O)ncn1)c1ccc(N(C)C)cc1 906144903 OHOLRWRNIGMGCR-JTQLQIEISA-N 286.335 2.414 10 20 CECD O=C(COCC1CC1)NCc1cc(Cl)ccc1O 846472154 HRTSBJSOFVRHNB-UHFFFAOYSA-N 269.728 2.088 10 20 CECD COc1cccc([C@@H](C)NC[C@H](CO)C(C)C)c1O 846169870 GNMFGKWGFYTXKV-VXGBXAGGSA-N 267.369 2.316 10 20 CECD CC(C)OCC(C)(C)NC(=O)c1cc(O)cs1 846655382 LWMYUATVBKJNJP-UHFFFAOYSA-N 257.355 2.387 10 20 CECD COc1ccc(N2CC[C@H](CNC(=N)NC(C)C)C2)cc1 849044095 SZMKNOXITGXAHF-CYBMUJFWSA-N 290.411 2.044 10 20 CECD COc1cccc(CN[C@@H]2CCCC[C@@H]2CN)c1O 841030123 KJXIMGXNJCDEJD-DGCLKSJQSA-N 264.369 2.008 10 20 CECD COc1cc(CNCCN2CCC2)c(O)c(C(C)(C)C)c1 850222277 UORCMGKZXDDZCT-UHFFFAOYSA-N 292.423 2.494 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC2(N)CCCC2)c1 854224668 YGFONYLAEHLYDJ-NSHDSACASA-N 292.379 2.101 10 20 CECD CCC1(C(=O)N[C@H](C)c2cc(OC)ccc2O)COC1 755787638 WIGUHWUNVXVPPJ-SNVBAGLBSA-N 279.336 2.005 10 20 CECD CC(C)(C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210258 UTFCGZQWFVKEPN-UHFFFAOYSA-N 290.407 2.310 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H](C)O[C@H]2C)c1 858540590 JGDAUNLBTWPZBX-AVGNSLFASA-N 292.379 2.313 10 20 CECD CN(C)CCN(C(=O)/C=C\c1cn(C)cn1)c1ccccc1 931134549 VCUGNUHODOTAPH-KTKRTIGZSA-N 298.390 2.028 10 20 CECD Oc1cccc(Br)c1CN1CCC(O)CC1 862213971 ZUJDAXWTFXRIMB-UHFFFAOYSA-N 286.169 2.111 10 20 CECD CN(C)c1cc(F)c(CNCC2(C(=O)O)CCC2)cc1F 864513286 YVMKQFMVBNPDMU-UHFFFAOYSA-N 298.333 2.375 10 20 CECD COC(=O)C(C)(C)N(C)Cc1cc(C)c(C)cc1O 769305765 MVGGDVPJBJKVOB-UHFFFAOYSA-N 265.353 2.392 10 20 CECD CC(=O)c1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 762275753 ZJGRFGMHRJWHQV-UHFFFAOYSA-N 299.326 2.273 10 20 CECD O=C(N[C@H](CCO)c1cccs1)c1cc(O)cs1 779265868 XEWYIRPDLZTFKK-SECBINFHSA-N 283.374 2.369 10 20 CECD CN(C(=O)CCC1CCNCC1)c1ccc(N)cc1 877077318 COBFRYQHELEYIZ-UHFFFAOYSA-N 261.369 2.011 10 20 CECD OC[C@@H]1CSCCN1Cc1cc(Cl)c(F)cc1O 877780390 OWZDNYCFRKLOIU-SECBINFHSA-N 291.775 2.094 10 20 CECD C[C@H](NCCc1cncn1C)c1c(O)cccc1F 886594710 SAZDCTFQZQFPCT-JTQLQIEISA-N 263.316 2.158 10 20 CECD Cc1ccc(CN[C@@H](C)c2c(O)cccc2F)c(=O)n1C 886600755 ANENCURQPYNWQZ-NSHDSACASA-N 290.338 2.389 10 20 CECD CCOC(=O)CCN(Cc1ccc(N)cc1)C1CC1 1120370605 BXRAIWCKMXQXID-UHFFFAOYSA-N 262.353 2.186 10 20 CECD CCN(C)c1ccc(Cn2cc([C@](C)(N)CC)nn2)cc1 881313149 BCISJGPGHQMKDZ-MRXNPFEDSA-N 287.411 2.366 10 20 CECD COc1ccc(CN2CCOC[C@H]2C2CC2)c(O)c1OC 892109685 CYIKIPMSKWVNRZ-ZDUSSCGKSA-N 293.363 2.020 10 20 CECD COc1cccc(CN2CC[C@H]3OCCC[C@@H]3C2)c1O 93506640 KORRKFBCILBXLX-TZMCWYRMSA-N 277.364 2.402 10 20 CECD CC(C)[C@@H](N[C@@H](C)c1cc(F)ccc1O)C(=O)O 94617948 SUQGWBWBFBJLMQ-QPUJVOFHSA-N 255.289 2.291 10 20 CECD COc1cccc(CN2CCn3cccc3C2)c1O 896760668 NBZOZDSIQHLAMH-UHFFFAOYSA-N 258.321 2.218 10 20 CECD Cc1c[nH]nc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 799424472 KCZJMHCAGMGYSG-NSHDSACASA-N 272.352 2.275 10 20 CECD C[C@@H](NCc1ccnn1C)c1ccc(N(C)C)cc1 71333443 VAXCAKJUCKYTQD-GFCCVEGCSA-N 258.369 2.337 10 20 CECD C[C@@H](O)CCN(C)Cc1ccc(N2CCCC2)cc1 1319706803 DPQUQEBWKOPEOO-CQSZACIVSA-N 262.397 2.490 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCC(F)(F)CN 1325724356 WJEKBONAQNDKPE-UWVGGRQHSA-N 270.323 2.433 10 20 CECD CC(C)OC(=O)[C@@H]1CCCN1Cc1ccc(N)cc1 1336285192 IMEPUMFSQVCOKE-AWEZNQCLSA-N 262.353 2.185 10 20 CECD CN(C)c1cc(F)c(CNCc2csnn2)cc1F 1262011354 IWDLPTRGOWHQRJ-UHFFFAOYSA-N 284.335 2.172 10 20 CECD CCOc1cccc(CNCC2CCOCC2)c1O 110904309 WATMVAMKHWBNCY-UHFFFAOYSA-N 265.353 2.307 10 20 CECD COc1ccc(O)c(CNCc2ccncc2C)c1 229657701 FPTKNJPKGFNEFF-UHFFFAOYSA-N 258.321 2.394 10 20 CECD C[C@H](N[C@@H]1C[C@H]2CCC[C@H]21)c1cccc(-c2nn[nH]n2)c1O 1589957713 SJJUVCQDWUMCRZ-UZWIWUQPSA-N 299.378 2.412 10 20 CECD CC(C)(C)c1cnc(SCCC(=O)NC(N)=O)s1 164170549 CTTRKNNYDSOMCU-UHFFFAOYSA-N 287.410 2.118 10 20 CECD COc1cccc(O)c1CN1CC[C@H](OC)[C@@H](C)C1 824815067 IBWSUQSSDGKHEI-FZMZJTMJSA-N 265.353 2.258 10 20 CECD C[C@H]1CCSCCN1C(=O)c1cccc(O)c1O 276899832 RYWRZPGINBLXGJ-VIFPVBQESA-N 267.350 2.065 10 20 CECD COc1ccc(O)c([C@H](C)NCC2=CCCOC2)c1 379883024 VXGQPRQTMCJNTH-NSHDSACASA-N 263.337 2.398 10 20 CECD CCOc1cccc(CNC[C@H](OC)C2CC2)c1O 381217288 MZVNLTHXEBJMQC-AWEZNQCLSA-N 265.353 2.306 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@H]3CC[C@H]2COC3)c1O 695036811 AGQNXPGLRRPRHG-STQMWFEESA-N 279.311 2.097 10 20 CECD Cc1ccc(O)c(CNCc2nn(C)cc2Cl)c1 393516831 QHBXXNKOCCPGST-UHFFFAOYSA-N 265.744 2.377 10 20 CECD Cc1oc(C(=O)O)cc1COc1cccc(F)c1C(N)=O 51361108 JDIGNFAVIVJOPL-UHFFFAOYSA-N 293.250 2.103 10 20 CECD Cc1ccc(C(=O)N2CCn3cccc3[C@H]2C)c(O)c1O 177668811 SBPIMUFUZGAASP-LLVKDONJSA-N 286.331 2.425 10 20 CECD Cc1nn(C)cc1C(=O)N(C)Cc1ccc(N(C)C)cc1 113143375 RGSHNNFEBKAKAT-UHFFFAOYSA-N 286.379 2.067 10 20 CECD COc1ccc(CNCC(C)(C)N(C)C)cc1C 35052557 LLDBEFAJWPRWCG-UHFFFAOYSA-N 250.386 2.433 10 20 CECD CCC[C@](C)(CO)NC(=O)NCc1ccc(N(C)C)cc1 304628189 NNJCPXUDJRXZLZ-MRXNPFEDSA-N 293.411 2.103 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 183379412 GOVINMVGHUJOMD-GFCCVEGCSA-N 296.798 2.394 10 20 CECD CCC[C@H](C)C(=O)NCCc1ccc(O)c(O)c1 156651927 ZHRXHMCIWKBJJV-JTQLQIEISA-N 251.326 2.193 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C/c2ccc(O)cc2)c1 127525185 SAWBURXDTPNXSP-RUDMXATFSA-N 299.326 2.436 10 20 CECD Cc1cc(CNCc2ccc(N3CCOCC3)cc2)on1 44986166 IMYXARREIJKEBT-UHFFFAOYSA-N 287.363 2.109 10 20 CECD CC[C@H]1CO[C@H](C)CN1Cc1cc(OC)ccc1O 131498791 QLQJGZPPLXZEMO-YPMHNXCESA-N 265.353 2.400 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2cc(Cl)ccc2O)C1 92100872 GXRDIXXVBXPOIB-LBPRGKRZSA-N 296.798 2.346 10 20 CECD O=C(Cc1ccc(F)cc1)NCCc1ccc(O)c(O)c1 98074466 CMUIXNSYLOCJQK-UHFFFAOYSA-N 289.306 2.138 10 20 CECD COc1ccc(O)c(CN[C@@H](C)C(=O)OC(C)(C)C)c1 180033722 BKXPAFBWCGDOBE-JTQLQIEISA-N 281.352 2.221 10 20 CECD CC(C)C[C@H](N)C(=O)NCc1ccc2c(c1)CCCN2C 236709693 LCCYRVREMNZSCY-HNNXBMFYSA-N 289.423 2.059 10 20 CECD COc1cccc(CNC(=O)c2cc(C)n(C)c2C)c1O 269206871 UOMPJODQKWYZHP-UHFFFAOYSA-N 288.347 2.286 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1cccc(O)n1 279286393 YELPIJIEOSDOJF-UHFFFAOYSA-N 297.358 2.317 10 20 CECD CCOc1cccc(CN2CC[S@](=O)[C@H](C)[C@H]2C)c1O 271175569 FUUNDNFJQPIYJU-HTGLOVNISA-N 297.420 2.132 10 20 CECD CC(C)N1C[C@H](N[C@@H](C)c2ccccc2O)CC1=O 272910654 WNMXMAYFZNAJBN-NWDGAFQWSA-N 262.353 2.052 10 20 CECD CCOCc1cc(CNCc2cncn2C)ccc1OC 289937624 UCVSCFWNGJAGBO-UHFFFAOYSA-N 289.379 2.255 10 20 CECD COCC(COC)NCc1ccc(N2CCCCC2)cc1 388511598 RKFPECFTCABBOJ-UHFFFAOYSA-N 292.423 2.428 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccsn1 295429514 WNGVIRHRUBMZSD-UHFFFAOYSA-N 289.360 2.248 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H](F)C(F)(F)F)cc1F 290106508 IGZGMZHXURDRFN-JTQLQIEISA-N 296.239 2.408 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](F)C(F)(F)F)c1 810348338 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701661413 KNKMSLLCJBRWLZ-LBPRGKRZSA-N 251.326 2.012 10 20 CECD CCC[C@@H](CCO)NCc1cc(F)cc(F)c1O 708394196 RQFVGLNKTQHTPU-NSHDSACASA-N 259.296 2.311 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H](C)S1=O 792192759 PZVQJSHNUOKZRV-CHWSQXEVSA-N 280.437 2.094 10 20 CECD COc1cccc(O)c1CN1CCCO[C@@H](C)C1 769318099 INRCQAYWEVZYMC-NSHDSACASA-N 251.326 2.012 10 20 CECD C[C@@H](N[C@H]1CCn2ccnc2C1)c1ccccc1O 779060674 HXZMTXTWBQHKPI-NEPJUHHUSA-N 257.337 2.254 10 20 CECD Cc1ccc(C(=O)N2CC(C)(C)CC[C@H]2CO)c(O)c1O 1339147009 BYFXTRLAGCKRFP-NSHDSACASA-N 293.363 2.029 10 20 CECD C[C@@H]1NCCN(Cc2ccc(N3CCCC3)cc2)[C@H]1C 1345942500 BADIHXWRZXOKIO-GJZGRUSLSA-N 273.424 2.469 10 20 CECD C[C@H](NCc1ccn(C)c1)c1cc(C(=O)O)ccc1O 1609780423 JDQQLTLBZBHDMY-JTQLQIEISA-N 274.320 2.280 10 20 CECD C[C@@H](NCCC(=O)O)c1ccc(Br)cc1O 1609921579 RJSKYELZLJWQNC-SSDOTTSWSA-N 288.141 2.280 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)C(=O)NC(C)C)c(O)c1 228931823 XLHCPRRIQHBUKM-RYUDHWBXSA-N 264.369 2.264 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H]2CC[C@]21CN 1579616641 CQEBHQWCYSVUHK-RDJZCZTQSA-N 273.424 2.374 10 20 CECD C[C@@H](NCCC1(O)CCC1)c1cc(C(=O)O)ccc1O 1593260709 GWKKEKYGIJYZJA-SNVBAGLBSA-N 279.336 2.046 10 20 CECD C[C@@]1(NCc2cc([N+](=O)[O-])ccc2O)CCC[C@@H]1C(=O)O 1777409838 XODWJCKNOGUELA-BXUZGUMPSA-N 294.307 2.033 10 20 CECD CCc1onc(C)c1CNCc1ccc(C(=O)O)cc1O 1777000216 XMQWDYWZMKUYMX-UHFFFAOYSA-N 290.319 2.239 10 20 CECD COc1cccc(CN2CCC[C@H]2C(C)(C)O)c1O 154415529 GJEUBXXHPWEUGZ-ZDUSSCGKSA-N 265.353 2.136 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H]2C(C)(C)O)cc1 154448331 FVJAGDOCNLXYPC-OAHLLOKOSA-N 262.397 2.488 10 20 CECD C[C@H](NCc1ccc(N2CCCCC2)cc1)C(=O)O 49355078 MKKDQKZJUDJYIJ-LBPRGKRZSA-N 262.353 2.240 10 20 CECD COc1cccc(CNC2(CO)CCCCC2)c1O 53096118 COMZLJGNXPNAPQ-UHFFFAOYSA-N 265.353 2.186 10 20 CECD C[S@@](=O)C1(CNCc2cc(Cl)ccc2O)CC1 380172904 LTAUCRKGMOJZOU-QGZVFWFLSA-N 273.785 2.046 10 20 CECD COc1ccc(N2CCCN(C(=O)NC3CC3)CC2)cc1 55339313 PJQFLBHZGBZYIP-UHFFFAOYSA-N 289.379 2.079 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCc3[nH]ncc3C2)c1 186115100 ZVOMIEFVOHYSTR-ZYHUDNBSSA-N 287.363 2.332 10 20 CECD CN1CCC[C@@H](CNCc2cccc(Cl)c2O)C1 124812549 HDAAJOFFMWLHLE-NSHDSACASA-N 268.788 2.477 10 20 CECD CC[C@@H](NCC(=O)N(C)CC)c1ccc(N(C)C)cc1 186813471 YDOMKUCUTWKHJW-OAHLLOKOSA-N 277.412 2.272 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCOC2)c1 37738141 FYEHUCFLVKLYDN-WDEREUQCSA-N 251.326 2.088 10 20 CECD Cc1ccnc(N[C@@H](C)Cc2ccc(O)c(O)c2)n1 184146571 WSKRVGCUFQYEEF-JTQLQIEISA-N 259.309 2.239 10 20 CECD C[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CCS1 191931640 LBQNGPWFFHGODP-JOAKQRRISA-N 293.388 2.465 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](C)CCO)c1 97440108 NXGAXIUNOODUCV-QWRGUYRKSA-N 253.342 2.070 10 20 CECD CNCCNC(=O)c1cc(C)n(-c2ccccc2C)c1C 237107036 WOTQIGMLCIAHTO-UHFFFAOYSA-N 285.391 2.352 10 20 CECD COCCCCN[C@@H](C)c1cc(C(=O)OC)ccc1O 273444806 ZSVVLTUHBYAIAF-NSHDSACASA-N 281.352 2.256 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@@H](C)CC(N)=O)c1O 808703596 PCDWQEKDINWNNQ-DTWKUNHWSA-N 270.760 2.269 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@H](C)c1cc(C)ccc1O 724873382 PHPOSPFCSHUDPI-UXIGCNINSA-N 265.353 2.155 10 20 CECD CCC(=O)C1(C(=O)NCc2ccc(N(C)C)cc2)CC1 822227135 WNBGKKPJVUEKRD-UHFFFAOYSA-N 274.364 2.128 10 20 CECD O=C1CC[C@H]2CN(Cc3c(O)cccc3Cl)CC[C@H]2N1 827133907 XUHDXGXXWROJPD-GXFFZTMASA-N 294.782 2.146 10 20 CECD Fc1cc(CN2CC[C@H](F)C2)ccc1N1CCOCC1 824572548 ZNVCKFMTDVUIOY-ZDUSSCGKSA-N 282.334 2.206 10 20 CECD CN(C)c1ccc([C@@H](N)CNCc2ccc(CN)cc2)cc1 904353228 JJWVZFODBCIOJY-SFHVURJKSA-N 298.434 2.001 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccnnc1 839918622 BRYKZVRHUDITKP-CYBMUJFWSA-N 298.390 2.212 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2CCCNC2=O)cc1 839197092 ZVQFFKCVTUGRKO-OAHLLOKOSA-N 289.423 2.149 10 20 CECD COc1cccc(CN2CCCc3c(cnn3C)C2)c1O 840954658 LZGPQMGEZORBCH-UHFFFAOYSA-N 287.363 2.083 10 20 CECD C[C@H](NC(=O)NCCc1ccc(N)cc1)c1ccccn1 841632327 MMVJZWWMSRZLQZ-LBPRGKRZSA-N 284.363 2.267 10 20 CECD CC[C@@H](NCc1cc(Cl)c(F)cc1O)C(=O)O 843040282 UBUMHWKZHAIRNP-SECBINFHSA-N 261.680 2.138 10 20 CECD C[C@H]1CC[C@H](CCC(=O)NCc2ccc(O)cc2O)O1 910951257 QIMQBLBYWWBYCI-GXFFZTMASA-N 279.336 2.062 10 20 CECD CC(C)[C@H](CNCc1ccc(N(C)C)c(F)c1)C(=O)O 848638673 BNPBJJGQVVLGDA-LBPRGKRZSA-N 282.359 2.338 10 20 CECD Cc1cc(Br)c(O)c(CN(C)C2CC(N)C2)c1 843124556 BZIOFHGFUKKAEJ-UHFFFAOYSA-N 299.212 2.385 10 20 CECD C[C@@H]1CCC[C@@H](N(C)C(=O)C(=O)Nc2ccc(N)cc2)C1 841015745 LITBAEKUGQHGFE-BXUZGUMPSA-N 289.379 2.244 10 20 CECD Cc1ccc(C(=O)Nc2nccn2C2CC2)c(O)c1O 840568692 DKCJFWTXIMFCAK-UHFFFAOYSA-N 273.292 2.190 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1cc(Cl)ccc1O 841064756 IVYRCFYVBMTEAH-CABZTGNLSA-N 254.761 2.276 10 20 CECD NCc1ccc2c(c1)CCCN2CC[C@@H]1CCCNC1 843350043 IOOQMJWHADEPMT-AWEZNQCLSA-N 273.424 2.288 10 20 CECD Oc1ccccc1CN[C@H]1CCCC(F)(F)[C@@H]1O 840971650 RKEXWQZGRYFBIN-CMPLNLGQSA-N 257.280 2.031 10 20 CECD COC(C)(C)CC(=O)NCc1cc(Cl)ccc1O 846474625 XJWUMRXSMHXXNI-UHFFFAOYSA-N 271.744 2.477 10 20 CECD CCn1cc(CN[C@@H](C)c2cccc(OC)c2O)cn1 846152220 QMRUDENGCGUSAI-NSHDSACASA-N 275.352 2.468 10 20 CECD C[C@H](NC[C@@]1(O)CCO[C@H]1C)c1ccc(Cl)cc1O 841753365 SKXUPLFQKOWSHO-BHDSKKPTSA-N 285.771 2.236 10 20 CECD C[C@H]1C[C@@H](N[C@H](C)CCO)c2c(O)ccc(F)c21 756584993 IDVFHWQYDWHGLW-IQJOONFLSA-N 253.317 2.440 10 20 CECD C[C@H](NC[C@@H]1CCCN(C)C1)c1cc([N+](=O)[O-])ccc1O 756555117 RGWZWFNTZXZMAK-RYUDHWBXSA-N 293.367 2.293 10 20 CECD C=C/C=C/CCN1C(=O)CN(Cc2ccccc2O)C1=O 925076855 ZTWSMRNKRYUBQP-ONEGZZNKSA-N 286.331 2.289 10 20 CECD Cc1ccc(NC(=O)c2ccc(C)c(O)c2O)c(O)n1 756246113 PILODLSZATUZMZ-UHFFFAOYSA-N 274.276 2.068 10 20 CECD COC1CCN(CCNCc2c(O)cccc2Cl)CC1 751147463 BAEXNHWEAQULAV-UHFFFAOYSA-N 298.814 2.246 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CC[C@H](N)CC2)c1 870881689 GVGYFTAFSWVTDW-IJLUTSLNSA-N 292.379 2.096 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2N[C@@H]1CC[C@H](C(N)=O)C1 1117779000 CWQRAJSMMCSADS-RVMXOQNASA-N 288.391 2.493 10 20 CECD OC[C@H](Cc1ccc(F)cc1)NCc1cc(F)ccc1O 779100380 PKSVZLMCFCPGEL-HNNXBMFYSA-N 293.313 2.364 10 20 CECD COC(=O)CC1(NCc2ccc(N(C)C)c(F)c2)CCC1 777439279 BZGJXUDCYDBORB-UHFFFAOYSA-N 294.370 2.467 10 20 CECD CCc1nc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)co1 773744799 WHEWBRFHWFHZGZ-VIFPVBQESA-N 290.319 2.009 10 20 CECD C[C@H](N[C@@H]1CCN(C2CC2)C1)c1c(O)cccc1F 886522283 GKFHVNNRLHUGCV-WDEREUQCSA-N 264.344 2.419 10 20 CECD CCOc1ccc(CN2CC[C@H](C(=O)OC)[C@H]2C)c(O)c1 787420842 KYLZOKDNDKSCTL-RISCZKNCSA-N 293.363 2.174 10 20 CECD CC(C)OC(=O)CC[C@@H](C)NC(=O)c1cc(O)cs1 792682113 ITUXFOMZWKPJMG-SECBINFHSA-N 285.365 2.304 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2csc(O)n2)c1 792238618 SUZVOICSRVWORR-ZETCQYMHSA-N 294.332 2.054 10 20 CECD COC[C@@](C)(O)CNCc1cc(Cl)cc(Cl)c1O 69911646 CXFAZALHOUTWQX-LBPRGKRZSA-N 294.178 2.186 10 20 CECD C[C@H](OC1CCCCC1)C(=O)NCc1ccc(O)c(O)c1 1320158572 GPKIDLBXYDSGFP-NSHDSACASA-N 293.363 2.452 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCC[C@H]2CCO)c1O 1332004591 LYUBEQRRIXBRIG-GXTWGEPZSA-N 279.380 2.350 10 20 CECD C[C@@H](Nc1cc(N)ncn1)c1ccc(N(C)C)cc1 1337828523 BENMZQAVRIAEJQ-SNVBAGLBSA-N 257.341 2.298 10 20 CECD Cc1ccc(CN2CC[C@H](C)C[C@@H]2C(=O)O)c(O)c1 1600412764 KMEXLVYNXVAOAV-WCQYABFASA-N 263.337 2.386 10 20 CECD C[C@H](CC(F)F)C(=O)NCc1cccc(O)c1O 1548791547 PBRPJIXPKSOBHA-SSDOTTSWSA-N 259.252 2.005 10 20 CECD COc1ccc(O)c(CN[C@@H](CCO)C(C)(C)C)c1 231073218 NEGOJULONZPKGB-AWEZNQCLSA-N 267.369 2.288 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)Nc1ccccc1 6475594 IFAHMGOBYVTUFR-UHFFFAOYSA-N 272.304 2.462 10 20 CECD COc1ccc(CN[C@H](CN)CC(C)C)cc1C 841037648 BXUNBNFGLCRBRH-AWEZNQCLSA-N 250.386 2.467 10 20 CECD CNCCC1CCN(Cc2c(O)cccc2OC)CC1 843057157 FQFOHNZXUFGBJT-UHFFFAOYSA-N 278.396 2.222 10 20 CECD C[C@H](NC[C@]1(O)CCSC1)c1ccc(N(C)C)cc1 158174811 NCFRNPSSJVVGBQ-SWLSCSKDSA-N 280.437 2.271 10 20 CECD COc1ccc(CNC2CCN(C3CC3)CC2)c(O)c1 40906580 HCNBQHBJCIXAAH-UHFFFAOYSA-N 276.380 2.117 10 20 CECD CN(C)c1ccc(CNCCOCC(F)(F)F)cc1 70167120 FBRJWSVRMUHADU-UHFFFAOYSA-N 276.302 2.421 10 20 CECD COc1cc(F)cc(NC(=O)c2cccc(O)c2O)c1 312505827 CTZMJCFMWSYZLQ-UHFFFAOYSA-N 277.251 2.498 10 20 CECD CC(C)(C)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 55523021 YLDBVXWRQOZXKM-UHFFFAOYSA-N 294.370 2.325 10 20 CECD COCCN(C)C(=O)NCc1ccc(N2CCCC2)cc1 56876787 DMBKEQLFJLLKHD-UHFFFAOYSA-N 291.395 2.075 10 20 CECD COc1ccc(O)c(CNC(=O)NCCCOC(C)C)c1 172065072 CPQHWNVXYYLZEH-UHFFFAOYSA-N 296.367 2.015 10 20 CECD C[C@H](Nc1ncccn1)c1ccc(N2CCOCC2)cc1 68463381 QBAZAGJORFPQKH-ZDUSSCGKSA-N 284.363 2.486 10 20 CECD Cc1cccc2c1N[C@@H](c1cc3c(cc1O)OCO3)NC2=O 63495471 ARVXYZLQILROHP-OAHLLOKOSA-N 298.298 2.283 10 20 CECD C[C@H](CO)CCCNCc1ccc(N(C)C)cc1 230161411 QRQYNTSWRMOXIV-ZDUSSCGKSA-N 250.386 2.251 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2cncs2)cc1F 188416155 TZWCFEPCWOHFQF-UHFFFAOYSA-N 293.367 2.207 10 20 CECD Cc1nscc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186423545 IKNSLFMCUXNYLE-MRVPVSSYSA-N 292.360 2.224 10 20 CECD COc1ccc(O)c(CNC[C@H]2Cc3ccccc3O2)c1 38009539 PTIZQWLWAFOASY-OAHLLOKOSA-N 285.343 2.494 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](C)CO)cc1 125536429 HBBBYDSCDCBFDG-NSHDSACASA-N 272.348 2.205 10 20 CECD COc1ccc(N(C)CC2OCCO2)cc1Cl 182455556 XLFYPRRCZZPXEQ-UHFFFAOYSA-N 257.717 2.158 10 20 CECD CSC[C@](C)(O)CNCc1c(O)cccc1Cl 120646938 HZWHMKUGGSDGCQ-GFCCVEGCSA-N 275.801 2.249 10 20 CECD CC(C)(C)c1nnc(NC(=O)c2cccc(O)c2O)s1 186994316 FOMNJJDFFSFOBY-UHFFFAOYSA-N 293.348 2.499 10 20 CECD CCOc1cccc(CN(C)C(C)(C)C(=O)O)c1O 86762647 SXFMUHNAOQEVPX-UHFFFAOYSA-N 267.325 2.086 10 20 CECD C[C@H](NCc1cc2c(cc1O)OCO2)C(F)(F)F 288349791 BXJLBIOFZPAYRF-LURJTMIESA-N 263.215 2.161 10 20 CECD CC(=O)N(C)C1CCN(Cc2ccc(N(C)C)cc2)CC1 92538031 ADDZREIRDBSMHC-UHFFFAOYSA-N 289.423 2.195 10 20 CECD CCOCc1cc(CNC[C@@H](O)C2CC2)ccc1OC 265220019 GNNATAUNOOKDDJ-OAHLLOKOSA-N 279.380 2.092 10 20 CECD C[C@H](NCCC[C@@H](C)O)c1cc([N+](=O)[O-])ccc1O 278964382 BPWJSQKGZDDBJX-ZJUUUORDSA-N 268.313 2.112 10 20 CECD Cc1ccc(O)c(CN2CCN(C3CCC3)CC2)c1 271163539 GNOQJSNXRNDICR-UHFFFAOYSA-N 260.381 2.371 10 20 CECD CCN(CCO)Cc1ccc(N2CCCCC2)cc1 271020379 TVTBEPILKUQRSR-UHFFFAOYSA-N 262.397 2.491 10 20 CECD COc1ccc(N2CCN(c3nc(C)cnc3C)CC2)cc1 298209709 SYPJUSBYKTVRRG-UHFFFAOYSA-N 298.390 2.429 10 20 CECD OC[C@@]1(F)CCN(Cc2cc(Cl)cc(F)c2O)C1 802660520 OBHPGXNNDKKSSR-GFCCVEGCSA-N 277.698 2.091 10 20 CECD C[C@H]1C[C@@H](NCC(C)(C)OCCO)c2c(O)ccc(F)c21 806664424 PZZWUMKNMZRMRQ-CMPLNLGQSA-N 297.370 2.457 10 20 CECD CCOC1CC(COC(=O)/C=C\c2ccc(O)c(O)c2)C1 803400485 ZTTGEEMFMHPWAO-XQRVVYSFSA-N 292.331 2.469 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)OC[C@@H]1CCCO1 805005471 QGYWBVVGMMNINN-HNNXBMFYSA-N 292.379 2.466 10 20 CECD Cn1cncc1C(=O)NCc1ccc(N2CCCCC2)cc1 809635566 JCUCRPAAINSYHI-UHFFFAOYSA-N 298.390 2.340 10 20 CECD Cc1cc(CN[C@@H]2CCCC[C@H]2C(N)=O)ccc1N(C)C 815089361 DARCBXKLVLQAAC-HUUCEWRRSA-N 289.423 2.195 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)c3cc[nH]c3)C2)cc1 819582726 PHEZUMKOXYKQHS-ZDUSSCGKSA-N 299.374 2.280 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cncs2)c1 728979713 KYKCZCHJKQXXQC-MRVPVSSYSA-N 278.333 2.348 10 20 CECD COC(=O)C[C@H]1CCCCN1C(=O)c1cc(O)cs1 823317312 MMVFGWHBBWJNNV-SECBINFHSA-N 283.349 2.012 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CC(C)=NO2)cc1 822603494 UXEUPTTUAQGMHC-HNNXBMFYSA-N 289.379 2.314 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCCC[C@@H]2CCOC2)c1 825133721 LUVHLFOKXYKXHU-LLVKDONJSA-N 280.324 2.207 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1[nH]cnc1C 820879374 RQKHTIFRDFVKLT-UHFFFAOYSA-N 273.336 2.476 10 20 CECD CCn1nc(C)c(CN(C)c2ccc(OC)c(OC)c2)n1 824160784 IWPVPBYPWMVZOF-UHFFFAOYSA-N 290.367 2.260 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ncc[nH]1 824234575 NAGFCMYXJHWEGZ-UHFFFAOYSA-N 286.379 2.067 10 20 CECD Cc1cc(C)c(O)c(CN2CCC3(CC2)CNC(=O)O3)c1 902499559 PWUAVZMSNAHHFC-UHFFFAOYSA-N 290.363 2.083 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CC[C@@H]2CCCCN21 901125510 YESIKYUBAGGYHU-UONOGXRCSA-N 274.364 2.025 10 20 CECD Cn1c(-c2ccccc2)cnc1SC[C@H](O)CC(=O)O 739000145 WRHBARXSRMOFDM-LLVKDONJSA-N 292.360 2.015 10 20 CECD CCC[C@H](C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832292281 DWYKYKAALPVDGL-SWLSCSKDSA-N 277.412 2.305 10 20 CECD CCN1C[C@H](N[C@@H]2C[C@H](C)c3c(F)ccc(O)c32)CC1=O 834888909 CXPRBYMGZVZZTN-HOSYDEDBSA-N 292.354 2.290 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCc2cnc(C)o2)c1 840794101 CRTIEIFWDXZLMG-VIFPVBQESA-N 290.319 2.326 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@H]2NCC[C@H]2C1 843126606 LPYVMLNABLLSQC-JOYOIKCWSA-N 284.762 2.369 10 20 CECD CC(C)[C@H](CNCc1cccc(Cl)c1O)C(=O)O 848639752 KXVRPQFIDAZXNO-JTQLQIEISA-N 271.744 2.492 10 20 CECD CC[C@@H](NCCS(=O)(=O)C1CC1)c1ccc(C)cc1O 840878055 AFKCULKHRTVIEX-CQSZACIVSA-N 297.420 2.319 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CS[C@H](C)C2)c1O 840958567 MVFZRZVMPHVVHY-PSASIEDQSA-N 298.364 2.293 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@@H](C)CN1 843119708 DISFORNCDCKPQM-IUCAKERBSA-N 299.758 2.136 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1ccc(CO)o1 742371364 SJIOWCMNYBMUIU-UHFFFAOYSA-N 274.364 2.436 10 20 CECD C[C@H](CCN(C)C)NCc1cc(Cl)ccc1O 49553262 HANIRLMKTGNOSY-SNVBAGLBSA-N 256.777 2.475 10 20 CECD C[C@@H](Cn1ccnc1)NCc1cc(F)c(N(C)C)cc1F 858093565 BHOXURUHGYHBQT-NSHDSACASA-N 294.349 2.406 10 20 CECD CN(C)c1ccc(CNCc2cnc3n2CCC3)cc1F 850099771 XWNHTAYCYCJWFQ-UHFFFAOYSA-N 288.370 2.324 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCC[C@H]([S@@](C)=O)C1 850356370 OVIJNTMYTSYRMF-XAAFQQQXSA-N 297.420 2.180 10 20 CECD CN(C)c1ccc(CNC(=O)c2ncc3n2CCCC3)cc1 864573570 NUUIXLKYUQRIKJ-UHFFFAOYSA-N 298.390 2.215 10 20 CECD Cc1cc(O)nc(C(C)(C)NCc2cc(F)ccc2O)n1 862433588 YERFZFQVGJPTGK-UHFFFAOYSA-N 291.326 2.360 10 20 CECD C[C@H](c1ccc(N(C)C)cc1)N1C(=O)[C@@H]2CCCN2C1=O 761577954 ILYAKNRKJBOETC-RISCZKNCSA-N 287.363 2.240 10 20 CECD CC[C@@](C)(O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 935463622 KIBGIEPUMBTCHC-IAQYHMDHSA-N 264.369 2.091 10 20 CECD C[C@@H](N(C)Cc1cc2c(cc1O)OC[C@H]2O)C1(C)CC1 768463646 KWTAFDQCZGECTJ-QMTHXVAHSA-N 277.364 2.438 10 20 CECD CC[C@H]1CC[C@H](C(=O)NCc2cc(C)ccc2O)O1 862758134 PXDRVVBPQNCBMF-GXTWGEPZSA-N 263.337 2.274 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1cccc(Cl)c1O 761222466 JCJPYBZWUSGKCB-OLZOCXBDSA-N 285.771 2.329 10 20 CECD Cc1ccc(CN2CCC(N3CCOC3=O)CC2)c(O)c1 877640977 TVOARGFNXVOPGD-UHFFFAOYSA-N 290.363 2.117 10 20 CECD CCC[C@@](C)(O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 775411145 PFTJVUOMFYGXIP-MLGOLLRUSA-N 278.396 2.481 10 20 CECD C[C@@H](NC[C@H](O)COc1ccccc1)c1ccccc1O 775131817 WKFMYZQGNFPONS-KGLIPLIRSA-N 287.359 2.483 10 20 CECD Cc1cc(CN[C@H]2C[C@@H](O)C2(C)C)ccc1N(C)C 779414355 XTCDKBXTMKXRIO-LSDHHAIUSA-N 262.397 2.310 10 20 CECD CC[C@@H](NCCOCCN(C)C)c1ccc(N(C)C)cc1 774375415 AHKRINHXICHMGU-QGZVFWFLSA-N 293.455 2.372 10 20 CECD Cc1cccc(O)c1CN1CCn2c(nnc2C(F)F)C1 877642314 TZQOIDNJSDZAID-UHFFFAOYSA-N 294.305 2.246 10 20 CECD CC[C@@H](F)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 1120669847 GKMBQODMXSRDHX-OAHLLOKOSA-N 294.370 2.012 10 20 CECD CCOC(=O)c1cnc(S[C@@H](C)[C@@H](C)O)s1 390476027 JDDJOKCVKSRRSX-RQJHMYQMSA-N 261.368 2.181 10 20 CECD COC[C@H](CO)N[C@@H](C)c1cccc(C(F)(F)F)c1O 788804553 IRIGGKJPLKMNEH-IUCAKERBSA-N 293.285 2.069 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCC[C@H]2OC)c1O 894901307 AQKBDJYFQQAEPR-CHWSQXEVSA-N 265.353 2.366 10 20 CECD CC[C@H]1CN(Cc2cc(F)cc(F)c2O)CCO1 708421445 GFCUTMZVTRLNBK-NSHDSACASA-N 257.280 2.281 10 20 CECD CSC[C@H]1CCCN1C(=O)c1cccc(O)c1O 193138671 CDDJMWCIRSYPNC-SECBINFHSA-N 267.350 2.065 10 20 CECD CC(C)C[C@H](N)CC(=O)N(C)Cc1ccc(N(C)C)cc1 1340319720 LQUNIVLMHUGKPV-HNNXBMFYSA-N 291.439 2.475 10 20 CECD CO[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)CCO1 1262367328 QXOOWZNQCVLUAQ-INIZCTEOSA-N 276.380 2.092 10 20 CECD CC[C@@H](C)[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 1348502058 IJGPKAWOGAXTIL-QMTHXVAHSA-N 263.337 2.210 10 20 CECD CCOC[C@@H](NC(=O)NCc1ccc(N)cc1)C(C)C 1353493266 UWEBYDBTPPNYHD-CQSZACIVSA-N 279.384 2.129 10 20 CECD COCCN(C(=O)/C=C\[C@H]1CCCNC1)c1ccccc1 1579026999 MBQYTGPFWZMADD-FJVVXJACSA-N 288.391 2.222 10 20 CECD Nc1ccc(CCNC(=O)N2Cc3cccc(O)c3C2)cc1 1580443385 ANJQZAOFYGSAIE-UHFFFAOYSA-N 297.358 2.242 10 20 CECD Nc1ccc(CNC(=O)NC[C@H]2CCC3(CCC3)O2)cc1 1580445564 KJYIAKNPGYQNOK-CQSZACIVSA-N 289.379 2.170 10 20 CECD CCN(C)c1ccc(CN[C@@H](COC)CC(=O)O)c(C)c1 1776856592 FVTHBIHUDTUVIG-CQSZACIVSA-N 294.395 2.030 10 20 CECD COc1ccc(N(C)CC(OC)OC)cc1Cl 161534186 XYKRYKTWXHBRPR-UHFFFAOYSA-N 259.733 2.404 10 20 CECD C[C@@H](NCCc1cnn(C)c1)c1ccc(F)cc1O 128020463 VDQQDFKIAXKFDB-SNVBAGLBSA-N 263.316 2.158 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)[C@H]2CCOC2)c1 252806386 HBFOFZVAXVUPNA-SRVKXCTJSA-N 265.353 2.476 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)c2nncn2C)c1 37017587 CSQJKVFWYYXPHA-GHMZBOCLSA-N 260.341 2.241 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)Cn2ccnc2)c1 37157735 IKGIKPQDVNQYCH-NEPJUHHUSA-N 275.352 2.337 10 20 CECD Cc1ccc(O)c([C@H](C)NCCC(=O)NC(C)C)c1 181270489 LZTBSKDHTFGJQV-LBPRGKRZSA-N 264.369 2.266 10 20 CECD CN(Cc1ncc(Cl)n1C)c1ccc(N)cc1 700225922 VEHBNVRJJJQLNS-UHFFFAOYSA-N 250.733 2.292 10 20 CECD Nc1ccc(CN2CCC[C@@H](N3CCCC3)C2)cc1 382552679 JYLONPIQDQSSBT-MRXNPFEDSA-N 259.397 2.329 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccn(C)n1 115765518 DBMBSIQPGIYZDT-UHFFFAOYSA-N 287.367 2.116 10 20 CECD CC[C@H](C(=O)NCc1ccc(N(CC)CC)cc1)N(C)C 178006956 LHVWFRRBSXEEAZ-MRXNPFEDSA-N 291.439 2.489 10 20 CECD Cc1ocnc1C(=O)N1CCOc2cc(N(C)C)ccc21 173186671 LZDKZTXKQNLBKQ-UHFFFAOYSA-N 287.319 2.088 10 20 CECD CC(C)CONC(=O)NCc1ccc(N(C)C)c(F)c1 127811710 YYGHRVIYJXKIRL-UHFFFAOYSA-N 283.347 2.279 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)COC(C)(C)C 183123477 JKYVEMRZUSZVSR-UHFFFAOYSA-N 292.379 2.293 10 20 CECD CCOc1ccc(N(C)CCC2OCCO2)cc1 124386635 FTUOTATUQRKJBH-UHFFFAOYSA-N 251.326 2.285 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)[C@@H]1CCSC1 130542554 AQKJGWYYGTWSEM-MRXNPFEDSA-N 292.448 2.461 10 20 CECD COCCNc1nc(-c2ccc(O)c(O)c2)cs1 41863531 ZLLFRGAVGGQZFN-UHFFFAOYSA-N 266.322 2.280 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@H]2CCCOC2)c1 193596312 DJYGYJJSSFUJNA-VXGBXAGGSA-N 293.363 2.395 10 20 CECD CN(C)CCCNCc1cccc(Br)c1O 42411707 KDNKWKGSGYTJPJ-UHFFFAOYSA-N 287.201 2.196 10 20 CECD COc1cccc(CN(C)Cc2nccs2)c1O 93582588 PQITWYYYTHHRGC-UHFFFAOYSA-N 264.350 2.489 10 20 CECD CN(Cc1nccn1C(F)F)C(=O)Cc1ccc(N)cc1 237197031 LRUSWGQIAFAMHA-UHFFFAOYSA-N 294.305 2.062 10 20 CECD COCCC(=O)NCc1c(C)c2ccccc2n1C 348634897 PXAWVNTXVGIYQG-UHFFFAOYSA-N 260.337 2.139 10 20 CECD CCSCC[C@@H](C)NC(=O)c1c(F)ccc(O)c1O 276508235 AUHGFJQOEDWLBA-MRVPVSSYSA-N 287.356 2.498 10 20 CECD C[C@H]1C(=O)CC[C@H]1CC(=O)N(C)Cc1ccccc1O 279726441 CGFLBMZVFQPNRH-NEPJUHHUSA-N 275.348 2.356 10 20 CECD C[C@@H](O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 270834579 ULKCBUOTXGPHRL-CYBMUJFWSA-N 290.407 2.453 10 20 CECD C[C@H](NC1CCN(C)CC1)c1cc([N+](=O)[O-])ccc1O 273424088 STWPJWNRFIRLJE-JTQLQIEISA-N 279.340 2.045 10 20 CECD CCO[C@@H]1C[C@H](NCc2cccc(Cl)c2O)[C@@H]1OC 274934352 PCDRQVPXHKPIER-SCRDCRAPSA-N 285.771 2.328 10 20 CECD COC(C)(C)CC(=O)NCc1ccc(N(C)C)cc1 278162310 ANUAXERKZQETNE-UHFFFAOYSA-N 264.369 2.184 10 20 CECD COc1cccc(CN[C@H](C)CCn2cccn2)c1O 289186393 BASLMYWVIYMHRM-GFCCVEGCSA-N 275.352 2.166 10 20 CECD Cc1ncc(/C=C/C(=O)N2CCCc3n[nH]cc32)s1 280029937 FHJZZXCANJXHBF-SNAWJCMRSA-N 274.349 2.167 10 20 CECD CO[C@@H](C)CN(C)C(=O)NCc1ccc(N(C)C)cc1C 806820833 GUOUCSWLZGJSIC-ZDUSSCGKSA-N 293.411 2.237 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccncc1 808095949 YTPOBMMHOAOAMJ-UHFFFAOYSA-N 277.320 2.203 10 20 CECD Oc1ccccc1CN1CCC2(CC1)OCCCO2 293604505 JNKUEAJDPACHRH-UHFFFAOYSA-N 263.337 2.121 10 20 CECD CCCN1C[C@@H](CNCc2cc(C)ccc2O)CC1=O 817411007 LALDKHNUPQFQAU-CYBMUJFWSA-N 276.380 2.049 10 20 CECD Cc1ccc([C@H](C)NCCCCS(C)(=O)=O)c(O)c1C 818351527 TUKGKSLHWSYZLF-ZDUSSCGKSA-N 299.436 2.484 10 20 CECD COc1ccc(CNC(=O)c2ncccc2Cl)c(O)c1 816550226 LQMZGMPPOVZQBM-UHFFFAOYSA-N 292.722 2.379 10 20 CECD c1cc(N2CCOCC2)ccc1CN1CC[C@@H]2C[C@@H]2C1 827506686 KDNAQSVXBNHSJJ-HZPDHXFCSA-N 272.392 2.365 10 20 CECD COc1cc(O)c(CN2CC[C@@H](CCCO)C2)cc1OC 825337683 HZZZXDZUAWFGRV-GFCCVEGCSA-N 295.379 2.004 10 20 CECD CN(C)c1ccc(CN(C)S(=O)(=O)C2(C)CC2)cc1 820779158 CUEAKXCOSLAXJP-UHFFFAOYSA-N 282.409 2.067 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2c(O)ccc3ccncc23)C1 828028919 IGBIFTVUUNJPMN-INIZCTEOSA-N 286.331 2.237 10 20 CECD NCC[C@H](NCc1ccc2c(c1)CCCO2)C(F)(F)F 904358316 KVPOZRUDEPCHCW-ZDUSSCGKSA-N 288.313 2.381 10 20 CECD Cc1cc(N(C)C)ccc1CN(CC(=O)O)C(C)C 901977136 MPNAKVSFCZKXON-UHFFFAOYSA-N 264.369 2.356 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)CCCN)cc1 841716634 CEGIUUQQAQARQM-UHFFFAOYSA-N 292.427 2.023 10 20 CECD CCOc1ccc(CN[C@@H]2CCC[C@H](N)C2)c(O)c1 841054629 FVRRXICRXYJECQ-QWHCGFSZSA-N 264.369 2.150 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cc2nnc(C)n2cn1 840264716 XUMONXAJHJCZRK-UHFFFAOYSA-N 296.378 2.419 10 20 CECD Cc1ccc(C(=O)N2CCC[C@H](OC(C)C)C2)c(O)c1O 846367610 RRGGUQHEPKCVHN-LBPRGKRZSA-N 293.363 2.436 10 20 CECD CC[C@@H](NCc1cc2c(cc1O)OCO2)C1CCOCC1 746054258 PHRNEJLCTSTOSI-CYBMUJFWSA-N 293.363 2.416 10 20 CECD C[C@@H]1NCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@@H]1C 843058862 ZZKWRYHBZLSGAB-DTWKUNHWSA-N 299.758 2.136 10 20 CECD COCCCCN(C)C(=O)NCc1ccc(N(C)C)cc1 841717847 WWLZKYXGLZYZAI-UHFFFAOYSA-N 293.411 2.321 10 20 CECD c1cc2c(cc1CNCCC[C@H]1CCCN1)CCO2 841073711 WHWQFZYITYBBIF-HNNXBMFYSA-N 260.381 2.243 10 20 CECD CC[C@H](N[C@@H](CO)CCF)c1ccc(F)cc1O 846207529 CRSKRGHODKRBLJ-PWSUYJOCSA-N 259.296 2.293 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1=CCCCO1 846477590 VCXVAASQYQZQJK-UHFFFAOYSA-N 267.712 2.356 10 20 CECD CCOc1cccc(CN[C@H]2CC[C@@H](CN)C2)c1O 841084552 KQASXBZLPFYHSK-YPMHNXCESA-N 264.369 2.008 10 20 CECD Cc1cc(Br)cc(CN[C@H]2CCCNC2)c1O 841042248 HEKVCWAOVJEGSZ-LBPRGKRZSA-N 299.212 2.305 10 20 CECD COC[C@@H](C)CNCc1cc(F)c(N(C)C)cc1F 858108309 BOBYIOROOVBKGK-JTQLQIEISA-N 272.339 2.403 10 20 CECD CN(CCNCc1ccc(N(C)C)c(F)c1)CC(F)F 858336334 DFNBJRUVVYYXJN-UHFFFAOYSA-N 289.345 2.178 10 20 CECD COc1cccc([C@H](C)NC[C@H](CO)CC2CC2)c1O 850546412 LRXZEBHZRGDWHP-WCQYABFASA-N 279.380 2.460 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)CCCF 854988038 OQMCTKXMAKJUPY-UHFFFAOYSA-N 297.326 2.034 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2C[C@@H]2C)cc1 754150437 RVTJYGZMRAUFHD-NWDGAFQWSA-N 263.337 2.331 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccc(F)nc1 935947097 SRBJTPAPPIPKBI-UHFFFAOYSA-N 295.310 2.342 10 20 CECD CCN(CCN)Cc1cc(C)cc(Br)c1O 863644510 YRPLANMCCPNSDE-UHFFFAOYSA-N 287.201 2.244 10 20 CECD CCN(CCC1CC1)Cc1cc2c(cc1O)OC[C@@H]2O 760537057 AKNKKFYIOHJJHM-HNNXBMFYSA-N 277.364 2.440 10 20 CECD CCC(O)(CC)CN(C)Cc1c(O)cccc1OC 862538571 ASIMIHRUCTVLKB-UHFFFAOYSA-N 267.369 2.384 10 20 CECD C[C@H](CCN(C)C)NC(=O)N[C@H](C)c1ccccc1O 868366662 TZMTXBADJHSHBC-VXGBXAGGSA-N 279.384 2.093 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cn(C)nc2C2CC2)c1 862756240 UNVDIGMBMSTBRL-UHFFFAOYSA-N 285.347 2.242 10 20 CECD Oc1cc2c(cc1CN(CC(F)F)C1CC1)[C@H](O)CO2 768451023 LKUZLPGNUPJYEZ-GFCCVEGCSA-N 285.290 2.048 10 20 CECD Cc1ccc(CN[C@@H]2CCO[C@]3(CCOC3)C2)c(O)c1 877132819 OKUNPWRRNWALRT-GDBMZVCRSA-N 277.364 2.128 10 20 CECD CC(=O)c1cccc(C(=O)NCc2ccc(O)c(O)c2)c1 778919694 JYKWTAHQMUTIKV-UHFFFAOYSA-N 285.299 2.230 10 20 CECD CCCOc1ccc(CNCCCS(C)(=O)=O)cc1C 873042186 NBZNCKKZIAFFOX-UHFFFAOYSA-N 299.436 2.308 10 20 CECD CC(C)CN1CCN(Cc2ccccc2O)[C@H](C)C1=O 779202421 OHGHZPCKCZUISZ-CYBMUJFWSA-N 276.380 2.081 10 20 CECD CCO[C@H](C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773013050 ZHQJHUWBPZPRIK-NWDGAFQWSA-N 264.369 2.355 10 20 CECD CCN(C)c1ccc(CN(C)CC2(O)CCC2)cc1 773843718 DKCRDLWPQIHVHW-UHFFFAOYSA-N 262.397 2.490 10 20 CECD CCOc1ccc(CN[C@@H](CC(C)C)C(=O)OC)c(O)c1 895590749 KVUXWZWOQNVTSN-AWEZNQCLSA-N 295.379 2.468 10 20 CECD CCc1c(C)nc2ncnn2c1NCc1ccccc1O 892160626 AIVPZVHRIDHCSN-UHFFFAOYSA-N 283.335 2.313 10 20 CECD CCOc1cccc(CN2CCC[C@@H](OC)C2)c1O 91772489 JSRWOMYPLMBWJW-CYBMUJFWSA-N 265.353 2.402 10 20 CECD CCOc1cccc(CN2CC[C@@H](COC)C2)c1O 211515762 PMOJKHRWFWKKGD-GFCCVEGCSA-N 265.353 2.259 10 20 CECD CCN(CC)CCO[C@H]1CCN(Cc2ccc(N)cc2)C1 1335288924 KHKLFEUEENDEGP-KRWDZBQOSA-N 291.439 2.202 10 20 CECD Cc1ccc(CCNC(=O)NCc2ccc(N)cc2)cn1 1338519761 NIGVJQWDTLWFBU-UHFFFAOYSA-N 284.363 2.014 10 20 CECD Nc1ccc(CN2CCC[C@H](c3cc[nH]n3)C2)cc1 1345159510 JFWUSMKPYNIFAJ-ZDUSSCGKSA-N 256.353 2.372 10 20 CECD CCCN(C)C[C@H]1CCN(Cc2ccc(N)cc2)C1 1262487675 AEAPLEBVPLNEJW-OAHLLOKOSA-N 261.413 2.433 10 20 CECD CC[C@@H](NC[C@H](C)C(=O)O)c1ccc(C)cc1O 1603585364 AOAOOFSKGGHCKP-CMPLNLGQSA-N 251.326 2.462 10 20 CECD CN(C)c1cc(F)c(CN2CC[C@H]3CC[C@]32CN)cc1F 1578423087 PGYHIPSEOCTYHU-WBMJQRKESA-N 295.377 2.344 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1c(O)ccc2ccncc12 1589440986 HEPLFZQXQXTWOW-CYBMUJFWSA-N 274.320 2.235 10 20 CECD CCN1CCc2cc(CNC3CC(C(=O)O)C3)ccc21 1776877420 FDFOEXLYCRVRNX-UHFFFAOYSA-N 274.364 2.022 10 20 CECD CCN1CCc2cc(CNc3cnc(C(=O)O)cn3)ccc21 1776878018 MGQPVMORHHPJGI-UHFFFAOYSA-N 298.346 2.169 10 20 CECD COc1ccc(O)c(CNCCCn2nc(C)cc2C)c1 164419204 PTPYBUGXJXAAHB-UHFFFAOYSA-N 289.379 2.394 10 20 CECD Cc1ccc(F)cc1C(=O)NCc1ccc(O)c(O)c1 159047228 FBRBRBWKQGAOGI-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CN(C)c1ccc(NC(=O)c2cccc(O)c2O)cc1 126268224 OFWVBDCJHYUXSU-UHFFFAOYSA-N 272.304 2.416 10 20 CECD COc1ccc(NC(=O)c2cccc(O)c2O)cc1F 126252087 UYGSPHSZYUEJGK-UHFFFAOYSA-N 277.251 2.498 10 20 CECD COCCO[C@@H]1CCCN(Cc2cc(C)ccc2O)C1 802653032 NMNXCYGFKCNHCT-OAHLLOKOSA-N 279.380 2.328 10 20 CECD CCOc1cccc(CNCC(C)(C)N(C)C)c1O 20125781 BHIAPABOMWWKGC-UHFFFAOYSA-N 266.385 2.221 10 20 CECD Cc1ccc(O)c([C@H](C)NCCCN2CCOCC2)c1 35628870 IDLOKMCWBDKNIF-AWEZNQCLSA-N 278.396 2.074 10 20 CECD C[C@H](CN1CCCC1=O)NCc1cc(Cl)ccc1O 37782005 HKIZFGBIYRDJIU-SNVBAGLBSA-N 282.771 2.146 10 20 CECD C[C@@H]1CCC[C@@]1(O)CNCc1ccc(N(C)C)cc1 293165400 VWXRMZPUCKVILD-CZUORRHYSA-N 262.397 2.393 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H]3NCC[C@H]3C2)c1O 313194470 MSPBLWQLPPKCCZ-GWCFXTLKSA-N 296.798 2.238 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H](CF)C1)OCO2 711495500 GDTZKAROOWQGPW-SNVBAGLBSA-N 267.300 2.302 10 20 CECD C[C@H](N[C@H](CO)CC(F)(F)F)c1ccccc1O 717816835 BKWWDRVYHNGXAW-IUCAKERBSA-N 263.259 2.356 10 20 CECD OCC[C@H](NCc1cccc(Cl)c1O)C(F)(F)F 894852788 VZGIHIWMKXYVNT-VIFPVBQESA-N 283.677 2.449 10 20 CECD CCN(CC)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1729013 ZYXURUJGOKPLQF-UHFFFAOYSA-N 291.395 2.279 10 20 CECD COc1cccc(CNC(=O)[C@H]2C[C@@H]2C2CC2)c1O 176130891 JFEBKFZGBBCOOW-NEPJUHHUSA-N 261.321 2.063 10 20 CECD COc1ccc(N2CCN(c3cncc(C)n3)CC2)cc1 61928839 OZXSZLAGKQPSPH-UHFFFAOYSA-N 284.363 2.120 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)OCC1CC1 115280474 FVOZUXLRBSAWBT-ZDUSSCGKSA-N 290.407 2.492 10 20 CECD CCOc1ccc(O)c(CN2CCCO[C@@H](C)C2)c1 179400753 QNCSQZFILJMLMQ-LBPRGKRZSA-N 265.353 2.402 10 20 CECD Cc1cccc(C[C@@H](CO)NCc2ccccc2O)c1 189017245 CALVMWRCGSQHGB-INIZCTEOSA-N 271.360 2.394 10 20 CECD CC1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCS1 180851609 IKTCXLHBOSNCGN-GQCTYLIASA-N 293.388 2.465 10 20 CECD COC(=O)COc1ccc(N(C)Cc2cccnc2)cc1 183811679 DRTPLVVOWJJOLR-UHFFFAOYSA-N 286.331 2.270 10 20 CECD COC[C@H]1CCCN(Cc2cc(F)ccc2O)C1 180139695 DSPKASUIITUFNS-NSHDSACASA-N 253.317 2.390 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ncc(F)cc1F 192166275 DYLBCJVVGWTWLF-UHFFFAOYSA-N 278.258 2.338 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2CCOc3ccccc32)cc1 237941630 CATICWMGMGOGQT-MRXNPFEDSA-N 296.370 2.494 10 20 CECD COc1ccc(O)c(CNC[C@]2(C)CCCO2)c1 94798390 CWBCJISLGDQTRQ-AWEZNQCLSA-N 251.326 2.060 10 20 CECD COC[C@H](O)CN[C@H](C)c1ccc(N2CCCCC2)cc1 268893234 KCFRMSNIOLUBLR-RHSMWYFYSA-N 292.423 2.335 10 20 CECD C[C@H](NCC(C)(C)N(C)C)c1cc([N+](=O)[O-])ccc1O 273423074 SNGILFYYRDYVRM-JTQLQIEISA-N 281.356 2.291 10 20 CECD C[C@H](NCCC(C)(C)O)c1ccc(N2CCOCC2)cc1 271782296 IEEWFCTYAXVNBY-AWEZNQCLSA-N 292.423 2.335 10 20 CECD COC(=O)[C@H](NCc1ccc(OC)c(C)c1)C1CC1 272785695 BTXJDPBBARLWRN-CQSZACIVSA-N 263.337 2.045 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H](CO)[C@@H]2CCOC2)c(O)c1 284940799 DUTQUSDYPAIOMS-ZNMIVQPWSA-N 293.407 2.305 10 20 CECD CCC[C@@]1(CO)CCN(Cc2cc3c(cc2O)OCO3)C1 377835234 RYHFYDRRRZUHJP-MRXNPFEDSA-N 293.363 2.105 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)NC2CC2)cc1 296486033 QIJIFNABEPDFLB-CYBMUJFWSA-N 289.423 2.290 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H](C)S(C)(=O)=O)c(O)c1 815598248 QBYIXZWRXWRWLV-VXGBXAGGSA-N 285.409 2.093 10 20 CECD Cc1cc(O)c(CN[C@H](CO)C2CC2)cc1Cl 825291201 GQXCDKLGMSJRFI-GFCCVEGCSA-N 255.745 2.215 10 20 CECD C[C@H](NCc1ccccc1O)C(=O)NCCc1ccccc1 825035352 HDJRCHRGTPZUFW-AWEZNQCLSA-N 298.386 2.229 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3cc(F)ccc32)cn1 492858051 LFAQRCJGSJQEPR-DJWKRKHSSA-N 299.305 2.227 10 20 CECD C/C=C/[C@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 900404860 OSKOVCVIDNZBPB-MRKPZDFFSA-N 288.391 2.230 10 20 CECD Cc1cc(C(N)=O)ccc1NC(=O)c1cc(O)cs1 732270241 RXNRLRKULLMPBZ-UHFFFAOYSA-N 276.317 2.113 10 20 CECD CC[C@H](N[C@@H](C)CC(=O)NC)c1ccc(C)cc1O 834898659 ATVNGDOAAKENNX-AAEUAGOBSA-N 264.369 2.266 10 20 CECD CN(CC1CC1)C[C@@H]1CCN(C(=O)c2cc(O)cs2)C1 746409920 SVLQGVBVZYJADJ-LBPRGKRZSA-N 294.420 2.258 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC23CCNCC3)cc1F 841078696 IQIRDSFQXOIZBG-OAHLLOKOSA-N 277.387 2.123 10 20 CECD CC(C)C[C@H](CCO)CNC(=O)c1cc(O)cs1 748398649 PABWVIHARIVCGT-JTQLQIEISA-N 271.382 2.228 10 20 CECD COCC[C@H](C)CNCc1cc([N+](=O)[O-])ccc1O 840954780 KBDHUQPPAGDAMC-JTQLQIEISA-N 268.313 2.063 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)C[C@@H](C)N)c1 843129233 OEEQVDNNUHVJCN-MNOVXSKESA-N 252.358 2.006 10 20 CECD Nc1ccc(Cc2noc([C@H]3C[C@H]4CC[C@H]3O4)n2)cc1 843158951 JFGGVQKPKFYHSS-FRRDWIJNSA-N 271.320 2.278 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CC[C@@H](CN)C2)c1O 841083246 ABBGIZPKCOAIOV-SKDRFNHKSA-N 284.787 2.271 10 20 CECD Cc1n[nH]c(C)c1CN1CCCc2cc(CN)ccc21 843057763 UIQQEBPMQJBGTF-UHFFFAOYSA-N 270.380 2.438 10 20 CECD CNC[C@H]1CCCN1Cc1c(O)ccc(Cl)c1F 843055240 HKLBQAZFLAPCBQ-SECBINFHSA-N 272.751 2.369 10 20 CECD COc1cccc([C@@H](C)NC2COC(C)(C)OC2)c1O 846162440 HKJNOWQZFKCJEG-SNVBAGLBSA-N 281.352 2.203 10 20 CECD CC[C@@H](NCCN1CCCC1=O)c1ccc(F)cc1O 846206588 QILIWYFYXOEWHF-CYBMUJFWSA-N 280.343 2.194 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CC(=O)NC(C)C 840910243 OWRVEWPATROCGI-UHFFFAOYSA-N 277.412 2.017 10 20 CECD COc1ccc(O)c(CNC[C@@H](C)C(=O)OC(C)(C)C)c1 848926054 KGUDTURZCBVRHK-LLVKDONJSA-N 295.379 2.468 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCC[C@@H](N)C2)c1O 841057298 IWXCDHQJACVKNB-VXGBXAGGSA-N 284.787 2.414 10 20 CECD Cn1ccnc1[C@@H]1N(C(=O)Cc2ccc(N)cc2)CC1(C)C 852873360 TWGDEHGPMONLAT-HNNXBMFYSA-N 298.390 2.155 10 20 CECD CCN(CC[C@@H]1CCS(=O)(=O)C1)c1ccc(OC)cc1 760850883 IDDJSYSNNYSLQZ-CYBMUJFWSA-N 297.420 2.346 10 20 CECD COc1cccc(CNc2cncc(N(C)C)c2)c1O 865669074 WVFWAASJBLNYRA-UHFFFAOYSA-N 273.336 2.474 10 20 CECD CN1CCCN(Cc2cc(F)c(N(C)C)cc2F)CC1 862210214 CZPONYAQCPVKSA-UHFFFAOYSA-N 283.366 2.168 10 20 CECD C[C@H](NC(=O)[C@H]1CCCO1)c1ccc(N(C)C)cc1 772994942 AAVURCBFSBLNTC-SMDDNHRTSA-N 262.353 2.109 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)CO 776636854 KJAVTZQNAJWNBZ-UHFFFAOYSA-N 278.396 2.120 10 20 CECD CCN(C)c1ccc(CN(C)[C@H](C)C[S@@](C)=O)cc1 773839839 OATVSKHYQQVQAI-BFUOFWGJSA-N 282.453 2.342 10 20 CECD C[C@@H](NCCC(=O)Nc1ccccn1)c1ccccc1O 783499803 BKOKWBNETYBYQV-GFCCVEGCSA-N 285.347 2.467 10 20 CECD Cc1ccc(C(=O)Nc2scnc2C)c(O)c1O 780970533 YSFAUCZUMDIBOE-UHFFFAOYSA-N 264.306 2.423 10 20 CECD Oc1c(F)cc(F)cc1CN1CCCc2n[nH]cc21 894589969 NZNAMZBBTAJBNN-UHFFFAOYSA-N 265.263 2.346 10 20 CECD COc1ccc(CN2CCC[C@@H]3COC[C@@H]32)c(O)c1OC 894862782 JRKSANVBAACGHG-OLZOCXBDSA-N 293.363 2.020 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN3CCC[C@@H]3C2)c1O 894188227 SHZFOFNGEQCMEV-LSDHHAIUSA-N 290.407 2.426 10 20 CECD O=C(N[C@@H]1CCc2c(O)cccc21)c1cccc(O)c1O 790640321 NNOPQGDJZSPKEQ-GFCCVEGCSA-N 285.299 2.221 10 20 CECD C[C@@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)C1CC1 798637972 HXYLDBUHTQOUGW-SEYNBYMXSA-N 276.288 2.022 10 20 CECD Cn1cc(CCNCc2c(O)ccc(Cl)c2F)cn1 790951833 QTRYUAQJJXNFBX-UHFFFAOYSA-N 283.734 2.251 10 20 CECD Cc1cnc(CNCc2cccc(Br)c2O)[nH]1 693480511 DPBYNXZZQDDZJV-UHFFFAOYSA-N 296.168 2.476 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CCn2ccnc2C1 779191109 FGLPVLXWGDCIMC-NSHDSACASA-N 277.755 2.347 10 20 CECD Cn1c(-c2ccccc2)cnc1SC[C@@H]1CNC(=O)C1 1327515973 FRKRHFKUEQSIRD-NSHDSACASA-N 287.388 2.315 10 20 CECD COc1ccc(CNCc2ncc(C)s2)c(O)c1OC 1334964798 KWASRJDZWGNBHG-UHFFFAOYSA-N 294.376 2.464 10 20 CECD CCc1nc([C@@H](C)Sc2ncc(C(=O)O)s2)n[nH]1 1605842271 FJMSSSMOTRPZIG-RXMQYKEDSA-N 284.366 2.375 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCc2cc(F)c(F)cc2O)C1 1606395659 CRZNJWPXMJQUOU-APPZFPTMSA-N 271.263 2.013 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2cc(C)c(C)cc2O)C1 165139338 OYYHCTSMUAYHKX-HNNXBMFYSA-N 290.407 2.309 10 20 CECD Cc1ccc(CN[C@@H](C)Cc2cnn(C)c2)c(O)c1 877570397 HNQZGTNZHGKQQW-LBPRGKRZSA-N 259.353 2.155 10 20 CECD CC[C@@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2O)C[C@H]1O 270835112 DDYJJRNICYVRPI-QMTHXVAHSA-N 297.782 2.451 10 20 CECD CO[C@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)C1(C)C 300642285 SZOXRNGAMWTCJW-RYUDHWBXSA-N 263.341 2.204 10 20 CECD OC[C@@H](CC(F)(F)F)N[C@@H]1CCc2cccc(O)c21 717745474 QOIFSXOMQAVMJY-NXEZZACHSA-N 275.270 2.282 10 20 CECD CN(C)C1(CNCc2cc3c(cc2O)OCO3)CCCC1 112016939 WBZYVAPMEJBICV-UHFFFAOYSA-N 292.379 2.085 10 20 CECD CCCCS(=O)(=O)NCc1ccc(N(C)C)cc1C 115592864 PPBMFRRUKQJZJJ-UHFFFAOYSA-N 284.425 2.281 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2[C@@H](C)C2(F)F)c1 1352464787 IYSDYZAXBWMENA-KCJUWKMLSA-N 255.264 2.218 10 20 CECD CCOC(C)(C)CNC(=O)NCc1ccc(N(C)C)cc1 187203115 ADOOTOYZXDMPNZ-UHFFFAOYSA-N 293.411 2.367 10 20 CECD O=C1N[C@H](c2cc(F)ccc2O)Nc2ccccc21 193497439 OUERBGMSTHGWDG-CYBMUJFWSA-N 258.252 2.385 10 20 CECD COc1cc(Cl)cc(CN(C)CC2CC(O)C2)c1O 191159352 ZUCNXYOKBOVWGD-UHFFFAOYSA-N 285.771 2.257 10 20 CECD COc1cc(N2CCC[C@H](OC)C2)c([N+](=O)[O-])cc1OC 91688613 HXCYLZWDZKSSFN-JTQLQIEISA-N 296.323 2.227 10 20 CECD C[C@@H](NCc1nnc2n1CCC2)c1ccc(N(C)C)cc1 268789012 XBAVSYNVPBXZBV-GFCCVEGCSA-N 285.395 2.141 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccn(C)c2)cc1 267064936 MXOJISUONRMSDO-UHFFFAOYSA-N 286.379 2.091 10 20 CECD C[C@H](NC[C@H](O)CN1CCCC1)c1cc(Cl)ccc1O 273383848 IVOFPZIJKWOLMX-AAEUAGOBSA-N 298.814 2.153 10 20 CECD CC(=O)C(=O)CSc1nc(C)c(C)n1CC(C)C 289530160 DSZDLRBXVZSNHL-UHFFFAOYSA-N 268.382 2.406 10 20 CECD COc1cccc(CNC(=O)C(C)(C)CSC)c1O 282439417 JMDRQTQUHFCHAO-UHFFFAOYSA-N 283.393 2.406 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H](CO)[C@H]2CCOC2)c(O)c1 284940787 DUTQUSDYPAIOMS-KKUMJFAQSA-N 293.407 2.305 10 20 CECD CCNC(=O)C[C@@H]1CCCCN1Cc1cccc(F)c1O 285303787 VZRCNXPIRRHFLG-ZDUSSCGKSA-N 294.370 2.412 10 20 CECD Cc1cc(C(=O)N(C)C2CC(N)C2)c(C)n1-c1ccccn1 294716418 APGPTWKCEISPQW-UHFFFAOYSA-N 298.390 2.051 10 20 CECD CCCCN(Cc1ccccc1O)c1ccc2nnnn2n1 800886744 IHMBSTLMNMXMGA-UHFFFAOYSA-N 298.350 2.032 10 20 CECD COCC1(COC(=O)c2cccc(O)c2O)CCC1 812594058 YXUVLRRLGBWDKT-UHFFFAOYSA-N 266.293 2.071 10 20 CECD CCO[C@@H](CC(=O)NCCc1ccc(N)cc1)C(C)C 818546114 RMCNJOUGIBBBRF-HNNXBMFYSA-N 278.396 2.379 10 20 CECD Cn1nc(C2CC2)cc1CNCc1ccccc1O 823752454 GCAJBTHSZUVHMI-UHFFFAOYSA-N 257.337 2.293 10 20 CECD Cc1cc(O)c(CNCCC2(O)CCOCC2)cc1Cl 825886187 NASSQLOYLSDDBS-UHFFFAOYSA-N 299.798 2.375 10 20 CECD COc1cc(CN(C)CCC(N)=O)c(O)c(C(C)(C)C)c1 825893318 VTOKQFBPIJXQMR-UHFFFAOYSA-N 294.395 2.006 10 20 CECD CC[C@@H]1C[C@H]1CNC(=O)NCc1cccc(OC)c1O 838665584 PPVXHABGEVFIID-PWSUYJOCSA-N 278.352 2.246 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@H](C)c1ccc(C)c(C)c1O 903300319 YBPCOAWREFFIPX-BPLDGKMQSA-N 279.380 2.464 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCN(CC(F)F)C2)cc1C 841894872 ZCPYTUIPSUAGLE-CYBMUJFWSA-N 284.350 2.438 10 20 CECD CCC[C@@H](O)CC(=O)NCc1cc(Cl)ccc1O 846476775 QAGPHNHNJJTINB-LLVKDONJSA-N 271.744 2.213 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1cccc(Cl)c1O 844937956 QZRULSRIYCGCKA-JTQLQIEISA-N 257.717 2.341 10 20 CECD CC[C@]1(C)CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841054248 VUKQNDLOQPWXLF-MRXNPFEDSA-N 289.379 2.246 10 20 CECD CC1(N)CCN(Cc2cc(Cl)cc(F)c2O)CC1 843108036 QXRZXHPVVFCENI-UHFFFAOYSA-N 272.751 2.498 10 20 CECD CCn1nccc1CN[C@@H](C)c1cccc(OC)c1O 853239591 IKIOUEHZTADJPL-NSHDSACASA-N 275.352 2.468 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H](C)c1cc(F)cc(F)c1O 756595140 UFDDTDFUNUJNAQ-DNSOKLHBSA-N 291.363 2.433 10 20 CECD COC[C@@H](C)CC(=O)NCc1ccc(N(C)C)cc1 755060790 ORBDQJFYMMLWLH-LBPRGKRZSA-N 264.369 2.041 10 20 CECD CCOc1ccc(CN2CCOC[C@@H]2C)c(O)c1 768770559 JLQLSAPZRSOSQO-NSHDSACASA-N 251.326 2.012 10 20 CECD CCn1ccc(NC(=O)NCc2cc(C)ccc2O)n1 861214648 LGGXBDBCVFITDL-UHFFFAOYSA-N 274.324 2.239 10 20 CECD CCOc1ccc(CN2CC[C@H](C(=O)O)[C@@H](C)C2)c(O)c1 863740560 XREQEGMGYBCZHH-FZMZJTMJSA-N 293.363 2.334 10 20 CECD CS[C@@H](C)CC(=O)NCc1cc(C)ccc1O 862758205 SMWZYEXPFAVWFA-JTQLQIEISA-N 253.367 2.458 10 20 CECD CN1CCN(c2ccc(CN3CC=CCC3)cc2F)CC1 1116506810 HOXWTBVYUASZIH-UHFFFAOYSA-N 289.398 2.339 10 20 CECD COc1cc(/C=C2\SC(=S)NC2=O)ccc1[N+](=O)[O-] 770568027 IVVSAWUXZFKKSH-UITAMQMPSA-N 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YUMVUJHTPBAETN-CYBMUJFWSA-N 284.363 2.486 10 20 CECD CCOc1cccc(CN(C)CCn2cccn2)c1O 125275466 BLWQLACOZWILER-UHFFFAOYSA-N 275.352 2.119 10 20 CECD CCN(CCCO)Cc1cc(Br)ccc1O 76118534 SDUQTUVRVAMLAT-UHFFFAOYSA-N 288.185 2.359 10 20 CECD C/C=C/C[C@@H](CO)N[C@H](C)c1cc(OC)ccc1O 186520289 YTLTYINZTHCIDD-RVAOTSRCSA-N 265.353 2.379 10 20 CECD CCN1CCN(Cc2cc(F)ccc2O)[C@H](C)C1 289186230 AOGHHHPUTGLORB-LLVKDONJSA-N 252.333 2.057 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2(SC)CC2)c1 190724249 QNIAHKNLBOBBGM-SECBINFHSA-N 281.377 2.474 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2CC[C@H](C)O2)cc1 191085918 AXKCNBTVTSHWEO-WFASDCNBSA-N 293.363 2.242 10 20 CECD COc1cc(Cl)cc(CNc2cnn(C)c2)c1O 228673067 IGADKENYCCURCD-UHFFFAOYSA-N 267.716 2.400 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H](C)O 93143171 QQESLVBHSDQWEH-CYBMUJFWSA-N 250.386 2.344 10 20 CECD Cc1ccc([C@@H](C)NCC2(C(N)=O)CCCC2)c(O)c1 273604677 SVNMSCMTQZCGNC-GFCCVEGCSA-N 276.380 2.397 10 20 CECD C[C@H](O)CCCN[C@H](C)c1ccc(F)c(F)c1O 279124660 QKQHZJWIWWCIBM-DTWKUNHWSA-N 259.296 2.482 10 20 CECD CCCCN(CCOCCO)Cc1ccccc1O 282443845 LCZKARVWIHDBQY-UHFFFAOYSA-N 267.369 2.003 10 20 CECD C[C@@H]1OCC[C@]12CN(Cc1ccc(N(C)C)cc1)CCO2 280404251 LBLTXDBKEHUNTL-YOEHRIQHSA-N 290.407 2.132 10 20 CECD COC(=O)c1cnc(SCc2ccc(OC)nn2)s1 295157937 GHHFSPGYTUCMRA-UHFFFAOYSA-N 297.361 2.021 10 20 CECD CC[C@@H](NC[C@@H](O)CN(C)C)c1cccc(Cl)c1O 806137092 GQMGBIISYZJOOW-ZWNOBZJWSA-N 286.803 2.009 10 20 CECD Cc1cc(C(=O)N2CCOC[C@@H]2C)c(C)n1-c1ccccn1 298772634 UCQBJUBZSKEXJQ-ZDUSSCGKSA-N 299.374 2.350 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@@H]2COCCO2)c1O 808677839 FJSGHTMVBSNPPA-ZYHUDNBSSA-N 285.771 2.420 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](O)C(C)C)cc1 291454854 KAFOJFDJWYNAQQ-HNNXBMFYSA-N 278.396 2.166 10 20 CECD CCCN1C[C@H](CNCc2cc(Cl)ccc2O)CC1=O 817410859 IVDNXSLJQUGUQU-NSHDSACASA-N 296.798 2.394 10 20 CECD CN1C[C@@H]2CCCN(Cc3ccc(N(C)C)c(F)c3)[C@@H]2C1 822520998 VCEXHCYOCIMFDO-WMLDXEAASA-N 291.414 2.418 10 20 CECD CC[C@](C)(CC(=O)O)NCc1cc(C)ccc1O 828664604 CVDKFEGNMOMFAZ-CQSZACIVSA-N 251.326 2.434 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2CC(=O)O)cc1F 902008821 XLUWHMHHSXNMTF-LBPRGKRZSA-N 280.343 2.331 10 20 CECD CC(C)CCOCCNC(=O)/C=C\c1ccc(O)c(O)c1 588404662 IFDNCXFKXMCYMD-XQRVVYSFSA-N 293.363 2.290 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 903299189 HIGAPYSIQGGLOT-PQFRYHKHSA-N 295.354 2.473 10 20 CECD CCc1noc(CC)c1CC(=O)NCc1ccc(N)cc1 837303590 ZDUVTHFYRHUGKF-UHFFFAOYSA-N 287.363 2.241 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCC[C@H]1CCOC1 837063870 FEBJKXPOCFRBOQ-AGLBCWCQSA-N 291.347 2.044 10 20 CECD CC(C)(C(=O)NCc1ccc(O)cc1O)c1cccnc1 910950231 STRHZUIHRSKSGH-UHFFFAOYSA-N 286.331 2.087 10 20 CECD C[C@@H](C(=O)NC(C)(C)C)N(C)Cc1ccc(N(C)C)cc1 741447816 PXDZVCIWVBTZPY-ZDUSSCGKSA-N 291.439 2.488 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCCC[C@H]2CN)c1 841028663 BXEDWBOFQGUJGG-SMDDNHRTSA-N 264.369 2.008 10 20 CECD CCCN(CCO)Cc1ccc(N(C)C)cc1C 840910960 YNMBNAPOMPAUOK-UHFFFAOYSA-N 250.386 2.265 10 20 CECD CCn1cncc1CN1CCOc2cc(N(C)C)ccc21 841874069 JQUIEEQHWPUMNH-UHFFFAOYSA-N 286.379 2.368 10 20 CECD NC[C@@H]1CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843046836 BVWFONUPOAPGPB-VIFPVBQESA-N 299.758 2.125 10 20 CECD C[C@@](O)(CNC(=O)c1cc(O)cs1)c1cccs1 740155043 AHDMWTILVWKEPD-GFCCVEGCSA-N 283.374 2.153 10 20 CECD CCc1cccc(CN2CCN(C)[C@H](C)[C@H]2C)c1O 848904438 UBYXPMVYOVFWEM-CHWSQXEVSA-N 262.397 2.479 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2C[C@H](O)C2)cc1 856393716 XLVZTFBPGUSSOM-KOMQPUFPSA-N 284.359 2.347 10 20 CECD O=C(c1cccc(O)c1O)N1CC(Cc2ccsc2)C1 857410460 SJLOGPIGJWPAIA-UHFFFAOYSA-N 289.356 2.474 10 20 CECD COc1cccc(CNC(=O)N[C@@H](C)c2ccc[nH]2)c1O 760875814 ZNPUFOCLCOEDGZ-JTQLQIEISA-N 289.335 2.289 10 20 CECD C/C=C\C[C@H](CO)NCc1c(O)cccc1Cl 769936074 CYZGVMQQRURFFM-MXQLGCADSA-N 255.745 2.462 10 20 CECD CCO[C@H]1C[C@@](CO)(NCc2ccc(C)cc2O)C1(C)C 877459825 LURRYBVYEYLBPF-RDJZCZTQSA-N 293.407 2.356 10 20 CECD CCCn1cc(CN(C)c2ccc3c(c2)OCO3)nn1 877180448 XFVNOSLVIUVUHT-UHFFFAOYSA-N 274.324 2.053 10 20 CECD CCO[C@H]1C[C@](CO)(NCc2ccc(C)cc2O)C1(C)C 877459823 LURRYBVYEYLBPF-DOTOQJQBSA-N 293.407 2.356 10 20 CECD Cc1cccc(CNC[C@@H](CO)Cc2ccco2)c1O 776247956 HJZZEMRLGLTNFV-ZDUSSCGKSA-N 275.348 2.234 10 20 CECD CCOC(=O)c1ccc(CNCc2ccccc2O)o1 776151605 QNSDZHRILCRNBY-UHFFFAOYSA-N 275.304 2.452 10 20 CECD CC[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@@H]1O 775744004 IUZGPEAUTYMTSY-PELKAZGASA-N 273.735 2.387 10 20 CECD C[C@@H](CC(N)=O)N[C@H](C)c1cccc(C(F)(F)F)c1O 788633875 WOJPMVKAWIVTCW-JGVFFNPUSA-N 290.285 2.326 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(Br)cc2O)CO1 691429779 WZHFSORFJMUUOS-GZMMTYOYSA-N 286.169 2.422 10 20 CECD CC[C@H](N[C@H]1CCC[C@H]1C(=O)NC)c1ccc(F)cc1O 796853066 KKKSNRBGRFQCIS-RDBSUJKOSA-N 294.370 2.487 10 20 CECD CCC(=O)N1C[C@H](NCc2ccc(OC)c(C)c2)C[C@H]1C 987676477 ZTBSDMGQWWSTNG-UKRRQHHQSA-N 290.407 2.493 10 20 CECD OC[C@@H](CCF)NCc1ccc(N2CCCC2)cc1 1327310850 JTUGHYKQBDOQSC-CQSZACIVSA-N 266.360 2.097 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC[C@H]1CCOC1 1324664774 ALWXELQHZXSDGE-DTRQGZQOSA-N 278.304 2.081 10 20 CECD COc1cc(C)cc(CNCCCCCCO)c1O 1334357369 DMWAIEUAGIJDTD-UHFFFAOYSA-N 267.369 2.352 10 20 CECD Cc1ncncc1C(=O)Nc1c(Cl)ccc2nonc12 1346939909 CJLDMRCWOYDSCC-UHFFFAOYSA-N 289.682 2.227 10 20 CECD COc1cc(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c(O)cc1C 1599406586 GVDCOXIIPAUOOR-AVGNSLFASA-N 291.347 2.147 10 20 CECD COc1ccc(O)c(CNCc2cc(C(=O)O)cs2)c1 1599598558 OYMIJTMWVZWQBX-UHFFFAOYSA-N 293.344 2.450 10 20 CECD C/C=C(/CC)C(=O)OCC(=O)c1ccc(O)c(O)c1 784907389 ZGMQHEBMEGWUTC-OQFOIZHKSA-N 264.277 2.180 10 20 CECD NC[C@H]1CCCC[C@@H]1NCc1ccc2c(c1)CCO2 841029055 FCLNWCCFORSUBK-CABCVRRESA-N 260.381 2.229 10 20 CECD Cc1nnc(CCNCc2cc(F)ccc2O)s1 291554172 MMXRZZXTBFTKLL-UHFFFAOYSA-N 267.329 2.024 10 20 CECD Cc1ccc(O)c(CNc2ccc(CC(N)=O)cc2)c1 71407671 AYRBFYDLHVNXQL-UHFFFAOYSA-N 270.332 2.341 10 20 CECD COc1cccc(CNC(C)(C)CN2CCCC2)c1O 308641399 JZMJLHMRDWZJPD-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CC(C)[C@@H](CCO)NCc1cc(F)cc(F)c1O 708452791 BMQWYKHOLYWCQM-GFCCVEGCSA-N 259.296 2.167 10 20 CECD COc1cccc(CN[C@@H]2C[C@H]2C(F)(F)F)c1O 865754667 ZFNCYHCPWBABBR-RKDXNWHRSA-N 261.243 2.441 10 20 CECD CCOC[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1 113922793 ZMPXYXFXLPNLPJ-GFCCVEGCSA-N 293.363 2.369 10 20 CECD COCCNC(=O)c1ccc(-n2c(C)ccc2C)cc1 22404802 CFQGEDLZTKIHHF-UHFFFAOYSA-N 272.348 2.470 10 20 CECD CSCCCN(C)C(=O)Nc1ccc(N)cc1 302370032 ROPKKYRVDMDLBX-UHFFFAOYSA-N 253.371 2.486 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCCN1 37807394 JBGJWNTTXYTKMI-INIZCTEOSA-N 289.423 2.243 10 20 CECD CC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H](C)O1 181067582 YVIDJNXMBVOHNO-FXOGGVSJSA-N 291.347 2.137 10 20 CECD CNC(=O)c1ccc(NCc2cccc(OC)c2O)cc1 36957762 FOJTYRQRAILBPE-UHFFFAOYSA-N 286.331 2.373 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cc(F)ccc1O)CC2 185318300 XUBWENHTKWTETL-CABZTGNLSA-N 290.342 2.097 10 20 CECD COc1cc(CNC(=O)c2cccc(O)c2O)ccc1C 192989684 QBRVXTNHOVHNHK-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CC(C)(C)OC(=O)CSc1ncc([N+](=O)[O-])s1 192535057 MNLVCWUYVXYGDJ-UHFFFAOYSA-N 276.339 2.485 10 20 CECD COC(=O)CCCN(C)c1cc(OC)c(OC)c(OC)c1 265991641 JUEBVVUVABVXGH-UHFFFAOYSA-N 297.351 2.102 10 20 CECD C[C@]1(O)CCCN(Cc2cc(F)ccc2O)CC1 279703713 RNWUOQNHWKYRIS-AWEZNQCLSA-N 253.317 2.268 10 20 CECD Cc1nsc(N[C@H](C)Cc2ccc(O)c(O)c2)n1 273823715 DKZNEHVTSMGAKW-SSDOTTSWSA-N 265.338 2.301 10 20 CECD C[C@@](O)(C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 286099303 RFUIUAIYVUSUGN-KRWDZBQOSA-N 288.391 2.064 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@H]2[C@@H]2CCCO2)c1 377709400 YVMQGJYUPPSPBE-HOCLYGCPSA-N 277.364 2.080 10 20 CECD CN(C)c1ccc(CN[C@H]2C[C@@H](O)C2)c(C(F)(F)F)c1 294938940 VBDAWZKRCHVJGZ-KLPPZKSPSA-N 288.313 2.384 10 20 CECD NC(=O)C1(CN[C@@H]2CCc3cccc(O)c32)CCCC1 297651859 KFWKSASYKRPRHY-GFCCVEGCSA-N 274.364 2.015 10 20 CECD C[C@@H](N[C@@H]1CC12CCNCC2)c1ccc(F)cc1O 817976851 VMJRDQGTOOGJOC-QMTHXVAHSA-N 264.344 2.324 10 20 CECD CNCCCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 817939655 HTAMBKMENKUJCX-GXSJLCMTSA-N 252.333 2.279 10 20 CECD Cc1cc(CN[C@@H](C)c2ncn(C)n2)ccc1N(C)C 815099483 XEGDDLCUHNNNPA-LBPRGKRZSA-N 273.384 2.040 10 20 CECD COc1ccc(O)c(CN[C@@H](C)C2(OC)CCOCC2)c1 834651015 UFUDQQHSYUWXDP-LBPRGKRZSA-N 295.379 2.075 10 20 CECD CN1CCCC[C@H]1C(=O)NCCCSc1nccs1 736680740 RXUNQAUZERHLIV-NSHDSACASA-N 299.465 2.226 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC([C@H](C)N)CC2)c1O 843348736 OUOXARFYWKNDDF-JTQLQIEISA-N 294.370 2.293 10 20 CECD C[C@@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(Cl)cc1O 841747535 CFYDCDGUSUQFSM-KOLCDFICSA-N 294.782 2.460 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@H](CN)C1 843047098 NZJAGEWSGFJNDN-AWEZNQCLSA-N 261.413 2.232 10 20 CECD C[C@@H](N[C@@H](CO)C1CCOCC1)c1ccc(Cl)cc1O 841752067 FOYSZFOEELTGMT-YGRLFVJLSA-N 299.798 2.484 10 20 CECD C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CS1 840243317 COKNYDLVCQWISB-DGCLKSJQSA-N 293.436 2.446 10 20 CECD C[C@@H]1[C@@H](CO)CCCN1Cc1ccc(N(C)C)c(F)c1 840978246 MQBPYAVYAYLSGJ-TZMCWYRMSA-N 280.387 2.485 10 20 CECD CCn1nncc1CN[C@@H](C)c1cc(F)cc(F)c1O 858440272 PENBPANJKZSNBB-QMMMGPOBSA-N 282.294 2.133 10 20 CECD C[C@@H](CC(N)=O)N[C@@H](C)c1cc2c(cc1O)CCCC2 756660143 JDPJQQDRMMYDFO-QWRGUYRKSA-N 276.380 2.186 10 20 CECD COc1ccc(N(C)Cc2cnc(C)nc2)cc1OC 920418566 KTHTVDVMKHXQRL-UHFFFAOYSA-N 273.336 2.439 10 20 CECD Cc1nc([C@@H](C)N2CCCc3cc(CN)ccc32)n[nH]1 852740676 JBRKQRKIIVZXTF-SNVBAGLBSA-N 271.368 2.086 10 20 CECD Cc1cc(F)cc(S(=O)(=O)NCc2ccccc2O)c1 751149205 NYDCTUHWQTWCDQ-UHFFFAOYSA-N 295.335 2.318 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)NOCC(F)F 758838795 QUDCENIESOECNT-UHFFFAOYSA-N 299.321 2.283 10 20 CECD CCC(CC)(CCO)CNC(=O)c1cc(O)cs1 762883672 RXOHSTMRERLWGU-UHFFFAOYSA-N 271.382 2.372 10 20 CECD COC(=O)[C@@H](NCc1cc(F)ccc1O)C(C)(C)C 768518379 CSZMJGASIIXYMD-GFCCVEGCSA-N 269.316 2.209 10 20 CECD Cc1cc(N(C)C)ccc1CN1C(=O)CN(C(C)C)C1=O 761354587 JEVTXLJQFPNRKZ-UHFFFAOYSA-N 289.379 2.234 10 20 CECD Cc1ccc(O)c(CNC(=O)c2snnc2C2CC2)c1 862756190 SKAMQLZPSIQVMF-UHFFFAOYSA-N 289.360 2.360 10 20 CECD Cc1nnccc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773001228 RSDWWKJIJDFZDC-LLVKDONJSA-N 284.363 2.342 10 20 CECD COc1ncc(/C=C/C(=O)N2CCc3cc(C)ccc32)cn1 773865840 NYIGIJMRWBKWMJ-GQCTYLIASA-N 295.342 2.396 10 20 CECD C[C@H](NC(=O)[C@@H](C)n1cccn1)c1ccc(N(C)C)cc1 773006738 FLERCLBOYXOQSX-QWHCGFSZSA-N 286.379 2.388 10 20 CECD COC1(C)CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 776250535 VEUBTTUWVLSHJD-GFCCVEGCSA-N 291.395 2.244 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(F)cc(F)c2O)[C@H]1C 894538049 NTZQDSPPHDKDTA-KWQFWETISA-N 285.290 2.054 10 20 CECD Cc1ccc(O)c(CN(CCC(=O)O)C(C)C)c1 86748349 PVBWDEMGKYMTBC-UHFFFAOYSA-N 251.326 2.386 10 20 CECD C[S@@](=O)c1cccc(NC(=O)c2cccc(O)c2O)c1 790790561 MSEHROJJRQOATB-HXUWFJFHSA-N 291.328 2.088 10 20 CECD Cc1ccc(CN2CCC3(CC2)C[C@H](O)CCO3)c(O)c1 897258533 UBZPCFOBKWPADA-OAHLLOKOSA-N 291.391 2.207 10 20 CECD COc1ccc(CNC(=O)CCc2ccccn2)c(O)c1 794376025 AURROYZLNIWUQZ-UHFFFAOYSA-N 286.331 2.045 10 20 CECD COC(=O)[C@H]1CCCCN1Cc1cc(C)cc(OC)c1O 798213298 VHQVDSOZYZAXHL-CYBMUJFWSA-N 293.363 2.237 10 20 CECD COc1ccc(CNC(=O)c2ccccc2OC)c(O)c1 794388599 YMEPRCUIVFXNQK-UHFFFAOYSA-N 287.315 2.339 10 20 CECD O=C(NCc1ccccc1O)c1csc2cncn12 735856499 HISCFBOTDJPDFT-UHFFFAOYSA-N 273.317 2.031 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCC[C@@H]3OCC[C@@H]32)cc1 1337016678 UNCLVQXNWWVPSQ-KFWWJZLASA-N 289.379 2.026 10 20 CECD C[C@@H]1C[C@@H](CCNC(=O)NCc2ccc(N)cc2)CCO1 1337014974 GYUSQCBERTUAGH-OLZOCXBDSA-N 291.395 2.273 10 20 CECD C[C@H](NCc1ccc(N)cc1)C(=O)OC1CCCC1 1334755141 XKUWLQPZIDYUOI-NSHDSACASA-N 262.353 2.233 10 20 CECD Nc1ccc(CN2CCC(c3ncc[nH]3)CC2)cc1 1262487478 UWACGCRMWJJZFQ-UHFFFAOYSA-N 256.353 2.372 10 20 CECD CC[C@](C)(O)CNC1CCN(c2ccc(OC)cc2)CC1 154533206 PONLOGYCIRNNQI-KRWDZBQOSA-N 292.423 2.415 10 20 CECD Nc1ccc(NC(=O)NCCC[C@@H]2CCOC2)cc1 402134606 KHBAPXIJNVMJNA-LLVKDONJSA-N 263.341 2.207 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1C(=O)O 383286503 UIARZGKNIBWYNO-SWLSCSKDSA-N 276.380 2.295 10 20 CECD C[C@@H](N[C@H](CCO)C(F)(F)F)c1cc(F)ccc1O 886801139 IHXATXAAHRIXGV-RDDDGLTNSA-N 281.249 2.495 10 20 CECD CCCCO[C@H](C)C(=O)NCc1cc(OC)ccc1O 114543326 FTCIMICOPYJEOU-LLVKDONJSA-N 281.352 2.222 10 20 CECD Cc1ccc(O)c(CN2CCN(C)C[C@H]2C(C)C)c1 248905455 YFJYPZWSSQFCPS-HNNXBMFYSA-N 262.397 2.473 10 20 CECD C/C=C(\C)C(=O)N1CCOc2cc(N(C)C)ccc21 176301881 PCAOOOJIWQOPBB-VZUCSPMQSA-N 260.337 2.444 10 20 CECD Cc1ccc(C(=O)N(C[C@H]2CCOC2)C2CC2)c(O)c1O 179454984 OSCHYEOXHOGNOT-LLVKDONJSA-N 291.347 2.047 10 20 CECD CCCC[C@H](COC)NC(=O)c1ccc(C)c(O)c1O 182473994 ZMRWDGKGOYFQFH-LLVKDONJSA-N 281.352 2.341 10 20 CECD Cn1c(Sc2ncc([N+](=O)[O-])s2)nnc1C(F)F 192527629 YKQMWNSNNAIPNL-UHFFFAOYSA-N 293.280 2.269 10 20 CECD C[C@H](N[C@H]1C[C@@H](O)C1(C)C)c1cc(F)ccc1O 228855085 IXGFHPQNMLKXCR-AQUOVQTQSA-N 253.317 2.341 10 20 CECD Cc1ccc(C(=O)N2CCSC[C@@H](C)C2)c(O)c1O 191569277 QVMKCMDURQPQRH-VIFPVBQESA-N 281.377 2.231 10 20 CECD CCOc1cccc(CN2CC[C@@H](OC)C2)c1O 233820945 TXXZQSYKVSYCQG-GFCCVEGCSA-N 251.326 2.012 10 20 CECD COC[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCCO1 278928504 USMWMBXFYMTMCR-ZBFHGGJFSA-N 296.386 2.175 10 20 CECD CC[C@@H]1CN(Cc2cc(Cl)cc(OC)c2O)C[C@H]1O 273779463 SLDCAQHWZKBAOH-BXKDBHETSA-N 285.771 2.257 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@](O)(C2CC2)C1 373324769 QRJUEQADRKWUHE-CQSZACIVSA-N 267.756 2.392 10 20 CECD C[C@@H](N[C@@H]1CCO[C@@H]1C)c1ccc(F)c(F)c1O 293378334 IGBWSPNDGRUOPH-SOCHQFKDSA-N 257.280 2.498 10 20 CECD C[C@@H](NCc1nc(C2CC2)n[nH]1)c1cc(F)ccc1O 296355093 IKZZSKCDSBOREV-MRVPVSSYSA-N 276.315 2.378 10 20 CECD C[C@@H](N[C@H]1CC[C@@H](CO)C1)c1cc([N+](=O)[O-])ccc1O 296475516 NYXYUQHNQGNQHQ-MXWKQRLJSA-N 280.324 2.112 10 20 CECD CCn1cc([C@H](C)NC(=O)c2ccc(C)c(O)c2O)cn1 296890339 IGGZXIUKQGKTIX-JTQLQIEISA-N 289.335 2.114 10 20 CECD COCC(C)(C)CNC(=O)NCc1ccc(N(C)C)cc1 291783591 WSLHWVFHRLHCQL-UHFFFAOYSA-N 293.411 2.224 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2CCCN2)c2c(O)ccc(F)c21 817953226 XQFBLEHEQPXQHG-FOGDFJRCSA-N 264.344 2.421 10 20 CECD Cc1cc(CN2CCN(C)[C@H](C)C2)ccc1N(C)C 815078903 JJVDFAWYTNUKPS-CQSZACIVSA-N 261.413 2.197 10 20 CECD Cc1c(C)n(C)c2ccc(OC(=O)c3ncn(C)n3)cc12 817762928 XNWGSLASSGXHGX-UHFFFAOYSA-N 284.319 2.143 10 20 CECD CCCCCN1C(=O)CN(Cc2ccccc2O)C1=O 819171368 VQIGJMLIEANSAX-UHFFFAOYSA-N 276.336 2.347 10 20 CECD CN(Cc1cn(C)nn1)Cc1ccc2ccccc2c1O 827305355 RFBDHQKZGJDUHY-UHFFFAOYSA-N 282.347 2.306 10 20 CECD CCn1cnc(C(=O)NCCCSc2nccs2)c1 827475126 SLZGADLDGKTNSI-UHFFFAOYSA-N 296.421 2.272 10 20 CECD CC(C)(O)C1CCN(C(=O)c2cc(O)cs2)CC1 827767924 CRJGTGXENXKIHL-UHFFFAOYSA-N 269.366 2.077 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCN1C1CC1)c1ccccc1O 827946298 CUVZPNGCSHACFB-RISCZKNCSA-N 274.364 2.196 10 20 CECD CC/C=C\CNCc1ccc(N2CCN(C)CC2)cc1 824701979 FMVXXJNGHSOYJQ-PLNGDYQASA-N 273.424 2.494 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCCCC(=O)O 737021143 PGIMZEOPCQXYGY-UHFFFAOYSA-N 294.351 2.179 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccccn1 734407380 RCXWEDIGNOVHRF-UHFFFAOYSA-N 269.348 2.386 10 20 CECD CC(=O)N[C@H]1CCN(Cc2cc(Cl)c(C)cc2O)C1 826130152 DRUVZHNAGJURMY-LBPRGKRZSA-N 282.771 2.064 10 20 CECD O=C(CC1COC1)NCc1cc(Cl)cc(Cl)c1O 908211981 MXTZEIZWNBVZKA-UHFFFAOYSA-N 290.146 2.352 10 20 CECD CC(C)[C@H](CNCc1ccc2c(c1)CCCO2)C(=O)O 900022889 PQMFZBZNKUPFRD-AWEZNQCLSA-N 277.364 2.458 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(F)cn1 588405972 QNFRGXIFEHDRCG-KXFIGUGUSA-N 274.251 2.284 10 20 CECD CN(C)[C@H](CN[C@H]1CCc2cccc(O)c21)C1CC1 834518684 MGNUFBIWZVKZNR-UONOGXRCSA-N 260.381 2.309 10 20 CECD CCCNCCNC/C=C/c1ccc(N(C)C)cc1 841046640 KEUSRVDXPYCRQW-AATRIKPKSA-N 261.413 2.355 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCC[C@@H]2CN)cc1F 841030952 PYTWKAJEYPIBEK-UKRRQHHQSA-N 279.403 2.499 10 20 CECD O=C(CSc1nccs1)Nc1ccccn1 918002594 HSFBVTAXMYFARV-UHFFFAOYSA-N 251.336 2.269 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CS[C@H](C)C2)c1 840297139 FYURVIHUBMHNKV-KOLCDFICSA-N 296.392 2.094 10 20 CECD CN(CC1CC1)C[C@H]1CCN(C(=O)c2cc(O)cs2)C1 746409918 SVLQGVBVZYJADJ-GFCCVEGCSA-N 294.420 2.258 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CCn3ccnc3C2)c1O 846162240 CGFOPBWEZALINY-NEPJUHHUSA-N 287.363 2.263 10 20 CECD C[C@@H](CC(F)(F)F)NC(=O)NCCc1ccc(N)cc1 841960805 XDQBXJACSQPYES-VIFPVBQESA-N 289.301 2.451 10 20 CECD Nc1ccc(CC(=O)Nc2ccc(F)c(N)c2)cc1 1349398512 MBOUVHJCNRWESN-UHFFFAOYSA-N 259.284 2.171 10 20 CECD CCn1nccc1CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 853241422 UZVZTBGTUZAFMK-JTQLQIEISA-N 290.323 2.368 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CCn1cccc1 935949337 YLWIWHCODDBVBU-UHFFFAOYSA-N 293.363 2.386 10 20 CECD COCCOCCN1CCCc2cc(OC)ccc21 750817279 MPLUXVNMHKZTFC-UHFFFAOYSA-N 265.353 2.111 10 20 CECD CN1CCCN(C(=O)/C=C/c2cn(C)cn2)c2ccccc21 933217981 NQCFPRKGJRIQPL-CMDGGOBGSA-N 296.374 2.306 10 20 CECD C[C@H](NC(=O)N1CCOC[C@H]1C)c1ccc(N(C)C)cc1 767861289 PLYATYYSXNQOTL-OLZOCXBDSA-N 291.395 2.244 10 20 CECD Cc1ccc(O)c(CNC(=O)CCC(=O)OC(C)(C)C)c1 862757575 YYFOYFRNNLCSTM-UHFFFAOYSA-N 293.363 2.439 10 20 CECD COc1cc(CN(C)Cc2ccon2)c(O)cc1C 768446806 OSOBTCRLQPCABM-UHFFFAOYSA-N 262.309 2.329 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@]2(F)CCOC2)cc1 1117525288 IQMOUSARRCASEF-INIZCTEOSA-N 294.370 2.278 10 20 CECD Cc1nnc(O)c(CNCc2ccc3c(c2)CCCO3)c1C 1119676968 BIAUREKRDFJBIE-UHFFFAOYSA-N 299.374 2.414 10 20 CECD CC(=O)N(C)C1CCN(Cc2c(C)cccc2O)CC1 876646861 YMZLHFVBFFKVQF-UHFFFAOYSA-N 276.380 2.143 10 20 CECD OCCN(Cc1cc(Cl)cc(F)c1O)C1CC1 775652779 TUSLNGKUDWVBDU-UHFFFAOYSA-N 259.708 2.141 10 20 CECD C[C@H](CNCc1cc(F)cc(F)c1O)Cn1cccn1 882905922 ZMDRLZZHMHSMBP-SNVBAGLBSA-N 281.306 2.293 10 20 CECD COc1ccc(CN(C)C2CCC2)c(O)c1OC 892059147 XALIEIQIWADTRX-UHFFFAOYSA-N 251.326 2.394 10 20 CECD COc1csc(C(=O)NCc2ccc(OC)cc2O)c1 794373037 FFGPIXOUHRARSJ-UHFFFAOYSA-N 293.344 2.401 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1cncc(F)c1 795560999 DRRBFYKOJPXSSU-DUXPYHPUSA-N 289.262 2.389 10 20 CECD O=C(O)[C@H]1CCC[C@H]1CNCc1ccc2c(c1)CCO2 89447112 UISKOSOXTPEAOT-KBPBESRZSA-N 275.348 2.212 10 20 CECD Cc1ccc([C@@H](C)NCc2nnc(C)n2C)c(O)c1C 1320117981 CKEFOMQWEYGFCE-LLVKDONJSA-N 274.368 2.297 10 20 CECD COCCNCCN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 1329025222 ZPTNVTHXFHHASR-STQMWFEESA-N 278.396 2.075 10 20 CECD Nc1ccc(CN2CCn3nc(C4CC4)cc3C2)cc1 1337837299 ANETUSPOJWBBKO-UHFFFAOYSA-N 268.364 2.359 10 20 CECD CO[C@H]1C[C@@H](NC(=O)NCc2ccc(N)cc2)C12CCC2 1353412887 CUTRPVAXBCVDDL-KGLIPLIRSA-N 289.379 2.026 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CSCCS2)c1 164753375 OASACGZICDSUQA-GFCCVEGCSA-N 285.434 2.339 10 20 CECD O=C(O)c1cnc(SCCN2CCCC2)s1 1602537565 VPNIMUBOOHWPEZ-UHFFFAOYSA-N 258.368 2.029 10 20 CECD CCC(CC)(CO)CNCc1cc(F)ccc1O 226617715 QHCLOTREURCZNJ-UHFFFAOYSA-N 255.333 2.420 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C)c(C(=O)O)o2)c1 1600464771 JYJZGYVHGRMPEN-UHFFFAOYSA-N 289.287 2.230 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2[C@@H]3CNC[C@@H]32)cc1 1579674020 LESCETTUQJHQIW-FVQHAEBGSA-N 295.386 2.042 10 20 CECD COc1cc(C)cc(CNCc2ccc(C(=O)O)o2)c1O 1599391644 BOUNAPXAYXCCDV-UHFFFAOYSA-N 291.303 2.290 10 20 CECD C[C@@H]1C[C@@H](C(=O)N[C@H](C)c2ccccc2O)CCO1 827940947 LINNASZYZQSTHM-UTUOFQBUSA-N 263.337 2.385 10 20 CECD Cc1ccc([C@H](C)NCCNC(=O)C(C)C)c(O)c1 20125457 QQHRQUHIPXSMOT-LBPRGKRZSA-N 264.369 2.123 10 20 CECD C[C@@H]1CN(C)CC[C@@H]1N(C)Cc1cc(F)cc(F)c1O 894783211 QTWZINOWQXANEW-YGRLFVJLSA-N 284.350 2.442 10 20 CECD COc1ccc(O)c(CN[C@H](C)CN2CCCCC2)c1 37153259 QMSMNZIMDWTLDX-CYBMUJFWSA-N 278.396 2.365 10 20 CECD c1cnn(CCNCc2ccc(N3CCCC3)cc2)c1 48449375 QNAXIFRLPZVNNG-UHFFFAOYSA-N 270.380 2.273 10 20 CECD COC(=O)CN(Cc1cccc(Cl)c1O)C(C)C 179743748 MXFUSRSNUDCWGU-UHFFFAOYSA-N 271.744 2.429 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2Cc3ccccc3O2)c1 173580555 XCNJCIVCTVOZME-INIZCTEOSA-N 299.326 2.021 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H]3C[C@@H]3C2)cc1F 1350479964 MLVKIBXOVRLDKI-QWHCGFSZSA-N 291.370 2.443 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1noc(C)n1 122482203 HEPSZIRGAWAQMW-UHFFFAOYSA-N 288.351 2.106 10 20 CECD CC[C@@H]1C[C@H](C(=O)NCc2cccc(OC)c2O)CCO1 183611333 CUWBBCIMZCLTHG-DGCLKSJQSA-N 293.363 2.222 10 20 CECD CC[C@@H](CO)N[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 188666167 PZZCORSIGQERLK-JSGCOSHPSA-N 296.386 2.084 10 20 CECD Cc1ncsc1C(=O)NCc1ccc(N(C)C)cc1 46572816 FMXPJMUSQGOHTM-UHFFFAOYSA-N 275.377 2.448 10 20 CECD Cc1cnc(CNCc2ccc(N3CCOCC3)cc2)o1 227084066 QMOXCTIKTLQDAE-UHFFFAOYSA-N 287.363 2.109 10 20 CECD CCS(=O)(=O)C[C@H](C)N(C)Cc1ccc(N(C)C)cc1 93416671 QJPIODPQUNFOIZ-ZDUSSCGKSA-N 298.452 2.008 10 20 CECD CC(=O)c1cc(F)cc(CN2CCN(C)CC2(C)C)c1O 270989154 DQWCIDVONBYELM-UHFFFAOYSA-N 294.370 2.260 10 20 CECD CN(C)C(=O)c1ccc(N(C)Cc2ccccc2O)nc1 271705215 DZQMCDNPBQRQTP-UHFFFAOYSA-N 285.347 2.125 10 20 CECD COc1ccc(O)c(CNC[C@H](O)c2ccc(C)o2)c1 271798459 IJUXMQDYVFKPQH-AWEZNQCLSA-N 277.320 2.125 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](N3CCCC3)[C@H]2C)c1 289141837 AITCMVXTHRFBQN-CZUORRHYSA-N 290.407 2.459 10 20 CECD COc1cccc(CN2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@@H]4OC)c1O 289623728 LRCUXTOILSZUGZ-UOZBHZCFSA-N 289.375 2.256 10 20 CECD C[C@@H](N[C@@H]1COC[C@H]1O)c1ccc(Cl)c(Cl)c1O 295982601 OWWPCNURXXSAJR-BDODKLCJSA-N 292.162 2.109 10 20 CECD CCOc1ccc(O)c(CNc2ccc(CO)cn2)c1 291677162 WVXGXCXQCDWPAC-UHFFFAOYSA-N 274.320 2.290 10 20 CECD C[C@H]1C[C@@H](CO)CN(Cc2cc(Cl)ccc2O)C1 817412875 PYLOVZPLEBUADB-WDEREUQCSA-N 269.772 2.496 10 20 CECD COC[C@@H](NCc1ccc(N(C)C)c(C)c1)[C@H]1CCCO1 815104041 XRPCEQSSJAAUCN-NVXWUHKLSA-N 292.423 2.345 10 20 CECD C[S@@](=O)CCCNCc1cc(Cl)c(F)cc1O 816552675 SJJRPATXOWLYBC-QGZVFWFLSA-N 279.764 2.043 10 20 CECD CC(=O)c1cc(CN(C)c2ccc3c(c2)OCO3)on1 821396391 MCRRFFVVOGFZJB-UHFFFAOYSA-N 274.276 2.242 10 20 CECD CC[C@@](C)(O)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 822834512 XXZYXRGBMDOPER-CXAGYDPISA-N 292.423 2.269 10 20 CECD O=C1CC[C@@H]2[C@H]1[C@H]2C(=O)NCc1c(O)ccc2c1CCCC2 907059292 IVZWIUZVAZKBOB-JLZZUVOBSA-N 299.370 2.112 10 20 CECD CCN1CC[C@@H](N(C)C(=O)c2cc(O)cs2)C[C@@H]1C 828491265 XWYWDELAZHTDRN-WDEREUQCSA-N 282.409 2.399 10 20 CECD CCc1nnc(NCc2cc(F)cc(F)c2O)o1 905414037 GXBVGGQGLFVEJN-UHFFFAOYSA-N 255.224 2.228 10 20 CECD Cc1cc(NCc2ccc(N(C)C)cc2C)n2ncnc2n1 734481673 AIWXDVQWCVBXPV-UHFFFAOYSA-N 296.378 2.419 10 20 CECD C[C@H](C1CC1)N(C)C(=O)/C=C\c1ccc(O)c(O)c1 588404386 PXLPSMJAEDRJMJ-NAXAJZLFSA-N 261.321 2.368 10 20 CECD CCC(C)(C)NC(=O)[C@@H](C)OC(=O)c1cc(O)cs1 732353509 RYEJRXNMZQJJNQ-MRVPVSSYSA-N 285.365 2.304 10 20 CECD O=C(Nc1nnc([C@H]2CCCO2)s1)c1cc(O)cs1 830429991 DVHQNQVLFZSUNW-SSDOTTSWSA-N 297.361 2.409 10 20 CECD Oc1ccccc1CN(C[C@@H]1CCOC1)C[C@H]1CCCO1 732203617 YYGINVANUUEGCA-GOEBONIOSA-N 291.391 2.410 10 20 CECD CCOc1ccc(CNC[C@](C)(O)CC)c(O)c1 732229202 HSOBZVPNHHDUFM-CQSZACIVSA-N 253.342 2.042 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)c1ccc(C)c(O)c1O 837138522 ZPISKGXQMZDLII-VXGBXAGGSA-N 279.336 2.094 10 20 CECD CNC(=O)c1cccc(NC(=O)NCc2ccccc2O)c1 748444043 UASSJSVPOYLDLU-UHFFFAOYSA-N 299.330 2.074 10 20 CECD CCOc1ccc(N(C)CCn2ccc([N+](=O)[O-])n2)cc1 747963879 YKRLJWAPRICCSU-UHFFFAOYSA-N 290.323 2.326 10 20 CECD COc1cccc(CNC(=O)[C@H](C)c2ccco2)c1O 743333354 OMOAEWFQPUUWTM-SNVBAGLBSA-N 275.304 2.414 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC[C@@]2(O)CCCOC2)c1 846212478 LRVXAEVZOJZKJJ-CJNGLKHVSA-N 279.380 2.283 10 20 CECD Cc1nn(C)c2ncc(CNCCc3ccc(N)cc3)cc12 841036453 OASLPOWSUDSCHK-UHFFFAOYSA-N 295.390 2.191 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)O)cc1F 840995101 LCDZCEFPTXVKQO-UHFFFAOYSA-N 268.332 2.188 10 20 CECD NC1(CNCc2c(O)cccc2Cl)CCCC1 849350487 YXONGTCLSUMHFM-UHFFFAOYSA-N 254.761 2.407 10 20 CECD CO[C@@H]1CCC[C@@H](CC(=O)NCc2ccc(O)cc2O)C1 910946909 VPEOGGNWRCPEPH-BXUZGUMPSA-N 293.363 2.309 10 20 CECD COc1cccc([C@H](C)NC[C@@H](C)C[C@@H](C)O)c1O 846145138 MYINUAQMRMBVGF-TUAOUCFPSA-N 267.369 2.458 10 20 CECD COc1cccc([C@H](C)N[C@H](CCO)C2CC2)c1O 846152653 BNCMGDGBDYIBSM-GXFFZTMASA-N 265.353 2.212 10 20 CECD C[C@H](CN)CNCc1ccc(N(C)C)cc1C(F)(F)F 841047665 AVCMIVBBEVBVDP-SNVBAGLBSA-N 289.345 2.456 10 20 CECD Nc1ccc(CCNC(=O)N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)cc1 841956127 WAGMBTWAPKMBMN-XJNFMUPTSA-N 299.418 2.499 10 20 CECD C[C@@H]1C[C@@H](CN)CN1Cc1cccc(Br)c1O 843057876 NFFQESDXLDGPEL-ZJUUUORDSA-N 299.212 2.324 10 20 CECD COCCN(CCN(C)C)Cc1ccc(N(C)C)cc1C 840949108 QSCXUDDYGPWIOO-UHFFFAOYSA-N 293.455 2.071 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2CCc3c[nH]nc3C2)c1O 846144280 BXJMPEDPLYTPEZ-ZYHUDNBSSA-N 287.363 2.332 10 20 CECD COC[C@@H](CC(C)C)NCCc1ccc(N)cc1 841036543 UUXDOHYOVJFHII-OAHLLOKOSA-N 250.386 2.462 10 20 CECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1cccs1 758775236 UGVIPDRNZXOIJR-UHFFFAOYSA-N 297.357 2.457 10 20 CECD COC(=O)N(C)CCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 850548537 UVCUXHXHNYTAJS-KOLCDFICSA-N 296.342 2.367 10 20 CECD CCOc1ccc(O)c(CNCCOC(C)C)c1 757977860 NPVPZYGLBNJALB-UHFFFAOYSA-N 253.342 2.306 10 20 CECD COc1ccc(OCC(=O)C(C)=O)c(C(F)(F)F)c1 863360132 ZEPNMSPWKXLUKP-UHFFFAOYSA-N 276.210 2.251 10 20 CECD O=C(CCc1cn[nH]c1)NCCCSc1nccs1 863873336 AUNGMLITQZAYEP-UHFFFAOYSA-N 296.421 2.097 10 20 CECD C[C@@H](C[C@H]1CCCC(=O)N1)NCc1ccc(N(C)C)cc1 876905543 IODFHPFGNXFZBF-DZGCQCFKSA-N 289.423 2.290 10 20 CECD C[C@@H](NC(=O)C1=COCC1)c1ccc(N(C)C)cc1 773018329 VAZWXUVBXQERFZ-LLVKDONJSA-N 260.337 2.234 10 20 CECD O=C(NCc1cccc(Br)c1O)[C@@H]1C[C@H]1F 1123754969 RTUBHAJKCABZFD-VXNVDRBHSA-N 288.116 2.129 10 20 CECD O=[N+]([O-])c1ccc2nc(CNCc3ccccc3O)[nH]c2c1 775179673 OOPXDGXWOCZTNA-UHFFFAOYSA-N 298.302 2.467 10 20 CECD C[C@H](NC[C@H]1CC[C@@H](O)C1)c1c(O)cccc1F 886598774 JVMSQXNHGICYFD-GARJFASQSA-N 253.317 2.343 10 20 CECD Nc1ccc(CNC(=O)NCCOCC2CCCC2)cc1 1120626194 NVKWAJFQJAKLMV-UHFFFAOYSA-N 291.395 2.275 10 20 CECD COc1ccc(N2CCCN(CCC[C@H](C)O)CC2)cc1 789310284 PZOYMKXWRLLWEN-HNNXBMFYSA-N 292.423 2.368 10 20 CECD O=C(NCc1cc(F)ccc1F)c1c(F)ccc(O)c1O 789976046 KAXBERBZQHNBBL-UHFFFAOYSA-N 297.232 2.445 10 20 CECD COc1cc(C)cc(CN(C2CC2)C2COC2)c1O 894869512 ZZYWJYPINWBNFS-UHFFFAOYSA-N 263.337 2.072 10 20 CECD CC[C@](C)(CNCc1ccc(OC)c(OC)c1O)OC 894713198 XQLWUXHONCDJTE-OAHLLOKOSA-N 283.368 2.314 10 20 CECD COc1cc(C)cc(CN[C@@H](C)Cc2cnccn2)c1O 894207764 XSRSRZAEOUGAEW-LBPRGKRZSA-N 287.363 2.220 10 20 CECD C[C@H](CNCc1ccccc1O)CC1(C)OCCO1 716006176 KTDVBHIZXZSMMM-LBPRGKRZSA-N 265.353 2.271 10 20 CECD CCCN(CC)c1nnc(-c2sccc2O)n1C 1338087703 NXWFCLQJBDSVRU-UHFFFAOYSA-N 266.370 2.486 10 20 CECD CC1CCC(OCC(=O)NCc2cccc(O)c2O)CC1 1347232853 CHSIAOUCJQUNMK-UHFFFAOYSA-N 293.363 2.309 10 20 CECD O=C(/C=C\c1cc(C(=O)O)co1)NCc1ccccc1O 1601233168 KUHJXDVXULRXRT-WAYWQWQTSA-N 287.271 2.013 10 20 CECD CCN1CC[C@@H](CN[C@@H](C)c2cc(C(=O)O)ccc2O)C1 1610004884 RJZZQLVHNKHTIN-RYUDHWBXSA-N 292.379 2.083 10 20 CECD COc1cccc(CNCC[C@@H]2CCCCO2)c1O 227338492 ULYPZPNUCHGPRC-ZDUSSCGKSA-N 265.353 2.450 10 20 CECD Cn1nccc1CCNCc1cccc(Cl)c1O 231036736 CYGDYWZZOICRDI-UHFFFAOYSA-N 265.744 2.111 10 20 CECD CC1(C)C[C@H](NCc2cc([N+](=O)[O-])ccc2O)CCO1 160466949 FENNJSRYOGWAPT-LLVKDONJSA-N 280.324 2.348 10 20 CECD CN(CC1=CCCOC1)C(=O)Nc1ccc(N)cc1 850751033 SSAHPSWBEQSOSQ-UHFFFAOYSA-N 261.325 2.079 10 20 CECD C[C@H](N[C@H]1CCCCNC1=O)c1ccc(N(C)C)cc1 37282686 VPZRJARNOYWIMO-WFASDCNBSA-N 275.396 2.072 10 20 CECD CCOc1cccc(CNCC2CCN(C)CC2)c1O 44515621 DDCNHRIBROBPEJ-UHFFFAOYSA-N 278.396 2.222 10 20 CECD C[C@H]1CC(NC(=O)Nc2ccc(N)cc2)C[C@H](C)O1 694775851 WPJKZZYGNIKBCZ-UWVGGRQHSA-N 263.341 2.346 10 20 CECD NCC[C@H]1CCN(Cc2c(O)cccc2Cl)C1 723674928 LGCKQZPHCNRCAR-JTQLQIEISA-N 254.761 2.216 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccc(F)nc2)c1 118785944 JXZJVPUVXQVLSI-SECBINFHSA-N 290.294 2.426 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)OCCC(C)C)c1 114541469 FQQHCSCROONIHC-GFCCVEGCSA-N 295.379 2.468 10 20 CECD CC(C)(C)C(=O)N1CCN(Cc2cc(F)ccc2O)CC1 179918499 NGMXNFPRUZXLHB-UHFFFAOYSA-N 294.370 2.222 10 20 CECD COc1ccc(N(C)CC(=O)NC2CCCC2)cc1F 121805372 RSUMREHGOFROEG-UHFFFAOYSA-N 280.343 2.329 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](N(C)C)[C@H]2C)c1O 314399512 XASFWSBKQGRZTI-MEBBXXQBSA-N 294.370 2.258 10 20 CECD CN(C)[C@H](CNC(=O)Cc1ccc(N)cc1)c1ccccc1 237193310 KUVCEPVVTPMWCL-QGZVFWFLSA-N 297.402 2.230 10 20 CECD CCCOc1ccc(CN2C[C@H](O)[C@H](CC)C2)c(O)c1 271279568 LTBPWZQOCBBGRX-WBMJQRKESA-N 279.380 2.384 10 20 CECD Cc1nsc(N[C@@H](C)Cc2ccc(O)c(O)c2)n1 273823716 DKZNEHVTSMGAKW-ZETCQYMHSA-N 265.338 2.301 10 20 CECD CCN1C(=O)/C(=C\c2ccc(C(=O)OC)o2)SC1=S 299354017 YAUQUGPCPYTERX-RMKNXTFCSA-N 297.357 2.287 10 20 CECD CCCOc1ccc(CN2CCn3cncc3C2)c(O)c1 291653311 UUCHURUCCDRBGG-UHFFFAOYSA-N 287.363 2.393 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H](C)CO)cc1 809746134 QKLYJIHNRMRMNM-CYBMUJFWSA-N 250.386 2.345 10 20 CECD Cc1cc(C)c(CNCc2cc3c(cc2O)OCO3)cn1 397064859 SVXTYUJYORABNH-UHFFFAOYSA-N 286.331 2.423 10 20 CECD CN(Cc1ccccc1O)c1nnc(CC2CC2)n1C 290175598 KSGRHDPFQHHYGO-UHFFFAOYSA-N 272.352 2.110 10 20 CECD COC(=O)c1cnc(SCc2ncnn2C(C)C)s1 295324198 OMRDWCFMYNXRCS-UHFFFAOYSA-N 298.393 2.394 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1 394631022 BQBCNGZYOZHOCC-IMJJTQAJSA-N 288.391 2.438 10 20 CECD C[C@H](NC[C@H]1CCCNC1)c1cc(F)ccc1O 817946003 PNWUHPNYMLVSKK-QWRGUYRKSA-N 252.333 2.182 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCCCN2)c1 817949867 OMHAWZBAXBPGHZ-NWDGAFQWSA-N 264.369 2.194 10 20 CECD CC[C@H](CNCc1cccc(Cl)c1O)C(=O)O 903704761 DHICFQDSPZGDIK-MRVPVSSYSA-N 257.717 2.246 10 20 CECD Oc1cccc(Cl)c1CN1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 824839001 UUODOZBCDHEJAU-ANGCBRKESA-N 277.751 2.431 10 20 CECD CN(C)c1ccc(CNC(=O)CN(C)C(C)(C)C)cc1 830544924 AHGQVRZMJALBFJ-UHFFFAOYSA-N 277.412 2.099 10 20 CECD CN1CCCN(C(=O)/C=C\c2cnn(C)c2)c2ccccc21 737584212 ODQGMBCNTBFDII-HJWRWDBZSA-N 296.374 2.306 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cc(CC2CC2)[nH]n1 830876872 JYJMBYOWUULHMM-XQRVVYSFSA-N 299.330 2.425 10 20 CECD CC1CCN(CCCNC(=O)c2cc(O)cs2)CC1 731865508 LTAAPQKUSPVQLC-UHFFFAOYSA-N 282.409 2.306 10 20 CECD C[C@@H](NC[C@@H]1CCCNC1=O)c1ccc(Cl)cc1O 841756481 VYIFTPNUDPAEQX-ZJUUUORDSA-N 282.771 2.222 10 20 CECD CN[C@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 843048508 DHOHSGWPCFJDTA-NSHDSACASA-N 272.751 2.369 10 20 CECD COc1cc(C)cc(CN2C[C@@H]3[C@H](C2)C3(F)F)c1O 844754746 YQHDVFUGLTZACY-PHIMTYICSA-N 269.291 2.406 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H](N)C1CC1 841965788 KGHYOMMSTYNWSZ-AWEZNQCLSA-N 291.395 2.051 10 20 CECD CC[C@@H](N[C@@H]1CCc2c(nnn2C)C1)c1ccccc1O 848562233 BNUWSBBYQJDHMQ-DGCLKSJQSA-N 286.379 2.119 10 20 CECD CCOc1ccc(CNC[C@H]2CCCCN2)c(O)c1 841033620 XXIJLLUYCWBVPJ-CYBMUJFWSA-N 264.369 2.023 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H](C)CCN 841966917 HRXDVXZIDDWZDO-ZDUSSCGKSA-N 292.427 2.021 10 20 CECD N[C@H](CNCc1c(O)ccc(Cl)c1F)C1CC1 841050619 JFROKPSJYNDBDA-SNVBAGLBSA-N 258.724 2.012 10 20 CECD COC[C@H](C)NC(=S)NCc1cc(Cl)ccc1O 844583841 HRBOWCYHRXKGBI-QMMMGPOBSA-N 288.800 2.045 10 20 CECD CCNC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840256256 PLLZQXFMHBHPSQ-LBPRGKRZSA-N 263.385 2.311 10 20 CECD Cc1noc([C@@H](C)N(C)C(=O)Nc2ccc(N)cc2)n1 848594579 NBOOPLVFWIOFIF-MRVPVSSYSA-N 275.312 2.185 10 20 CECD CNC[C@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 923282745 PWVXKHAEBWDFKH-MRXNPFEDSA-N 275.440 2.492 10 20 CECD Cc1ccc(C(=O)OCc2ncc(Cl)n2C)c(O)c1O 750618935 NJGPUPHUICUFTO-UHFFFAOYSA-N 296.710 2.150 10 20 CECD COc1ccc(N(C)Cc2nccc(C)n2)cc1OC 756485796 IGYHROCSGSFPJN-UHFFFAOYSA-N 273.336 2.439 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@@H]3C[C@H]3C2)cc1 853245256 WLAIMEVRBPNYCC-KGLIPLIRSA-N 273.380 2.304 10 20 CECD Cc1cnccc1CCNC(=O)c1cc(O)cs1 755312330 ILNRKXXOLCAYBC-UHFFFAOYSA-N 262.334 2.130 10 20 CECD CC(C)(C)O[C@@H]1C[C@H]1C(=O)NCc1ccc(N)cc1 850711203 LPIMTOKNZUCNKE-CHWSQXEVSA-N 262.353 2.089 10 20 CECD CC(C)CN1CC(=O)N[C@H]1c1cc(Cl)cc(F)c1O 768273544 KGCNOPVLWJANKV-CYBMUJFWSA-N 286.734 2.271 10 20 CECD Cc1noc(CN(C)Cc2cc(F)c(N(C)C)cc2F)n1 862407557 YXBZDYOCLFCNHR-UHFFFAOYSA-N 296.321 2.354 10 20 CECD CC[C@H](O)CCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776239943 SLGQWUFBERWASL-DOMZBBRYSA-N 293.411 2.274 10 20 CECD CN(C(=O)c1noc2c1CCCC2)c1ccc(N)cc1 877081135 VMCXXMUSXFNFLQ-UHFFFAOYSA-N 271.320 2.412 10 20 CECD CC(=O)OC1CCN(Cc2ccc(C)cc2O)CC1 876740375 MWDVDKSXDFEUIN-UHFFFAOYSA-N 263.337 2.228 10 20 CECD CCOCCONC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773516696 JPMPFIYQVSXHET-LBPRGKRZSA-N 295.383 2.081 10 20 CECD CCn1cc(NCc2ccc(OC)c(OC)c2O)cn1 893245177 IDCLKSALVLFTDL-UHFFFAOYSA-N 277.324 2.238 10 20 CECD COc1cc(C)cc(CN[C@H](C)Cn2ccnc2)c1O 894173972 MRKKCKMRZJOGNU-GFCCVEGCSA-N 275.352 2.084 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCN2C(C)(C)C)c1 899133801 QHPYCDUHMBXEGZ-CYBMUJFWSA-N 276.380 2.190 10 20 CECD COCCc1nsc(NCc2cc(C)ccc2O)n1 798188664 BRAGZTHZHAMYPW-UHFFFAOYSA-N 279.365 2.353 10 20 CECD Cc1cc(N(C)C)ccc1CNCC[C@H](O)C1CC1 898197638 ICTZYVUPJLBKNH-INIZCTEOSA-N 262.397 2.312 10 20 CECD CCOc1cccc(CN[C@H]2C[C@H](OC)C2)c1O 706492648 UAVRISVDWKAPAM-HAQNSBGRSA-N 251.326 2.058 10 20 CECD CC[C@@H](C[C@@H](C)CO)NCc1ccc(OC)c(OC)c1O 893074144 KXWPMOAMNMHWBO-YPMHNXCESA-N 297.395 2.296 10 20 CECD CN(C)c1ccc(CNC(C)(C)C(=O)N2CCCC2)cc1 793397502 YPIIWSRZGJSKFV-UHFFFAOYSA-N 289.423 2.243 10 20 CECD CCOCC1(C(=O)N[C@@H](C)c2cc(OC)ccc2O)CC1 799697853 LXWPDOZDLGIHPK-NSHDSACASA-N 293.363 2.395 10 20 CECD C[C@H](NS(=O)(=O)c1ccoc1)c1ccc(N(C)C)cc1 795934554 WOCUYOMPZXSTAJ-NSHDSACASA-N 294.376 2.385 10 20 CECD COc1ccc(CNC(=O)NCc2ccsc2)c(O)c1 792811143 BHSYGEXZFCWGNY-UHFFFAOYSA-N 292.360 2.462 10 20 CECD COC(=O)[C@]1(NC(=O)c2cc(O)cs2)CC[C@H](C)CC1 1328796885 ZFRSPDBBCJISAJ-KMHCFJFGSA-N 297.376 2.305 10 20 CECD CCCn1cc(C(=O)Nc2ccc(N)cc2)c(C)n1 1339846368 YBUDVBJMXMJNJA-UHFFFAOYSA-N 258.325 2.436 10 20 CECD CC(C)O[C@H]1CCCN(C(=O)NCc2ccc(N)cc2)C1 1335736500 BGYJWCYWWVZLLN-HNNXBMFYSA-N 291.395 2.368 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccns1 1335521258 JWSARPXOQCPRBF-UHFFFAOYSA-N 275.377 2.481 10 20 CECD C[C@H](NC(=O)N1CC(F)(F)C1)c1ccc(N(C)C)cc1 1345856588 BROKLYKGHGSBFC-JTQLQIEISA-N 283.322 2.474 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@@H]1F 1346245386 DBLZGDFABAMUEC-OLZOCXBDSA-N 250.317 2.069 10 20 CECD COc1ccc(OCCNCc2ccc(N)cc2)cc1 107787565 ISTKAQIBXRXYRX-UHFFFAOYSA-N 272.348 2.446 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@H](c3ncc[nH]3)C2)cc1 1353538860 DZGABXCBJSMODP-ZDUSSCGKSA-N 299.378 2.081 10 20 CECD O=C(O)C1CN(Cc2ccc3ccccc3c2O)C1 1601848052 SJHRJWPXKZPBCC-UHFFFAOYSA-N 257.289 2.062 10 20 CECD CN(C)c1ccc(/C=C\CN[C@H]2CNCC23CC3)cc1 1578425603 HYOPIZWSUUVGDO-QGZUEGPWSA-N 271.408 2.107 10 20 CECD CCOc1cccc(CN(C[C@@H](C)C(=O)O)C2CC2)c1O 1597153145 AEDYIMMTIIYSPB-LLVKDONJSA-N 293.363 2.476 10 20 CECD O=S(=O)(CC1CCCCC1)NCc1ccccc1O 134912143 URLVDMYWKAWFDQ-UHFFFAOYSA-N 283.393 2.392 10 20 CECD CC[C@H](O)CCNCc1cc(Br)ccc1O 166139401 RWCUWWVGLOAACP-NSHDSACASA-N 288.185 2.405 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCC[C@H]1C3)OCO2 902659880 WTSDMYAOWSQMAA-JQWIXIFHSA-N 261.321 2.495 10 20 CECD CCOCCOCCN[C@@H](C)c1ccccc1O 927086163 DFJJVERJDUHGOQ-LBPRGKRZSA-N 253.342 2.096 10 20 CECD CCOc1cccc(CN[C@H](CO)CC(C)C)c1O 40773804 XFXJYDLMDLZJOQ-ZDUSSCGKSA-N 267.369 2.288 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCc1nncn1C 38007585 DNHNQDOVQBAUDG-MNOVXSKESA-N 272.352 2.167 10 20 CECD C[C@]1(NCc2cc(F)cc(F)c2O)CCCOC1 708438209 VSNOWOGGVAZERA-ZDUSSCGKSA-N 257.280 2.329 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(F)ccc2O)c1 177163659 BFCOSDLTRHKFEQ-UHFFFAOYSA-N 291.278 2.176 10 20 CECD O=C1NC(=S)S/C1=C\c1cc(F)cc(F)c1 179171259 CTWNVHVBULQZGU-BAQGIRSFSA-N 257.286 2.454 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC1CCSCC1 181005428 JDROTGAJBBKPKB-DUXPYHPUSA-N 279.361 2.123 10 20 CECD Cc1nc(Sc2nccs2)c2cnn(C)c2n1 48894053 AKWNKFFJUCENNC-UHFFFAOYSA-N 263.351 2.279 10 20 CECD CN(CCCN)Cc1cc(Cl)cc(Cl)c1O 227744781 NGZQORGFQQHRPT-UHFFFAOYSA-N 263.168 2.480 10 20 CECD CNC(=O)Cc1ccccc1NCc1cc(F)ccc1O 226581270 ZLWBBKJWUXNZKO-UHFFFAOYSA-N 288.322 2.432 10 20 CECD CCCN(Cc1ccccc1O)Cc1nonc1C 265145994 RNUVZDDHAUVKNZ-UHFFFAOYSA-N 261.325 2.496 10 20 CECD C[C@@H]1COCCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 91810250 YMOXGSHHQCMKOX-MRVPVSSYSA-N 286.715 2.175 10 20 CECD COc1cccc(CNC(=O)c2conc2C(C)C)c1O 528859054 GFWDQIUUZOZJLT-UHFFFAOYSA-N 290.319 2.442 10 20 CECD CN(C(=O)/C=C\c1cccnc1)c1ccc2c(c1)OCO2 255696339 DXBGJWRKETXRAE-DAXSKMNVSA-N 282.299 2.487 10 20 CECD CCCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264677969 YSFLKEKGHGQHOC-VMPITWQZSA-N 274.364 2.063 10 20 CECD C[C@H](N[C@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1O 368602875 LIRYWQHBBSHGFY-XEZPLFJOSA-N 277.364 2.381 10 20 CECD CNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1O 374872749 FHZMKZZZAMLHNW-INIZCTEOSA-N 296.370 2.065 10 20 CECD CCNC(=O)[C@H](C)N[C@H](CC)c1ccc(F)cc1O 285606848 KCHXWWNEWGEAON-JOYOIKCWSA-N 268.332 2.097 10 20 CECD CC[C@@H](NCc1nncn1C)c1ccc(C)cc1O 280276090 YDGMHJMEPVKZCV-GFCCVEGCSA-N 260.341 2.070 10 20 CECD CCOCc1cc(CN[C@@H](C)CN(C)C)ccc1OC 290210678 VVSSEERHDNVKPJ-ZDUSSCGKSA-N 280.412 2.271 10 20 CECD CCc1ccc([C@@H](O)CNC(=O)c2cc(O)cs2)cc1 807665590 BBFCDICCLPFIND-ZDUSSCGKSA-N 291.372 2.480 10 20 CECD CO[C@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 816513287 LWCATZPRPJUNRX-VIFPVBQESA-N 259.708 2.405 10 20 CECD C[C@@H](N)CN[C@H](C)c1cc(Br)c(F)cc1O 817973455 UCMPBEUIHOOPHI-RNFRBKRXSA-N 291.164 2.292 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@@H]3CNC[C@H]3C2)c1 817987591 UNMIOBBGBFSKIH-REWJHTLYSA-N 290.407 2.440 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NC1CCC1 734528787 DBYIOINVXURFOR-UHFFFAOYSA-N 261.369 2.413 10 20 CECD CCOC[C@@H](O)CN(CC1CC1)c1ccc(OC)cc1 831587727 IQARMNUZMPLUBQ-HNNXBMFYSA-N 279.380 2.309 10 20 CECD NCC[C@@H](NCc1cc(Cl)cc(F)c1O)C(F)F 841073642 IZIAJOFLIULCTA-SECBINFHSA-N 282.693 2.257 10 20 CECD CC(C)n1[nH]cnc1=NCc1c(O)ccc(Cl)c1F 840887311 WOLCIELEVIHGEX-UHFFFAOYSA-N 284.722 2.391 10 20 CECD C[C@H](c1cnn(C)c1)c1nc(Cc2ccc(N)cc2)no1 843160797 JCOVQRYRFAXIAC-SNVBAGLBSA-N 283.335 2.128 10 20 CECD CCCCOC(=O)[C@@H](C)OC(=O)c1ccc(C)c(O)c1O 744909675 KXWRIYMYSLTNJF-SNVBAGLBSA-N 296.319 2.295 10 20 CECD C[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)CS1 840957376 AGDISSKUPMVEJO-SCZZXKLOSA-N 268.338 2.284 10 20 CECD CCC[C@]1(C)C(=O)NCCN1Cc1cccc(CC)c1O 848906474 WTZZQSVEJHWASF-QGZVFWFLSA-N 290.407 2.445 10 20 CECD CCN(CC)c1ccc(CN(CCOC)CC(=O)O)cc1 840995626 ZLGHOXYIPDLNIE-UHFFFAOYSA-N 294.395 2.066 10 20 CECD CCN1CC[C@H](CNCc2cc(F)c(N(C)C)cc2F)C1 858100038 HLTDAFKAFYSOHR-GFCCVEGCSA-N 297.393 2.462 10 20 CECD COC(=O)C1(C(=O)CSc2ncc(Cl)s2)CC1 850001502 IBUSZSLMMPWBHW-UHFFFAOYSA-N 291.781 2.411 10 20 CECD Oc1ccccc1CN(CCc1cnn[nH]1)Cc1ccco1 851841362 PLHGBDFQAPJHFT-UHFFFAOYSA-N 298.346 2.348 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccn(C)c1 935949184 UXAVDLDCTMKUMN-UHFFFAOYSA-N 279.336 2.146 10 20 CECD CCCNC(=O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756355044 GDHSMFFWUYPHNJ-KOLCDFICSA-N 280.343 2.195 10 20 CECD CCOc1ccc(CN2CC[C@@]3(CCOC3)C2)c(O)c1 769531542 GSJCQVYCBQJAKV-MRXNPFEDSA-N 277.364 2.403 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2cnccc2C)c1 862753920 LNGVYSLFQRMBKN-UHFFFAOYSA-N 270.332 2.263 10 20 CECD Cc1ccc(O)c(CN2CCC(CN(C)C)CC2)c1 132792108 WXQMGCXPTUHTCS-UHFFFAOYSA-N 262.397 2.474 10 20 CECD C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N[C@H](C2CC2)C1=O 761576309 BQQDMVJJWPEPML-IINYFYTJSA-N 287.363 2.144 10 20 CECD C[C@@H](NC(=O)Nc1ccnn1C)c1ccc(N(C)C)cc1 775752225 DYRYXTPDTHYOOE-LLVKDONJSA-N 287.367 2.369 10 20 CECD Cc1cccc(O)c1CNCCCCCS(C)(=O)=O 877423456 ARXNQAKAZGLVJP-UHFFFAOYSA-N 285.409 2.005 10 20 CECD CCC[C@@H]1NC(=O)N(CCCSc2nccs2)C1=O 777649482 HJCKZWBDFWKGMD-VIFPVBQESA-N 299.421 2.346 10 20 CECD COCCOCCN[C@H](C)c1c(C)cc(C)cc1O 788564982 USUPMHNHBHARQV-CYBMUJFWSA-N 267.369 2.323 10 20 CECD Cc1cc(C(=O)N2C[C@H](O)C[C@H]2C)c(C)n1-c1ccccn1 788547378 IWTUXZATHFVGDP-BXUZGUMPSA-N 299.374 2.084 10 20 CECD C[C@H]1OCC[C@]12CN(Cc1cc(F)cc(F)c1O)CCO2 894603521 ZJNMPHYIKJQCKE-BMIGLBTASA-N 299.317 2.050 10 20 CECD CCC[C@@H](NCc1ccc(OC)c(C)c1)C(=O)OC 83482099 NIUZLUFZFMKVSI-CYBMUJFWSA-N 265.353 2.435 10 20 CECD CC(C)(C)OC(=O)C1CN(Cc2cc(F)cc(F)c2O)C1 894970831 MNVZHLIVIADXHU-UHFFFAOYSA-N 299.317 2.444 10 20 CECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccoc1 795843167 MJYORHIJYBJDDI-UHFFFAOYSA-N 294.376 2.133 10 20 CECD CCc1cccc(CNCCC[C@H](C)CO)c1O 691496822 VYGKSFSYGIMZHY-LBPRGKRZSA-N 251.370 2.453 10 20 CECD COc1ccc(CNc2ncncc2Cl)c(O)c1 795284985 OZUGLUHTNNBVBG-UHFFFAOYSA-N 265.700 2.456 10 20 CECD Oc1cc(Br)ccc1CNC[C@H]1C[C@H](O)C1 720947218 LFKJKUOOGUIGOJ-JLIMDTESSA-N 286.169 2.015 10 20 CECD CC[C@H]1CO[C@@H](C)CN1Cc1c(O)cccc1OC 768172229 NSHGCIMMFVURDH-RYUDHWBXSA-N 265.353 2.400 10 20 CECD CCO[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 1329777445 KBEVQSQFMDOBDN-OAHLLOKOSA-N 294.370 2.323 10 20 CECD Cc1nn(C)c(C)c1[C@@H](C)C(=O)NCc1ccc(N)cc1 1343568025 VQWJSXGTAGLPBP-SNVBAGLBSA-N 286.379 2.039 10 20 CECD Nc1ccc(CN2CCCC[C@H]2[C@H]2CCCN2)cc1 1345160107 QYUMEEQPZYNTAE-CVEARBPZSA-N 259.397 2.375 10 20 CECD Cc1ccc(CN2CC[C@@H](C)C[C@@H]2C(=O)O)c(O)c1 1600412763 KMEXLVYNXVAOAV-DGCLKSJQSA-N 263.337 2.386 10 20 CECD CC(C)c1oncc1C(=O)NCCc1ccc(N)cc1 1575898379 MEFPONWTNIKJIY-UHFFFAOYSA-N 273.336 2.353 10 20 CECD CC1(C)C[C@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 160983767 DWGKUJUADNMUIX-FVOPLDGLSA-N 291.347 2.185 10 20 CECD CNC1=NC(=O)/C(=C\c2ccc3ncccc3c2)S1 200338415 OTTNNAIKNUBBIR-XYOKQWHBSA-N 269.329 2.425 10 20 CECD Oc1ncccc1CNCc1ccc2c(c1)CCCO2 922295895 QBIABVCDPMHAGO-UHFFFAOYSA-N 270.332 2.402 10 20 CECD CC[C@@](C)(CNCc1c(O)cccc1OC)OC 824744077 ZARHMKNLVZJEAY-AWEZNQCLSA-N 253.342 2.306 10 20 CECD C[C@H](O)CC(C)(C)CNC(=O)Nc1ccc(N)cc1 841301082 ZMDJUMYCCGSVFP-JTQLQIEISA-N 265.357 2.187 10 20 CECD COCCO[C@H]1CCCN(Cc2c(C)cccc2O)C1 877502314 FOQNWRHQSJMTMP-AWEZNQCLSA-N 279.380 2.328 10 20 CECD C[C@@H](NCCc1cncn1C)c1ccc(N(C)C)cc1 401877357 OFFJOHDDWMXCBN-CYBMUJFWSA-N 272.396 2.379 10 20 CECD CCc1noc(C)c1C(=O)N(C)c1ccc(N)cc1 702054697 YSAQOTLUIMWABC-UHFFFAOYSA-N 259.309 2.404 10 20 CECD CC(C)[C@@H](CO)CN[C@H](C)c1cc(F)ccc1O 394073296 RTLVYMFYGKOFGO-GHMZBOCLSA-N 255.333 2.446 10 20 CECD CC(C)N(C)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 108685771 OSKYYOJHYLGSNU-RMKNXTFCSA-N 288.391 2.403 10 20 CECD COc1cccc(CNCc2cnn(C)c2Cl)c1O 816610188 BFNLCGIEHZXDKP-UHFFFAOYSA-N 281.743 2.078 10 20 CECD CCOc1ccc(O)c(CNC[C@@H](O)c2ccco2)c1 304527937 MCPHGFSWAVZKQE-CQSZACIVSA-N 277.320 2.207 10 20 CECD COCCc1nsc(N(C)Cc2ccccc2O)n1 302674092 SYTLNPSNOCBYHC-UHFFFAOYSA-N 279.365 2.069 10 20 CECD CO[C@@H]1CCN(Cc2cccc(Br)c2O)C1 300046511 WHDHJYGUYBCWBJ-SNVBAGLBSA-N 286.169 2.375 10 20 CECD CC[C@@H](C)C[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 400859794 MOQNKEVDWYEOMW-CJNGLKHVSA-N 291.439 2.475 10 20 CECD CC(C)n1cc(C(=O)N(C)Cc2ccccc2O)cn1 188357847 PUOHHJQULHPJEM-UHFFFAOYSA-N 273.336 2.442 10 20 CECD CN(Cc1cc(Cl)ccc1O)[C@H]1CCCCNC1=O 123894261 IQNHRNGXEUZUEM-LBPRGKRZSA-N 282.771 2.146 10 20 CECD CCC[C@](C)(NCc1ccccc1O)C(=O)OC 184047294 YGWILXRFXOJXCL-AWEZNQCLSA-N 251.326 2.214 10 20 CECD CCN1CC(=O)N[C@@H]1c1ccc(N2CCCCC2)cc1 189860415 GPYGFRRYOWAHKD-INIZCTEOSA-N 273.380 2.127 10 20 CECD CN(C)c1ccc(CN2CCC(Cn3cncn3)CC2)cc1 189975755 MUEHRPLDBJQHPK-UHFFFAOYSA-N 299.422 2.256 10 20 CECD C[C@H](NCCc1cn[nH]c1)c1ccc(N(C)C)cc1 289738290 KMDMWPFOWSEAMO-LBPRGKRZSA-N 258.369 2.369 10 20 CECD CCc1nsc(NCc2cc(OC)ccc2O)n1 92654519 WJNUJIGHDOONAC-UHFFFAOYSA-N 265.338 2.427 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2cccc(C)c2O)C1 180550022 TVGIUINRMFJJTQ-AWEZNQCLSA-N 262.397 2.474 10 20 CECD CC1(C(=O)NCCc2ccc(O)c(O)c2)CCCC1 298760695 KKYNEBAXGNEQAJ-UHFFFAOYSA-N 263.337 2.337 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)C1(O)CCCC1 266454375 DUWLHMUYYAGRNX-UHFFFAOYSA-N 289.375 2.192 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC1CCCC1 272417531 JSKBRNGEBMEKJL-SOFGYWHQSA-N 261.321 2.417 10 20 CECD CN1CCCc2cc(CN3C(=O)NC4(CCC4)C3=O)ccc21 277846203 NOYSOGOFTOOSBQ-UHFFFAOYSA-N 299.374 2.044 10 20 CECD COC1(C(=O)NCc2ccc(N(C)C)c(F)c2)CCC1 272740746 MTECXYOCNQKSNX-UHFFFAOYSA-N 280.343 2.077 10 20 CECD C[C@H]1C[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 271888831 JLJPZKSIWORXNF-WCQYABFASA-N 294.370 2.323 10 20 CECD CCOC1CC(O)(CN[C@H](C)c2cc(C)ccc2O)C1 278547859 VOTBWOIXMMYVPW-VEAWUBTESA-N 279.380 2.281 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)cc1 374271986 PPICKJXBDVJUQQ-WBVHZDCISA-N 290.407 2.180 10 20 CECD CC[C@H](NCc1nncn1C)c1cccc(Cl)c1O 287565621 GKSLDRPICUCFNI-NSHDSACASA-N 280.759 2.415 10 20 CECD CC(=O)C(=O)COc1cc(C)c([N+](=O)[O-])cc1Cl 808043300 VBHYXXAKORZAOA-UHFFFAOYSA-N 271.656 2.094 10 20 CECD CC(=O)C(=O)COC(=O)c1c(C)nc2ccccc2c1C 808490686 HEQRZEAJNNEBPC-UHFFFAOYSA-N 285.299 2.167 10 20 CECD Cc1ncc2n1C[C@H](C(=O)N(C)Cc1ccccc1O)CC2 816889016 JFDOFZKQRAFUHN-CQSZACIVSA-N 299.374 2.118 10 20 CECD COc1cc(Cl)cc(CNC(CF)CF)c1O 824554850 NXCCUFJHOOLSFP-UHFFFAOYSA-N 265.687 2.451 10 20 CECD COc1ccc(N(C)Cc2cnns2)cc1OC 827491362 KZZVPQUXMVUUTE-UHFFFAOYSA-N 265.338 2.192 10 20 CECD CN(C(=O)c1cc(O)cs1)[C@H](CO)CC(C)(C)C 839787376 YEDMLNDLPXTUCF-VIFPVBQESA-N 271.382 2.323 10 20 CECD O=C1[C@H](NCc2cccc(Cl)c2O)C[C@@H]2CCCCN12 835075664 ZLUYKQGAFLDRRI-WCQYABFASA-N 294.782 2.289 10 20 CECD COc1ccc(O)c(CNC(=O)NCCc2ccco2)c1 734064878 NLGHQIJYXROADX-UHFFFAOYSA-N 290.319 2.036 10 20 CECD C[C@H]1CCCC[C@H]1NC(=O)COC(=O)c1cc(O)cs1 731911232 GZZSQKBRZWZCGU-GXSJLCMTSA-N 297.376 2.305 10 20 CECD CCOc1ccc(O)c(CN2CC(C)(COC)C2)c1 839145757 TYIADSGLNUTFDH-UHFFFAOYSA-N 265.353 2.259 10 20 CECD CCCCN(Cc1ccccc1O)C[C@@H](O)CN(C)CC 846894213 UPDVROMOCOAASM-INIZCTEOSA-N 294.439 2.307 10 20 CECD CCS(=O)(=O)CCCN[C@H](C)c1ccc(C)c(C)c1O 840889756 VPOACBPSOJHZHK-CYBMUJFWSA-N 299.436 2.484 10 20 CECD COc1cccc([C@H](C)N[C@H](CCO)C(C)C)c1O 846149429 ZJDSCKZRVMVWIQ-WCQYABFASA-N 267.369 2.458 10 20 CECD CC[C@H](NCc1cc(F)c(N(C)C)cc1F)[C@H](C)O 858172408 SYYYNJAFVHJIQW-ZANVPECISA-N 272.339 2.280 10 20 CECD CCS(=O)(CC)=NC(=O)c1ccc(C)c(O)c1O 925886191 CXWDMCCFORSTGE-UHFFFAOYSA-N 271.338 2.054 10 20 CECD Cc1ccc([C@@H](C)NCCO[C@@H]2CCOC2)c(O)c1C 927081856 XOPCSSJYZOCAIP-ZIAGYGMSSA-N 279.380 2.465 10 20 CECD C[C@H]1CCN(C(=O)c2cc(O)cs2)CCS1 757685786 BXKVRWPXULNZPO-QMMMGPOBSA-N 257.380 2.421 10 20 CECD Cc1ccc(O)c(NC(=O)c2cc(O)cs2)n1 753464645 HBHSDYJRXKWENK-UHFFFAOYSA-N 250.279 2.115 10 20 CECD CC[C@@H](C)CCNC(=O)c1c(F)ccc(O)c1O 857306989 MYWXHBKOCJUBEI-MRVPVSSYSA-N 255.289 2.403 10 20 CECD CCOc1ccc(CN2CCN(C)CC2(C)C)c(O)c1 769446828 NEUXRKLDZSZXNU-UHFFFAOYSA-N 278.396 2.317 10 20 CECD Cc1nnc(NCc2cc(F)c(N(C)C)cc2F)o1 865289808 FHGSPPGQKUIYEJ-UHFFFAOYSA-N 268.267 2.334 10 20 CECD Cc1ccc(CN2CCOC[C@H]2[C@H]2CCCO2)c(O)c1 877516145 BPNDSLXQLVCEHR-GOEBONIOSA-N 277.364 2.080 10 20 CECD Fc1ccc(CNCc2ccc3c(c2)CCO3)cn1 778161849 NZSJDBAIFWZGCO-UHFFFAOYSA-N 258.296 2.445 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccc(N)nc1 876632978 PDVDSQGMRAMIKV-UHFFFAOYSA-N 285.347 2.422 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@@H]1O 775744007 IUZGPEAUTYMTSY-UFBFGSQYSA-N 273.735 2.387 10 20 CECD COC[C@@H](C)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773276326 KQJUMRRSNPNLME-QWHCGFSZSA-N 293.411 2.395 10 20 CECD C[C@H](NCC(=O)NC1CCCC1)c1ccccc1O 775137397 UDGBMEDYBFVUQI-NSHDSACASA-N 262.353 2.102 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)C[C@@H]2CCCO2)cc1C 886226126 HZUCFOJEMNMQTF-CABCVRRESA-N 279.380 2.029 10 20 CECD C[C@H](NC(=O)C[C@@H]1CCCO1)c1ccc(N(C)C)cc1 773011288 FNIDXVSMICXDFR-WFASDCNBSA-N 276.380 2.499 10 20 CECD COc1ccc(O)c(CNS(=O)(=O)CC2(C)CCC2)c1 881924419 MEQVZCJKTTZLDM-UHFFFAOYSA-N 299.392 2.010 10 20 CECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)c1ncco1 886275937 QZOYWBSYCWUHQM-CYBMUJFWSA-N 287.363 2.362 10 20 CECD CCC(C)(C)C(=O)OCC(=O)c1ccc(O)c(O)c1 783390816 YFTLQEMEBGWUKD-UHFFFAOYSA-N 266.293 2.260 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOC[C@H]1[C@H]1CCCO1 894747497 LUSQWRDSGHALIU-UONOGXRCSA-N 299.317 2.050 10 20 CECD CN(Cc1ccccc1O)c1ccc(C(=O)O)cn1 1593760807 XEEIAHNPGGBZLL-UHFFFAOYSA-N 258.277 2.122 10 20 CECD Oc1c(F)cc(F)cc1CN1CC[C@H](N2CCCC2)C1 708424086 WGBXWLSXOILSTB-ZDUSSCGKSA-N 282.334 2.341 10 20 CECD CCOc1nc(C(=O)N(C)Cc2ccccc2O)co1 753833226 DVKZKSYACUEZDY-UHFFFAOYSA-N 276.292 2.051 10 20 CECD CC[C@H](NC[C@@H](O)COCC1CC1)c1ccc(F)cc1O 796737489 VZTZYSARQMENBA-HIFRSBDPSA-N 297.370 2.360 10 20 CECD C[C@H](CCNCc1ccc(N(C)C)cc1)CC(=O)O 1255786601 MPYLFHUTTHIVGD-GFCCVEGCSA-N 264.369 2.343 10 20 CECD CC[C@H](C)[C@](C)(O)CNCc1ccc(OC)c(OC)c1O 1342948322 VYLRNIUPTHVUOV-MEDUHNTESA-N 297.395 2.296 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cc(N)ccn2)cc1 1346040548 JGPMLAMQOFXNMN-UHFFFAOYSA-N 298.390 2.440 10 20 CECD COc1ccc(N(C)Cc2cc(C(=O)O)no2)cc1F 1607267752 HMWDHCXCLDUDIO-UHFFFAOYSA-N 280.255 2.157 10 20 CECD Cc1ccc(O)c(CN2CCCC[C@@H]2CS(C)(=O)=O)c1 824914672 XASJBHLURRDEQB-CQSZACIVSA-N 297.420 2.100 10 20 CECD CC(C)[C@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CCO1 831505994 NGVMAMUMTNGBKJ-LSDHHAIUSA-N 276.380 2.131 10 20 CECD c1coc(CNCc2ccc(N3CCOCC3)cc2)c1 20083980 NKSKSKKYIJYKNH-UHFFFAOYSA-N 272.348 2.406 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H](N)C(C)(C)C)cc1 136918184 XHNMYQBLPXAHMC-CQSZACIVSA-N 277.412 2.132 10 20 CECD CC(C)N(C)C[C@@H](C)NCc1cc(F)cc(F)c1O 708516969 LZOKCNDMOFYLRC-SNVBAGLBSA-N 272.339 2.489 10 20 CECD Cc1ccc([C@@H](C)NC[C@H]2CCCCS2(=O)=O)c(O)c1 694591104 RLFWRPMCWZGMAS-CHWSQXEVSA-N 297.420 2.319 10 20 CECD COc1cc(Cl)cc(CNC2([C@@H](C)O)CC2)c1O 827586022 STNSURIEXVWJQU-MRVPVSSYSA-N 271.744 2.057 10 20 CECD Cn1nccc1NC(=O)NCc1ccc(N2CC=CC2)cc1 125118465 NAJCCTXOSGBTTI-UHFFFAOYSA-N 297.362 2.118 10 20 CECD CSC(C)(C)CNC(=O)/C=C/c1ccc(O)c(O)c1 181145549 DKINHHJYQZXJFB-FNORWQNLSA-N 281.377 2.369 10 20 CECD CN1c2ccccc2C(=O)N[C@H]1c1cc(F)ccc1O 77472036 GIFXXNVVYVHEQU-CQSZACIVSA-N 272.279 2.410 10 20 CECD CCCCn1nccc1NC(=O)c1cccc(O)c1O 188339038 JCAGMICONFWCBL-UHFFFAOYSA-N 275.308 2.347 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCNC(C)(C)C 37801185 WEUOXRBJIXRICL-UHFFFAOYSA-N 291.439 2.489 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccncc1 180605093 XIBPWKJKSOEFFV-DUXPYHPUSA-N 256.261 2.145 10 20 CECD Oc1ccccc1CNC[C@H](O)c1cccc(F)c1 134228731 AUQJCNLNKDFGTE-HNNXBMFYSA-N 261.296 2.355 10 20 CECD C[C@](O)(CNCc1ccc2c(c1)CCO2)c1ccco1 266170348 QVMXKZNLMPSALO-INIZCTEOSA-N 273.332 2.212 10 20 CECD Cc1ccc(O)c(CN2CC[C@H]3CCN(C)C[C@H]32)c1 272261102 ARCLJNKWMYBRKH-UKRRQHHQSA-N 260.381 2.227 10 20 CECD C[C@H](O)C[C@@H](C)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273613429 WTZUMCJHJASDRT-VWYCJHECSA-N 282.340 2.358 10 20 CECD COc1ccc(O)c(CN[C@@]2(C)CCO[C@H]2C2CC2)c1 273175724 NHPSVCBYGHDANU-HOTGVXAUSA-N 277.364 2.448 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H]1c1ncc[nH]1)OCO2 375356417 ZOEVSDIXFYHCIB-NSHDSACASA-N 287.319 2.181 10 20 CECD CC(C)Oc1ccc(C(=O)NCc2ccc(N)cc2)cn1 297257311 RGAAXZXXDBGRKE-UHFFFAOYSA-N 285.347 2.381 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@@H]2CCCO2)cc1F 299336002 ONNKZZHMBWGALI-ZDUSSCGKSA-N 294.370 2.467 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CC1(F)F 817559519 VAEWCLNTSXWQTB-AMIZOPFISA-N 285.290 2.190 10 20 CECD Cc1cccc(CN2CCNC(=O)c3ccccc32)c1O 811508539 VRFCQKRSJYFMJL-UHFFFAOYSA-N 282.343 2.451 10 20 CECD Nc1ccc(Cc2nc(C(=O)NCC3CC3)cs2)cc1 817912965 ZWMDYIKTSYZVJW-UHFFFAOYSA-N 287.388 2.456 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@@H]1C(=O)O 828456685 NAWPPQNXQWABOC-HZMBPMFUSA-N 275.348 2.033 10 20 CECD Cc1cc(O)c(CN2CC[C@](C)(C(N)=O)C2)cc1Cl 825752996 LDZHEBFAMJULDZ-AWEZNQCLSA-N 282.771 2.051 10 20 CECD CCN1CCC[C@@H](N[C@H](C)c2cc(F)cc(F)c2O)C1=O 903392380 RJUDWBXUWRENQK-NOZJJQNGSA-N 298.333 2.332 10 20 CECD COc1cc(NCc2cc(C)c(C)cc2O)ncn1 902180719 GRECXTLTBDJPBY-UHFFFAOYSA-N 259.309 2.420 10 20 CECD N[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2O)C1 906508678 UNKKFVPQRIDMDY-KYZUINATSA-N 261.152 2.278 10 20 CECD CCOc1ccc(CN(CC(=O)O)C2CCC2)c(O)c1 848640891 VJKNMJMZGLZJRV-UHFFFAOYSA-N 279.336 2.230 10 20 CECD C[C@@]1(CNC(=O)NCCc2ccc(N)cc2)CCCS1 841861129 STXVHHUOSYVUDT-HNNXBMFYSA-N 293.436 2.396 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCN2CCCC2=O)cc1 846208839 MKQHQDNHUHDDDS-CQSZACIVSA-N 289.423 2.416 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)N[C@H](C)CN 841968599 BKSUNKNBAMUGHF-GFCCVEGCSA-N 279.384 2.051 10 20 CECD CO[C@@H](CNC(=O)c1ccc(C)c(O)c1O)CC(C)C 841445705 NJZAPFZCZBTPPN-LLVKDONJSA-N 281.352 2.197 10 20 CECD C[C@@H](O)CN(Cc1ccccc1)C(=O)c1cc(O)cs1 741296649 SKVMJEZGWKMKRH-LLVKDONJSA-N 291.372 2.477 10 20 CECD CN(C)c1ccc(CN[C@H]2CCNCC2(C)C)cc1F 841072352 IYQOCKWUPLEKEZ-HNNXBMFYSA-N 279.403 2.369 10 20 CECD NC1(C(=O)NCc2c(O)ccc3c2CCCC3)CCCC1 843489780 LXNBDYNFJOOLBY-UHFFFAOYSA-N 288.391 2.159 10 20 CECD C[C@H]1COC[C@H]1NCc1c(O)ccc(Cl)c1F 922641128 GQYLIWIJKHUJRH-OIBJUYFYSA-N 259.708 2.309 10 20 CECD CC(C)(C)OCCCNC(=O)c1cc(O)cs1 855701141 FDIONHGWLOJVCV-UHFFFAOYSA-N 257.355 2.389 10 20 CECD COc1ccc(C(=O)NCc2cc(Cl)ccc2O)cn1 857547663 OOSQAEIUOQCUOI-UHFFFAOYSA-N 292.722 2.379 10 20 CECD Cc1cc(O)c(CN(C)[C@@H]2CCNC2=O)cc1C(C)C 758403108 WZPGKYUPLULEHS-CQSZACIVSA-N 276.380 2.144 10 20 CECD COC1(CCNC(=O)NCc2cc(C)ccc2O)CCC1 858490400 XXACGHVOIBRTDG-UHFFFAOYSA-N 292.379 2.459 10 20 CECD COc1cccc(CN(C)C[C@@H]2CCCCO2)c1O 132605503 QLURWXKZCXQAMH-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD Cc1ccc(O)c(CNC(=O)C(=O)C2CCSCC2)c1 863498674 LXAKZCYCGTXLIL-UHFFFAOYSA-N 293.388 2.029 10 20 CECD Oc1cc2c(cc1CNCC[C@H](O)C1CCCC1)OCO2 865875153 LLVYIFQYSUXZMC-ZDUSSCGKSA-N 293.363 2.152 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1nnnn1C1CC1 766270790 UAOFPGDCNZWTIQ-UHFFFAOYSA-N 299.378 2.360 10 20 CECD C[C@@H](NC(=O)[C@H]1NCCc2ccccc21)c1ccccc1O 877256124 NVYAITMEBNGQMX-PXAZEXFGSA-N 296.370 2.456 10 20 CECD O=C(/C=C\c1cncc(F)c1)N1CCc2ncccc21 770671970 IHPRXVQOATWLGH-ARJAWSKDSA-N 269.279 2.218 10 20 CECD C[C@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(N(C)C)cc1 773012351 XJZQBJHTVDQHOQ-BJKJVOPESA-N 288.391 2.497 10 20 CECD C[C@@H](NCC[C@]1(O)CCCOC1)c1c(O)cccc1F 886633137 NPBALIUQAIDWHZ-IAQYHMDHSA-N 283.343 2.114 10 20 CECD CC(C)c1cc(NS(=O)(=O)c2ccn(C)n2)ccc1O 882799201 TVWHKNLTPORHHO-UHFFFAOYSA-N 295.364 2.050 10 20 CECD OCC[C@H](NCc1cc(F)cc(F)c1O)c1ccco1 883089956 YFGFFOZGGLEEQL-LBPRGKRZSA-N 283.274 2.477 10 20 CECD CCN(CC)c1ccc(CN2CCCNCC2)cc1 77253402 YDLKZAUNNJTKRU-UHFFFAOYSA-N 261.413 2.328 10 20 CECD COc1ccc(O)c(CN2c3ccccc3C[C@@H]2CO)c1 895241441 FUSIXQGNUGZWRL-CQSZACIVSA-N 285.343 2.324 10 20 CECD CCc1nn(C)cc1NCc1ccc(OC)c(OC)c1O 893284501 HDPQZBCISIVZBF-UHFFFAOYSA-N 291.351 2.317 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CC1)c1cc(F)cc(F)c1O 799727414 JNQALMCEKXEURQ-LILOVNGRSA-N 289.347 2.232 10 20 CECD C[C@@H](NCCCCS(C)(=O)=O)c1ccc(N(C)C)cc1 709607533 QDQRENDFQDWQPE-CYBMUJFWSA-N 298.452 2.228 10 20 CECD CC1(C)CO[C@H](CNC(=O)Nc2ccc(N)cc2)C1 717565369 WSTOMKPDXFTYEF-LBPRGKRZSA-N 263.341 2.205 10 20 CECD Cc1ccc(C(=O)OCCO[C@@H]2CCCCO2)c(O)c1O 791813720 HTQUZGJNFGVVNR-GFCCVEGCSA-N 296.319 2.106 10 20 CECD CCc1cccc(CN2C[C@H](C)N(C)[C@H](C)C2)c1O 692130033 RXFUMILYHNJANV-BETUJISGSA-N 262.397 2.479 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC(C)(C)CN 1353559004 KCQFUBJAAQPXSI-UHFFFAOYSA-N 277.412 2.052 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1C 1589444344 VHKXKXMJOVWRGU-CQSZACIVSA-N 264.369 2.356 10 20 CECD C[C@@H](N[C@H](C)c1cc(C(=O)O)ccc1O)c1csnn1 1593199700 YPUNRSBLCNQCLQ-HTQZYQBOSA-N 293.348 2.354 10 20 CECD CC1(C)CC(NCc2ccc3c(c2)CCO3)(C(=O)O)C1 1776538721 NWYLJDWFFYPEDD-UHFFFAOYSA-N 275.348 2.355 10 20 CECD COc1ccc(O)c(CNC2(C)CCOCC2)c1 164770691 SLQPQBNKSBTVHI-UHFFFAOYSA-N 251.326 2.060 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@H]1CCCN1C 817290025 AMUVBYXEPRUDPM-MRXNPFEDSA-N 261.413 2.279 10 20 CECD CCCOc1ccccc1NC[C@@H](O)COCC 819399997 ZQDNKMTTXAGVQN-GFCCVEGCSA-N 253.342 2.285 10 20 CECD C[C@@H](NCCN1CCCC1)c1ccc(N(C)C)cc1 37228657 NGQUMTYTFRZCAB-CQSZACIVSA-N 261.413 2.499 10 20 CECD Cc1noc(CN[C@@H](C)c2ccc(N(C)C)cc2)n1 38034084 KAJHUDWUZQPEOP-JTQLQIEISA-N 260.341 2.295 10 20 CECD CCOc1cccc(CN[C@@H](CO)C2CCCC2)c1O 289673329 RPWIVTFXSYSHSP-AWEZNQCLSA-N 279.380 2.432 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2cn[nH]c2)c1 289701031 IPLAKRFRJVFLFU-SNVBAGLBSA-N 261.325 2.017 10 20 CECD COCC(C)(C)NCc1ccc(N2CCOCC2)cc1 66996085 ZQFVUAIUXBUQDE-UHFFFAOYSA-N 278.396 2.038 10 20 CECD COc1ccc(O)c(CN2CCCC[C@H]2CCN)c1 70148650 QYNAFVNGDSFMBN-ZDUSSCGKSA-N 264.369 2.104 10 20 CECD CC[C@@](C)(CNCc1cc(OC)ccc1O)OC 322495066 DRSLEJXUKZQBIG-AWEZNQCLSA-N 253.342 2.306 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1327377093 WQDUAMBGXXZWMJ-KZVDOYCCSA-N 277.364 2.252 10 20 CECD CC[C@H](C)[C@@](C)(O)CNCc1cc([N+](=O)[O-])ccc1O 304067296 UJMLVCGSWBHBAF-HZMBPMFUSA-N 282.340 2.187 10 20 CECD Cc1ccc(C(=O)N[C@H]2[C@@H]3Cc4ccccc4[C@H]23)c(O)c1O 182818838 AMOOOVSWESBBRV-ILXRZTDVSA-N 295.338 2.474 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CCCS1 75220607 JUNHFTAJHRVGJE-AWEZNQCLSA-N 292.404 2.374 10 20 CECD O=[N+]([O-])c1ccc(O)c(CN[C@H](CCO)c2ccco2)c1 184500514 LMVBMBMJBQKUCB-GFCCVEGCSA-N 292.291 2.107 10 20 CECD COc1ccc(N(C)CC(=O)NCC2CCC2)c(OC)c1 131984199 WDHCAHRYKRUXSI-UHFFFAOYSA-N 292.379 2.056 10 20 CECD CC[C@H](NC[C@@H](COC)OC)c1ccccc1O 229574316 LNBYNHKAYCFFPL-AAEUAGOBSA-N 253.342 2.094 10 20 CECD Cc1c(CNC(=O)c2ccnn2C)n(C)c2ccccc12 348665227 JAUOQXRNZZENMO-UHFFFAOYSA-N 282.347 2.150 10 20 CECD CCOc1cccc(CNCc2ccn(C)c2)c1O 267120772 TZFFZYWINWBWGC-UHFFFAOYSA-N 260.337 2.419 10 20 CECD Oc1c(Cl)cccc1CN1CCOC[C@H]1[C@H]1CCCO1 377701411 PAYAPZAMFKAIPG-UONOGXRCSA-N 297.782 2.425 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@]2(C)CCOC2=O)c1O 289580005 OZZDKJVNHUNMLC-CQSZACIVSA-N 297.738 2.043 10 20 CECD CC(C)(O)c1nnc(NCc2c(O)cccc2Cl)o1 283794133 GZWJCDAAOYOYBO-UHFFFAOYSA-N 283.715 2.268 10 20 CECD CC[C@@H](NC[C@@](C)(O)CCOC)c1ccc(F)cc1O 285914481 DKORNRZLNYWCID-HIFRSBDPSA-N 285.359 2.360 10 20 CECD COC[C@H](N[C@H]1CCc2cccc(O)c21)[C@H]1CCCO1 296591185 WVTQBFHEPPNXDO-KCQAQPDRSA-N 277.364 2.163 10 20 CECD Cc1cc(CN2CCC[C@@H](OCCO)C2)ccc1N(C)C 293046406 KEHHWDVTKWEWLO-MRXNPFEDSA-N 292.423 2.034 10 20 CECD CC(=O)C(=O)COC(=O)CSc1ccc(Cl)cc1 808489261 KAYRSDYVWRCYLT-UHFFFAOYSA-N 286.736 2.133 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C(C)(F)F 293428464 NLISBYKMTWYKTM-UHFFFAOYSA-N 270.279 2.133 10 20 CECD C[C@H](N[C@H](C)CN)c1ccc(N2CCOCC2)cc1Cl 817966950 ZZTNMZHXVGYIAY-NEPJUHHUSA-N 297.830 2.174 10 20 CECD CN(C)c1cccc(CNC(=O)NCc2ccccc2O)c1 726250755 CXIWXNHTZDPVLF-UHFFFAOYSA-N 299.374 2.458 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@](C)(C(=O)O)C2)c1O 825946669 KDTVOLGRAVBBCK-OAHLLOKOSA-N 295.310 2.031 10 20 CECD O=C1CC[C@@H]2[C@@H]1[C@@H]2C(=O)NCc1ccc(N2CCCC2)cc1 906110766 HCPCCXGKIPCXRI-HYVNUMGLSA-N 298.386 2.128 10 20 CECD CCc1noc(C(=O)NCCCSc2nccs2)n1 902633360 QNQBQXUDSUOBAH-UHFFFAOYSA-N 298.393 2.001 10 20 CECD C[C@H]1CCCC[C@H]1N(C)C(=O)C(=O)Nc1ccc(N)cc1 841016838 OYYUAHOOGPPUDQ-SMDDNHRTSA-N 289.379 2.244 10 20 CECD COc1ccccc1OCC(=O)NCc1ccccc1O 748353056 KQHTWKDDWREYIC-UHFFFAOYSA-N 287.315 2.096 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC[C@@H]1N 843053028 XXVOGGGRBZAOAD-KWQFWETISA-N 299.758 2.123 10 20 CECD CCN1C[C@H](N[C@H](C)c2ccc(Cl)cc2O)CC1=O 841759300 YJLZNTKSSOBCTI-MWLCHTKSSA-N 282.771 2.317 10 20 CECD C[C@@H](CCCN)NCc1cc(Br)ccc1O 841078321 AUOHRZYPALETQR-VIFPVBQESA-N 287.201 2.372 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@H]2CCCNC2=O)cc1 840827272 GMTTUONEVDIXRV-DZGCQCFKSA-N 289.423 2.320 10 20 CECD CCNCCCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 841881912 DSPDISUSURKMHW-CYBMUJFWSA-N 292.427 2.112 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)C(C)(C)F)cc1 844855492 YHOCYOSPCFPRRS-UHFFFAOYSA-N 282.359 2.338 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCS2)c1 743334605 BSEUXUJGHWOTGP-RNCFNFMXSA-N 281.377 2.474 10 20 CECD CCOc1ccc(CNCc2ccnn2CC)c(O)c1 853093497 LTFOWLFZVAZDBT-UHFFFAOYSA-N 275.352 2.297 10 20 CECD CCCN1CC[C@@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2O)C1 850557333 WGKTYVATGCYTNC-VXGBXAGGSA-N 293.367 2.435 10 20 CECD COc1cc(C)cc(CN(C)Cc2ccon2)c1O 754739803 BNYHVEMTKKTNEX-UHFFFAOYSA-N 262.309 2.329 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(N(C)C)cc2)c2ncnn21 850352499 YMLXRVPJZRPWOT-SMDDNHRTSA-N 271.368 2.140 10 20 CECD COc1ccc(N(C)C[C@@H]2CCC(=O)O2)cc1Cl 851807130 AAJXTLCGPGIMMG-JTQLQIEISA-N 269.728 2.490 10 20 CECD C[C@H](N[C@H]1CCN(C)[C@@H](C)C1)c1cc([N+](=O)[O-])ccc1O 756610043 HCSJXMUZZSKTED-SRVKXCTJSA-N 293.367 2.434 10 20 CECD COCCCN(CCOC)Cc1cc(C)ccc1O 133088788 QVEHFXLDRQIFNB-UHFFFAOYSA-N 267.369 2.186 10 20 CECD O=C(COC(=O)c1cccc(O)c1O)c1ccc(F)cc1 776283411 MBLROEVPMCGILK-UHFFFAOYSA-N 290.246 2.277 10 20 CECD C[C@@H](NCCc1ccn(C)n1)c1c(O)cccc1F 886589863 HZLZSVLGPSELDJ-SNVBAGLBSA-N 263.316 2.158 10 20 CECD Cc1nc([C@@H]2CCN(Cc3cc(C)c(C)cc3O)C2)n[nH]1 895007931 PTDRKZAJVFSMSS-CYBMUJFWSA-N 286.379 2.425 10 20 CECD COc1cc(C)cc(CN2CCN(C)[C@@H](C)[C@H]2C)c1O 894487113 GJFZIOOOYHZVDU-QWHCGFSZSA-N 278.396 2.234 10 20 CECD Cc1nc([C@H]2CCN(Cc3ccc(N(C)C)cc3C)C2)n[nH]1 895012959 QEIOIPLNPOHANV-HNNXBMFYSA-N 299.422 2.477 10 20 CECD COCCC1CCN(C(=O)Cc2ccc(N)cc2)CC1 704165274 HCLINMRVXSBVBB-UHFFFAOYSA-N 276.380 2.086 10 20 CECD CCN(CC)C[C@H](C)NCc1cc(F)cc(F)c1O 708517716 SFZPJLAGNGWXJZ-JTQLQIEISA-N 272.339 2.490 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCNC1 699664737 JUGKGWGWIPXFFV-UKRRQHHQSA-N 261.413 2.230 10 20 CECD CCCc1n[nH]cc1C(=O)NCc1ccc(OC)cc1O 1322448191 ZTZLKFPNJBTJIE-UHFFFAOYSA-N 289.335 2.006 10 20 CECD C[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)[C@@H]1CO 1321701263 JRPOTLAVJJSAKH-RHSMWYFYSA-N 274.408 2.490 10 20 CECD C[C@@H](NC[C@H](CO)CC1CCOCC1)c1ccccc1O 1256035331 MHVBRBPHUNTOQQ-UKRRQHHQSA-N 293.407 2.468 10 20 CECD CCC[C@H]1CN(Cc2ccc(N)cc2)CCN1CCOC 1335284569 DOTJHEMXMKGKHK-KRWDZBQOSA-N 291.439 2.202 10 20 CECD CCOc1ccc(O)c(CN2CC3(CCOC3)C2)c1 1347709181 KBLHJSKVUBZHDP-UHFFFAOYSA-N 263.337 2.013 10 20 CECD COC(=O)c1cnc(SCc2snnc2C)s1 1346829357 RUDNLUBTWGTUGW-UHFFFAOYSA-N 287.391 2.382 10 20 CECD O=C([C@@H]1C[C@@H]1F)N(Cc1ccccc1O)C[C@@H]1CCCO1 1349356118 SONZDSBBLQQPGL-MJBXVCDLSA-N 293.338 2.258 10 20 CECD O=C(O)c1cc(CNCc2cccc(Cl)c2O)on1 1608843698 VUIAQDRJHHRJGI-UHFFFAOYSA-N 282.683 2.022 10 20 CECD O=C(Nc1ccc(O)c(C(=O)O)c1)c1cc(O)cs1 1594805451 NQYFIKUFYKPOPQ-UHFFFAOYSA-N 279.273 2.110 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](C)C[C@H]2C(=O)O)c1O 1599392312 LAYGMWCNJKXQKH-MFKMUULPSA-N 293.363 2.394 10 20 CECD COc1ccc(N(C)C/C(C)=C/C(=O)O)cc1OC 1599584500 VERUKLOYYJZWCX-JXMROGBWSA-N 265.309 2.171 10 20 CECD CC[C@@H](C)N(C)CCN[C@@H](C)c1cc(C(=O)O)ccc1O 1594967944 COXLGPXFJJQQBS-NEPJUHHUSA-N 294.395 2.471 10 20 CECD COc1ccc(O)c(CNCc2ccccc2O)c1 134650436 YCZIAMCSIODEBX-UHFFFAOYSA-N 259.305 2.396 10 20 CECD CCN(CC)c1ccc(CN[C@H]2C[C@H](CO)C2)cc1 923006542 BPKFITCPZXRPTG-SHTZXODSSA-N 262.397 2.393 10 20 CECD CCC1(C)CN(C(=O)NCCc2ccc(N)cc2)C1 841956335 CNJSUHDHBYLYIZ-UHFFFAOYSA-N 261.369 2.253 10 20 CECD Oc1ccccc1CNC[C@@H]1Cc2ccccc2O1 38009307 HQOZIQSMQRMCML-AWEZNQCLSA-N 255.317 2.486 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)cc1O)c1ncn(C)n1 275802430 YNGJADDUCWSGBN-BDAKNGLRSA-N 264.304 2.072 10 20 CECD Oc1cc2c(cc1CN1CC(F)(F)C(F)(F)C1)OCO2 313327212 VXNAQMGZCCPGNC-UHFFFAOYSA-N 293.216 2.207 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1cc(F)cc(F)c1O 708393394 DASQAXYIHIJJFC-SECBINFHSA-N 286.322 2.065 10 20 CECD CO[C@H](CNC(=O)Nc1ccc(N)cc1)C(C)C 381305475 RWCJZEMHMCFIKS-GFCCVEGCSA-N 251.330 2.061 10 20 CECD CC(C)COC(=O)CN(C)Cc1ccccc1O 181485015 WXCHIRLRIBITCP-UHFFFAOYSA-N 251.326 2.023 10 20 CECD CCN(C)C(=O)CNCc1ccc(N(CC)CC)c(F)c1 185184463 BZXDJQVQFBBCMQ-UHFFFAOYSA-N 295.402 2.240 10 20 CECD COc1csc(C(=O)NCc2ccc(O)c(O)c2)c1 182548090 NGSHOTNMJOSHTL-UHFFFAOYSA-N 279.317 2.098 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc(O)c1 210388330 TUCRGTOIEKYIRD-ALCCZGGFSA-N 271.272 2.455 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc(N(C)C)ccn2)cc1 195245995 KAPWJWXAXXCMCL-UHFFFAOYSA-N 298.390 2.144 10 20 CECD C/C=C(\C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 81557023 QQAUVTMOKXLCCE-YIXHJXPBSA-N 274.364 2.310 10 20 CECD CC(C)(NC(=O)Cc1ccc(N)cc1)c1nccs1 82284215 OHVHYTSLKHOOEW-UHFFFAOYSA-N 275.377 2.319 10 20 CECD COc1cccc(CN(C)CCOCC2CC2)c1O 93818614 AYMLCXZBMOMGJP-UHFFFAOYSA-N 265.353 2.259 10 20 CECD CC[C@@](C)(CCO)NCc1ccc(N(C)C)cc1 230222225 RUNZNESEMBBJPM-HNNXBMFYSA-N 250.386 2.393 10 20 CECD COc1ccc(N(C)C(=O)/C=C\c2cncc(F)c2)cn1 255289367 BLDXGVREYKTEBY-UTCJRWHESA-N 287.294 2.301 10 20 CECD CN1CCCc2cc(CNc3nccn4cnnc34)ccc21 266417690 DWGHOYPPHNJQIA-UHFFFAOYSA-N 294.362 2.119 10 20 CECD C[C@@]1(CNC(=O)c2cccc(O)c2O)CCO[C@@H]1C1CC1 370497087 AGYDRXSWERKPNB-ZBFHGGJFSA-N 291.347 2.033 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@H]2CCCO2)cc1F 299335997 ONNKZZHMBWGALI-CYBMUJFWSA-N 294.370 2.467 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)NC1CC1 295336819 ZWAPJEGEPDTEQF-LBPRGKRZSA-N 276.380 2.271 10 20 CECD C[C@H](N[C@H]1CCC[C@H](N)C1)c1cc([N+](=O)[O-])ccc1O 817969899 HWOLFWQFFVUMIG-DCAQKATOSA-N 279.340 2.221 10 20 CECD NC(=O)N1CCCN(Cc2ccc3ccccc3c2O)CC1 816499328 LWZKPJWEVDPWBM-UHFFFAOYSA-N 299.374 2.132 10 20 CECD Cn1nc(C(=O)Nc2ccc(N)cc2)cc1C1CC1 818556159 ZRNZXUPDZIYFGF-UHFFFAOYSA-N 256.309 2.132 10 20 CECD OC/C=C\CNCc1cc(Cl)cc(Cl)c1O 717477673 GECBVYLMRODEDJ-UPHRSURJSA-N 262.136 2.337 10 20 CECD Cc1ccc(O)c(CN[C@@H](CC(N)=O)c2ccccc2)c1 815155006 JVIRAHHNXGZUKY-HNNXBMFYSA-N 284.359 2.407 10 20 CECD CC(C)(CC(=O)O)NCc1cccc(Cl)c1O 833455879 CGIPWZOCFPFNRF-UHFFFAOYSA-N 257.717 2.389 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)N2CCC[C@H](O)C2)s1 1537962898 IFFYMYUGEKFJTL-QMMMGPOBSA-N 266.326 2.155 10 20 CECD O=C(C[C@H]1CCOC1)NCc1cc(Cl)ccc1O 846472649 DBIUXVGGNFTARV-SECBINFHSA-N 269.728 2.088 10 20 CECD Nc1ccc(NC(=O)[C@@H]2CCO[C@H]2c2ccncc2)cc1 846662195 NAMWSEGTQVGGCO-CABCVRRESA-N 283.331 2.380 10 20 CECD C[C@@H]1C[C@H](CNC(=O)/C=C\c2ccc(O)c(O)c2)[C@@H](C)O1 840514057 CVRMMAIQCXPMNX-OORKTBMBSA-N 291.347 2.041 10 20 CECD C[C@H](CCCN)NCc1ccc(N(C)C)c(F)c1 841080844 QYHIREBZFCRYQI-LLVKDONJSA-N 253.365 2.109 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H](F)C1 846630144 IVMHLWAZZCLKEU-VLWUPBBWSA-N 265.284 2.072 10 20 CECD C[C@@H](NC[C@H]1CCCN(C)C1)c1cc([N+](=O)[O-])ccc1O 756555118 RGWZWFNTZXZMAK-VXGBXAGGSA-N 293.367 2.293 10 20 CECD CS[C@@H](C)CNC(=O)NCc1cc(C)ccc1O 858313106 JGIFCBNUWXOGCX-JTQLQIEISA-N 268.382 2.251 10 20 CECD C/C(=C\C(=O)N1CCNc2ncc(C)cc21)c1cnccn1 858001351 VVCCLFJRXUEVAL-XYOKQWHBSA-N 295.346 2.042 10 20 CECD CN(C)c1ccc(OCC(=O)NCC2CCC2)cc1 757718847 YQHNUJAFWAJWHR-UHFFFAOYSA-N 262.353 2.048 10 20 CECD C[C@@H](CO[C@@H]1CCOC1)NCc1ccc2c(c1)CCCO2 921825245 KZXZDZJTLKKYEL-XJKSGUPXSA-N 291.391 2.295 10 20 CECD COc1cccc(CNC(=O)/C=C\c2cnccc2C)c1O 752596411 MDZAFBUFDCUQEL-SREVYHEPSA-N 298.342 2.434 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1CCSC1 762207821 RUHWVIKQTGYFTC-VIFPVBQESA-N 288.463 2.495 10 20 CECD Oc1cc2c(cc1CN1CCc3c(O)cccc3C1)OCO2 862530037 SRBCQRWRNBPKIO-UHFFFAOYSA-N 299.326 2.385 10 20 CECD COc1cc(CN2CCN(C3CCC3)CC2)c(O)cc1C 768448648 UVSNBICYTKPNLB-UHFFFAOYSA-N 290.407 2.379 10 20 CECD CCOc1ccc(CN2CCO[C@H](C)[C@H]2C)c(O)c1 769423470 RXKLZSJAXJBCQB-VXGBXAGGSA-N 265.353 2.400 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@@H](O)C(F)(F)F 865712468 YHSMYVMMLVPYEX-PRHODGIISA-N 294.292 2.293 10 20 CECD C/C=C/C[C@H](CO)NCc1ccc(N(C)C)c(F)c1 769935726 PZVCAEINNFBMQK-MUBLQREKSA-N 266.360 2.308 10 20 CECD CC1(C)C[C@H]1CNC(=O)/C=C\c1ccc(O)c(O)c1 779517306 PHQHKUZPRPTXPB-QZPNVGJNSA-N 261.321 2.273 10 20 CECD CCN[C@H](C)C(=O)NCc1ccc(N(CC)CC)c(F)c1 876756217 QWLMDMFMIXFEKI-GFCCVEGCSA-N 295.402 2.286 10 20 CECD COc1cccc(O)c1CN(C)C[C@@H]1CCCC[C@@H]1O 779152976 IQENZDYLVIXXGS-JSGCOSHPSA-N 279.380 2.384 10 20 CECD C[C@H](NC[C@@H]1CC[C@H](O)C1)c1c(O)cccc1F 886598772 JVMSQXNHGICYFD-AXFHLTTASA-N 253.317 2.343 10 20 CECD CCC(CC)C(=O)OCC(=O)c1ccc(O)c(O)c1 782986801 OZUIYIZRXNQUBN-UHFFFAOYSA-N 266.293 2.260 10 20 CECD CO[C@@H]1[C@@H](C)[C@@H](NC(=O)c2ccc(C)c(O)c2O)C1(C)C 781018188 TWZHDOSDPJFVRF-CUOATXAZSA-N 293.363 2.196 10 20 CECD Nc1ccc(CCNC(=O)N2CCC[C@@H](CF)C2)cc1 892039604 VXHADQGFIZXXDO-ZDUSSCGKSA-N 279.359 2.202 10 20 CECD CC[C@H](C)[C@H](O)CN[C@@H](C)c1cc(OC)ccc1O 185438691 ZKOGZCWKLILRRZ-ZIBATOQPSA-N 267.369 2.458 10 20 CECD CCOc1cc(O)ccc1NC(=O)c1cccc(O)c1O 791144176 VZKNZHQZDTVFRF-UHFFFAOYSA-N 289.287 2.454 10 20 CECD Cc1cccc(CN2CCO[C@@H](c3ccnn3C)C2)c1O 897558428 HYYVTOKJFDAUQY-OAHLLOKOSA-N 287.363 2.008 10 20 CECD COCC[C@@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898449382 DDDNPSSWSDFRHW-RHSMWYFYSA-N 293.455 2.370 10 20 CECD CC[C@@H](C)CC[C@H](O)CC(=O)NCc1ccc(O)c(O)c1 793689059 IWZZZSHSIWIUEL-YPMHNXCESA-N 295.379 2.291 10 20 CECD CC(C)O[C@@H]1C[C@@H](NC(=O)c2cccc(O)c2O)C1(C)C 790934200 HULBFKDSXQGKJV-CHWSQXEVSA-N 293.363 2.420 10 20 CECD CC[C@H](NCc1nnnn1C1CC1)c1ccc(F)cc1O 796817712 KFUXDPMOCKYQMM-LBPRGKRZSA-N 291.330 2.094 10 20 CECD COc1ccc(CNCC2CCN(C(C)=O)CC2)cc1C 997456702 VWULSRNJPZIASZ-UHFFFAOYSA-N 290.407 2.352 10 20 CECD CO[C@@H]1COC[C@H]1N[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 1328400770 WQDUAMBGXXZWMJ-GFQSEFKGSA-N 277.364 2.252 10 20 CECD CN[C@@H](C)CCN[C@@H](C)c1cc(F)cc(F)c1O 1325742090 BFWWOKSRZWLQHT-IUCAKERBSA-N 258.312 2.319 10 20 CECD Cc1cccc(CNCCc2ncc(C(=O)O)s2)c1O 1600532633 XAUGITOBXCVADT-UHFFFAOYSA-N 292.360 2.188 10 20 CECD CCCC[C@H](OC(=O)c1cc(O)cs1)C(=O)O 1605252702 ZQUPKCDNJFVFHU-QMMMGPOBSA-N 258.295 2.254 10 20 CECD CO[C@@]1(C(=O)O)CCN(Cc2cc(Cl)cc(C)c2O)C1 1606707062 VGPLKNVVYTXAFE-AWEZNQCLSA-N 299.754 2.030 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H](C)CN 1579674043 LSSQIFTVKUUGIT-VIFPVBQESA-N 277.393 2.233 10 20 CECD C[C@@H](NCC1CCN(C)CC1)c1cc(C(=O)O)ccc1O 1593256793 JLDKNUSHJPAIMK-LLVKDONJSA-N 292.379 2.083 10 20 CECD COC(=O)c1cnc(SC/C(C)=C/C(=O)O)s1 1599009789 WTNZTQHKUUSGMJ-ZZXKWVIFSA-N 273.335 2.053 10 20 CECD Cc1cccc(CCNC(=O)c2cccc(O)c2O)c1 126379973 LYSVUWDVSAZNDQ-UHFFFAOYSA-N 271.316 2.379 10 20 CECD O=C1COc2ccc(NCc3ccccc3O)cc2N1 20125546 JSNSEHYDSQAPQR-UHFFFAOYSA-N 270.288 2.335 10 20 CECD C[C@@H](Cn1ccnc1)NCc1ccc(N(C)C)cc1 35274900 QABQXTKAYNBXEU-ZDUSSCGKSA-N 258.369 2.127 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CCCCNC2=O)c1 36977559 HJHIIHJGSTVFPU-DGCLKSJQSA-N 262.353 2.020 10 20 CECD CC(C)S(=O)(=O)CCN[C@H](C)c1ccc(N(C)C)cc1 275016085 SPQCXPSKEWDFKK-CYBMUJFWSA-N 298.452 2.226 10 20 CECD CCN(CC)C[C@@H](C)NCc1ccc2c(c1)CCO2 45693390 HXXHBKYQXVTORK-CYBMUJFWSA-N 262.397 2.441 10 20 CECD C[C@@H](NCC1([S@](C)=O)CC1)c1ccc(N(C)C)cc1 282390086 RDBCQVOEJZYBHV-BLVKFPJESA-N 280.437 2.314 10 20 CECD C[C@@H](N[C@H](C)c1nncn1C)c1ccc(F)cc1O 62746965 XDYBETDOFFFZPI-RKDXNWHRSA-N 264.304 2.072 10 20 CECD C[C@@H]1CCCC[C@H]1NC(=O)CN(C)c1ccc(N)cc1 702070219 XMIMHYMHEDGCNZ-IUODEOHRSA-N 275.396 2.400 10 20 CECD Cc1ccc(C(=O)NCCCOCC(C)C)c(O)c1O 177667276 PAKOOSZBFKRGPY-UHFFFAOYSA-N 281.352 2.199 10 20 CECD Cc1[nH]ncc1C(=O)NCCCSc1nccs1 172197561 QUECEQHBSGIGPL-UHFFFAOYSA-N 282.394 2.087 10 20 CECD C[C@H](O)CC(C)(C)CNC(=O)/C=C/c1ccc(O)c(O)c1 180832830 MSKVFCGJDMJOEV-ZRQQLDRUSA-N 293.363 2.024 10 20 CECD CN1CCCc2cc(CNC(=O)Nc3ccnn3C)ccc21 125415586 AMBDFCLAWSRDFR-UHFFFAOYSA-N 299.378 2.124 10 20 CECD CC[C@H](C)[C@@H](C)NCC(=O)NCc1ccc(N(C)C)cc1 183060929 UMUYRTXGBZPSBD-UONOGXRCSA-N 291.439 2.393 10 20 CECD CCNC(=O)CN(c1ccc(OC)cc1)[C@H](C)C1CC1 121200306 WJUWWNNCXPGBFR-GFCCVEGCSA-N 276.380 2.436 10 20 CECD COCCC1(C(=O)N[C@@H](C)c2cc(OC)ccc2O)CC1 127039190 HWGWOSSRAJZYIC-NSHDSACASA-N 293.363 2.395 10 20 CECD CN(Cc1c(Cl)cnn1C)c1ccc2c(c1)OCO2 188340348 QYYWYKNVCVIDHN-UHFFFAOYSA-N 279.727 2.439 10 20 CECD CCCC[C@@H](COC)NC(=O)c1ccc(C)c(O)c1O 182473972 ZMRWDGKGOYFQFH-NSHDSACASA-N 281.352 2.341 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H]([C@@H](C)O)C2)c1O 184744348 CKMBZUWKEFSKKA-NXEZZACHSA-N 285.771 2.257 10 20 CECD Cc1ncc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)s1 186377872 DJZHHBBDNGOBCM-QMMMGPOBSA-N 292.360 2.224 10 20 CECD C[C@H]1CSCCN1C(=O)/C=C/c1ccc(O)c(O)c1 181110638 JSJZBWNYUXHHJC-GFAPAMAISA-N 279.361 2.075 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@](C)(O)Cc1ccccc1 269168986 WWALHHDIGDKUSB-SFHVURJKSA-N 299.370 2.344 10 20 CECD Cc1ccc(O)c(CN2CC[S@](=O)[C@H](C)[C@H]2C)c1 271196699 NZRGDDQDGFHBBP-FMTVUPSXSA-N 267.394 2.042 10 20 CECD COC[C@H](O)CN[C@H](C)c1cc(Cl)c(Cl)cc1O 278680492 JVERQGHXSRKFKE-HTQZYQBOSA-N 294.178 2.357 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H](O)CCc1ccccc1 271058380 VGNGKYIUOGRTEY-KRWDZBQOSA-N 299.370 2.344 10 20 CECD CC(C)N1C[C@@H](N[C@@H](C)c2ccc(F)c(F)c2O)CC1=O 276898529 ISWRPQBSDVKHPX-UWVGGRQHSA-N 298.333 2.330 10 20 CECD CCCOc1ccc(CN(CC)CCCO)c(O)c1 271213307 VSNJKHQHZPHTJF-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CC[C@H](NCC[C@@H](O)COC)c1ccc(C)cc1O 280151583 QGAKUUUVVMTLBK-OCCSQVGLSA-N 267.369 2.139 10 20 CECD CC[C@H](CNCc1ccc(N(C)C)c(F)c1)OC 289795107 LTLXLMMCJAXAAM-GFCCVEGCSA-N 254.349 2.406 10 20 CECD CC[C@H](N[C@H](C)CN1CCOCC1)c1ccc(C)cc1O 280032659 IHKLIWWUVRIUKA-ZBFHGGJFSA-N 292.423 2.462 10 20 CECD O=C(NC[C@@H](CO)C1CCCCC1)c1cccc(O)c1O 294552007 MHEVZLOSCKRETN-LBPRGKRZSA-N 293.363 2.016 10 20 CECD CO[C@](C)(CNCc1cc([N+](=O)[O-])ccc1O)C1CC1 291073544 SIUKQYGBFYNDJZ-CQSZACIVSA-N 280.324 2.205 10 20 CECD CCc1nnc(NCc2ccc(N(C)C)c(F)c2)o1 296158431 XCRIFPDYZWIPIV-UHFFFAOYSA-N 264.304 2.449 10 20 CECD Oc1cccc2c1[C@H](NCc1nnc3n1CCCCC3)CC2 296081228 SPWWJESOMPBRQT-CYBMUJFWSA-N 298.390 2.487 10 20 CECD CNC(=O)C(C)(C)CNCc1ccc2ccccc2c1O 816557893 FZUDKAHGTNZVHQ-UHFFFAOYSA-N 286.375 2.407 10 20 CECD C[C@@H](NCCC1=CCNCC1)c1cc([N+](=O)[O-])ccc1O 817984972 DDYGTZUASMTIRI-LLVKDONJSA-N 291.351 2.261 10 20 CECD CCOc1ccc(O)c(CN(C)[C@H]2CC(C)(C)OC2=O)c1 814180448 OKQJLLSZTZUWDK-ZDUSSCGKSA-N 293.363 2.317 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCn2cncc2C1 811515442 UQTGRARVAQIZIP-UHFFFAOYSA-N 281.718 2.397 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C\[C@H]1CCOC1 822265521 REDTUXPXSPBVST-AJHXJQRKSA-N 288.391 2.304 10 20 CECD CCC[C@H](OC)C(=O)N[C@@H](C)c1cc(OC)ccc1O 825736526 BKASWKVXGPAWQS-HZMBPMFUSA-N 281.352 2.393 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H]1CCCS1 588404938 UBPAOLFKLINJKX-VLWUPBBWSA-N 279.361 2.123 10 20 CECD CN1CC[C@@H]2CN(Cc3cc(Cl)ccc3O)C[C@@H]21 824893636 XJCVPJHXJUYRJG-MFKMUULPSA-N 266.772 2.182 10 20 CECD O=C(c1cc(O)cs1)N(CCO)CCc1ccccc1 733002079 DXPBOGNMQYGFIO-UHFFFAOYSA-N 291.372 2.131 10 20 CECD CN1CCN(c2ccc(CN3CC(C(F)F)C3)cc2)CC1 839141035 LOXZPRFUEZFKKV-UHFFFAOYSA-N 295.377 2.135 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@@H]1CCc2cccc(O)c21 834880485 FWTIHGWCBOWIKO-UMVBOHGHSA-N 277.364 2.021 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](CN2CCCCC2)C1 743711695 CGXWDOSYAWHEKA-LBPRGKRZSA-N 294.420 2.402 10 20 CECD Cc1nc(CNC(=O)NCc2ccccc2O)cs1 748462757 IOYWOCPFJRCPFU-UHFFFAOYSA-N 277.349 2.157 10 20 CECD Cn1nccc1[C@H]1CCCCN1C(=O)Cc1ccc(N)cc1 846690278 GOPMJPBEIDGAOC-MRXNPFEDSA-N 298.390 2.299 10 20 CECD C[C@@H]1C[C@@H]1C(=O)NCc1ccc2c(c1)CCCN2C 746809272 QWBOIWZFGUBSIS-RISCZKNCSA-N 258.365 2.341 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](C)N[C@H](C)C1 843049001 CTZRWDODUUJBFC-OKILXGFUSA-N 261.413 2.243 10 20 CECD C[C@@H]1C[C@H](NCc2cc(Cl)c(F)cc2O)CO1 843432932 RMLDUNKOSBUZKV-APPZFPTMSA-N 259.708 2.452 10 20 CECD CN(C)[C@@H](C(=O)NCc1ccccc1O)c1ccccc1 748346937 QBLSBEILQQWNTB-MRXNPFEDSA-N 284.359 2.311 10 20 CECD C[C@@H](NCCCc1cnn(C)n1)c1ccc(Cl)cc1O 841752427 ASBVXZOLOICPCL-SNVBAGLBSA-N 294.786 2.458 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCCCNC 841914907 KYKZAWOIPJVBQT-UHFFFAOYSA-N 293.411 2.313 10 20 CECD Cc1cc(C(=O)N[C@H]2CO[C@H](C)C2)c(C)n1-c1ccccn1 844108329 VCDNPVAYJMPQLL-TZMCWYRMSA-N 299.374 2.396 10 20 CECD COc1cccc([C@@H](C)N[C@@H](CO)CC(C)C)c1O 846144692 MYEKIHWVRUWVQJ-VXGBXAGGSA-N 267.369 2.458 10 20 CECD CCOc1ccc(CNCC2CC3(C2)OCCO3)c(O)c1 922799547 RERKAPAGPBKVTK-UHFFFAOYSA-N 293.363 2.034 10 20 CECD C[C@H](NCc1cc[nH]n1)c1cc(F)cc(F)c1O 756552613 GPDITJOTOVVDQG-ZETCQYMHSA-N 253.252 2.244 10 20 CECD CC(C)OCCCCNC(=O)c1cc(O)cs1 753477004 RVPBCACNZNUZOI-UHFFFAOYSA-N 257.355 2.389 10 20 CECD C[C@H](O)C(=O)OCCCSc1ncc(Cl)s1 850000412 UBKGMTZXYNAGMU-LURJTMIESA-N 281.786 2.203 10 20 CECD CN(C)c1cc(F)c(CNCCCn2cccn2)cc1F 858092556 FRCITMJAANCTGG-UHFFFAOYSA-N 294.349 2.407 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C[C@H]1CNC(=O)C1 851732318 NWMAGQXUMYGSJD-OAHLLOKOSA-N 289.423 2.099 10 20 CECD CC[C@@](C)(CO)NCc1cc(F)c(N(C)C)cc1F 858122904 UCAQIGIUJPJBRS-AWEZNQCLSA-N 272.339 2.281 10 20 CECD CCN(CC)c1ccc(CNC(=O)CNC(C)C)cc1 851631253 ZGTQSXAHKIBRLI-UHFFFAOYSA-N 277.412 2.147 10 20 CECD O=C(CCCCO)NCc1ccc(N2CCCC2)cc1 864861751 FJSOENGCOKKJGP-UHFFFAOYSA-N 276.380 2.066 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CC3(CC3)C(=O)O2)c1 763728033 CSJPBDWZCJZSBX-ZYHUDNBSSA-N 291.347 2.147 10 20 CECD Cc1ccc(CN[C@H](c2nncn2C)C(C)C)c(O)c1 877513743 BYOYMJYROKTBQR-AWEZNQCLSA-N 274.368 2.316 10 20 CECD COc1ccc(/C=C\C(=O)NCc2ccccc2O)cc1O 773398691 SMVBHKUSUSOAPG-CLFYSBASSA-N 299.326 2.436 10 20 CECD Cc1cccc(O)c1CNCCC(=O)Nc1ccccn1 876979371 CZYVQZBYYDIZPB-UHFFFAOYSA-N 285.347 2.214 10 20 CECD Cc1ccc(CN[C@H]2CCN(C(C)(C)C)C2=O)c(O)c1 877602970 AVISDQNGHUIJLS-ZDUSSCGKSA-N 276.380 2.190 10 20 CECD COC(=O)c1cc(CN(C)c2ccc(OC)c(F)c2)on1 877181005 FBBYCBLOPNOJNC-UHFFFAOYSA-N 294.282 2.245 10 20 CECD COc1ccc(CNCCNC(=O)c2ccoc2)cc1C 1123519040 KCIOBAJZYPQGNC-UHFFFAOYSA-N 288.347 2.116 10 20 CECD Cc1ccc(C(=O)NCC[C@@H]2CCCC[C@@H]2O)c(O)c1O 887551084 WIWVFSDSRVMGQA-AAEUAGOBSA-N 293.363 2.077 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2c(O)cccc2F)n1 886628692 ZMSPJHDWVURZFN-SNVBAGLBSA-N 278.331 2.302 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCC[C@@H]2N)c1 1122026730 DLKNCTRPRPKJMR-QKCSRTOESA-N 292.379 2.096 10 20 CECD CCN(CCNCc1cc(C)cc(OC)c1O)C1CC1 894214433 XXFYOTLVLYAACP-UHFFFAOYSA-N 278.396 2.283 10 20 CECD CC(C)n1ccc(NC(=O)c2cc(O)cs2)n1 796441806 KLENHSWSVBGXLU-UHFFFAOYSA-N 251.311 2.483 10 20 CECD Cc1coc(C(=O)NCCc2ccc(O)c(O)c2)c1C 1322451989 MRGGEFBFLIFIKD-UHFFFAOYSA-N 275.304 2.280 10 20 CECD C[C@@H]1CC[C@@H](C(=O)O)N(Cc2ccc(N(C)C)cc2)C1 1776619907 XKDGQERLZDICRZ-DOMZBBRYSA-N 276.380 2.438 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H]2OCCC[C@H]2C1 1347321904 DSOZSDSKHQPGTI-GXSJLCMTSA-N 267.350 2.095 10 20 CECD CC[C@H](F)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1514664256 SMEXSNSUJWOEHP-GJZGRUSLSA-N 295.402 2.220 10 20 CECD O=C(O)c1cnc(SC[C@@H](O)CC(F)(F)F)s1 1602537380 QRULMKMEYATRER-BYPYZUCNSA-N 287.284 2.247 10 20 CECD c1cc(N2CCOCC2)ccc1CN[C@H]1CCSC1 230704055 DQSDAXRIMGOEPG-AWEZNQCLSA-N 278.421 2.118 10 20 CECD COc1cc(CN2CCC23CNC3)c(O)c(C(C)(C)C)c1 1579149036 KUZUVOQBGKEXKQ-UHFFFAOYSA-N 290.407 2.246 10 20 CECD COc1ccc(N(C)C/C(C)=C\C(=O)O)cc1OC 1599584501 VERUKLOYYJZWCX-YFHOEESVSA-N 265.309 2.171 10 20 CECD Cc1cc(CN(C)CCCC(=O)O)ccc1N(C)C 1594302387 OIFNKNXCDAWCHE-UHFFFAOYSA-N 264.369 2.358 10 20 CECD O=C(Cn1ccc2ccccc21)NCc1ccc(O)c(O)c1 158899366 PLXMQOITLLICEV-UHFFFAOYSA-N 296.326 2.369 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@H](C2)N3)cc1 843104991 OLNCERMNJMIUBP-GASCZTMLSA-N 259.397 2.079 10 20 CECD CN(CCN1CCCCC1)C(=O)Nc1ccc(N)cc1 846310287 KZWJMQZUDPBUMN-UHFFFAOYSA-N 276.384 2.218 10 20 CECD CC(C)CN(CC(=O)O)Cc1cc(F)cc(F)c1O 708217154 YGDZGHGYZNBPHE-UHFFFAOYSA-N 273.279 2.213 10 20 CECD CC[C@H](C)C[C@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 400859793 MOQNKEVDWYEOMW-BBRMVZONSA-N 291.439 2.475 10 20 CECD CCN(CC)CC(=O)N(C)Cc1ccc(N(C)C)cc1 66861715 QMJCJBCSIFILIG-UHFFFAOYSA-N 277.412 2.053 10 20 CECD Cc1cc(C(=O)N2CC(O)C2)c(C)n1-c1ccc(F)cc1 304994626 ADISIRJBJXHUDC-UHFFFAOYSA-N 288.322 2.050 10 20 CECD Cc1cncc(NCc2ccc(N3CCOCC3)cc2)n1 302108202 OKASBGOPWNDYNG-UHFFFAOYSA-N 284.363 2.234 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCc3[nH]ncc3C2)c1 186115088 ZVOMIEFVOHYSTR-CMPLNLGQSA-N 287.363 2.332 10 20 CECD CN(Cc1ccncc1)Cc1cc2c(cc1O)OCO2 183747913 RURLUOZPBMXVBT-UHFFFAOYSA-N 272.304 2.148 10 20 CECD CCOCc1cc(CN[C@H]2C[C@H](O)C2(C)C)ccc1OC 189328143 NCCGSAJJAKZNGH-HOTGVXAUSA-N 293.407 2.481 10 20 CECD CCN(CC)C(=O)CNCc1c(O)cccc1Cl 134653000 CBVBMVBZEGAADZ-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CCOC(=O)[C@H](CC)N1CCOc2cc(N(C)C)ccc21 130413117 USZHBGIOPKSPQJ-ZDUSSCGKSA-N 292.379 2.293 10 20 CECD Cc1nn(C)c(C)c1OCc1cc(C(=O)O)oc1C 88453073 CBJNOEXFXRSMDU-UHFFFAOYSA-N 264.281 2.216 10 20 CECD Oc1ccccc1CNCc1n[nH]cc1Br 381533715 DJDYMNWNMFNHKM-UHFFFAOYSA-N 282.141 2.168 10 20 CECD CN1CC[C@@H]2[C@H](CCCN2Cc2ccccc2O)C1 290565329 SQNQZWXDSZRNDV-UKRRQHHQSA-N 260.381 2.308 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](Cn3ccnn3)C2)cc1 92069548 HNMPVMDCAKGFMG-INIZCTEOSA-N 299.422 2.256 10 20 CECD C[C@@H]([C@@H](C)N(C)Cc1ccc(N(C)C)cc1)S(C)(=O)=O 93420060 XLMIPUZVBNQINP-OLZOCXBDSA-N 298.452 2.006 10 20 CECD COc1cc(C(=O)NCc2c(C)c3ccccc3n2C)on1 348632539 ACXHETYIJVPQQX-UHFFFAOYSA-N 299.330 2.413 10 20 CECD CCN(C[C@H](O)CSC)c1ccc(OC)cc1 275488150 YELTVHCUSXSALX-LBPRGKRZSA-N 255.383 2.245 10 20 CECD CCC1(CNC(=O)c2ccc(C)c(O)c2O)CCOCC1 272765155 RCGJCXGNWNTOKA-UHFFFAOYSA-N 293.363 2.343 10 20 CECD CCc1cncc(C(=O)NCc2cccc(OC)c2O)c1 279503628 PYSJROCKGKQYRX-UHFFFAOYSA-N 286.331 2.288 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c1 280574180 WCOFVRXRIBNDPG-VBQJREDUSA-N 291.391 2.469 10 20 CECD Oc1cccc2c1[C@@H](NCCCO[C@H]1CCOC1)CC2 297540138 DYWBIMHDKVUDBG-KBPBESRZSA-N 277.364 2.165 10 20 CECD CN(CCN[C@@H]1CCc2cccc(O)c21)CC(F)(F)F 297911652 WRBBAELSPQDMRJ-LLVKDONJSA-N 288.313 2.463 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2ccccc2)s1 808021833 VVUYAZCKMTUDOU-UHFFFAOYSA-N 278.358 2.455 10 20 CECD Cc1ccccc1[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1 294833595 SOSYDXXMGQKGSV-QGZVFWFLSA-N 297.402 2.377 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)C(C)(F)F)C2)cc1 818090807 IXGOWMFVZTVYCV-LLVKDONJSA-N 298.333 2.293 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@@H]2CNCCCO2)c1O 817981413 JANJIQKRVWPGCO-YPMHNXCESA-N 298.814 2.383 10 20 CECD COC[C@H](C)[C@@H](C)C(=O)N[C@@H](C)c1cc(OC)ccc1O 812498267 KCRLUWXNNPIKAE-TUAOUCFPSA-N 295.379 2.497 10 20 CECD COc1ccc(CNC(=O)c2c(C)nsc2C)c(O)c1 816549980 FAPQHVQVMZHDPO-UHFFFAOYSA-N 292.360 2.404 10 20 CECD OCC1(CCNCc2cc(Cl)cc(F)c2O)CC1 825040357 IASNPBRMMCOQFL-UHFFFAOYSA-N 273.735 2.437 10 20 CECD C[C@@H](NCc1cc(Cl)c(F)cc1O)C1(CO)CC1 826991265 XTPVRRDNZFZNKF-MRVPVSSYSA-N 273.735 2.435 10 20 CECD CC[C@@H](O)[C@@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 900026108 IWIYKLMESPPAPK-IUODEOHRSA-N 278.396 2.118 10 20 CECD CCc1ncncc1C(=O)NCc1ccc(N(C)C)cc1C 734402050 DRZDSKOQZPKCPL-UHFFFAOYSA-N 298.390 2.343 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H](OC)C2CC2)cc1 844402272 RGRPVPSDIQQPNV-QGZVFWFLSA-N 292.423 2.488 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCCC(=O)O 840991593 JWOJZNLUPFJOMY-UHFFFAOYSA-N 294.351 2.179 10 20 CECD CC[C@H](NCc1cc([N+](=O)[O-])ccc1O)[C@H](O)C(C)C 840966166 CXGMHLPUHUDFOV-GXTWGEPZSA-N 282.340 2.186 10 20 CECD COC/C(C)=C\C(=O)NCc1cc(Cl)ccc1O 846476197 KADCOPKMKDDOSX-UITAMQMPSA-N 269.728 2.255 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CCS[C@H]2C)c1O 843434869 NWBNYLYYDWKEFW-WPRPVWTQSA-N 298.364 2.293 10 20 CECD COc1cccc([C@H](C)NCCC2(O)CCC2)c1O 846172662 OBPABRCDBOYZAD-NSHDSACASA-N 265.353 2.357 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(C(=O)O)cc1 746334926 DJNSQTZGOVFCLU-UHFFFAOYSA-N 285.299 2.363 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCCC[C@@H]2CN)c1 841031471 SITIYDIIPDASJD-IUODEOHRSA-N 278.396 2.398 10 20 CECD COc1cccc([C@H](C)N[C@@H](CO)CC(F)F)c1O 846164127 FPEPPQLHZAGETC-DTWKUNHWSA-N 275.295 2.068 10 20 CECD CN(Cc1c(O)ccc2ccccc12)C[C@H]1COCCO1 853558893 LAKOIBJDOYHTII-AWEZNQCLSA-N 287.359 2.393 10 20 CECD COC(=O)C1=NO[C@H](CSc2ncc(Cl)s2)C1 850000582 ZSIDYRCUWBTZND-YFKPBYRVSA-N 292.769 2.207 10 20 CECD Cc1ccsc1CNC(=O)CN(C)c1ccc(N)cc1 863556701 CRVFKRVWXNTZDC-UHFFFAOYSA-N 289.404 2.391 10 20 CECD CCOc1ccc(O)c(CN(C)CC2(C)COC2)c1 862477226 ILHAYAKPGNANQW-UHFFFAOYSA-N 265.353 2.259 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@]3(CCOC3)C2)c(O)c1 877492000 DSZUPFDFAZHKHB-XJKSGUPXSA-N 277.364 2.080 10 20 CECD CC[C@@H](C)NC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 775830165 DXOPCCZSOYDGRT-OLZOCXBDSA-N 277.412 2.318 10 20 CECD C[C@H]1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CCO1 773615783 YGYOGHZFJNRULQ-QWHCGFSZSA-N 291.395 2.244 10 20 CECD CC[C@@H]1[C@@H](C)CCN1Cc1cc2c(cc1O)OC[C@@H]2O 774618424 JTMYCPUDRLTBPU-ZBINZKHDSA-N 277.364 2.438 10 20 CECD CCc1noc(CCCC(=O)N(C)c2ccc(N)cc2)n1 877078353 NEPLXBOACMQRKD-UHFFFAOYSA-N 288.351 2.200 10 20 CECD COC(=O)C1(CNCc2cc(F)cc(F)c2O)CCCC1 883039526 RBIJHHCVMXXBIV-UHFFFAOYSA-N 299.317 2.493 10 20 CECD CC(C)(CN)CC(=O)NCc1ccc(N2CCCC2)cc1 1121909215 JVWHHNCNRJWDHS-UHFFFAOYSA-N 289.423 2.278 10 20 CECD CN(Cc1cc(F)cc(F)c1O)[C@H]1CC(C)(C)OC1=O 894851911 QTNWBTMOLFCSMW-NSHDSACASA-N 285.290 2.196 10 20 CECD CC1(C)CN(Cc2cc(F)cc(F)c2O)CC[C@H]1O 894533889 KHMMHYJNIWAGKI-GFCCVEGCSA-N 271.307 2.263 10 20 CECD C[C@@H](CCCO)NCc1ccc(Br)cc1O 691453598 IUGMLSWREJQOEJ-VIFPVBQESA-N 288.185 2.405 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CC=CCC2)c(O)c1 793028692 RHJJUOKTDNWWKF-LBPRGKRZSA-N 276.336 2.309 10 20 CECD CCC[C@H](CCO)NCc1cc(OC)ccc1O 716895858 UHQNIEJFWKCJKT-GFCCVEGCSA-N 253.342 2.042 10 20 CECD CC[C@@]1(O)CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 778398687 NGIORSXQVFLUCU-OAHLLOKOSA-N 281.327 2.081 10 20 CECD O=C(O)C[C@H]1CCCN1Cc1ccc(Cl)cc1O 1601953941 RKPGVHWHUZZJJE-LLVKDONJSA-N 269.728 2.485 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1coc(CC)n1 1333970078 UIIPGSQGOWTXNB-UHFFFAOYSA-N 295.335 2.358 10 20 CECD CCc1cnccc1CNC(=O)NCc1ccc(N)cc1 1335544846 BVLLTMCHENNDCO-UHFFFAOYSA-N 284.363 2.226 10 20 CECD N[C@@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1261483299 PJUOHZSTOWLEHW-OAHLLOKOSA-N 259.397 2.210 10 20 CECD CCNC(=O)[C@H](C)N[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 218322925 PTYSOXLZSQRZSA-WOPDTQHZSA-N 276.380 2.363 10 20 CECD O=C(O[C@@H](C(=O)O)c1ccsc1)c1cccc(O)c1O 1602605468 OLCOHWQENXJYQW-LLVKDONJSA-N 294.284 2.142 10 20 CECD C[C@@H](CCN(C)C)N[C@H](C)c1cc(C(=O)O)ccc1O 1604142258 LGMIFERGWPHXRA-WDEREUQCSA-N 280.368 2.081 10 20 CECD COc1ccc(CN[C@H](C)C(=O)NC(C)C)cc1C 228941857 VKDHVIDGTWFWJR-GFCCVEGCSA-N 264.369 2.006 10 20 CECD COc1cccc(CN[C@@H](CC(C)(C)C)C(=O)O)c1O 1599672938 AUQZUQHVLDVZDY-NSHDSACASA-N 281.352 2.380 10 20 CECD CCC(=O)N[C@H]1C[C@@H](NCc2ccc(OC)c(C)c2)C1 1021750617 RCIGWHRERIOGGH-OKILXGFUSA-N 276.380 2.150 10 20 CECD C[C@@H]1CCCCN1C(=O)NCCc1ccc(N)cc1 841962631 QCHHMGOKENMQRZ-GFCCVEGCSA-N 261.369 2.395 10 20 CECD O[C@H](CCNCc1ccc2c(c1)CCCO2)C1CC1 898195443 WUINJFPXNDIROI-OAHLLOKOSA-N 261.365 2.262 10 20 CECD COc1ccc(O)c([C@H](C)NCCN2CCCC2)c1 20126894 GZGYILQXFZUZAC-LBPRGKRZSA-N 264.369 2.147 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccccc1N 37839862 DTLBCTFWHSLPEP-UHFFFAOYSA-N 256.305 2.247 10 20 CECD COc1ccc(CNCc2cc(C)ns2)c(O)c1 404278583 MPHYQZTWEOFBKU-UHFFFAOYSA-N 264.350 2.456 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC[C@@H]2COC[C@@H]21 708413720 NFVMNUXKWRVKRX-RNCFNFMXSA-N 269.291 2.281 10 20 CECD CN1CCCc2cc(CNc3ncccn3)ccc21 58555666 WLXVPKMQCMILCQ-UHFFFAOYSA-N 254.337 2.471 10 20 CECD CC(C)NC(=O)CCNCc1cccc(Cl)c1O 135754400 HWDJQSFTYHXOMR-UHFFFAOYSA-N 270.760 2.050 10 20 CECD CCC(CC)[C@@H](O)CNC(=O)/C=C/c1ccc(O)c(O)c1 181204914 DLWXDSYNUSEEES-VFADXPBXSA-N 293.363 2.024 10 20 CECD CC(C)[C@@H](O)CN[C@@H](C)c1ccc(F)c(F)c1O 187722814 NFCOUHCNHADLGC-KWQFWETISA-N 259.296 2.338 10 20 CECD CN1CCC[C@@H]1CNCc1cc(Cl)ccc1O 227440233 JICOKJDODZEUND-GFCCVEGCSA-N 254.761 2.229 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NC[C@@H](C)N)c2C)c1 194924909 JIWRGZNIFMBOAH-GFCCVEGCSA-N 285.391 2.480 10 20 CECD CNC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 80622923 WBQRVWBIJUWPAH-SNVBAGLBSA-N 299.321 2.186 10 20 CECD CN1CC[C@H](NCc2ccc(N3CCCC3)cc2)C1 49084902 UFMGUNMPPBJWLH-HNNXBMFYSA-N 259.397 2.081 10 20 CECD CCOc1cccc(CN[C@@H](C)CCCO)c1O 94941579 IDKWQDVCTNWIKN-NSHDSACASA-N 253.342 2.042 10 20 CECD Cc1c(CNC(=O)CCc2cnc[nH]2)n(C)c2ccccc12 357468649 HFGSATRIJDQWRE-UHFFFAOYSA-N 296.374 2.459 10 20 CECD C[C@@H](NCC1CCOCC1)c1cc([N+](=O)[O-])ccc1O 273618402 YICDLVNIKRTTDX-SNVBAGLBSA-N 280.324 2.378 10 20 CECD CO[C@]1(C)C[C@H](NC(=O)c2c(F)ccc(O)c2O)C1(C)C 276610544 PNLOPYSXZDKXGE-ZUZCIYMTSA-N 297.326 2.170 10 20 CECD CS[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1N(C)C 278845749 LLZZHWHZXDTINE-CVEARBPZSA-N 293.480 2.230 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCCSC1 272655603 NQYTWYINQJGJJI-DUMNWFOQSA-N 279.361 2.123 10 20 CECD CC(C)OC[C@H]1CN(Cc2ccccc2O)CCO1 372115621 FFXPHKXUXMCRPJ-CQSZACIVSA-N 265.353 2.018 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@@H](n2cncn2)C1 372817387 ZFVIUTIADAUHGM-SECBINFHSA-N 296.733 2.223 10 20 CECD CCCOc1ccc(CN(C)[C@@H](CC)CO)c(O)c1 295061637 GPHACTKSESNPKB-ZDUSSCGKSA-N 267.369 2.384 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)c1c(F)ccc(O)c1O 295098417 XAKGYHRBXYSROU-MRVPVSSYSA-N 285.315 2.170 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@@H]1CCCO1 816529606 ZCYASHHLLVSYIG-VIFPVBQESA-N 259.708 2.453 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccncc2)c1 728980684 MVGDFUCXVWBXGO-SNVBAGLBSA-N 272.304 2.287 10 20 CECD CC(=O)c1cc(O)ccc1NS(=O)(=O)CCCCF 829910919 OGRATVLOWIBAPS-UHFFFAOYSA-N 289.328 2.086 10 20 CECD Cc1ncc(C(=O)NCc2ccc(N(C)C)cc2C)[nH]1 734558449 UZQIICYQZDDIGA-UHFFFAOYSA-N 272.352 2.023 10 20 CECD CC[C@H]1CCCN1CC(=O)NCc1ccc(N(C)C)cc1 839480262 QDVMMFVFPITVPW-HNNXBMFYSA-N 289.423 2.243 10 20 CECD O=C(N[C@H]1CCCN2CCCC[C@H]12)c1cc(O)cs1 848392138 VIJOFVITTRAPGC-NWDGAFQWSA-N 280.393 2.200 10 20 CECD CC(C)(CNC(=O)C(=O)Nc1ccc(N)cc1)C1CCC1 841137648 MZLXQHQHRCBFAX-UHFFFAOYSA-N 289.379 2.150 10 20 CECD COc1ccc(O)c(CNCc2ccc(CN)cc2F)c1 844904088 ARHGJGIWAZBDJD-UHFFFAOYSA-N 290.338 2.288 10 20 CECD CCS(=O)(=O)CCN[C@@H](C)c1ccc(Cl)cc1O 841748641 XWUJVBCKGYRMFQ-VIFPVBQESA-N 291.800 2.131 10 20 CECD C[C@@H](NCCN1CCC1)c1ccc(Cl)cc1O 841752440 SNKZDJHEPRXHSQ-SNVBAGLBSA-N 254.761 2.402 10 20 CECD CCCN(Cc1cc(F)cc(C(C)=O)c1O)[C@@H]1CCNC1 843349434 ZFQCVEPNFOUPHA-CQSZACIVSA-N 294.370 2.308 10 20 CECD CC[C@@H]1CN(Cc2cccc(F)c2O)CC[C@H]1N 843052744 SHKFXQWVRZXZSE-ZWNOBZJWSA-N 252.333 2.091 10 20 CECD CO[C@H](CNC(=O)c1cc(O)cs1)CC(C)C 842264692 BNFXUWFHYVRIJG-JTQLQIEISA-N 257.355 2.245 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1C(F)(F)F)C(=O)O 854239132 BIDMHKPODXRYMI-MRVPVSSYSA-N 290.285 2.334 10 20 CECD CC[C@H](NCCN(C)OC)c1ccc(F)cc1O 850477979 MEGCBNSYQRJTSQ-LBPRGKRZSA-N 256.321 2.065 10 20 CECD CON(C)C(=O)[C@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 858580623 SIOSNKRTAGTQDF-RYUDHWBXSA-N 280.368 2.068 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@H](C)c1cc(OC)ccc1O 760890358 XDDAFZINNRVPCD-DIOULYMOSA-N 295.379 2.245 10 20 CECD O=C(NC[C@@H]1CCCCN1C1CC1)c1cc(O)cs1 765943117 GEEKPMKICITXME-NSHDSACASA-N 280.393 2.200 10 20 CECD Cc1ccc(CN[C@@H]2CCc3n[nH]cc3C2)c(O)c1 877053648 UZQBAOROVOELID-CYBMUJFWSA-N 257.337 2.071 10 20 CECD C[C@H](NC(=O)N[C@@H]1CC[C@H](C(=O)O)C1)c1ccccc1O 874405306 PWKJFAIXBHRZJE-GARJFASQSA-N 292.335 2.006 10 20 CECD CC(C)(O)[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1 877796604 KGBJZLGXKPOUPV-GFCCVEGCSA-N 293.363 2.104 10 20 CECD CCN(CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C1CC1 775408617 AGCFGMLXKPLZEL-ZDUSSCGKSA-N 289.423 2.414 10 20 CECD CC(=O)c1ccc(C(=O)NCc2ccccc2O)o1 772406861 OODHRNQZNFNWGD-UHFFFAOYSA-N 259.261 2.118 10 20 CECD Cc1ccc(C(=O)N[C@H](C)Cc2ccco2)c(O)c1O 780880729 CUSMIAXOWIHRDC-SNVBAGLBSA-N 275.304 2.360 10 20 CECD CCC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CCC1 784054910 OBXNXGKXWNZMDP-UHFFFAOYSA-N 278.304 2.404 10 20 CECD CCCOc1ccc(CN[C@H]2C(=O)NCC2(C)C)cc1C 895326747 ZXUGKKGKXYINKE-HNNXBMFYSA-N 290.407 2.398 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)N(C)C[C@H]2C)c1O 894487276 HTUSTQLWBBVADF-CHWSQXEVSA-N 278.396 2.234 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1ccc(C)cc1O 186030248 JRNQKXLOSYITFV-NEPJUHHUSA-N 285.409 2.174 10 20 CECD C[C@H]1C[C@H](O)CN1Cc1c(O)ccc(Cl)c1F 792178052 BMONHJFPXHJTOK-YUMQZZPRSA-N 259.708 2.140 10 20 CECD CCNC(=O)CN(CC)Cc1ccc(N2CCCC2)cc1 1324712291 QUGXWPNMOOMXJL-UHFFFAOYSA-N 289.423 2.245 10 20 CECD C=CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 1338389637 MEEVINSEYIRSFX-MRXNPFEDSA-N 288.391 2.446 10 20 CECD COC(=O)CN(Cc1cc(C)cc(OC)c1O)CC(C)C 1333666944 DHOGLXMFKQCTRK-UHFFFAOYSA-N 295.379 2.340 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@](O)(C2CC2)C1 1331397818 FQCVPKUEGPBXLJ-QGZVFWFLSA-N 274.408 2.408 10 20 CECD CC(C)OC1(C(=O)NCc2cccc(O)c2O)CCC1 1349079158 LFMRAHBYQNBIBM-UHFFFAOYSA-N 279.336 2.062 10 20 CECD CC(C)(C(=O)NCc1cccc(O)c1O)C(F)F 1352658167 QSCHWZQDJYTMMM-UHFFFAOYSA-N 259.252 2.005 10 20 CECD C[C@H]1CC[C@@](NCc2ccc(N(C)C)cc2)(C(=O)O)C1 1776628243 IXAUCYVBUAVJHA-LRDDRELGSA-N 276.380 2.486 10 20 CECD CC[C@@H](C)[C@H](NCc1cc(F)cc(F)c1O)C(=O)O 1776687518 ZAKCOFXJLAZHJA-HQJQHLMTSA-N 273.279 2.259 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cc2ccccn2c1 156627626 USGWEZALJXITFD-UHFFFAOYSA-N 296.326 2.323 10 20 CECD COc1cccc(CNC2CCN(C(C)C)CC2)c1O 20189128 XFXSGIDGSGCWPL-UHFFFAOYSA-N 278.396 2.363 10 20 CECD CC[C@H](NCC(=O)NCC(C)C)c1ccccc1O 135733800 BZEWRBDZSIGMTP-ZDUSSCGKSA-N 264.369 2.205 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](C)[C@H](CN)C2)c1O 253195853 SCFISVYYETWUPH-ZYHUDNBSSA-N 298.814 2.471 10 20 CECD COc1cccc(CNC2CCN(C3CC3)CC2)c1O 37140983 ADLYPDGENLVPJK-UHFFFAOYSA-N 276.380 2.117 10 20 CECD C[C@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CCO1 708436158 KFPLKVPLIOQETL-KWQFWETISA-N 257.280 2.328 10 20 CECD CCNC(=S)N(CC)Cc1ccc(N(C)C)cc1 7500764 TWCIYMFIOHLSRS-UHFFFAOYSA-N 265.426 2.469 10 20 CECD C[C@@H]1C[C@@H]1C(=O)N1CCOc2cc(N(C)C)ccc21 173200796 JKJCRVLNFXDAEW-PWSUYJOCSA-N 260.337 2.134 10 20 CECD CCn1cc(C(=O)N[C@H](C)c2cc(OC)ccc2O)cn1 114539006 AXBCTIBPRFBHCG-SNVBAGLBSA-N 289.335 2.108 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](C)OC)c1 170900520 GKLHAIYMHOEHEY-ZJUUUORDSA-N 267.325 2.003 10 20 CECD Cc1cc(C(=O)N[C@H](C)CO)c(C)n1-c1ccc(C#N)cc1 305188606 UOOMBTPAVDFETB-LLVKDONJSA-N 297.358 2.076 10 20 CECD COCC(C)(C)C(=O)NCc1ccc(N(C)C)c(F)c1 124600919 LEZWDBMPMOVUKI-UHFFFAOYSA-N 282.359 2.181 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccnc(F)c2F)c1 189385255 YPOIXEJVZZIJRQ-UHFFFAOYSA-N 294.257 2.004 10 20 CECD COCC1=CCN(Cc2cc(OC)c(OC)cc2O)CC1 185047185 UFFJTJQFODEAAC-UHFFFAOYSA-N 293.363 2.188 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CCCC1 183481412 LNQCCVQTQDTDLW-SNVBAGLBSA-N 263.337 2.335 10 20 CECD C[C@@H]1C[C@H](N)CCN1Cc1cc(Br)ccc1O 220332740 JYSQSSXJRKDBQP-BXKDBHETSA-N 299.212 2.466 10 20 CECD C[C@H]1CN(Cc2cc(Br)ccc2O)CC[C@@H]1N 220184840 IZVLXPOCYRRLKS-CABZTGNLSA-N 299.212 2.324 10 20 CECD CCN(CC)c1ccc(CNC(=O)CN(C)C(C)C)cc1 195313404 BUNGNCXOFXRQHN-UHFFFAOYSA-N 291.439 2.489 10 20 CECD OC[C@@H]1CCC[C@@H]1NCc1cc(Cl)ccc1O 230680578 VAUWTNKRVFYFNH-CABZTGNLSA-N 255.745 2.296 10 20 CECD CCn1nc(C)c(C(=O)NCc2ccc(N)cc2)c1C 297138670 HYMBNPNTOZGQDQ-UHFFFAOYSA-N 272.352 2.032 10 20 CECD CCOC[C@@H](O)CN(Cc1ccc(N(C)C)cc1)C1CC1 265062959 ZFQQMBOEDYVVFQ-KRWDZBQOSA-N 292.423 2.114 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCO[C@H](C)C2)c1 271315506 XLSMQLXVARTJOZ-DGCLKSJQSA-N 265.353 2.448 10 20 CECD O=C(NCC1(c2ccccn2)CCC1)c1cccc(O)c1O 367797792 AYPVUXWGDRHVHA-UHFFFAOYSA-N 298.342 2.345 10 20 CECD CCCOc1ccc(CN(CCO)C2CC2)c(O)c1 271093103 XGJACEIUCSSEGN-UHFFFAOYSA-N 265.353 2.138 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1O 271347279 PHTPFWLIDFJDAV-SWLSCSKDSA-N 266.360 2.094 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(N3CCOCC3)CC2)c1 278491901 PQPYAHZMLYNQNR-CQSZACIVSA-N 290.407 2.216 10 20 CECD COc1ccc(O)c(CN2C[C@@H](N3CCCC3)C[C@H]2C)c1 289876191 VXVMYJCLFSCHNP-HIFRSBDPSA-N 290.407 2.459 10 20 CECD C[C@@H]1CCC[C@@H]1NCC(=O)NCc1ccc(N(C)C)cc1 282062694 MSCYQWVEDQHAPV-CJNGLKHVSA-N 289.423 2.147 10 20 CECD CCC[C@@H](CNCc1ccc(N2CCOCC2)cc1)OC 378848784 UQKRUJGYSDVWKE-KRWDZBQOSA-N 292.423 2.428 10 20 CECD CC[C@@H](N[C@@H](CO)COC)c1cccc(Cl)c1O 286942138 GXZDHJFYZOHUCY-JOYOIKCWSA-N 273.760 2.094 10 20 CECD O=C(NCc1ccccc1O)NC(C1CC1)C1CC1 299512003 OBXALADHEGTVKO-UHFFFAOYSA-N 260.337 2.380 10 20 CECD CCn1cc([C@@H](C)NC(=O)c2ccc(C)c(O)c2O)cn1 296890344 IGGZXIUKQGKTIX-SNVBAGLBSA-N 289.335 2.114 10 20 CECD CN(C)C1CCC(NCc2cc3c(cc2O)OCO3)CC1 817416253 WGGDHUIHKAPWPC-UHFFFAOYSA-N 292.379 2.083 10 20 CECD Cc1cc(C)c([C@H](C)NCC(F)(F)CN)c(O)c1 817968899 XVIAJPFEBQKWDT-JTQLQIEISA-N 258.312 2.254 10 20 CECD CCCC[C@@H](CN)N[C@H](C)c1cc(C(=O)OC)ccc1O 817962069 HPPMSTZLJVTGLU-YPMHNXCESA-N 294.395 2.347 10 20 CECD CN(C)c1ccc(CNCCC2(CO)CC2)cc1F 825040678 SGHJRKAPJMJPFQ-UHFFFAOYSA-N 266.360 2.144 10 20 CECD CC(C)C1(C(=O)N[C@H](C)c2ccccc2O)COC1 828539770 UVSNQAVKHSJCNV-LLVKDONJSA-N 263.337 2.242 10 20 CECD COC(=O)c1cnc(SCCN2CCCC2)s1 829684449 OMUYDLKZHVBYHO-UHFFFAOYSA-N 272.395 2.118 10 20 CECD CCC[C@](C)(N)C(=O)N[C@H](C)c1cc(OC)ccc1O 828668210 ZKYHZOXIQTVMEW-BMIGLBTASA-N 280.368 2.096 10 20 CECD C[C@@H](NC(=O)CCC(C)(C)O)c1ccccc1O 827941185 OSSLKXGENVLNRY-SNVBAGLBSA-N 251.326 2.121 10 20 CECD COc1ccc2c(c1)CCCCN2CC[S@@](C)=O 828568563 FNGCUKUJIXBQJD-GOSISDBHSA-N 267.394 2.216 10 20 CECD CCCN1CC[C@H](NC(=O)N(C)Cc2ccccc2O)C1 823053705 DGXZSPDCGXQKGK-AWEZNQCLSA-N 291.395 2.018 10 20 CECD C[C@H](NCCC1(CO)CC1)c1cc(F)cc(F)c1O 834896869 OPNBYZBYPAHLEE-VIFPVBQESA-N 271.307 2.484 10 20 CECD C[C@H](NC(=O)NCc1cc(Cl)ccc1O)[C@@H]1CCOC1 845009271 CYFNZKVTXSJMPV-VHSXEESVSA-N 298.770 2.270 10 20 CECD C[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)[C@H]1CN 843051088 DZLMRASTASBHQQ-LRDDRELGSA-N 279.403 2.451 10 20 CECD CC(C)NCCC(=O)NCc1ccc(N2CCCC2)cc1 746313987 DQZKQRBQPNJWDK-UHFFFAOYSA-N 289.423 2.291 10 20 CECD CN(C[Si](C)(C)C)C(=O)/C=C\c1ccc(O)c(O)c1 911725901 CBWYMCPQYJUTFK-VURMDHGXSA-N 279.412 2.447 10 20 CECD CC[C@@H](NCc1c(O)cccc1OC)[C@@H](O)C(C)C 840966475 GBWDDXLGQGAIQW-DOMZBBRYSA-N 267.369 2.286 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](N)C[C@@H]2C)c1O 846707862 ZRNNCBRWFJIJLB-TVQRCGJNSA-N 280.343 2.046 10 20 CECD COc1cccc([C@H](C)NC2CCOCC2)c1O 846142250 ZBRMUCQQBJKWBA-JTQLQIEISA-N 251.326 2.230 10 20 CECD COc1ccc(C(=O)NCc2ccc(N(C)C)c(F)c2)o1 846843628 SJZMTQXZPMHJCK-UHFFFAOYSA-N 292.310 2.423 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1ccc(C(N)=O)cc1 843057935 ZTHBDUBPOQBJJJ-UHFFFAOYSA-N 295.386 2.197 10 20 CECD COc1cccc([C@H](C)NC[C@@H](C2CC2)N(C)C)c1O 846142278 ZUFFCEQQIGNDMV-FZMZJTMJSA-N 278.396 2.392 10 20 CECD CC(C)OCCCN(C)c1ccc(OCC(=O)O)cc1 846280162 SSHUKDZMMLBKAE-UHFFFAOYSA-N 281.352 2.401 10 20 CECD COc1cccc(CN[C@@H](CN)C2CCCCC2)c1O 841039243 GSTDJXQMIIVVNF-AWEZNQCLSA-N 278.396 2.398 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2C[C@]2(C)OC)c1O 850570949 KSYPCTBHWVDFJD-IUPBHXKESA-N 251.326 2.229 10 20 CECD CC(=O)c1cc(F)cc(CN(C)[C@H]2C[C@@H](C(=O)O)C2)c1O 851709726 XLUBYQJFUJFBLB-WVSHTKLVSA-N 295.310 2.029 10 20 CECD CO[C@@](C)(CNC(=O)NCc1cc(C)ccc1O)C1CC1 858476364 AGONFSHPRUZZAY-INIZCTEOSA-N 292.379 2.315 10 20 CECD CCO[C@@H](CC(=O)NCCc1ccc(O)c(O)c1)C(C)C 762274631 JNDWTBUVLRKHAL-HNNXBMFYSA-N 295.379 2.208 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@@H](CO)C2)cc1F 862210582 PPGUHKFCAWOYCN-LLVKDONJSA-N 284.350 2.235 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccn(CC(F)F)n2)c1 862756134 QXEVPURFQLOPCH-UHFFFAOYSA-N 295.289 2.092 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2C[C@@H](CO)C2)c2c(O)ccc(F)c21 866415920 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COc1cc(C)cc(CNC2(CN(C)C)CCC2)c1O 1338263361 JOBQPFWKFQSIGS-UHFFFAOYSA-N 278.396 2.283 10 20 CECD Cc1nc(N2CCOCC2)ccc1NCc1ccc(N)cc1 1262488082 PQLSQOQSYNBLMB-UHFFFAOYSA-N 298.390 2.421 10 20 CECD CN(C)c1cc(F)c(CNCCC2CC(O)C2)cc1F 1348099452 GECNRJUUVHVBIR-UHFFFAOYSA-N 284.350 2.281 10 20 CECD O=C(O)[C@@H](CC(F)F)NCc1ccc(N2CCCC2)cc1 1601639395 RQHZOLAHAVCRKX-CYBMUJFWSA-N 298.333 2.485 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1594920807 LSFMVZGLOHUIPY-BHDSKKPTSA-N 281.352 2.148 10 20 CECD C[C@@H](NC(=O)COCC(F)(F)F)c1ccccc1O 827930893 TYYPGKQGGAOJCS-MRVPVSSYSA-N 277.242 2.148 10 20 CECD Cc1ccc(CN2CC[C@@]3(CCN(C)C3)C2)c(O)c1 877546023 NWUGCUSUEFTRPR-MRXNPFEDSA-N 260.381 2.228 10 20 CECD COc1cc(Cl)cc(CNCC2=CCCOC2)c1O 289986333 BYMKSZNDVKRZBL-UHFFFAOYSA-N 283.755 2.491 10 20 CECD C[C@H](NCc1ncccn1)c1ccc(N(C)C)cc1 702342760 WCUSROAMMZJYCZ-LBPRGKRZSA-N 256.353 2.393 10 20 CECD CC(C)N1CCC(NC(=O)Nc2ccc(N)cc2)CC1 387386701 IRFIKGSTUCTIEE-UHFFFAOYSA-N 276.384 2.263 10 20 CECD CN(C)c1ccc(CN2CCCC[C@H]2C(=O)O)cc1 3755549 MADUPLUHJKWHTJ-AWEZNQCLSA-N 262.353 2.192 10 20 CECD NCc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)o1 178710708 PMRWJQJOVUNIAM-UHFFFAOYSA-N 299.374 2.269 10 20 CECD CCOC(=O)[C@H](NCc1cc(F)cc(F)c1O)C1CC1 1353592381 DRHQOXZPRSZPAZ-GFCCVEGCSA-N 285.290 2.102 10 20 CECD COc1cccc(CNC(=O)Cc2cccc(F)c2)c1O 68488821 QIVGKJNODJMIRO-UHFFFAOYSA-N 289.306 2.399 10 20 CECD C[C@H](CN[C@H](C)c1cc(F)ccc1O)CN1CCOCC1 185505669 KGOWRUVTZNMLLX-CHWSQXEVSA-N 296.386 2.150 10 20 CECD Cc1ccc(C(=O)NCc2ccc(O)c(O)c2)c(F)c1 182529395 BXGWNADHKJEJQY-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CC(C)C[C@@H](CO)NCc1ccc(N(C)C)cc1 40773103 JBZSXVYEJXEQFB-AWEZNQCLSA-N 250.386 2.249 10 20 CECD COc1cccc(CN2CC[C@@H](CN3CCCC3)C2)c1O 93597858 IQBAQUIOIIGRLG-AWEZNQCLSA-N 290.407 2.319 10 20 CECD C[C@@H](NCc1cccc(C(N)=O)c1)c1cc(F)ccc1O 94617144 ANNKEKXXCVJGBT-SNVBAGLBSA-N 288.322 2.481 10 20 CECD COC(=O)[C@@H]1CCCCCN1Cc1cc(OC)ccc1O 360021029 VOGVAKSMFAJAHF-AWEZNQCLSA-N 293.363 2.318 10 20 CECD CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccccc1O)CC2 271460281 XEHLABOXSYVVPS-CVEARBPZSA-N 291.391 2.144 10 20 CECD C[C@@H]1C(=O)CC[C@@H]1CC(=O)NCc1ccccc1O 279858390 KNYXFZVSMKPPAX-WDEREUQCSA-N 261.321 2.014 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)OC3(CCOCC3)C2)c1 280417838 IIWSJRGJRJBASK-AWEZNQCLSA-N 291.391 2.471 10 20 CECD COc1cccc(CNC(=O)C(C)(C)C2CC2)c1O 287888273 YGLHWSLPHGYAFL-UHFFFAOYSA-N 263.337 2.453 10 20 CECD Cc1noc(C(C)(C)NCc2ccc3c(c2)CCO3)n1 284087543 RLPJBSVOWGNOFK-UHFFFAOYSA-N 273.336 2.338 10 20 CECD C[C@H](NCc1cnnn1C)c1cc2c(cc1O)CCCC2 287475625 WQROONMEVOZBDL-NSHDSACASA-N 286.379 2.250 10 20 CECD CN(C)c1ccc(Cn2c(-c3ccccn3)noc2=O)cc1 814745564 ZVTCQGONVCJRKK-UHFFFAOYSA-N 296.330 2.013 10 20 CECD C[C@@H]1[C@H](O)CCN1Cc1cc(Cl)cc(F)c1O 825104036 LBTNIOLBFQVRNM-RDDDGLTNSA-N 259.708 2.140 10 20 CECD Cc1noc(CCCC(=O)N[C@H](C)c2ccccc2O)n1 827923563 VAESXBFFJSIVFX-SNVBAGLBSA-N 289.335 2.284 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2NCC2(C)C)cc1 827341240 XZYXWZWPZHNHCT-HNNXBMFYSA-N 289.423 2.147 10 20 CECD Cc1ccc(O)c(CN(CC(F)F)C[C@H](C)O)c1 825098394 IDGUYGKQYRBZND-JTQLQIEISA-N 259.296 2.149 10 20 CECD O=C(/C=C\c1cccc(O)c1)NCc1ccc(O)c(O)c1 588537024 QZPXKNXNBZBSNP-ALCCZGGFSA-N 285.299 2.133 10 20 CECD C[C@H](NC(=O)NCc1ccccc1O)c1cccnc1 731116008 JBKAQCDZYQZCLS-NSHDSACASA-N 271.320 2.348 10 20 CECD Cc1noc([C@@H](C)NCc2ccc(N(C)C)c(F)c2)n1 733328462 RRZHMUUBGVDTLJ-SECBINFHSA-N 278.331 2.434 10 20 CECD CCNC(=N)NCc1cc(Cl)cc(Cl)c1O 849028281 GSDULBZESNMDCG-UHFFFAOYSA-N 262.140 2.333 10 20 CECD Cc1cc(Br)cc(CN2CCC[C@H](N)C2)c1O 843043728 FKMPKBJVXROJCH-LBPRGKRZSA-N 299.212 2.386 10 20 CECD C[C@@H](NC(=O)Nc1ccc(N)cc1)C(C)(C)CN(C)C 841300504 SEXPWTJBJOJZDC-LLVKDONJSA-N 278.400 2.367 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 843058484 UIAHEKIYZLQXAF-NXEZZACHSA-N 254.761 2.215 10 20 CECD COc1cccc([C@@H](C)NC2CCN(C(C)=O)CC2)c1O 846136944 MLBSLWAIXLYVAA-LLVKDONJSA-N 292.379 2.062 10 20 CECD COc1ccc(N2CC[C@H](CN[C@H]3CO[C@@H](C)C3)C2)cc1 842713890 JYQPDLKOCCQTQD-RRFJBIMHSA-N 290.407 2.289 10 20 CECD CON(C)CCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 850479282 PFJZLCZNAVNXKB-MWLCHTKSSA-N 268.332 2.162 10 20 CECD CC(=O)CCCOC(=O)/C=C/c1ccc(O)c(O)c1 759589276 QUDGHCHVCRBWGA-FNORWQNLSA-N 264.277 2.023 10 20 CECD CN1CCCC[C@H](CNCc2cc([N+](=O)[O-])ccc2O)C1 858245365 RIIQMRSMCRMXIS-GFCCVEGCSA-N 293.367 2.122 10 20 CECD CC(C)CN(CCN(C)C)C(=O)c1cc(O)cs1 760172651 NLFJRZOZPLZXMG-UHFFFAOYSA-N 270.398 2.114 10 20 CECD CN(C)c1ccc(CNCCC2CC(O)C2)cc1F 762502571 GGJIWKMRCSRMFU-UHFFFAOYSA-N 266.360 2.142 10 20 CECD CCOc1ccc(O)c(CN(C)Cc2cn[nH]c2)c1 769427302 XLZUEVYAZUNNQZ-UHFFFAOYSA-N 261.325 2.146 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1C[C@]12CCOC2 764124093 BROMCGVMNACBBL-GWCFXTLKSA-N 298.433 2.168 10 20 CECD CCn1cc([C@@H](C)NCc2cc([N+](=O)[O-])ccc2O)cn1 765617401 ASAGEAIFRIGJKO-SNVBAGLBSA-N 290.323 2.368 10 20 CECD Cc1ccc(CNCCc2cn3c(n2)SCC3)c(O)c1 877395330 XKHOOUJQRLXNKO-UHFFFAOYSA-N 289.404 2.335 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H](C)c2ccc[nH]2)c1O 775041887 WBOYQQUGSOGCOH-SECBINFHSA-N 291.307 2.488 10 20 CECD CCOc1ccc(CN2CC[C@@](O)(CC)C2)c(O)c1 779217824 CMLJSGYLSMJSOR-HNNXBMFYSA-N 265.353 2.138 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@@H]([S@](C)=O)C2)c(O)c1 877623013 GVLJGIJCHPXWLG-LPMFXHHGSA-N 281.421 2.480 10 20 CECD CN(CCCF)CC(=O)N(C)Cc1ccc(N(C)C)cc1 887137872 WQMBETQHJQTLJV-UHFFFAOYSA-N 295.402 2.002 10 20 CECD C[C@@H](NC[C@H](CO)Cc1ccco1)c1ccccc1O 783519998 OFKYTAASNHPGRR-CHWSQXEVSA-N 275.348 2.487 10 20 CECD NC(=O)[C@]1(c2ccccc2)CCN(Cc2ccccc2O)C1 895004476 QUHSPUTXCABPGV-GOSISDBHSA-N 296.370 2.021 10 20 CECD COc1ccc(O)c(CNCCNc2ccc(C)cn2)c1 897182167 VSQJUIIYKZEFIG-UHFFFAOYSA-N 287.363 2.306 10 20 CECD CCCCN(C)S(=O)(=O)Nc1ccc(O)cc1C 743260177 YUCIBSHZBNIHIE-UHFFFAOYSA-N 272.370 2.089 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@@H](C)c1ccc(F)cc1O 62747748 UTXBIPZCMVBGJW-QWRGUYRKSA-N 280.343 2.193 10 20 CECD COc1ccc(CNC(=O)c2ncc(C)cc2C)c(O)c1 794387297 HXZQIRNAECFIIT-UHFFFAOYSA-N 286.331 2.343 10 20 CECD C[C@@H](NC(=O)NCCCCCO)c1ccc(N(C)C)cc1 790812818 LPYDYVFQBBXLCZ-CYBMUJFWSA-N 293.411 2.275 10 20 CECD CCCN(Cc1cccc(OCC)c1O)[C@H]1CCNC1 71314507 CNMHBGQROBBRCM-AWEZNQCLSA-N 278.396 2.365 10 20 CECD C[C@H](N[C@H](C)C1(CO)CC1)c1cc(F)ccc1O 829208205 GYGCUPPLXLMMQJ-VHSXEESVSA-N 253.317 2.343 10 20 CECD CCOc1cccc(CN2CC[C@H](C(=O)O)[C@@H]2C)c1O 92944243 PVMOALMNGRYNOU-JQWIXIFHSA-N 279.336 2.086 10 20 CECD CCOc1ccc(C(=O)NCCc2ccc(N)cc2)cn1 1326576035 AVHBPWDYTKWVIU-UHFFFAOYSA-N 285.347 2.035 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H]2OCCC[C@H]2C1 1347321907 DSOZSDSKHQPGTI-ONGXEEELSA-N 267.350 2.095 10 20 CECD CC[C@](COC)(NCc1ccc(N(C)C)c(C)c1)C(=O)O 1609926440 QZCUEXHEJVKWCO-MRXNPFEDSA-N 294.395 2.030 10 20 CECD C[C@](NC(=O)c1cc(O)cs1)(C(=O)O)c1ccccc1 1603239386 IOBSCHLZRQOIKK-CQSZACIVSA-N 291.328 2.184 10 20 CECD CC(C)(C)C[C@H](O)CNCc1cc2c(cc1O)OCO2 227373747 ZGPUJDQKBLIVAJ-NSHDSACASA-N 281.352 2.008 10 20 CECD O=C(NCc1cccc(O)c1O)C1(F)CCCCC1 1548791473 BJGKSJOPNQNNGO-UHFFFAOYSA-N 267.300 2.386 10 20 CECD COc1cccc(CNCc2ccncc2C)c1O 228654036 KRPUBFNYLMWYNA-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Cc1ccc(CN[C@@H]2C[C@H]3CC[C@@H](N3)[C@@H]2C)c(O)c1 1579696906 LUZZPJXHHIBPME-ZGKBOVNRSA-N 260.381 2.319 10 20 CECD CC(C)C[C@H](CNCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776317620 JGWRVILSRFZTNF-LLVKDONJSA-N 296.323 2.137 10 20 CECD CCCC(=O)N1CCC[C@@H](C(=O)Nc2ccc(N)cc2)C1 160416827 NWAIKYQIORMADG-GFCCVEGCSA-N 289.379 2.246 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](O)C(C)C)c1 168776273 FEDJCSLPJXCRMA-YGRLFVJLSA-N 253.342 2.068 10 20 CECD CN(C)C(=O)O[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 824576582 PFONXVOQPWROIX-GFCCVEGCSA-N 298.770 2.318 10 20 CECD Oc1ccc(F)cc1CN1CC[C@@]2(CCOC2)C1 180240149 CGMWJCNNLMQWDB-CQSZACIVSA-N 251.301 2.144 10 20 CECD O=C(c1cccc(O)c1O)N1CCC(C(F)F)CC1 307880856 PPUJXXQLSLDLEF-UHFFFAOYSA-N 271.263 2.215 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](C)[C@@H]2CCN)c1 404415928 GATCFBRPGRAQID-DOMZBBRYSA-N 278.396 2.350 10 20 CECD CS[C@@H]1CC[C@@H](N(C)C(=O)c2cccc(O)c2O)C1 707342147 FABJERZYVNZMAV-NXEZZACHSA-N 281.377 2.454 10 20 CECD CO[C@@H](C1CC1)[C@H](C)NCc1cc(F)ccc1O 388278589 KNCIOTGZYAIBOL-LKFCYVNXSA-N 253.317 2.434 10 20 CECD CC(=O)C(=O)CSc1nccn1Cc1ccccc1 808015888 ZSLNFOKWXIBUCK-UHFFFAOYSA-N 274.345 2.182 10 20 CECD CC[C@H](N[C@H](CO)C[C@H]1CCCO1)c1ccccc1O 886669775 DOGICYOSKOLKMR-GUTXKFCHSA-N 279.380 2.363 10 20 CECD COCCCCCNC(=O)N(C)Cc1ccccc1O 57648927 RFDSUVCWQSDYSN-UHFFFAOYSA-N 280.368 2.350 10 20 CECD CCc1nc(CN(C)c2ccc(OC)c(OC)c2)no1 64517151 ZPWYNORUHXDWFJ-UHFFFAOYSA-N 277.324 2.286 10 20 CECD C[C@H](N[C@H]1CCCCNC1=O)c1cc(Cl)ccc1O 184982102 MCLWOCXWDZAYEF-CABZTGNLSA-N 282.771 2.365 10 20 CECD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@H]3C2)c(O)c1O 182839362 XPDSPLHUFDEPBT-DGCLKSJQSA-N 291.347 2.047 10 20 CECD C[C@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C1CC1 186429435 UZOOJEOXTKWWET-ZJUUUORDSA-N 263.337 2.191 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1cccc(O)c1 181079897 QBQNRHQASYOTQX-FNORWQNLSA-N 285.299 2.133 10 20 CECD CC(C)(C)OC(=O)CCNCc1cc(F)ccc1O 180790180 CKFFWEPYWGSGDT-UHFFFAOYSA-N 269.316 2.353 10 20 CECD COC(=O)C1(CNCc2cccc(Cl)c2O)CC1 188676113 RRDPPCIXGLVAHU-UHFFFAOYSA-N 269.728 2.088 10 20 CECD CC(C)[C@H](CN[C@@H](C)c1ccccc1O)N1CCOCC1 183395170 NVQMOTGOVJXQCD-HOCLYGCPSA-N 292.423 2.400 10 20 CECD C[C@H]1[C@@H](C(=O)N2CCOc3cc(N(C)C)ccc32)C1(F)F 336579648 SLFGMHGGGMPOAK-ZANVPECISA-N 296.317 2.379 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](CO)C2)cc1 92764803 UQOBDTLNNCKDOU-OAHLLOKOSA-N 262.397 2.347 10 20 CECD C[C@H](CCN(C)C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273570617 KNGITJUFLHKYAE-GHMZBOCLSA-N 281.356 2.291 10 20 CECD CN(Cc1ccccn1)Cc1cc2c(cc1O)OCO2 273406522 NLRIECLTRXUWAE-UHFFFAOYSA-N 272.304 2.148 10 20 CECD Cc1cc(O)c(CN(C)[C@H](CO)COC(C)C)cc1C 809768335 IFTPHYDDRXCFQP-OAHLLOKOSA-N 281.396 2.227 10 20 CECD CS(=O)(=O)CCCCCN[C@@H]1CCc2cccc(O)c21 296349052 HIHJZMNDVJWJRM-CYBMUJFWSA-N 297.420 2.184 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc(F)c[nH]2)cc1 814790681 WBQVFFSHVSZUAB-UHFFFAOYSA-N 261.300 2.150 10 20 CECD CCN(C)c1ccc([C@@H](C)NCC2(CC(N)=O)CC2)cc1 817587571 YZMRRGOADPEYIE-CYBMUJFWSA-N 289.423 2.449 10 20 CECD COc1ccc(CNC(=O)[C@H](C)C(C)(F)F)c(O)c1 816550307 NUPBKBRRNZYNJY-QMMMGPOBSA-N 273.279 2.308 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCN(C)C2)cc1 729523909 XZEFFXHQENZZQV-OAHLLOKOSA-N 289.423 2.101 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C1(CN(C)C)CC1 820878005 GWXSZIDXDBGZJA-UHFFFAOYSA-N 290.407 2.473 10 20 CECD COCCOc1ccc(NC(=O)c2cc(O)cs2)cn1 731869023 IEZWZXHOVDZCEI-UHFFFAOYSA-N 294.332 2.126 10 20 CECD C[C@@H](NCCC1(CO)CC1)c1cc([N+](=O)[O-])ccc1O 834897891 WTFINTYMSSIJSU-SNVBAGLBSA-N 280.324 2.114 10 20 CECD COC(=O)N1CCC[C@H](N[C@H]2CCc3cccc(O)c32)C1 834559116 ZPJYWGFEJRMOBR-STQMWFEESA-N 290.363 2.200 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1COc2ccccc2C1 748461541 ZFCGAVCPOCIYGS-AWEZNQCLSA-N 298.342 2.195 10 20 CECD Cc1cc(C)c(C(=O)NCc2ccc(O)cc2O)c(C)n1 910957198 PYJHYRPGSYRBTJ-UHFFFAOYSA-N 286.331 2.348 10 20 CECD COC(=O)CC(C)(C)NCc1ccc(OC)c(C)c1 741255401 WKAGTJAQHUADER-UHFFFAOYSA-N 265.353 2.435 10 20 CECD CN(C[Si](C)(C)C)C(=O)/C=C/c1ccc(O)c(O)c1 911725900 CBWYMCPQYJUTFK-SOFGYWHQSA-N 279.412 2.447 10 20 CECD COc1cccc([C@@H](C)NCCC[C@@H](C)O)c1O 846169288 ZSTJJDRIDMZXIC-GHMZBOCLSA-N 253.342 2.212 10 20 CECD Cc1cc(Br)cc(CN2CCC[C@@H](N)C2)c1O 843043726 FKMPKBJVXROJCH-GFCCVEGCSA-N 299.212 2.386 10 20 CECD CCN1C[C@H](CN[C@H](C)c2cc(F)cc(F)c2O)CC1=O 846207814 GCOHLAXSCJDYMA-ZJUUUORDSA-N 298.333 2.189 10 20 CECD CCCC(=O)OCC(=O)N(C)Cc1ccc(N(C)C)cc1 747811873 RHGKZLNNDNNHLI-UHFFFAOYSA-N 292.379 2.054 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](C)N(C)C 840557579 RLCYDGWMOKCEPN-KBPBESRZSA-N 291.439 2.058 10 20 CECD CCc1cccc(CN[C@H]2CCc3c[nH]nc3C2)c1O 848897988 NYLWPDGNHKPXOQ-AWEZNQCLSA-N 271.364 2.325 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1cc(C)c(C)cc1O 843122794 UYRGNJXOHXFLAL-KBPBESRZSA-N 266.360 2.141 10 20 CECD C[C@@H](Cc1ccccn1)NC(=O)NCc1ccccc1O 847301815 GDEYNEIACBMNQT-LBPRGKRZSA-N 285.347 2.218 10 20 CECD COC(=O)[C@H](F)CSc1ncc(Cl)s1 849998599 GTVLNQWJSCPQCT-SCSAIBSYSA-N 255.723 2.400 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)NC[C@H](C)N)cc1 841985303 GZSXZUDJXZZGJG-ZDUSSCGKSA-N 292.427 2.021 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCNC2)c(C(F)(F)F)c1 841045278 ROJCHGQXZQSQDQ-LLVKDONJSA-N 287.329 2.223 10 20 CECD CCOCc1cc(CN[C@@H]2CCN[C@H](C)C2)ccc1OC 841062080 SKESUYVWEXOPMS-CZUORRHYSA-N 292.423 2.462 10 20 CECD COC[C@H](Cc1ccccc1)NC(=O)c1cc(O)cs1 746709349 IIFLTMTYMAYNNV-LBPRGKRZSA-N 291.372 2.441 10 20 CECD CC[C@@H](N[C@@H]1COC[C@H]1OC)c1ccc(N(C)C)cc1 842911892 ODQMTVHIFBGAKE-BZUAXINKSA-N 278.396 2.207 10 20 CECD COc1ccc(N(C)C/C=C(\C)C(=O)O)c(OC)c1 846252349 XUUDYDYQSOZMKS-JXMROGBWSA-N 265.309 2.171 10 20 CECD COc1cc(NCc2ccc(N(C)C)c(F)c2)[nH]n1 858231412 RNFFWSYLGXILID-UHFFFAOYSA-N 264.304 2.236 10 20 CECD COc1cc(O)c(CN(C)CC2=CCCOC2)cc1OC 853562246 HOKVWCQNUITSBS-UHFFFAOYSA-N 293.363 2.188 10 20 CECD CC[C@@H](CN1CCOCC1)NCc1ccc(OC)c(C)c1 922588887 DHGPMIPKXHTSRU-INIZCTEOSA-N 292.423 2.204 10 20 CECD CC1(CC(=O)NCc2ccc(N3CCOCC3)cc2)CC1 757856894 FBECCRYSSVITLA-UHFFFAOYSA-N 288.391 2.330 10 20 CECD CCN1C(=O)/C(=C\c2cc(OC)ns2)SC1=S 864087355 SXCJOFBLBGOENC-QPJJXVBHSA-N 286.403 2.373 10 20 CECD Cc1nccn1CCCOC(=O)c1cc(O)cs1 767629753 SXRFGGKSJRDSSX-UHFFFAOYSA-N 266.322 2.206 10 20 CECD COc1cccc(CNC(=O)[C@H]2CC23CCC3)c1O 760123170 SCLJMACFCGXQDD-LLVKDONJSA-N 261.321 2.207 10 20 CECD CN(C)c1nccc(CNCc2cccc(Cl)c2O)n1 779431965 ISJFINSUNWPIPL-UHFFFAOYSA-N 292.770 2.191 10 20 CECD C[C@H](NC(=O)[C@H](O)C(C)(C)C)c1ccc(N(C)C)cc1 775412305 WJBGRLZBVGMTSY-FZMZJTMJSA-N 278.396 2.337 10 20 CECD CN(C)c1ccc(CN[C@H]2CCn3ccnc3C2)cc1F 778190070 UYWIKLRXZJHDCO-ZDUSSCGKSA-N 288.370 2.193 10 20 CECD Cc1ccc(O)c(CNc2cccc(C(N)=O)c2)c1 71406400 YFSLTWKAUBXPIH-UHFFFAOYSA-N 256.305 2.412 10 20 CECD CCOC(=O)N1CC[C@@H](N[C@@H](C)c2c(O)cccc2F)C1 886594985 YFLNAKUOHLKVPZ-WDEREUQCSA-N 296.342 2.413 10 20 CECD C/C=C(/C)C(=O)NCCNCc1ccc(OC)c(C)c1 1125448989 CSUQAPVFFMWRTG-XGICHPGQSA-N 276.380 2.176 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C(=O)OC)[C@H]2C)c1 787421154 NYSXTZHEWFAARV-BXUZGUMPSA-N 293.363 2.174 10 20 CECD Cc1ccc(O)c(CN2[C@@H](C)[C@@H](C)N(C)C(=O)[C@H]2C)c1 895923621 XOCLTXMALAQZRI-FRRDWIJNSA-N 276.380 2.140 10 20 CECD COCC(C)(C)CNCc1cc(OC)ccc1O 277008307 XQAOTHBBFSWUNE-UHFFFAOYSA-N 253.342 2.163 10 20 CECD CCc1cccc(CNCCC(=O)NC(C)(C)C)c1O 691466593 OTJWGIRFGLMTRI-UHFFFAOYSA-N 278.396 2.349 10 20 CECD COCCOCCCCNCc1ccc2c(c1)CCO2 134005315 FKSUFCJNTULMKP-UHFFFAOYSA-N 279.380 2.154 10 20 CECD CCN1CCC[C@@H](N[C@@H](C)c2ccc(C)cc2O)C1=O 722361526 MUQVIBMPDBLDLI-GXTWGEPZSA-N 276.380 2.362 10 20 CECD CCCN(Cc1ccc(N(C)C)cc1)[C@H]1CCNC1 71314630 WWPYMRFUFFAMIP-INIZCTEOSA-N 261.413 2.327 10 20 CECD CCOc1cncc(NCc2ccc(OC)cc2O)n1 795285673 UFROAPMEEQOLEC-UHFFFAOYSA-N 275.308 2.202 10 20 CECD CC[C@H](NC(=O)NCc1ccc(N)cc1)[C@H]1CCCO1 1346406608 ZOELNQNNTMLDID-UONOGXRCSA-N 277.368 2.026 10 20 CECD CN1CCC[C@@H]1CNCc1ccc(N2CCCC2)cc1 221144751 BECVMLRYOIYFJZ-QGZVFWFLSA-N 273.424 2.471 10 20 CECD Cc1cc(Cl)cc(CN2CCOC[C@H]2CC(=O)O)c1O 1600218929 HBFYZGOJWDNLNB-GFCCVEGCSA-N 299.754 2.030 10 20 CECD Cc1oc(C(=O)O)cc1CNCc1c(O)cccc1F 1608037741 QZHKBUPFUAVUQG-UHFFFAOYSA-N 279.267 2.421 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](C)[C@@H]2CO)c1O 227057913 VBZBHVZEULKVDE-OTYXRUKQSA-N 297.782 2.451 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H]3CC[C@@H](C2)N3)c1O 229104753 WVQMGZRTUGUHOR-OLZOCXBDSA-N 296.798 2.381 10 20 CECD O=C(O)[C@H]1CC[C@@H](NCc2ccc3c(c2)CCO3)CC1 1119550015 ZJLCBVALHMTSGH-XBXGTLAGSA-N 275.348 2.355 10 20 CECD CN1CCC[C@@H](CCNCc2ccc3c(c2)CCO3)C1 839183312 WFAGAINRNUGRMD-AWEZNQCLSA-N 274.408 2.443 10 20 CECD CCc1cccc(CNCC2(OC)CCOCC2)c1O 848899445 OGBVOIUKHDLWJT-UHFFFAOYSA-N 279.380 2.240 10 20 CECD C[C@H](NC1CCN(C)CC1)c1ccc(N(C)C)cc1 37256071 XSOGTZLQMIJOIR-ZDUSSCGKSA-N 261.413 2.497 10 20 CECD CN(CC1(O)CCCC1)C(=O)Nc1ccc(N)cc1 161766574 HCGRUTZJXYUSGC-UHFFFAOYSA-N 263.341 2.038 10 20 CECD COc1cc(Cl)cc(CNCCN2CC=CCC2)c1O 279644865 DHZWZPVAHLQCIZ-UHFFFAOYSA-N 296.798 2.406 10 20 CECD C[C@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CCN1C 708505692 ZQGWNDQLLDRVFR-CABZTGNLSA-N 270.323 2.243 10 20 CECD CCC[C@H]1CN(C(=O)Nc2ccc(N)cc2)CCO1 709029841 OSXOHWUDMPIMNQ-ZDUSSCGKSA-N 263.341 2.302 10 20 CECD COc1cc(Cl)cc(CN2CCN[C@@H](C)[C@@H]2C)c1O 379436602 NIWQTQJGRBGFBX-UWVGGRQHSA-N 284.787 2.236 10 20 CECD COc1cccc(CN2C[C@H](CN)[C@@H](C)C[C@@H]2C)c1O 397356400 FQSAVTYNGXIMHO-OBJOEFQTSA-N 278.396 2.206 10 20 CECD CN(Cc1ccccc1O)C(=O)Nc1nnc2ccccn12 118024285 MQKQFDTUFPMVDK-UHFFFAOYSA-N 297.318 2.099 10 20 CECD CN(C)c1ccc(CN2CCC3(CC2)C[C@@H]3C(=O)O)cc1 405403798 STEPZEURFMOXLH-OAHLLOKOSA-N 288.391 2.439 10 20 CECD CCCCCN(CCO)Cc1cccc(OC)c1O 126887932 APEPFJKPGKXNBT-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CN1C(=O)/C(=C\c2ccc([N+](=O)[O-])s2)SC1=S 180764460 PLYLGQMVMGWHBA-GQCTYLIASA-N 286.359 2.487 10 20 CECD CCOCCN(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 313049580 UDAYYWPDAVDXAI-ALCCZGGFSA-N 294.307 2.165 10 20 CECD CCOC(=O)[C@H](NCc1cc(OC)ccc1O)[C@@H](C)CC 187865100 KZSYQQLQFCSVTC-XHDPSFHLSA-N 295.379 2.468 10 20 CECD C[C@@H](CC(F)(F)F)NC(=O)c1cccc(O)c1O 229418035 HOVHMQDJWIMTAF-LURJTMIESA-N 263.215 2.169 10 20 CECD CCN(CCOC)Cc1cc(F)cc(C(C)=O)c1O 49013392 IKZAHEFLGDRGRV-UHFFFAOYSA-N 269.316 2.202 10 20 CECD Cc1ccc([C@H](C)NCC(=O)NC(C)C)c(O)c1C 273402681 NRAIYCOIFJWSTP-LBPRGKRZSA-N 264.369 2.184 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](N(C)C)CC2)c1 277289804 AOEQITXWHDQBDS-CQSZACIVSA-N 278.396 2.317 10 20 CECD CNc1ccc(C(=O)N(C)Cc2ccc(N(C)C)cc2)cn1 278774689 XFNDZTABROTFPO-UHFFFAOYSA-N 298.390 2.462 10 20 CECD C[C@H](NCC1=CCN(C)CC1)c1cc([N+](=O)[O-])ccc1O 273502079 QHHQSXDOIWPELX-NSHDSACASA-N 291.351 2.213 10 20 CECD CC[C@H](NCCOCCO)c1cccc(Cl)c1O 286835618 DOSHRXCENRCLAR-LBPRGKRZSA-N 273.760 2.095 10 20 CECD COc1ccc(O)c(CN[C@H](c2nncn2C)C(C)C)c1 289644266 XRAYXTAEBCXZHB-AWEZNQCLSA-N 290.367 2.016 10 20 CECD O=C(N[C@H]1CCCC12CCOCC2)c1cccc(O)c1O 282466526 LAJJIUJZMZEBQK-ZDUSSCGKSA-N 291.347 2.177 10 20 CECD C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(O)cs1 807694566 MUTWFBFRGYSXIJ-QWRGUYRKSA-N 280.393 2.153 10 20 CECD COC[C@H](CO)N[C@@H](C)c1cc(Cl)cc(C)c1O 808718547 NRIMWCRNCKAJRQ-ONGXEEELSA-N 273.760 2.012 10 20 CECD CCO[C@H]1C[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 298792270 ZAMRMPLSTLFVHA-HOTGVXAUSA-N 288.391 2.328 10 20 CECD Oc1c(CNC[C@@H]2COCCO2)ccc2ccccc12 816536770 JMCSTHQTIJYNDB-CQSZACIVSA-N 273.332 2.050 10 20 CECD COc1cccc(O)c1CN1C[C@@H](CO)c2ccccc21 816637252 XXBANOJXCYBRLO-LBPRGKRZSA-N 285.343 2.497 10 20 CECD CC(C)OC(=O)[C@H](C)NCc1c(O)cccc1Cl 825118626 VWQOBLQLCKRZBF-VIFPVBQESA-N 271.744 2.475 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1ccon1 827962463 MKFXAFKUMNODIX-UHFFFAOYSA-N 287.363 2.298 10 20 CECD FC(F)C1CN(Cc2ccc(N3CCOCC3)cc2)C1 839137932 JRCASKNXHWEEKU-UHFFFAOYSA-N 282.334 2.220 10 20 CECD COc1ccc(N(CC(=O)NCC2CC2)CC2CC2)cc1 831582678 BRLKOQUBQRDTFV-UHFFFAOYSA-N 288.391 2.438 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H](C)c1cc(F)cc(F)c1O 834904858 SCQZTBUTFNDGCY-ZEGGKSINSA-N 287.306 2.125 10 20 CECD CN(CCO)c1ccc(N[C@H]2CCc3cccc(O)c32)nc1 834729610 IJRBQCGZMCUPFT-AWEZNQCLSA-N 299.374 2.315 10 20 CECD COc1cccc(CN(CCC(=O)O)CC(C)C)c1O 833735037 AZDOJSNOFPYVAR-UHFFFAOYSA-N 281.352 2.334 10 20 CECD CNC[C@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 843349210 LWWHZPSTGCLNFI-LLVKDONJSA-N 296.798 2.290 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2CC(=O)N(C3CC3)C2)c(O)c1 846204641 AGNYHRXPPZXHBT-OLZOCXBDSA-N 288.391 2.362 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@H]2CCOC2)c1 740082110 LQKDCRBOJFQZET-GHMZBOCLSA-N 279.336 2.005 10 20 CECD CCCN(Cc1cccc(F)c1O)C1CCNCC1 843044024 AAFQSBUTFNQETD-UHFFFAOYSA-N 266.360 2.495 10 20 CECD CCc1cccc(CN[C@H]2C[C@@H]3CCCCN3C2=O)c1O 848914352 IBEBOBUKRCEBOM-GJZGRUSLSA-N 288.391 2.198 10 20 CECD NCC[C@H](NCc1cc(Cl)cc(F)c1O)C(F)F 841073643 IZIAJOFLIULCTA-VIFPVBQESA-N 282.693 2.257 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](O)C(F)(F)F 840930634 NGGLNOKXZLHILX-LBPRGKRZSA-N 276.302 2.074 10 20 CECD CCc1cccc(CN[C@H](COC)[C@H]2CCCO2)c1O 848907175 JTHKVJTYKUOKLX-HUUCEWRRSA-N 279.380 2.238 10 20 CECD C[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)CCN1 841061417 IRQSLNRGSIBEKO-DGCLKSJQSA-N 265.376 2.122 10 20 CECD CCN1C(=O)/C(=C\c2c[nH]c(C(=O)OC)c2)SC1=S 753134903 ZFDRQLWOVLLDAB-WEVVVXLNSA-N 296.373 2.022 10 20 CECD CCCCN(CCc1cnn[nH]1)Cc1ccccc1O 852019065 UIEQMSPDBDGIEQ-UHFFFAOYSA-N 274.368 2.355 10 20 CECD O[C@H](CNCCCSc1nccs1)c1ccccn1 853097668 AMLQATXTIYVPIE-GFCCVEGCSA-N 295.433 2.344 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2C[C@]2(C)OC)c1 694413813 APEYSDMXKZIUND-FZQKWOKYSA-N 251.326 2.229 10 20 CECD COC(=O)[C@@H]1CN(Cc2ccc(C)cc2O)C[C@H]1C1CC1 877617268 UUZJKVIXXORINC-LSDHHAIUSA-N 289.375 2.332 10 20 CECD CO[C@H]1CCC[C@@H]1CNC(=O)N(C)Cc1ccccc1O 775459901 PKJZEIWQOHNXOY-DOMZBBRYSA-N 292.379 2.349 10 20 CECD CCN(CCCO)Cc1ccc(N(C)CC)cc1 773754787 NWHTYUSZUSXDTP-UHFFFAOYSA-N 250.386 2.347 10 20 CECD Cc1ccc(CN[C@H]2CN(C3CC3)C[C@H]2C)c(O)c1 877095207 PPRXNXLFSDBKMB-DOMZBBRYSA-N 260.381 2.273 10 20 CECD C[C@H](C(=O)N(C)c1ccc(N)cc1)N1CCCCCC1 877077620 OXPPPHSWDHJBKF-CYBMUJFWSA-N 275.396 2.496 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)c1O 887044133 GKABQVGBGCLZJJ-LKTVYLICSA-N 293.338 2.079 10 20 CECD Cc1nc([C@H](C)NCc2cc(Cl)cc(F)c2O)n[nH]1 894771976 CLDPKSPJQDJODN-LURJTMIESA-N 284.722 2.462 10 20 CECD CN(C)c1ccc([C@H](CNCc2cc[nH]c2)N(C)C)cc1 898450071 MQLCIMKZCJQLMQ-KRWDZBQOSA-N 286.423 2.473 10 20 CECD COc1cccc(O)c1CN1CCC[C@](C)(O)CC1 793245915 DAWRMCQTXGWQQM-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CCO[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1 708402171 VDOJYVMIZHZEMO-NSHDSACASA-N 257.280 2.281 10 20 CECD Cn1nc([C@@H]2CCCO2)cc1NC(=O)c1cc(O)cs1 791013068 RYGJUTWKUDCKED-JTQLQIEISA-N 293.348 2.291 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@H](C)c1ccccc1O 760884212 FIXNYMICFTWSDV-UXIGCNINSA-N 265.353 2.237 10 20 CECD CCCC1(C(=O)NCCc2ccc(O)c(O)c2)CC1 762275543 UKLXEBVTDLQMQZ-UHFFFAOYSA-N 263.337 2.337 10 20 CECD CS[C@H]1CC[C@@H](NC(=O)NCc2ccc(N)cc2)C1 1336841916 ZDYRQXDVOSWCOD-OLZOCXBDSA-N 279.409 2.352 10 20 CECD CCN(C)c1ccc(CNc2cc(N)ncn2)cc1F 1548511814 IDKZUGKACKNTQD-UHFFFAOYSA-N 275.331 2.266 10 20 CECD COC[C@H](CN[C@H](C)c1ccc(C)cc1O)OC 230672255 WHVWBJBMGHMEKN-NEPJUHHUSA-N 253.342 2.013 10 20 CECD CC(C)(C)CC[C@H](NC(=O)c1cc(O)cs1)C(=O)O 1588648914 SHTFNPFSZOTLHR-VIFPVBQESA-N 285.365 2.463 10 20 CECD O=C(O)[C@@]1(C(=O)N2Cc3cccc(O)c3C2)CC=CCC1 1594851987 OBAQWKOMERXPNH-INIZCTEOSA-N 287.315 2.046 10 20 CECD O=C(O)c1cccnc1N1Cc2cccc(O)c2C1 1595260484 HQFBIAHWKYIIDL-UHFFFAOYSA-N 256.261 2.006 10 20 CECD CN(C)c1ccc(CNCCNC(=O)OC(C)(C)C)cc1 134522142 CJCSIZPCBOBNGM-UHFFFAOYSA-N 293.411 2.367 10 20 CECD CC[C@H](C)N1CCN(Cc2c(O)cccc2OC)CC1 825098352 HJSYLISPVXYLCB-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD c1cc2c(cc1CN[C@@H]1CC[C@H]3CNC[C@H]3C1)CCO2 843341592 VSBSIHJELQFTLA-ARFHVFGLSA-N 272.392 2.099 10 20 CECD Cc1cc(CO)cc(N(C)Cc2ccccc2O)n1 853462498 WKMDSBQUXJLDHA-UHFFFAOYSA-N 258.321 2.224 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)[C@@H](O)C(F)(F)F 865711813 RBBUYFJXUDIPQW-QUBYGPBYSA-N 283.677 2.447 10 20 CECD C[C@H]1CCC[C@@]1(O)CNCc1cc(F)ccc1O 293951513 IUQOZPNDBNFQRZ-IINYFYTJSA-N 253.317 2.172 10 20 CECD CN(C)c1ccc(CNC(=O)c2cncc(Cl)n2)cc1 188888476 QIPPYALYMHBWJM-UHFFFAOYSA-N 290.754 2.126 10 20 CECD COc1ccc(CNC(C)(C)CN(C)C)cc1C 308610776 YLYXOMOJKZSZDC-UHFFFAOYSA-N 250.386 2.433 10 20 CECD O=C(COc1ccccc1F)NCc1ccccc1O 701130290 PLBBNBJCQNGQLO-UHFFFAOYSA-N 275.279 2.227 10 20 CECD CCc1cccc(CNCC[C@@H](C)CCO)c1O 709418259 QRJCFMZPCKZELI-GFCCVEGCSA-N 251.370 2.453 10 20 CECD COc1cccc(O)c1CN[C@@H]1C[C@H]1C(F)(F)F 865754199 UHUSGZKBMQXOKU-RKDXNWHRSA-N 261.243 2.441 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)NC2CC2)cc1 172876270 VPMCCXKCEVLCDH-UHFFFAOYSA-N 289.423 2.243 10 20 CECD Oc1ccccc1CN1CCN(Cc2ccccn2)CC1 179554556 QQURYUJJCIZUPJ-UHFFFAOYSA-N 283.375 2.105 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CCCO1 75159510 ZREAFXIGHXBWPC-HNNXBMFYSA-N 275.348 2.066 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NCCc2ccncc2)o1 1537963167 XXUQSDPXFRNPEE-UHFFFAOYSA-N 271.280 2.457 10 20 CECD CO[C@@H](C)CNCc1cc(Cl)cc([N+](=O)[O-])c1O 191147749 COGZUURQHZEPPV-ZETCQYMHSA-N 274.704 2.078 10 20 CECD CN(C)c1ccc(CN(CC(N)=O)Cc2ccccc2)cc1 93358375 FZIPBBZEBJMNSF-UHFFFAOYSA-N 297.402 2.240 10 20 CECD Cc1ccc(O)c(CNCCc2cn3c(n2)SCC3)c1 274270346 QPTXZBNBOQXHOX-UHFFFAOYSA-N 289.404 2.335 10 20 CECD CCN(CC)c1ccc(CN2C(=O)NC3(CC3)C2=O)cc1 272217110 HDPZNKMOYBDMFL-UHFFFAOYSA-N 287.363 2.117 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H](COC)OC)cc1 272642453 CXSHJFBFPAHGRT-CJNGLKHVSA-N 280.412 2.455 10 20 CECD COc1cc(Cl)cc([C@H]2NC(=O)CN2CC(C)C)c1O 273477895 IDUNZAIJGPXMNO-AWEZNQCLSA-N 298.770 2.141 10 20 CECD C[C@H](NCCN1CCCCC1)c1cc([N+](=O)[O-])ccc1O 273301116 BJEMSLIYRFGLEB-LBPRGKRZSA-N 293.367 2.437 10 20 CECD CN(Cc1ccccc1O)C(=O)OC[C@@H]1CCCO1 288267419 UJSXYTADTJTBAR-LBPRGKRZSA-N 265.309 2.140 10 20 CECD C[C@@H]1COCC[C@@H]1CNCc1ccc2c(c1)CCO2 285556851 REKRXFKRERLNLW-IUODEOHRSA-N 261.365 2.384 10 20 CECD N[C@H]1CC=C(C(=O)N2CCN(CC3CC3)c3ccccc32)C1 638129199 WHMGZBFCFQCAEH-HNNXBMFYSA-N 297.402 2.297 10 20 CECD CC(C)c1ncncc1C(=O)NCc1ccc(N)cc1 297309862 WCRZKAXURIZBIR-UHFFFAOYSA-N 270.336 2.112 10 20 CECD CCNC(=O)[C@H](C)N[C@H](C)c1c(C)cc(C)cc1O 293677661 KDZAZHUYONOCTP-NEPJUHHUSA-N 264.369 2.184 10 20 CECD CN(C)C(=O)CCN(Cc1ccc(N(C)C)cc1)C1CC1 299191735 FCVFHCZTQXYWPO-UHFFFAOYSA-N 289.423 2.195 10 20 CECD COC1([C@H](C)NCc2cc(F)ccc2O)CCOCC1 817419274 FCQKFVIDKSBUNV-NSHDSACASA-N 283.343 2.205 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC1SCCS1 823411885 ZNHVCTGZLNMXDF-UHFFFAOYSA-N 298.433 2.340 10 20 CECD O=C(OCc1nc(-c2ccco2)no1)c1cc(O)cs1 732354241 QFOUGTNGEUABJC-UHFFFAOYSA-N 292.272 2.454 10 20 CECD CCOCC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 839916534 VDLBVHUQOZIDBW-CYBMUJFWSA-N 278.396 2.145 10 20 CECD C[C@@H](NC[C@@]1(C)CCC(=O)N1)c1cc(Cl)ccc1O 834909565 SKKQPOAJKCSXLN-YMTOWFKASA-N 282.771 2.365 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@H]1CCc2cccc(O)c21 834880486 FWTIHGWCBOWIKO-VNHYZAJKSA-N 277.364 2.021 10 20 CECD COc1ccc(N(CC2CC2)CC2OCCO2)cc1 831587526 DBFKXWQXHUHISS-UHFFFAOYSA-N 263.337 2.285 10 20 CECD CCN1C[C@H](N[C@@H](C)c2cc(Cl)ccc2O)CC1=O 834889843 KJARNAGQNIVOOI-GXSJLCMTSA-N 282.771 2.317 10 20 CECD CCN(CC(=O)Nc1cc(C)on1)c1ccc(OC)cc1 746109171 LHCXTGKYBFITIX-UHFFFAOYSA-N 289.335 2.457 10 20 CECD CCN(C)C(=O)[C@@H](C)NCc1ccc(N(C)C)cc1C 840941883 PHRDEJIHAFHTIH-CYBMUJFWSA-N 277.412 2.017 10 20 CECD C[C@H](N)C[C@H](C)NCc1cccc(Br)c1O 843129935 UXUMSKDFABPWLG-IUCAKERBSA-N 287.201 2.370 10 20 CECD CN(Cc1cccc(F)c1O)C1CCC(N)CC1 843055938 SIPLYDMFQRHYBC-UHFFFAOYSA-N 252.333 2.233 10 20 CECD CCN(CC)c1ccc(CN2CCNC[C@@H]2C)cc1 843048357 ZXLCXGCQFUVJHB-AWEZNQCLSA-N 261.413 2.327 10 20 CECD Cc1ccc(C(=O)N(C)C[Si](C)(C)C)c(O)c1O 911727210 NURHIJPELBSEII-UHFFFAOYSA-N 267.401 2.356 10 20 CECD C[C@@H](C[C@@H](O)c1ccco1)NC(=O)Nc1ccc(N)cc1 841299145 GLAMLYIVMDBKGD-GXFFZTMASA-N 289.335 2.496 10 20 CECD C[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)CC(C)(C)C1 841087310 UJMNOJPCXVPHJJ-NSHDSACASA-N 289.379 2.102 10 20 CECD Nc1ccc(NC(=O)NCC[C@@]2(O)C[C@H]3CC[C@H]2C3)cc1 841298408 CSAULKLKYOOGBA-MQIPJXDCSA-N 289.379 2.332 10 20 CECD COc1cccc([C@@H](C)N[C@H](CO)CC2CC2)c1O 846157378 MARSSZCLNNVSBG-PWSUYJOCSA-N 265.353 2.212 10 20 CECD COc1cc(O)c(CN[C@@H](C)COCC2CC2)cc1OC 846072441 GODNDUAOYNPQBA-NSHDSACASA-N 295.379 2.314 10 20 CECD CSCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756351442 LBHGHTFTBDQZEZ-QMMMGPOBSA-N 256.327 2.314 10 20 CECD CC[C@H](NC(=O)c1cc(O)cs1)[C@@H]1CCCO1 756809834 RXSKXLCGRLVOOJ-UWVGGRQHSA-N 255.339 2.141 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1ncc[nH]1 857507954 KMTCKOGBVOTHHD-UHFFFAOYSA-N 286.118 2.352 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cn(C)nc1C(F)F 755178538 MAGAQIAQDOCHRT-UHFFFAOYSA-N 295.289 2.336 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H]3CCC[C@]3(N)C2)c1O 857085806 HTKUGHLCKXYJLU-WBMJQRKESA-N 292.354 2.047 10 20 CECD CC(C)[C@@H]1C[C@@H](C(=O)NCc2ccccc2O)CCO1 934936693 WDINKYMRGTZPAS-WFASDCNBSA-N 277.364 2.460 10 20 CECD COCCOC1CN(Cc2ccc(N3CCCC3)cc2)C1 1117814123 VGBHCMJIVFBWQU-UHFFFAOYSA-N 290.407 2.134 10 20 CECD CCN(C)c1ccc(Cn2cc(CN3CCCC3)nn2)cc1 881313366 KEMCORJNFVHOEQ-UHFFFAOYSA-N 299.422 2.378 10 20 CECD C[C@H](CC[S@](C)=O)N[C@H](C)c1c(O)cccc1F 886551202 DJSQZKRYLPAPMP-MHNGPXOMSA-N 273.373 2.339 10 20 CECD CN(Cc1cnc(N)s1)c1ccc2c(c1)OCO2 780778425 IIQPQARCPUKBEZ-UHFFFAOYSA-N 263.322 2.090 10 20 CECD CC(=O)Nc1nc(CN(C)Cc2ccccc2O)cs1 109770992 UCVHISAUNLYBCQ-UHFFFAOYSA-N 291.376 2.439 10 20 CECD COC(=O)[C@](C)(NCc1ccc(N(C)C)cc1)C1CC1 785767351 YWVSIFXRHFOVAG-MRXNPFEDSA-N 276.380 2.184 10 20 CECD COc1ccc(CNC[C@@H]2CCC[C@H]2OC)c(O)c1OC 893285325 NATCHUWBJIPYSX-WCQYABFASA-N 295.379 2.314 10 20 CECD OCCc1ccc(CNCc2cc(F)ccc2O)cc1 898170474 HCFHGMMRENPRQK-UHFFFAOYSA-N 275.323 2.356 10 20 CECD CO[C@@H](C)CCC(=O)NCc1ccc(N(C)C)cc1C 782296789 PBMUQLTWFRYQOQ-ZDUSSCGKSA-N 278.396 2.492 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cccc(C)c2O)[C@H]1C 787420885 LZZBEXWNEDRLAL-WCQYABFASA-N 263.337 2.084 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](C)[S@@](=O)CC2)c1O 894568012 VAIBMKFWDAWDQT-ODXCJYRJSA-N 297.420 2.052 10 20 CECD COc1cc(C)cc(CN2CC(OCC(F)F)C2)c1O 894976569 SNMQLLQAWOFQSP-UHFFFAOYSA-N 287.306 2.175 10 20 CECD O=C(N[C@H]1CCCc2occc21)c1cccc(O)c1O 186882735 RWIQILIFYAWJPI-NSHDSACASA-N 273.288 2.498 10 20 CECD C[C@@H](C[C@@H](C)O)NCc1c(O)cccc1Br 706871594 LOTYYSWAMJNLBA-DTWKUNHWSA-N 288.185 2.404 10 20 CECD Cc1cc(CNCc2ccc(Br)cc2O)n[nH]1 716457918 DSMYEKRECSDHJT-UHFFFAOYSA-N 296.168 2.476 10 20 CECD Cc1ccc(O)c(CNCc2cccc(C(N)=O)c2)c1 71407153 HHNATCZMIXADSJ-UHFFFAOYSA-N 270.332 2.089 10 20 CECD O=C(O)[C@H](CC1CC1)NCc1cc(F)cc(F)c1O 1331983320 RPTOYWGMOXBACM-NSHDSACASA-N 271.263 2.013 10 20 CECD CC[C@@H](F)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 1514664255 SMEXSNSUJWOEHP-CABCVRRESA-N 295.402 2.220 10 20 CECD CO[C@H](C)[C@H](C)N[C@H](C)c1cc(C(=O)O)ccc1O 1606666630 OBGRDSYFTVYDON-IVZWLZJFSA-N 267.325 2.164 10 20 CECD CC1(C)OC[C@H](CCN2CCCc3cc(CN)ccc32)O1 1576494863 GUNCBBSQOKQHAP-HNNXBMFYSA-N 290.407 2.440 10 20 CECD Cc1nc(Cl)ccc1CC(=O)NCc1ccc(N)cc1 1579861273 NDZWWIDHUQVTPA-UHFFFAOYSA-N 289.766 2.485 10 20 CECD Nc1ccc(CNCc2ccc3c[nH]nc3c2)cc1 1580446668 DNTYVQXHMNWWRU-UHFFFAOYSA-N 252.321 2.435 10 20 CECD N[C@@H]1CCC[C@@H](NC(=O)NCc2cccc(Cl)c2O)C1 1580176685 QBJFVDJJFZYHBE-GHMZBOCLSA-N 297.786 2.115 10 20 CECD O=C(O)CCCCNCc1cc(F)c(F)cc1O 1595046155 YJQDJYRAEMBFSY-UHFFFAOYSA-N 259.252 2.015 10 20 CECD C[C@H]1CCC[C@@]1(NCc1ccc(N(C)C)cc1)C(=O)O 1776639606 MOGZYFGAQIYOQR-LRDDRELGSA-N 276.380 2.486 10 20 CECD CCCN(Cc1n[nH]c(CC)n1)Cc1ccccc1O 158750156 ABONNPZCJFWFJI-UHFFFAOYSA-N 274.368 2.485 10 20 CECD CC[C@H]1COCCN1Cc1cc(OC)c(OC)cc1O 160232724 VCKQKQKVFCEYOA-LBPRGKRZSA-N 281.352 2.020 10 20 CECD Nc1ccc(CCNC(=O)C2[C@@H]3[C@@H]2[C@@H]2CC[C@@H]3C2)cc1 152547695 TVEQSYVZAXUBSE-UXOAXIEHSA-N 270.376 2.220 10 20 CECD CC(C)n1cccc1C(=O)NCCc1ccc(O)c(O)c1 159818225 ZJAJAQXPJCFIDY-UHFFFAOYSA-N 288.347 2.453 10 20 CECD Cc1cccc(CNC(=O)Cc2ccc(N)cc2)c1 20185653 KCIFYHASAATBDD-UHFFFAOYSA-N 254.333 2.436 10 20 CECD CC(C)c1ocnc1C(=O)NCc1ccc(N)cc1 837303248 BLBGSGGPDUGCTR-UHFFFAOYSA-N 259.309 2.310 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)[C@@H](C(=O)O)C1 846279448 AFEAYCMOYVVALN-SWLSCSKDSA-N 276.380 2.438 10 20 CECD C[C@@H](NCc1cc(Cl)ccc1O)[C@@H](O)C(F)(F)F 865711812 RBBUYFJXUDIPQW-LHLIQPBNSA-N 283.677 2.447 10 20 CECD C[C@@H](Cc1cnn(C)c1)NCc1cc(F)cc(F)c1O 883136331 ZWDLZLICNMLUCL-VIFPVBQESA-N 281.306 2.125 10 20 CECD CCN(CC)c1ccc(CNCC[C@@H](O)COC)cc1 153718097 BMPAASJETNVFEQ-MRXNPFEDSA-N 280.412 2.020 10 20 CECD CN(CCC1CCOCC1)C(=O)Cc1ccc(N)cc1 262619523 MZUWVGCPLCYVNU-UHFFFAOYSA-N 276.380 2.086 10 20 CECD Cc1ccc(O)c([C@H](C)NCC(=O)NCC(F)(F)F)c1 185179282 VCEVUBMOSAKCIS-VIFPVBQESA-N 290.285 2.030 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@H]3CNC[C@@H]3C2)cc1 401022543 RSGJKRMLGVWNQH-HRCADAONSA-N 273.424 2.230 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H]1CC(=O)N(C)C1 380674852 XVYPNWMPHGOVIA-GRYCIOLGSA-N 274.364 2.069 10 20 CECD COc1cccc(CN[C@H](C)[C@H](OC)C2CC2)c1O 388240154 QJRJWVJHONMUFP-BMIGLBTASA-N 265.353 2.304 10 20 CECD CC[C@](C)(O)CNCc1ccc(N(C)C)c(F)c1 113339279 QUKBEVHOQZYOLW-AWEZNQCLSA-N 254.349 2.142 10 20 CECD COCCCCCNC(=O)NCc1ccc(N(C)C)cc1 58515745 IFBKZWSAYJDKAR-UHFFFAOYSA-N 293.411 2.369 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)Nc1cccnn1 178247536 MQOSECOJRGQHJO-UHFFFAOYSA-N 297.362 2.399 10 20 CECD CCOC(=O)N1CCCN(Cc2cccc(C)c2O)CC1 179930141 LPNQVXZIUHSVQM-UHFFFAOYSA-N 292.379 2.365 10 20 CECD COC[C@H]1CN(Cc2c(O)ccc3ccccc23)CCO1 172922337 UOEXMRRCNPGJIP-CQSZACIVSA-N 287.359 2.393 10 20 CECD CC[C@H](OC)C(=O)N(C)Cc1ccc(N(C)C)cc1 68178900 LIUNPPWBXPFFBD-AWEZNQCLSA-N 264.369 2.136 10 20 CECD CN(Cc1ccccc1O)Cc1cnn(C)c1Cl 816492740 AVNNCPMHFKCYPA-UHFFFAOYSA-N 265.744 2.411 10 20 CECD C[S@](=O)c1ccc(NC(=O)c2cccc(O)c2O)cc1 185738855 FVLVFDZTBUBTHF-FQEVSTJZSA-N 291.328 2.088 10 20 CECD COc1ccc(CNC[C@@](C)(O)CSC)cc1C 217861979 WUHNSYBMVJEDRG-CQSZACIVSA-N 269.410 2.207 10 20 CECD Cc1nn(C)cc1CN(C)c1ccc2c(c1)OCO2 180759902 DHVXOSGDNHXMCQ-UHFFFAOYSA-N 259.309 2.094 10 20 CECD COc1cccc(CNC[C@H](O)Cc2ccccc2)c1O 237213130 LLNVDHNIAQKQJK-OAHLLOKOSA-N 287.359 2.094 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)CC1CC1 266344673 NJMNFYFDKOJPMH-UHFFFAOYSA-N 260.337 2.278 10 20 CECD CC(C)c1ncncc1C(=O)NCCc1ccc(N)cc1 262588698 XZZWFYDUDDMSHJ-UHFFFAOYSA-N 284.363 2.155 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@@H]1[C@H](O)C(F)(F)F 272214346 AZXDYLMBUQEZTF-PWSUYJOCSA-N 293.260 2.419 10 20 CECD CN1CC[C@H]2CCN(Cc3cccc(F)c3O)[C@H]2C1 272259468 AMCHDPVRHSUXIO-FZMZJTMJSA-N 264.344 2.057 10 20 CECD CC[C@H](N[C@@H](CO)COC)c1cccc(Cl)c1O 286942134 GXZDHJFYZOHUCY-CABZTGNLSA-N 273.760 2.094 10 20 CECD C[C@@H](N[C@H]1CCCNC1)c1cc(F)cc(F)c1O 817942491 ZZWDYNHNNAVDCA-SCZZXKLOSA-N 256.296 2.073 10 20 CECD Cc1c[nH]nc1CN(C)c1ccc(OCCN(C)C)cc1 811490841 XOSBHRATNIPLOQ-UHFFFAOYSA-N 288.395 2.295 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCC[C@@H](C)OC)c1 729053492 JJABRAUNPPVWCT-GHMZBOCLSA-N 296.367 2.186 10 20 CECD CCOc1cccc(CN[C@@H](C)Cc2cnn(C)c2)c1O 825046957 ZTHLCRWRIXSZMF-LBPRGKRZSA-N 289.379 2.245 10 20 CECD Cc1cc(O)c(CNCCc2cnn(C)c2)cc1Cl 825131311 LSRDKHUNOPBCMM-UHFFFAOYSA-N 279.771 2.420 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H](C)OC 821468936 FHLXTLSDGHFMDV-ZDUSSCGKSA-N 293.411 2.319 10 20 CECD O=C(/C=C/c1cncc(F)c1)N1CCc2ccncc21 492471124 HKZAJRCFKGKXLD-OWOJBTEDSA-N 269.279 2.218 10 20 CECD COc1ccc(N(C)C(=O)/C=C/c2cccnc2)nc1 492592235 IMYZRCXKZAFVIC-VMPITWQZSA-N 269.304 2.161 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)c2cccs2)cc1 832292339 FYXUITTVSACVGB-CYBMUJFWSA-N 289.404 2.244 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@@H]1CCC[C@H]1O 835080136 LNNGMUSAFBJUMU-MWLCHTKSSA-N 259.708 2.188 10 20 CECD CN(C)c1ccc(/C=C/CN2CCC[C@H]2C(=O)O)cc1 840995598 XTFHROFFGGBTIW-UJAVWCLSSA-N 274.364 2.315 10 20 CECD CC[C@H](NCc1cc(Cl)c(F)cc1O)C(=O)O 843040284 UBUMHWKZHAIRNP-VIFPVBQESA-N 261.680 2.138 10 20 CECD CCOc1ccc(O)c(CN(C[C@@H](C)O)C2CC2)c1 848928850 PJRZZCOJZCLZFQ-LLVKDONJSA-N 265.353 2.136 10 20 CECD CC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H](O)C(C)C 840525344 NGEPOQHAPCOULO-GKHPIFKOSA-N 293.363 2.023 10 20 CECD CN(C[C@H]1CCCCO1)C(=O)NCCc1ccc(N)cc1 841962033 LVTJUOVGNFTLMR-OAHLLOKOSA-N 291.395 2.022 10 20 CECD C[C@@H]1CN(C2CC2)C[C@@H]1NCc1ccc(N(C)C)cc1 757708299 XIFJWPXWXXECMG-DYVFJYSZSA-N 273.424 2.325 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H]2[C@@H](C)O)cc1 852557986 DKGHQKRJMIVTTO-CZUORRHYSA-N 262.397 2.488 10 20 CECD Cc1ccc(C(=O)NC[C@H]2CCCCS2)c(O)c1O 752798223 QEJLICSGHZYEJG-SNVBAGLBSA-N 281.377 2.422 10 20 CECD CC[C@H](NCC(=O)NCc1ccc(N(C)C)cc1)C1CC1 852555379 SIIQOOLYCHBLIX-INIZCTEOSA-N 289.423 2.147 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CSC[C@H]2C)c1 858450059 YFXZFQIBNLEAEE-ZYHUDNBSSA-N 280.393 2.251 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCC[C@@H]([S@](C)=O)C2)c1 850355815 LUWVGKPCTXOIEG-LPMFXHHGSA-N 281.421 2.480 10 20 CECD C[C@@H](NC(=O)N[C@H]1CC12CCOCC2)c1ccccc1O 868677020 VYBBAMHMRCOFFE-RISCZKNCSA-N 290.363 2.322 10 20 CECD CC[C@@H](C)CN(C)Cc1cc2c(cc1O)OC[C@@H]2O 768444404 AUOSGEKOHYULEF-YGRLFVJLSA-N 265.353 2.296 10 20 CECD Cc1cccc(-n2c(C)cc(CNC(=O)[C@@H](C)O)c2C)c1 863161572 GTWNLSANCVMKJG-CQSZACIVSA-N 286.375 2.400 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCO[C@@H](C)C2)c1 862757400 SNCGURWBWBQXTL-NWDGAFQWSA-N 263.337 2.132 10 20 CECD Cc1ccc(O)c(CN(C)Cc2cccc(C(N)=O)c2)c1 768925252 AIIHVEOPJJWUCZ-UHFFFAOYSA-N 284.359 2.432 10 20 CECD CNC(=O)OC[C@@H]1CCCCN1Cc1ccc(C)cc1O 877533247 OHGLGHNMCKRYCG-AWEZNQCLSA-N 292.379 2.411 10 20 CECD Cc1cccc(O)c1CN1CCC(F)(F)[C@H](CO)C1 877540729 ATOMAAHZASQIIZ-NSHDSACASA-N 271.307 2.150 10 20 CECD C[C@H](NC(=O)NC[C@H]1CCCO1)c1ccc(N(C)C)cc1 774018184 RINJIGCLTFQTIC-SWLSCSKDSA-N 291.395 2.292 10 20 CECD CN(C)c1nccc(CNCc2cc(Cl)ccc2O)n1 776495905 FADPHZCLIBJVCO-UHFFFAOYSA-N 292.770 2.191 10 20 CECD CCOC(=O)C1(CNCc2cc(C)c(C)cc2O)CC1 770665546 MJXSAHUDFRPPKI-UHFFFAOYSA-N 277.364 2.442 10 20 CECD Cc1ccc(C(=O)N(C)Cc2ccoc2)c(O)c1O 780905618 VJZQYWOQLORGMM-UHFFFAOYSA-N 261.277 2.271 10 20 CECD CC[C@H](NCCCn1cncn1)c1ccc(F)cc1O 796875316 XZOWPMJBXDTXOT-ZDUSSCGKSA-N 278.331 2.254 10 20 CECD CC[C@@H](C)[C@@H](OC)C(=O)NCc1ccc(OC)cc1O 794382489 XUVBZMQMLNTWEZ-QMTHXVAHSA-N 281.352 2.078 10 20 CECD CC[C@H](NC[C@H](C)S(C)(=O)=O)c1ccc(F)cc1O 796849805 WJWJTHNXMOAIQJ-CABZTGNLSA-N 289.372 2.005 10 20 CECD COc1ccc(CNC(=O)C[C@H]2C=CCC2)c(O)c1 794378868 XIPQIEGXZNMJFF-NSHDSACASA-N 261.321 2.373 10 20 CECD COc1cc(CN2CCC[C@](C)(O)CC2)c(O)cc1C 794666937 LSXWOOOEOZYALH-INIZCTEOSA-N 279.380 2.446 10 20 CECD COc1cc(C)cc(CN2CC[C@@](O)(C3CC3)C2)c1O 1332003921 IBODIMDJLXSMNX-INIZCTEOSA-N 277.364 2.056 10 20 CECD Oc1ccc(F)cc1CNC[C@H]1CCN(C2CC2)C1 226584539 XKPKCSLBUWOYIG-LLVKDONJSA-N 264.344 2.105 10 20 CECD CN1CCCc2cc(CN[C@H]3CC[C@H](C(=O)O)C3)ccc21 1606230089 PWGGUBGKEJPCJK-GJZGRUSLSA-N 288.391 2.412 10 20 CECD Nc1ccc(NC(=O)N[C@H](CC(=O)O)C2CCCC2)cc1 1601216899 VEUARAMWBDWTJF-CYBMUJFWSA-N 291.351 2.424 10 20 CECD CC(C)c1ccc(O)c(CNCC2[C@H]3CNC[C@H]23)c1 1575859022 YFNZQDZVMFPCDL-HUUCEWRRSA-N 260.381 2.071 10 20 CECD O=C(CC[C@H]1CCCCO1)NCc1ccccc1O 134524563 DLXIENVOKQYFLP-CYBMUJFWSA-N 263.337 2.358 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C[C@H]1CCCN1 154143929 CXPOFBHJPMNYQR-CQSZACIVSA-N 276.380 2.273 10 20 CECD COc1ccc(CN[C@@H](C)Cn2ccnc2)cc1C 35275342 FOPXPUCQYRXFDR-ZDUSSCGKSA-N 259.353 2.378 10 20 CECD COc1ccc(CNCC2([S@](C)=O)CCC2)cc1C 280626425 LOZAGSUSPPDLAE-IBGZPJMESA-N 281.421 2.394 10 20 CECD C[S@](=O)C1(CNCc2c(O)cccc2Cl)CC1 282268476 HMUAJHDZXOBZRD-KRWDZBQOSA-N 273.785 2.046 10 20 CECD Nc1ccc(NC(=O)NCCC[C@H]2CCOC2)cc1 402134607 KHBAPXIJNVMJNA-NSHDSACASA-N 263.341 2.207 10 20 CECD CN(C(=O)[C@@H]1CC12CCOCC2)c1ccc(N)cc1 709684340 BBWOJOYMTCVTLG-ZDUSSCGKSA-N 260.337 2.048 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN[C@@H]1CC[C@H]1O 378745546 RFFXCVZTALTCQU-NXEZZACHSA-N 262.136 2.312 10 20 CECD CCc1cccc(CN[C@H](CO)CC(F)(F)F)c1O 717734860 IEASBAUTZFAHCG-NSHDSACASA-N 277.286 2.358 10 20 CECD CC[C@@]1(NCc2cccc(OC)c2O)CCOC1 386009512 UIOKKZBCYGDFSA-CQSZACIVSA-N 251.326 2.060 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H](N)C1CCCCC1 1326277090 IJDPHDJTUIJXJQ-OAHLLOKOSA-N 276.380 2.258 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)Nc2nnn[nH]2)c1C 102894919 BJKQXLLUJUHFRP-UHFFFAOYSA-N 296.334 2.168 10 20 CECD COc1cccc(CNC(=O)c2cnc(C)s2)c1O 171486691 DMKGTSAYIMJLLB-UHFFFAOYSA-N 278.333 2.096 10 20 CECD CCc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)[nH]n1 123962075 WADLMUFRAIAOIX-UHFFFAOYSA-N 298.390 2.285 10 20 CECD CC[C@@H](COC)N[C@@H](C)c1cc(OC)ccc1O 79735684 LUYKQNIJVVZYDG-QWRGUYRKSA-N 253.342 2.476 10 20 CECD Cc1nc2ncnn2c(N(C)Cc2ccccc2O)c1C 89635438 YCUQKDHHWJXBFA-UHFFFAOYSA-N 283.335 2.083 10 20 CECD C[C@@H](NC[C@H]1CCCN1C)c1ccc(F)c(F)c1O 191221982 CIYKXKNFNWCAAV-NXEZZACHSA-N 270.323 2.415 10 20 CECD CCCOc1ccc(CN2C[C@@H]3CN(C)C[C@@H]3C2)c(O)c1 194538529 LZTUYEQCJBCXRX-GASCZTMLSA-N 290.407 2.174 10 20 CECD Cc1ccc(O)c(CN2CCC(N3CCCC3=O)CC2)c1 93088313 VACGDVKXIHMPGS-UHFFFAOYSA-N 288.391 2.287 10 20 CECD CO[C@H](CNC(=O)Cc1ccc(N)cc1)c1ccccc1 237196769 LDVXHDBHWYCFOR-MRXNPFEDSA-N 284.359 2.315 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCS2)cc1F 266505083 GPOFKZPPXHIQOE-ZDUSSCGKSA-N 282.384 2.404 10 20 CECD CC[C@@](C)(O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273602640 SGCGEKZLDLIHHH-NOZJJQNGSA-N 268.313 2.112 10 20 CECD CC(C)[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)CCO1 271567486 SZLUIDKLAAXONB-ZFWWWQNUSA-N 292.379 2.395 10 20 CECD CCN1CCC(N[C@@H](C)c2cc([N+](=O)[O-])ccc2O)CC1 273411878 PVUBCJRLOBUHTP-NSHDSACASA-N 293.367 2.435 10 20 CECD COc1ccc(CNC(=O)[C@H]2COc3ccccc32)c(O)c1 373670199 QXJOZMYRAATOMG-AWEZNQCLSA-N 299.326 2.193 10 20 CECD Cc1ccc([C@H](C)NC[C@H](CO)[C@H]2CCOC2)c(O)c1C 280975241 VUFYSOYOOUCCGM-SOUVJXGZSA-N 293.407 2.305 10 20 CECD CCc1c(C(=O)NCc2ccccc2O)ccn1C 289716035 BYLVPZZRHGDKGI-UHFFFAOYSA-N 258.321 2.223 10 20 CECD COc1cccc(CN2CC[C@H](N3CCCC3)[C@H]2C)c1O 289727594 HPEIWSOYMUHCJM-HIFRSBDPSA-N 290.407 2.459 10 20 CECD CCOC(=O)CC(=O)N(CC)Cc1ccc(N(C)C)cc1 299687595 UUHLKFYZYQYLLR-UHFFFAOYSA-N 292.379 2.054 10 20 CECD COc1ccc(O)c(CN[C@H]2CCCC[C@@H]2N(C)C)c1 1341800914 BQQZKELCQUKMBX-GJZGRUSLSA-N 278.396 2.363 10 20 CECD CCN1C[C@H](N[C@H]2C[C@@H](C)c3c(C)ccc(O)c32)CC1=O 391498811 IEKORWIUEKREMU-UPJWGTAASA-N 288.391 2.459 10 20 CECD Cc1cnn([C@H]2CCN(C(=O)c3cc(O)cs3)C2)c1 812380006 CFYCJKWOUUPNLA-JTQLQIEISA-N 277.349 2.046 10 20 CECD C[C@@H](CN)CN[C@H](C)c1cc(Br)ccc1O 817962010 GKGAEOKDJSLNAJ-DTWKUNHWSA-N 287.201 2.400 10 20 CECD NC(=O)C[C@H](NC(=O)c1cc(O)cs1)C1CCCCC1 829567178 ZXMLJRHHOPBCTJ-NSHDSACASA-N 296.392 2.008 10 20 CECD CCn1nnc(C)c1CN(C)Cc1ccc(N(C)C)cc1 823372142 XPIFPVKCFSNJBT-UHFFFAOYSA-N 287.411 2.304 10 20 CECD COc1ccc(O)c([C@H](C)NCc2ccnc(OC)n2)c1 824548917 QGXUGEHKLWWHLA-JTQLQIEISA-N 289.335 2.050 10 20 CECD Cc1cccc(CN2CCC[C@H]3CN(C)C[C@H]32)c1O 822521200 YDFBVHXCYISKCM-DZGCQCFKSA-N 260.381 2.227 10 20 CECD C/C(Cl)=C\C(=O)NCc1ccc(N2CCOCC2)cc1 900337951 PXCDCBIUSHTAGC-ZRDIBKRKSA-N 294.782 2.282 10 20 CECD CN(Cc1ccccc1O)C(=O)c1c(C2CC2)cnn1C 830140626 DWJUHCMKVSKECM-UHFFFAOYSA-N 285.347 2.275 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cncs1 734405822 IARRDDCCRJHMGC-UHFFFAOYSA-N 275.377 2.448 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CSC)C(=O)O)cc1 904039856 DUBAMSBEELFCRT-AWEZNQCLSA-N 296.436 2.439 10 20 CECD CC[C@H](CN1CCOCC1)N[C@@H](C)c1cc(C)ccc1O 903342482 FIDMTBLLZQQGCL-LSDHHAIUSA-N 292.423 2.462 10 20 CECD O=C(NCCOc1cccc(F)c1)c1cc(O)cs1 731869077 KYXFCTLQZOHBGC-UHFFFAOYSA-N 281.308 2.402 10 20 CECD Cn1cnc([N+](=O)[O-])c1NCCCSc1nccs1 733895491 GIJGZIRBPGIOGE-UHFFFAOYSA-N 299.381 2.379 10 20 CECD CC[C@@H](C)CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832278531 DSEJKEIAMDQAGW-IUODEOHRSA-N 277.412 2.305 10 20 CECD CCOc1cccc(CN(C)C2CCN(OC)CC2)c1O 835076377 OZTIAKWFSBTMSM-UHFFFAOYSA-N 294.395 2.249 10 20 CECD C[C@H]1[C@@H](CO)CCCN1Cc1ccc(N(C)C)c(F)c1 840978243 MQBPYAVYAYLSGJ-GXTWGEPZSA-N 280.387 2.485 10 20 CECD COc1cc(CNc2nncn2C)c(O)c(C(C)(C)C)c1 849345518 PMAWENCUOXPHAY-UHFFFAOYSA-N 290.367 2.439 10 20 CECD COc1cncc(/C=C2\SC(=S)N(C3CC3)C2=O)c1 849173048 BDDIYQDPEIBTPX-WZUFQYTHSA-N 292.385 2.454 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCc2c[nH]nc2C1 840935062 CZAJNFVUYURDHR-OAHLLOKOSA-N 284.407 2.431 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@@H](N)C2)cc1F 841056956 GHHHPHFILQXGPU-CHWSQXEVSA-N 265.376 2.251 10 20 CECD CC(C)Cn1nccc1/C=C1/SC(=S)NC1=O 843263616 KEWYATOPTCUCFD-WEVVVXLNSA-N 267.379 2.028 10 20 CECD C[C@H](NC(=O)N[C@@H]1COC[C@H]1C)c1ccc(N(C)C)cc1 922055141 MVPSEJPKCPAWBI-TYNCELHUSA-N 291.395 2.148 10 20 CECD CCOc1cccc(CN2CC[C@@H](C)[C@@H](CO)C2)c1O 857061973 XESQPEPROHZYGH-TZMCWYRMSA-N 279.380 2.241 10 20 CECD CN1CCCc2cc(CNC(=O)OCCF)ccc21 858926020 VEJLFWULWRQENF-UHFFFAOYSA-N 266.316 2.265 10 20 CECD CC[C@@H](N[C@@H]1CCN(C(C)=O)C1)c1ccccc1O 857068528 YASQDKHONMHTNM-TZMCWYRMSA-N 262.353 2.054 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H]3C[C@@H]3C2)cc1 853245258 WLAIMEVRBPNYCC-UONOGXRCSA-N 273.380 2.304 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CC1(Cl)Cl 769364695 JQZQYVRTPMHTPY-QMMMGPOBSA-N 260.120 2.202 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H](C)N(C)C[C@@H]2C)c1O 768762654 FDJCPGBKPWYUIV-QWRGUYRKSA-N 294.370 2.258 10 20 CECD C[C@H](NCC(=O)Nc1ccccn1)c1ccc(N(C)C)cc1 878455004 MPMBPACQJMVBLQ-ZDUSSCGKSA-N 298.390 2.437 10 20 CECD COc1cc(O)c(CNCc2cccc(F)n2)cc1OC 776251845 DSGVABOVOVHWEY-UHFFFAOYSA-N 292.310 2.233 10 20 CECD CN(C)c1ccc(CN(c2nccnc2CN)C2CC2)cc1 1120804285 QXEBAKZMUXUYRC-UHFFFAOYSA-N 297.406 2.170 10 20 CECD C[C@@H](NCC1(N2CCOCC2)CC1)c1c(O)cccc1F 886601356 QLFBVKWWFAZSRL-GFCCVEGCSA-N 294.370 2.047 10 20 CECD COc1cc(C)cc(CN2CC[C@H](C)[C@H](CO)C2)c1O 895375471 BRHUKEBJDQDNLB-JSGCOSHPSA-N 279.380 2.160 10 20 CECD COc1ccc(CNCCC[C@H]2CCOC2)c(O)c1OC 894769229 SGDKQGVKYDRSGW-LBPRGKRZSA-N 295.379 2.316 10 20 CECD COc1cc(C)cc(CN[C@@H](C)C(=O)OCC(C)C)c1O 894539848 XRDFLTOHCZGTEI-LBPRGKRZSA-N 295.379 2.387 10 20 CECD OCC[C@@H]1CCC[C@H]1NCc1cc(F)ccc1O 190307074 BNGGIUZDXZNYFA-GXFFZTMASA-N 253.317 2.172 10 20 CECD Cc1cc2c(cc1NC(=O)c1cccc(O)c1O)OCO2 790927873 MNJOIWTXLWNFOR-UHFFFAOYSA-N 287.271 2.387 10 20 CECD CCc1cccc(CNCCC(=O)N[C@@H](C)CC)c1O 691464610 IYWWMBTZWWSWPY-LBPRGKRZSA-N 278.396 2.349 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)c2ccco2)c(O)c1 794380479 DTATXKDJZXSFHW-JTQLQIEISA-N 275.304 2.414 10 20 CECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccoc1 795354186 RLLPVNUXVABBQO-UHFFFAOYSA-N 283.305 2.185 10 20 CECD COc1cc(Cl)cc(CN[C@H](CO)CC2CC2)c1O 761216618 UVNIGWBQEXOAPG-LBPRGKRZSA-N 285.771 2.305 10 20 CECD CCOc1cccc(CN2C[C@H](C)N(C)C[C@@H]2C)c1O 775981343 PNLOAFFFRLBDNL-STQMWFEESA-N 278.396 2.315 10 20 CECD COCCNCCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1329025221 ZPTNVTHXFHHASR-QWHCGFSZSA-N 278.396 2.075 10 20 CECD Cc1ccc(CN2CCC[C@@H](C(=O)NC3CC3)C2)c(O)c1 1333336947 SGCHRMYRASQUEQ-CQSZACIVSA-N 288.391 2.191 10 20 CECD CS[C@H](CO)[C@@H](C)NCc1ccc(N2CCCC2)cc1 219077257 BSPSVACXIPBTIX-CZUORRHYSA-N 294.464 2.489 10 20 CECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1C[C@@H]1F 1350909759 ZHVTXORUSYXZQR-KBPBESRZSA-N 294.395 2.214 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](C(=O)O)[C@H]2C)c1 1600163311 HUKKWRJOKGEVBL-DGCLKSJQSA-N 263.337 2.304 10 20 CECD CCc1cccc(CN2CCC[C@@]2(C)C(=O)O)c1O 1593642154 HCQYSBRVYBWUPK-HNNXBMFYSA-N 263.337 2.394 10 20 CECD C[C@H](NC/C=C\Cl)c1cc(C(=O)O)ccc1O 1593256462 IAGLOEPIRJJPOY-YAPUSRSVSA-N 255.701 2.494 10 20 CECD NCCCCCC(=O)NCCCSc1nccs1 155075856 DFMFPTGIPVCEQJ-UHFFFAOYSA-N 287.454 2.261 10 20 CECD CC[C@@H](NCCO[C@H]1CCOC1)c1ccccc1O 927080422 KVJZACDLWWFPJK-GXTWGEPZSA-N 265.353 2.238 10 20 CECD COCC1(C(=O)N[C@H](C)c2ccccc2O)CCC1 827946197 ADMHPVVQQZJJNL-LLVKDONJSA-N 263.337 2.386 10 20 CECD CC1(F)CCN(Cc2cc3c(cc2O)OCO3)CC1 872690244 HNFUFHASKZFTJS-UHFFFAOYSA-N 267.300 2.445 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](CN)C[C@H]2C)c1O 252879643 YXTZWIZYEUZUPF-NXEZZACHSA-N 284.787 2.223 10 20 CECD C[C@H](NCCn1cccn1)c1ccc(N(C)C)cc1 49075335 SWVUWJOGAZUYBN-ZDUSSCGKSA-N 258.369 2.300 10 20 CECD Cc1ccc(C(=O)NCc2cccc(F)c2)c(O)c1O 177670326 PRVCLDVJKUBJCD-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H]2C(C)(C)O)c1O 305734065 LHQDZGHAOQVYSU-AWEZNQCLSA-N 295.354 2.469 10 20 CECD COc1ccc(N(C)CC(=O)Nc2cc(C)on2)cc1F 121828325 IQBQWWZNDPBZDQ-UHFFFAOYSA-N 293.298 2.206 10 20 CECD CO[C@@H](C)CCC(=O)N1CCOc2cc(N(C)C)ccc21 181581956 GDJPUDNOVNMLHU-LBPRGKRZSA-N 292.379 2.293 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccc[nH]1 188759310 LQXLKFKMBSIBPX-OKPNEXGHSA-N 286.331 2.187 10 20 CECD Cc1nc(C)c(CCNC(=O)c2cccc(O)c2O)s1 187080790 FDXMORVABHWWRT-UHFFFAOYSA-N 292.360 2.144 10 20 CECD C[C@H]1CCCC[C@@H]1OCCNC(=O)c1cccc(O)c1O 186944704 YNHTVGKMSJAHIJ-FZMZJTMJSA-N 293.363 2.423 10 20 CECD COCCC(C)(C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186425867 OAXPRJGHROKXEL-LLVKDONJSA-N 295.379 2.208 10 20 CECD CNC[C@@H]1CCCN1Cc1cc(Br)ccc1O 220321609 MGQNPZZPDBXDOW-LBPRGKRZSA-N 299.212 2.339 10 20 CECD COc1ccc(N2CCC(NC[C@H](C)OC)CC2)cc1 364876739 BASXGWCEDUFLHK-ZDUSSCGKSA-N 278.396 2.289 10 20 CECD Cc1ccc(O)c(CN2CCC3(CC2)CCN(C)C3=O)c1 365835674 UWQORKKCZTWWDK-UHFFFAOYSA-N 288.391 2.145 10 20 CECD OC[C@H](CC1CCC1)NCc1cc(F)ccc1O 279831107 QHOZWJCCCMRCNH-ZDUSSCGKSA-N 253.317 2.172 10 20 CECD CCOCc1cc(CN[C@@]2(C)CCOC2=O)ccc1OC 289751345 IDYOIGSBEVQJMQ-INIZCTEOSA-N 293.363 2.027 10 20 CECD Cn1cc2c(n1)CCC[C@H]2NCc1cccc(F)c1O 283183507 ZWWQBRBJJXHGQI-CYBMUJFWSA-N 275.327 2.432 10 20 CECD CC[C@@H](NCC(=O)NC(C)C)c1ccc(F)cc1O 285551604 GQHQOKXCWFKBFG-GFCCVEGCSA-N 268.332 2.097 10 20 CECD O=C(NCCCSc1nccs1)c1cccc(O)n1 801620708 GTGDJOGURQDTAU-UHFFFAOYSA-N 295.389 2.156 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@@H]2CC2(C)C)cc1 299033528 KCTQHWSQWGPFRW-CYBMUJFWSA-N 261.369 2.350 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1CC(=O)O 722617234 NUDBWTOZOCLDFS-NXEZZACHSA-N 267.300 2.074 10 20 CECD CC[C@@H](NCC1(CC(N)=O)CC1)c1ccc(N(C)C)cc1 817586838 SSCBCPNOATXIRF-OAHLLOKOSA-N 289.423 2.449 10 20 CECD Cc1cc2c(NCCc3ccc(O)c(O)c3)nccn2n1 811811470 VKFCDGRGONXPCC-UHFFFAOYSA-N 284.319 2.104 10 20 CECD COc1cc2c(c(OC)c1)N(CC[C@H](C)O)CCC2 823239778 PKVITTHHGLOAHA-NSHDSACASA-N 265.353 2.227 10 20 CECD CN(CC1=CCCOC1)Cc1cc(F)ccc1O 827189151 GRNAMDOKDITTOF-UHFFFAOYSA-N 251.301 2.310 10 20 CECD COC[C@@H](C)CNC(=O)NCc1ccc(N(C)C)cc1C 734527402 SPBRBFGLSBNILE-LBPRGKRZSA-N 293.411 2.143 10 20 CECD O=C(NCCN1CCc2ccccc21)c1cc(O)cs1 732274185 MNQZIWFIQHUXHW-UHFFFAOYSA-N 288.372 2.246 10 20 CECD C[C@H](Cc1ccco1)NC(=O)c1cc(O)cs1 732271678 OJCYFKOWMRTDER-MRVPVSSYSA-N 251.307 2.408 10 20 CECD N[C@H]1C[C@@H](CN(Cc2ccccc2O)C[C@@H]2CCCO2)C1 904333753 FMROHGRFYCBPMA-IMJJTQAJSA-N 290.407 2.111 10 20 CECD Cc1noc(CN(C)Cc2c(O)cccc2Cl)n1 848927998 SWCOWNWPSPZEHF-UHFFFAOYSA-N 267.716 2.369 10 20 CECD COc1cccc(OCC(=O)NCc2ccccc2O)c1 748345342 JOGITBYLLTWQNI-UHFFFAOYSA-N 287.315 2.096 10 20 CECD Cc1cccc(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)c1O 843059206 GEADEVANBDSKQG-NWANDNLSSA-N 260.381 2.260 10 20 CECD COc1ccc(N2CCC(N[C@@H]3CCCNC3)CC2)cc1 841041679 DTXQUDQOBMJOFW-OAHLLOKOSA-N 289.423 2.006 10 20 CECD CCCN(Cc1cc(OC)ccc1O)C1CCNCC1 843044947 NFEWHAFBAKPBJE-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CCOc1cccc(CNCc2ccn(CC)n2)c1O 840956472 SDPIDVJLTXOPHB-UHFFFAOYSA-N 275.352 2.297 10 20 CECD COc1c(N)ncnc1NCc1ccc(N(C)C)cc1C 848665579 DYSFVEMCLQCTDM-UHFFFAOYSA-N 287.367 2.054 10 20 CECD CC[C@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)C1 841047602 RJWPNYJYGOLOMD-SMDDNHRTSA-N 289.379 2.292 10 20 CECD COC(=O)CC(C)(C)NCc1ccc(N(C)C)cc1C 840936543 KODKQBBXWNAGGB-UHFFFAOYSA-N 278.396 2.492 10 20 CECD COc1cc(O)c(CN2CCCC[C@@H]2CCN)cc1OC 843123511 LCPRLXVBDZRNOU-CYBMUJFWSA-N 294.395 2.113 10 20 CECD C[C@H]1NCCC[C@H]1NCc1ccc2c(c1)CCCN2C 925530904 HPJJBTVRUIKOJV-CZUORRHYSA-N 273.424 2.299 10 20 CECD CN(C)c1ccc(CNC(=O)c2c(Cl)cnn2C)cc1 854271477 IHPIWZDUJNEHHP-UHFFFAOYSA-N 292.770 2.070 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1ccc(N(C)C)c(F)c1 759173946 SCHLYNMGHGYLJV-GDBMZVCRSA-N 296.386 2.175 10 20 CECD CCC[C@H](O)CC(=O)NCc1ccc(N2CCCC2)cc1 750204951 ZQUQBTUVIJXWCX-INIZCTEOSA-N 290.407 2.454 10 20 CECD CCCNC(=O)CN[C@@H](C)c1ccc(C)c(C)c1O 756354749 CGJQKNKEDGJOOE-LBPRGKRZSA-N 264.369 2.186 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)C1CCCC1 759582007 YENRQFMVYCEMSS-VURMDHGXSA-N 290.315 2.414 10 20 CECD C[C@@H](NC[C@@H](O)C(F)(F)F)c1cc(F)cc(F)c1O 756450593 SUKUHUMKPAWQQU-MLUIRONXSA-N 285.212 2.244 10 20 CECD Cn1cnc2cc(/C=C3\SC(=S)NC3=O)ccc21 761199547 FZEHSNSMJAMJHP-YHYXMXQVSA-N 275.358 2.062 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)[C@@H](O)C(F)(F)F)c1 865712130 XEBUDRZUSRFIDP-PRHODGIISA-N 293.285 2.192 10 20 CECD CCCN(C)C(=O)N1CCN(c2ccc(OC)cc2)CC1 772319784 UCLHPMIVIYCXLR-UHFFFAOYSA-N 291.395 2.279 10 20 CECD C[C@@H](Nc1cc(N2CCNCC2)ccn1)c1ccccc1O 873244719 JBOYGEDZWQDZLC-CYBMUJFWSA-N 298.390 2.370 10 20 CECD OC[C@H](CNCc1cc(F)ccc1O)Cc1ccco1 779093693 XEWKMOUBRRJQSF-NSHDSACASA-N 279.311 2.065 10 20 CECD COC(=O)c1cccc(CN(C)Cc2ccccc2O)n1 773775307 YVNJOQRZEZHPRH-UHFFFAOYSA-N 286.331 2.206 10 20 CECD OC[C@@H](CC1CC1)NCc1cc(Cl)cc(F)c1O 776252374 SJDLYBVLQFLADX-LLVKDONJSA-N 273.735 2.435 10 20 CECD CC(C)COC[C@H](O)CN[C@@H](C)c1c(O)cccc1F 886511017 GMXYSTMOYSUIHT-NWDGAFQWSA-N 285.359 2.215 10 20 CECD Oc1c(F)cc(F)cc1CNCc1nc(C(F)F)no1 1120060381 ZGNIFDLEEISRGC-UHFFFAOYSA-N 291.204 2.281 10 20 CECD Oc1c(F)cc(Cl)cc1CNCCc1cnccn1 776256115 KJYZQAQDGKSFJS-UHFFFAOYSA-N 281.718 2.307 10 20 CECD C[C@H](NC(=O)N(C)Cc1ccccc1O)[C@H]1CCCOC1 780858789 ARQULESNPIGTNZ-JSGCOSHPSA-N 292.379 2.349 10 20 CECD O=C(CNCc1cc(F)cc(F)c1O)NC1CCCCC1 882992788 OIRUHJQLCBNAQI-UHFFFAOYSA-N 298.333 2.209 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cc(C)ccc2O)C1 896962328 LQSOHYHMFUUUSN-GFCCVEGCSA-N 263.337 2.086 10 20 CECD CCC(O)(CC)CCNC(=O)NCc1ccccc1O 788119171 PAEFDIPJFUVCHY-UHFFFAOYSA-N 280.368 2.133 10 20 CECD CC[C@H](NCCNc1cnccn1)c1ccc(F)cc1O 796798012 XRXKXTDOZLBHPE-ZDUSSCGKSA-N 290.342 2.474 10 20 CECD CCOc1ccc(CNCCN2CC=CCC2)c(O)c1 793318914 JGPSBBSGGDIZNN-UHFFFAOYSA-N 276.380 2.142 10 20 CECD C[C@H](CCCCC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1321907007 LPBDABBWONCMRS-SNVBAGLBSA-N 296.323 2.424 10 20 CECD C[C@H]1C[C@@H](C)CN1c1nnc(-c2sccc2O)n1C 1338086841 JHAKSDGIBPFCPY-BDAKNGLRSA-N 278.381 2.484 10 20 CECD CO[C@H]1CC[C@H](NC(=O)N[C@H](C)c2ccccc2O)C1 1330022192 QRHVBXLVDMPDLG-WOPDTQHZSA-N 278.352 2.320 10 20 CECD COc1ccc(N(C)C[C@H]2CN(C)C(=O)O2)cc1Cl 1261237128 IHGVIJHHWSSNCR-JTQLQIEISA-N 284.743 2.235 10 20 CECD COc1ccc(CNCCN2CCSCC2)cc1C 226246272 NFCFCHDTPZZUOQ-UHFFFAOYSA-N 280.437 2.142 10 20 CECD C[C@H](NCc1ccc(C(=O)O)cn1)c1ccccc1O 1607460673 BJUJBCPIVZPZEU-JTQLQIEISA-N 272.304 2.336 10 20 CECD CCc1cccc(CN2CC[C@H](C)[C@@H](C(=O)O)C2)c1O 1603975069 CPOUONYNVDSMDJ-FZMZJTMJSA-N 277.364 2.497 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@H]3C[C@@H]2C[C@H]3C(=O)O)cc1 1777040190 KBEOTBTXTWEJDF-RRCSTGOVSA-N 288.391 2.342 10 20 CECD CN1C(=O)c2ccccc2N[C@H]1c1cc2c(cc1O)OCO2 164627458 UXUDXSYWWSCZLR-OAHLLOKOSA-N 298.298 2.317 10 20 CECD CCOc1cccc(CN(C)CC(=O)N(CC)CC)c1O 155110482 ZXKZIRVIHNCQLD-UHFFFAOYSA-N 294.395 2.091 10 20 CECD OCC1(CNCc2cc3c(cc2O)OCO3)CCCCC1 157383868 QHCDYZRCHQZIGK-UHFFFAOYSA-N 293.363 2.153 10 20 CECD C[C@@H](NCCCn1cccn1)c1ccc(F)cc1O 126319267 PVVZNYMWGAEZDI-LLVKDONJSA-N 263.316 2.469 10 20 CECD COc1ccc(O)c(CN(C)C[C@H]2CCCN(C)C2)c1 179734025 RNOMZMWUBXJFCM-ZDUSSCGKSA-N 278.396 2.174 10 20 CECD COc1cccc(CN(C)CC(C)(C)OC)c1O 404319699 KRANGCSDIGASBC-UHFFFAOYSA-N 253.342 2.258 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)C(C)(C)O)c1 393959084 AINGPSBXXHWXSR-UWVGGRQHSA-N 253.342 2.211 10 20 CECD COc1ccc(CN[C@H](C(=O)O)C2CCC2)cc1C 399325573 RWEJCADPKLLHMD-AWEZNQCLSA-N 263.337 2.347 10 20 CECD CCCN1CCN(Cc2ccc(N(C)C)cc2)CC1 112119181 CFLPMSDCTWLGNF-UHFFFAOYSA-N 261.413 2.280 10 20 CECD COc1ccc(N(C)C[C@@H](O)Cn2cccn2)cc1Cl 177074062 JKFRGHAQNCELDG-GFCCVEGCSA-N 295.770 2.042 10 20 CECD Oc1ccc(CCNc2ccc3nccnc3n2)cc1O 301568172 MVSFUIOOKOOMGH-UHFFFAOYSA-N 282.303 2.091 10 20 CECD CN(Cc1ccccc1O)C(=O)/C=C/c1ccc(O)c(O)c1 180864189 RQXQLDXBTFHBKI-VQHVLOKHSA-N 299.326 2.475 10 20 CECD CC(C)N1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 127014724 IHIDKEUPUQHMDB-UHFFFAOYSA-N 279.403 2.418 10 20 CECD C[C@H](NCCSCCCO)c1ccccc1O 183498815 GUOLSBKOTVZZOQ-NSHDSACASA-N 255.383 2.158 10 20 CECD C[C@H](Nc1cccc(OCC(N)=O)c1)c1ccccc1O 37062329 NVXCVBGOKUGMFJ-NSHDSACASA-N 286.331 2.429 10 20 CECD CN(CC(=O)N1CCCC1)Cc1c(O)cccc1Cl 132705182 PADCZAFKJQZWTN-UHFFFAOYSA-N 282.771 2.100 10 20 CECD COc1ccc(O)c(CN2CCOC(C)(C)C2)c1 132306186 JSZKPKCVFMHNLE-UHFFFAOYSA-N 251.326 2.012 10 20 CECD COc1ccc(N(C)Cc2nc(C)no2)c(OC)c1 131929099 AKVUAAHBZNUCLF-UHFFFAOYSA-N 263.297 2.032 10 20 CECD CN(C)c1ccc(CNc2nnc(-c3nccn3C)o2)cc1 191133892 QEYDLUZRDSFSDG-UHFFFAOYSA-N 298.350 2.148 10 20 CECD CN(C)c1ccc(CN2CCOC[C@H]2C2CC2)cc1 93645158 QENJBRLUKCFZNA-INIZCTEOSA-N 260.381 2.363 10 20 CECD CO[C@H](C)CN(Cc1ccccc1O)C[C@@H]1CCCO1 182333866 IYWJLRSLMXSZHH-HIFRSBDPSA-N 279.380 2.408 10 20 CECD CC(C)[C@@H](CCO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273603083 SJBRZPPNLJBGGG-ZWNOBZJWSA-N 282.340 2.358 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCCSC1 272655605 NQYTWYINQJGJJI-MALLOTDXSA-N 279.361 2.123 10 20 CECD CC(C)(C)c1nsc(NC(=O)c2cccc(O)c2O)n1 279121773 ADEXMXPJTHHKTQ-UHFFFAOYSA-N 293.348 2.499 10 20 CECD CCN(CCO)Cc1ccc(N(CC)CC)cc1 271008367 OTOVSTXOUHFLAV-UHFFFAOYSA-N 250.386 2.347 10 20 CECD C[C@H](N[C@@H]1C[C@H](O)C1(C)C)c1cc([N+](=O)[O-])ccc1O 275335891 NVPXGEDFJHARPQ-CKLFPEKLSA-N 280.324 2.110 10 20 CECD CCOc1ccc(N(CC)Cc2cnnn2C)cc1 289405215 TZQHBDIAKIPQCF-UHFFFAOYSA-N 260.341 2.240 10 20 CECD COC(=O)CC1(CN(C)c2ccc(OC)cc2OC)CC1 281626588 KXOSOQTXRDBJMT-UHFFFAOYSA-N 293.363 2.483 10 20 CECD Cc1cc(Cl)cc([C@H](C)NC[C@@]2(O)CCOC2)c1O 808708173 IZTVRFNZKCYAAV-HZMBPMFUSA-N 285.771 2.156 10 20 CECD COc1cc(N(C)Cc2n[nH]cc2C)cc(OC)c1OC 290902346 OCNZQDMIXWPTOV-UHFFFAOYSA-N 291.351 2.380 10 20 CECD C[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCC1(F)F 296004677 KXNZOXDJVLWMMQ-SSDOTTSWSA-N 289.253 2.354 10 20 CECD Cc1cc(Cn2cc([N+](=O)[O-])ccc2=O)ccc1N(C)C 292752528 RRBLSJHLZGYUFT-UHFFFAOYSA-N 287.319 2.179 10 20 CECD CN(C)c1ccc(CNC(=O)c2cncs2)cc1 807288339 UXMVOYSKNZEWGT-UHFFFAOYSA-N 261.350 2.139 10 20 CECD CO[C@@H]1[C@H]2C[C@@H]3CN(C(=O)Nc4ccc(N)cc4)[C@H]1[C@H]3C2 394289071 MLIRXMBPMQQJLZ-GHBALNIRSA-N 287.363 2.156 10 20 CECD Cc1ccoc1CNC(=O)NCc1ccccc1O 813615949 YHYCGIXEDSKTBE-UHFFFAOYSA-N 260.293 2.293 10 20 CECD CC1(C)CN(C(=O)c2cc(O)cs2)[C@@H]1[C@@H]1CCCO1 811595521 PSYCVWHSWYGNSG-CMPLNLGQSA-N 281.377 2.483 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cnc3n2CCC3)c1 825935560 XYKRHZIFLCXCCV-NSHDSACASA-N 287.363 2.394 10 20 CECD Cc1cccc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1O 824838040 KUYHBKPILYBXAG-BYNSBNAKSA-N 257.333 2.086 10 20 CECD O=C(NCc1cccc2c1OCO2)c1cc(O)cs1 732276915 WOQCKHVEWMPZCG-UHFFFAOYSA-N 277.301 2.112 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(CC)C1)c1ccc(N(C)C)cc1 834892494 VOKYCEZAZCRSMQ-HOCLYGCPSA-N 289.423 2.414 10 20 CECD CNC(=O)CCNCc1cc(-c2ccccc2)ccc1O 738430898 SSFZBCVUODHIQR-UHFFFAOYSA-N 284.359 2.285 10 20 CECD CC1(C)[C@H](NC(=O)c2cc(O)cs2)[C@@H]2CCCO[C@H]21 743658691 BRXAWESJQPXNJG-MVWJERBFSA-N 281.377 2.387 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCCCN1 843490376 SWZHBFLUWRNSPA-OAHLLOKOSA-N 288.391 2.029 10 20 CECD COC(=O)C1CCC(NCCc2ccc(N)cc2)CC1 841038811 QWMNHZHOKKYJBB-UHFFFAOYSA-N 276.380 2.133 10 20 CECD Cc1cc(N(C)C)ccc1CNC1(C)CCNCC1 841065647 RPVONUIKCQRLEC-UHFFFAOYSA-N 261.413 2.293 10 20 CECD Cc1cc(Br)c(O)c(CN2CCCNCC2)c1 843045148 NJNNAALMKHGUOH-UHFFFAOYSA-N 299.212 2.258 10 20 CECD CC[C@](C)(CC(=O)OC)NCc1ccccc1O 748242537 OVFQIUDMZWFTGI-CQSZACIVSA-N 251.326 2.214 10 20 CECD CN1C(=O)/C(=C\c2ccc([N+](=O)[O-])c(O)c2)SC1=S 748358315 UDHMCRDESHLXCO-WEVVVXLNSA-N 296.329 2.131 10 20 CECD COc1ccc2c(c1)CCCN2CN1CC[C@H](C)C1=O 840030835 FDSUDZHUDRVGPZ-LBPRGKRZSA-N 274.364 2.274 10 20 CECD CCOCc1cc(CN[C@@H](CO)CC2CC2)ccc1OC 754832100 FDNXGQKIKNVCFP-MRXNPFEDSA-N 293.407 2.482 10 20 CECD CC1CCN(C[C@@H](C)NC(=O)c2cc(O)cs2)CC1 855899540 OELTYCUGDGOWQO-LLVKDONJSA-N 282.409 2.304 10 20 CECD COc1cccc(CNC(=O)NCC2CC=CC2)c1O 875798336 QHZDTMXZPGRAPQ-UHFFFAOYSA-N 276.336 2.166 10 20 CECD CC[C@H]1C[C@H](C(=O)N(C)c2ccc(N)cc2)CCO1 877076164 MUATVLVLYPCHQU-RISCZKNCSA-N 262.353 2.437 10 20 CECD C[C@@H](NC(=O)C1CCOCC1)c1ccc(N(C)C)cc1 773008117 CLTBKDNLPSEBPF-GFCCVEGCSA-N 276.380 2.356 10 20 CECD Cc1ccc(CN[C@H]2CCN(CC(F)(F)F)C2)c(O)c1 876990784 CQPYLVHJWCBQMF-LBPRGKRZSA-N 288.313 2.427 10 20 CECD C[C@@H](NC(=O)c1cnco1)c1ccc(N(C)C)cc1 775409456 GBKVERYZNXEWLB-SNVBAGLBSA-N 259.309 2.232 10 20 CECD O=C(O)C1(NCc2ccc(N3CCCCC3)cc2)CC1 779491235 LEEXMWJJLJLWJG-UHFFFAOYSA-N 274.364 2.384 10 20 CECD CCOc1ccc(CN2CC[C@H](OCCOC)C2)c(O)c1 783715216 KQLKZPMWCOTFIL-HNNXBMFYSA-N 295.379 2.028 10 20 CECD COc1ccc(CNCc2nc(C)cs2)c(O)c1OC 892532500 CRRGIGFACRQAAH-UHFFFAOYSA-N 294.376 2.464 10 20 CECD CN(Cc1cc(F)cc(F)c1O)CC1(C)COC1 895391994 IWPJETDBOGELCB-UHFFFAOYSA-N 257.280 2.139 10 20 CECD C[C@H](CC(=O)OCC(=O)c1ccc(O)c(O)c1)C1CC1 783198970 MJAGXTXATGGWMC-SECBINFHSA-N 278.304 2.260 10 20 CECD CCO[C@@H](CC(=O)NCc1ccc(OC)cc1O)C(C)C 794391194 UZOKLXHOCXAKPQ-HNNXBMFYSA-N 295.379 2.468 10 20 CECD C[S@](=O)C1(CNCc2cc(Cl)cc(F)c2O)CC1 799739248 SFJMHGDIAMQGFV-SFHVURJKSA-N 291.775 2.185 10 20 CECD Oc1ccccc1CN1CCC([C@H]2CCCN2)CC1 63197550 KNNOHNKUBAIGKT-OAHLLOKOSA-N 260.381 2.356 10 20 CECD O=C(NCc1ccccc1O)NC1CCSCC1 726251429 XVYVLOZMMDHCOW-UHFFFAOYSA-N 266.366 2.087 10 20 CECD CC[C@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(F)cc1O 796849808 WJWJTHNXMOAIQJ-SKDRFNHKSA-N 289.372 2.005 10 20 CECD Nc1ccc(CCNC(=O)N2CCCCCC2)cc1 91970963 IDIFCXYVMZAZJQ-UHFFFAOYSA-N 261.369 2.397 10 20 CECD Cc1ccc(CN2CC[C@@H](C(=O)O)[C@H](C)C2)c(O)c1 1605273102 GTSHINFEPAKGLF-DGCLKSJQSA-N 263.337 2.243 10 20 CECD C[C@@H](CCCC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1320748952 QGYUOZSCWHSJIM-VIFPVBQESA-N 282.296 2.033 10 20 CECD Oc1cc2c(cc1CNc1ccc(F)nc1)OCO2 226550559 NDCVUOHFSVCXNN-UHFFFAOYSA-N 262.240 2.267 10 20 CECD COC(=O)c1cnc(SCCOCC2CC2)s1 829678039 WQTHSGRUQYPVOT-UHFFFAOYSA-N 273.379 2.448 10 20 CECD CC(C)(C)[C@@H](CC(=O)O)NC(=O)c1cc(O)cs1 1589704114 AIAWGIAPQYAABN-SECBINFHSA-N 271.338 2.073 10 20 CECD C[C@H]1CC[C@H](COc2ccc(N(C)C)c(C(=O)O)c2)O1 1594306370 FVAFFYYIFGQOSW-CMPLNLGQSA-N 279.336 2.397 10 20 CECD CCC(CC)[C@H](O)CNC(=O)Nc1ccc(N)cc1 841299371 BKGTXBAOUJNCHC-CYBMUJFWSA-N 265.357 2.187 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)[C@@H](C)N 156574426 JMGLBQOKJYOMHE-CHWSQXEVSA-N 277.412 2.084 10 20 CECD CC(C)(C)SCCNC(=O)c1cccc(O)c1O 280628367 LNTFTCRSGXSQIO-UHFFFAOYSA-N 269.366 2.359 10 20 CECD COCCOCCCN[C@@H]1CCc2cccc(O)c21 296080882 SNLXEEHYUDXIDZ-CYBMUJFWSA-N 265.353 2.022 10 20 CECD C[C@H](N)[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1 63191470 SRSSVXUOTVFAAC-BBRMVZONSA-N 261.413 2.454 10 20 CECD COC[C@@H]1CCCCN1Cc1cc2c(cc1O)OCO2 307790792 VHLMXKJIJQEAAP-LBPRGKRZSA-N 279.336 2.122 10 20 CECD CN(C)c1ccc(CN2CCC(C)(C(=O)O)CC2)cc1 86776483 OYUJUXALJQDRCH-UHFFFAOYSA-N 276.380 2.439 10 20 CECD O=C1[C@@H](Sc2nccs2)CCN1CC(F)(F)F 109717767 OCCYOKLLOMSNJY-LURJTMIESA-N 282.312 2.398 10 20 CECD Cc1cc(NCc2ccc(N3CCOCC3)cc2)ncn1 301232624 IMEAKIKOYNSLDK-UHFFFAOYSA-N 284.363 2.234 10 20 CECD C[C@@H](Sc1nccs1)C(=O)NCC(F)(F)F 72016353 XJWGPQCQSJYKBT-RXMQYKEDSA-N 270.301 2.302 10 20 CECD CO[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)[C@H](C)C1 282367587 QCINKKGMFFALDE-ZYHUDNBSSA-N 279.336 2.120 10 20 CECD C[C@@H](N)[C@@H]1CCCCN1Cc1cc(F)ccc1O 219584515 RLKMCHHWBWCVIU-MFKMUULPSA-N 252.333 2.233 10 20 CECD Cc1cnccc1CNC(=O)N(C)Cc1ccccc1O 188254172 PLNCOVKKWAFBIR-UHFFFAOYSA-N 285.347 2.437 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](N)c1ccccc1 193934354 DGWYUAVHISKGGM-QGZVFWFLSA-N 297.402 2.411 10 20 CECD CN(Cc1ccccc1O)C(=O)C(=O)c1ccccc1 194407965 DYPYAEGWYCHZDU-UHFFFAOYSA-N 269.300 2.234 10 20 CECD CC(C)(C)n1cc(NC(=O)Cc2ccc(N)cc2)cn1 236768063 VWTGZRZLKUWGDZ-UHFFFAOYSA-N 272.352 2.402 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](N3CCCC3=O)C2)c1 93278668 WMRJQEHEGXYKON-HNNXBMFYSA-N 288.391 2.287 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 266189854 YDSFSJJJVOPHJC-DGCLKSJQSA-N 266.360 2.406 10 20 CECD CCCOc1ccc(CN2CCC[C@@H](CO)C2)c(O)c1 269351182 KKQWSBWPXSEIHE-CYBMUJFWSA-N 279.380 2.385 10 20 CECD O=C(c1cccc(O)c1O)N1CCC(OCC2CC2)CC1 365555391 FMATUHIJERTJMF-UHFFFAOYSA-N 291.347 2.129 10 20 CECD O=C(NCc1ccc2c(n1)CCCC2)c1cccc(O)c1O 277535812 AUGCGJRKEBMWQQ-UHFFFAOYSA-N 298.342 2.302 10 20 CECD CCCOc1ccc(CN2CCC[C@@](F)(CO)C2)c(O)c1 289816633 NWTOFVALOGCRGU-INIZCTEOSA-N 297.370 2.477 10 20 CECD CCOc1ccc(N(CC)CC(=O)NC(C)C)cc1 299402528 MKIKMIKDWOHNDJ-UHFFFAOYSA-N 264.369 2.436 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H](O)c2cnn(C)c2)c(O)c1 294841734 RXRYWQUENNHJCK-WFASDCNBSA-N 289.379 2.127 10 20 CECD C[C@@H](N)CN[C@H](C)c1cc(Br)cc(F)c1O 817971297 CATFFRHOYNMZMH-RNFRBKRXSA-N 291.164 2.292 10 20 CECD Cc1ncc2n1C[C@@H](C(=O)N(C)Cc1ccccc1O)CC2 816889015 JFDOFZKQRAFUHN-AWEZNQCLSA-N 299.374 2.118 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CC23CCNCC3)c1 817976698 RQBNJOAEQIJQCW-IUODEOHRSA-N 260.381 2.493 10 20 CECD C[C@H](NC[C@@H]1CNCCO1)c1ccc2ccccc2c1O 817983947 SFDIYOHILYMPNX-JSGCOSHPSA-N 286.375 2.184 10 20 CECD COCCC(C)(C)CNC(=O)c1c(F)ccc(O)c1O 828449484 UOPSVAQKUDKZGQ-UHFFFAOYSA-N 285.315 2.029 10 20 CECD CO[C@@H]1COCC[C@@H]1CNCc1cc(C)c(C)cc1O 824710285 WXVCAPYTMPSERC-CZUORRHYSA-N 279.380 2.150 10 20 CECD COc1ccc(CN[C@H]2C[C@H](C(=O)OC)C2)cc1C 827812595 REHXVFQJPZHTDI-JOCQHMNTSA-N 263.337 2.045 10 20 CECD COc1ccc(N(C)CCn2ccccc2=O)cc1OC 726186028 SDWNTVDTRUZREP-UHFFFAOYSA-N 288.347 2.002 10 20 CECD CC[C@H](O)CNC(=O)NCc1c(C)c2ccccc2n1C 490410121 QMWYJGMVQRHDQN-LBPRGKRZSA-N 289.379 2.057 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCS[C@H]2C)c1O 828543320 VAFKLJJEFHPXMN-ONGXEEELSA-N 296.392 2.094 10 20 CECD C[C@@H](NC(=O)c1cc(C2CC2)n(C)n1)c1ccccc1O 827936889 FIVCXZJLNRLMAH-SNVBAGLBSA-N 285.347 2.494 10 20 CECD O=C(Nc1cc(CC2CC2)[nH]n1)c1cc(O)cs1 830878016 VACJICJTPWNVGK-UHFFFAOYSA-N 263.322 2.382 10 20 CECD CC(C)[C@@H](CO)[C@H](NC(=O)c1cccc(O)c1O)C(C)C 834053066 LQDAPRWLXUMKSF-TZMCWYRMSA-N 295.379 2.117 10 20 CECD O=C(/C=C\c1ccco1)OCC(=O)c1ccc(O)c(O)c1 916590034 ANNJXZUAGCSVRI-XQRVVYSFSA-N 288.255 2.130 10 20 CECD CCc1ncc(CNCc2ccc(N(C)C)cc2)cn1 840875783 HNHWCGFHSCYPRY-UHFFFAOYSA-N 270.380 2.395 10 20 CECD CCOc1cccc(CN[C@@H](C)CCCN)c1O 841080014 MTUUUEUTULQEJO-NSHDSACASA-N 252.358 2.008 10 20 CECD NC1CCN(Cc2cc(Cl)cc(F)c2O)CC1 843046934 AEZPSPJTBUTFCI-UHFFFAOYSA-N 258.724 2.108 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCCO1 846476201 LSSIBQYXYMLIMK-GFCCVEGCSA-N 269.728 2.231 10 20 CECD CON(C)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840482532 XZYIUEFBKJOTMJ-LBPRGKRZSA-N 279.384 2.195 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)c(F)c2)nn1C 840886941 ONOLTRPHVXHBDW-UHFFFAOYSA-N 276.359 2.223 10 20 CECD CCN(CC)CCOCCN[C@H](C)c1ccccc1O 757673772 JGOLKUQBSCDHAZ-CQSZACIVSA-N 280.412 2.401 10 20 CECD Cc1cc(N(C)C)ccc1CNCCN(C)CC(F)F 862551419 UUELEDCYCREIOI-UHFFFAOYSA-N 285.382 2.348 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CC[C@H](N)CC1 870888197 KTHZZCKKXCYXCK-CTYIDZIISA-N 289.423 2.195 10 20 CECD COc1ccc2c(c1)CCN2C(=O)/C=C/[C@@H]1CCCNC1 876630791 KUTYWPAGVHMOLO-LVDDQXARSA-N 286.375 2.140 10 20 CECD CC(F)(F)CCC(=O)NCc1ccc(O)c(O)c1 778926861 ZPHLVFSYEBAASS-UHFFFAOYSA-N 259.252 2.149 10 20 CECD CCCOc1ccc(CNCc2nncn2C)cc1C 873012629 LFPZWCUHMYUNLZ-UHFFFAOYSA-N 274.368 2.202 10 20 CECD CO[C@@H]1CCC[C@H]1CNCc1cc2c(cc1O)OCO2 774830416 CNUWGFNUZHOHKH-GXFFZTMASA-N 279.336 2.026 10 20 CECD COCCCNCc1cc(Br)ccc1O 76275396 OHKAXKHJONEBCW-UHFFFAOYSA-N 274.158 2.281 10 20 CECD Cc1nc([C@H]2CCCN(Cc3ccc(N)cc3)C2)n[nH]1 1120263822 WIIUEIKFPBKYEO-ZDUSSCGKSA-N 271.368 2.075 10 20 CECD C[C@@H]1CC[C@H](COC(=O)/C=C\c2ccc(O)c(O)c2)O1 789071758 CVMBBEPULXMUIN-ZOZIERIHSA-N 278.304 2.222 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1cc(F)cc(F)c1O 894050394 ONHAPHIALZTXSH-LLVKDONJSA-N 285.290 2.198 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@@H]([C@H]2CCCO2)C1 894089069 PRJFQPODGNGMCL-ZIAGYGMSSA-N 299.317 2.050 10 20 CECD CCN1CCC[C@H](NCc2cc(Cl)c(C)cc2O)C1=O 896728515 AJOSRFAAYYEVET-ZDUSSCGKSA-N 296.798 2.455 10 20 CECD COc1ccc(CNC(=O)c2cc(C(C)C)[nH]n2)c(O)c1 794387436 HWJASSMOASBHIY-UHFFFAOYSA-N 289.335 2.177 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1cc(F)cc(F)c1 192717826 AFHCXLGTAZILJX-UHFFFAOYSA-N 285.271 2.471 10 20 CECD COc1ccc(CNC(=O)/C=C/c2cccnc2)c(O)c1 794369207 FFPWEZTVMSYXNS-QPJJXVBHSA-N 284.315 2.125 10 20 CECD C[C@H](N[C@H](C)Cn1ccnc1)c1ccc(F)cc1O 62747597 SMLHPDHBPGBXCR-MNOVXSKESA-N 263.316 2.467 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](F)C2)c1O 689911815 GMSINSMYEXEGSQ-JTQLQIEISA-N 255.264 2.278 10 20 CECD O=C(OCc1cncc(F)c1)c1cc(O)cs1 795504613 GJBORABTBSXCTB-UHFFFAOYSA-N 253.254 2.345 10 20 CECD c1cc(N2CCCC2)ccc1CNCC1OCCCO1 716345083 WJQOEVVOZFPIPA-UHFFFAOYSA-N 276.380 2.139 10 20 CECD O=C(N[C@H](CCO)c1cccs1)c1cccc(O)c1O 790907656 JUZUKSFVHPRZBW-SNVBAGLBSA-N 293.344 2.013 10 20 CECD COc1ccc(CNc2ncnc3c2CCC3)c(O)c1 795286025 XSESUAOGJPOEDE-UHFFFAOYSA-N 271.320 2.292 10 20 CECD C[C@@H](NCCOC[C@H]1CCCO1)c1cc(F)ccc1O 756582982 MMTCXSJRCZIZRC-DGCLKSJQSA-N 283.343 2.378 10 20 CECD COc1cc(C(=O)Nc2c(Cl)ccc3nonc23)on1 1326699055 VASZEHVNKDERDX-UHFFFAOYSA-N 294.654 2.125 10 20 CECD C[C@@H](NCCc1cnn(C)c1)c1cc(F)cc(F)c1O 1321023662 OHPBDBDWBRFTBN-SECBINFHSA-N 281.306 2.297 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1ccc(C)cc1O 1331039853 CRCVYLRWKUBVQE-UHFFFAOYSA-N 265.353 2.474 10 20 CECD CO[C@@H]1CCC[C@H]1C(=O)N[C@H](C)c1ccccc1O 1262636854 BYDCQIHNCPKMEW-MPKXVKKWSA-N 263.337 2.385 10 20 CECD COc1ccc(CNCc2cccnc2N(C)C)c(O)c1 1347137431 JMQGFKRLSKLZHV-UHFFFAOYSA-N 287.363 2.152 10 20 CECD COc1cc(C)cc(CN[C@H]2CC[C@@H](C(=O)O)C2)c1O 1594054481 NBRGCIFAEXCTMX-PWSUYJOCSA-N 279.336 2.052 10 20 CECD Cc1cccc(O)c1CN(C)C[C@@H]1CCCN(C)C1 876596727 JXXYFAGEBSVUOB-CQSZACIVSA-N 262.397 2.474 10 20 CECD CO[C@@H](CNCc1cc(F)cc(F)c1O)C(F)(F)F 882995577 DEULVBIKEYTIMN-VIFPVBQESA-N 285.212 2.337 10 20 CECD COc1ccc(O)c(CNCCc2cccnc2C)c1 898255874 OHDANSPYHWQMBM-UHFFFAOYSA-N 272.348 2.437 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H](C)CC(N)=O 168829196 UMKMMOYKLBGMAC-VWYCJHECSA-N 262.353 2.102 10 20 CECD O=C(c1cc(O)cs1)N(CCO)Cc1ccccc1 732269252 RMQVHLIJGPXSDW-UHFFFAOYSA-N 277.345 2.088 10 20 CECD CCCCCNC(=O)NCc1cc(OC)ccc1O 172064075 OHVXJRQNVOIQAP-UHFFFAOYSA-N 266.341 2.390 10 20 CECD C[C@@H]1CC/C(=C\C(=O)NCc2cccc(O)c2O)C1 1352658886 ZTLHJFQUYVZOHN-MXBGMFSPSA-N 261.321 2.460 10 20 CECD CCN(CC)c1ccc(CNCCN2CCCC2=O)cc1 405414931 ZOABLIKOZDCMBS-UHFFFAOYSA-N 289.423 2.245 10 20 CECD Cc1ccc(C(=O)NC[C@H](C)c2nccs2)c(O)c1O 186018775 AVQGZGVKKMBUOH-VIFPVBQESA-N 292.360 2.396 10 20 CECD CCN(CC)c1ccc(CNCc2nncn2CC)cc1 218221910 UMNSTQQYTRSFQH-UHFFFAOYSA-N 287.411 2.434 10 20 CECD O=C(c1cccc(O)c1O)N1CCCC[C@H]1c1ncc[nH]1 187049132 WKLFDXDGLCCBEG-NSHDSACASA-N 287.319 2.188 10 20 CECD O=C(NCCC[C@@H]1CCCCO1)c1cccc(O)c1O 193163674 ZWQQGNXRUCRVGP-NSHDSACASA-N 279.336 2.177 10 20 CECD C[C@@H](Cn1cncn1)N[C@@H](C)c1ccc(F)c(F)c1O 276003714 AVQIDZKADIRSOF-IUCAKERBSA-N 282.294 2.001 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H]2c2ncc[nH]2)c(O)c1O 373311381 PZAQWKLVDAOFME-LLVKDONJSA-N 287.319 2.107 10 20 CECD CCN(CC)c1ccc(CNCCCn2cncn2)cc1 394367676 UKDJCUJTMQQTEJ-UHFFFAOYSA-N 287.411 2.304 10 20 CECD CCc1nc([C@@H](C)N[C@@H]2CCc3cccc(O)c32)n[nH]1 297073409 WLZYNSIBVQBIAH-MWLCHTKSSA-N 272.352 2.411 10 20 CECD CO[C@H](CNCc1ccc(N2CCOCC2)cc1)C1CC1 393483558 RTIXFJPPNNHVNF-QGZVFWFLSA-N 290.407 2.038 10 20 CECD CCNC(=S)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819021387 RIZNFBUKFSYQDA-LBPRGKRZSA-N 293.436 2.006 10 20 CECD CC(C)[C@@H]1C[C@H]1N1C(=O)CN(Cc2ccccc2O)C1=O 819170238 ZRIGTIVAHPIDQB-QWHCGFSZSA-N 288.347 2.201 10 20 CECD C[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)c1ccncc1 817939168 AAPDPVRLNKBLQB-GUYCJALGSA-N 284.407 2.498 10 20 CECD CC[C@H](NC[C@H]1CNCCO1)c1cccc(Cl)c1O 817984188 VTYKENPGRZUFKR-MFKMUULPSA-N 284.787 2.075 10 20 CECD CC[C@H](O)[C@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 822576083 GVNYERCJOFANGA-LRDDRELGSA-N 290.407 2.092 10 20 CECD CCOC(=O)[C@H]1CCCCN1C(=O)c1cc(O)cs1 824776010 DNVQJEHNMRNUMX-SNVBAGLBSA-N 283.349 2.012 10 20 CECD Cc1cc(O)c(CN(CCO)C2CC2)cc1Cl 824561217 SRMPOKMUSGYKCR-UHFFFAOYSA-N 255.745 2.311 10 20 CECD C[C@@H](N[C@@H]1COC[C@H]1O)c1ccc(N2CCCCC2)cc1 834898156 ZWULAFDTGHWKSX-KBRIMQKVSA-N 290.407 2.087 10 20 CECD CCn1ncc(CNCCCSc2nccs2)n1 838961822 DIRRWAFOSHDLIN-UHFFFAOYSA-N 283.426 2.027 10 20 CECD CO[C@H](CC(=O)Nc1ccc(N)cc1)C(F)(F)F 846662628 VORBJNJOENPLCL-SECBINFHSA-N 262.231 2.175 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC(=O)N(CC2CC2)C1 840940642 IYRMTQLDKZWZJA-UHFFFAOYSA-N 287.407 2.073 10 20 CECD O=C1CN(Cc2cc3oc4ccccc4c3cc2O)CCN1 915808273 AQECYLCKTHTPQO-UHFFFAOYSA-N 296.326 2.223 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCNC1CC1 841089560 IHDCBXBRCIUPMG-UHFFFAOYSA-N 261.413 2.293 10 20 CECD Cc1cc(O)c(CN2CC[C@]3(CCNC3)C2)cc1C 843120883 XGPUQCKGKVIECD-INIZCTEOSA-N 260.381 2.194 10 20 CECD Cc1cc(O)c(CN2CC[C@H]3NCC[C@@H]3C2)cc1C 843126039 FEZDFWKHXGCKMT-UKRRQHHQSA-N 260.381 2.193 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCNC(=O)[C@@H]1C(C)C 840915017 ZADCHUBGMXVOEH-INIZCTEOSA-N 289.423 2.017 10 20 CECD COCC[C@H](C)CNC(=O)NCc1cc(C)ccc1O 858535670 FESMVVMNGFFCGP-LBPRGKRZSA-N 280.368 2.172 10 20 CECD CC[C@H](C)N(C)CCNC(=O)NCc1cc(C)ccc1O 858194676 JOOGJCCSUGEPSO-ZDUSSCGKSA-N 293.411 2.230 10 20 CECD C[C@@H](CCNCc1c(O)cccc1Cl)N(C)C 697838341 PXZVTRBFVOXTSS-JTQLQIEISA-N 256.777 2.475 10 20 CECD C[C@@H](N[C@@H](CO)CC1CC1)c1cc(F)cc(F)c1O 756768351 CZSJFVBBQRGMGH-LDYMZIIASA-N 271.307 2.482 10 20 CECD C[C@H](O)CCN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756572670 NHYWLOHTPRVLCN-YWVKMMECSA-N 253.317 2.440 10 20 CECD COC(C)(C)CCNC(=O)NCc1cc(C)ccc1O 868994241 XGBMSHOXKNVCLZ-UHFFFAOYSA-N 280.368 2.315 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@@H]2CCCOC2)c1 862756182 SDMWXVHJIFHZHV-LBPRGKRZSA-N 263.337 2.134 10 20 CECD CCN(CC1(CS(C)(=O)=O)CC1)c1ccc(OC)cc1 767423341 UTDHOWYSAMKAPJ-UHFFFAOYSA-N 297.420 2.346 10 20 CECD C[C@H](C(=O)NC(C)(C)C)N(C)Cc1cc(F)ccc1O 777221039 XPICREWLIYWWSX-SNVBAGLBSA-N 282.359 2.266 10 20 CECD Cc1ccc(CN(CCO)C2CCSCC2)c(O)c1 877574237 ZYWNJZFBLQJWGS-UHFFFAOYSA-N 281.421 2.391 10 20 CECD Nc1ccc(CN2CCC[C@H](c3ncc[nH]3)C2)cc1 1120371481 YWSOOMQIBTXPPR-ZDUSSCGKSA-N 256.353 2.372 10 20 CECD Cc1ccccc1C[C@H](CO)NC(=O)c1cc(O)cs1 788005440 FTAYSCDKZISXTQ-GFCCVEGCSA-N 291.372 2.096 10 20 CECD COc1ccc(CN[C@H]2CC[C@H](CO)CC2)c(O)c1OC 893125066 AGUDSCKZQRKUKO-AULYBMBSSA-N 295.379 2.050 10 20 CECD COc1cc(C)cc(CN[C@H](C)Cc2cnccn2)c1O 894207763 XSRSRZAEOUGAEW-GFCCVEGCSA-N 287.363 2.220 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)C[C@@]1(C)CO 895345509 VDRRZYLFNUUWDA-XPTSAGLGSA-N 271.307 2.121 10 20 CECD Cc1cccc(O)c1CNCCO[C@H]1CCCCO1 894797306 QKJDSQCHCMACGE-HNNXBMFYSA-N 265.353 2.333 10 20 CECD CN(Cc1cc(F)cc(F)c1O)CC1(O)CCC1 894460943 AHBLYTBHQWGBEK-UHFFFAOYSA-N 257.280 2.017 10 20 CECD CC[C@H](NCCN1CCO[C@H](C)C1)c1ccc(C)cc1O 794807790 LQWXMJLZNMHVRR-ZBFHGGJFSA-N 292.423 2.462 10 20 CECD COc1cccc(CN[C@H](CO)c2ccccc2)c1O 62999392 GIIUBTLZDKDYHE-CQSZACIVSA-N 273.332 2.224 10 20 CECD COc1ccc(CNC(=O)NC[C@@H]2CC2(C)C)c(O)c1 792939303 YCYMASDPWQXLNS-NSHDSACASA-N 278.352 2.246 10 20 CECD COc1ccc(CNc2ncnc3ncccc23)c(O)c1 794862480 BGJHLBSHEIWSNF-UHFFFAOYSA-N 282.303 2.351 10 20 CECD C[C@](O)(CNCc1c(O)ccc(Cl)c1F)C1CC1 790962733 NWGQKEUVJIPAIL-ZDUSSCGKSA-N 273.735 2.435 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](OC)C2CC2)c1 792237715 HRDLVUVDMUZEQL-LKFCYVNXSA-N 279.336 2.003 10 20 CECD CCOc1cccc(CN[C@@H](CO)CC2CC2)c1O 754832741 KFELDZAPOOOZQY-CYBMUJFWSA-N 265.353 2.042 10 20 CECD COc1ccc(CN[C@H](C)Cc2cnn(C)c2)cc1C 768400964 BWOBEOJNRGQKJT-CYBMUJFWSA-N 273.380 2.458 10 20 CECD C[C@H]1C[C@H]1C(=O)Nc1c(Cl)ccc2nonc12 1326698589 NVEPNVUTPVMKMX-NTSWFWBYSA-N 251.673 2.471 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccns1 1335806308 KCXNJLHZLHCLQA-UHFFFAOYSA-N 275.377 2.448 10 20 CECD CC(C)C[C@@H](NCc1cc(F)c(F)cc1O)C(=O)O 1603037913 YUPSAZBECWTFEM-LLVKDONJSA-N 273.279 2.259 10 20 CECD COC[C@@](C)(CC(=O)O)NCc1cccc(Cl)c1O 1606785553 RNDMXOIRMAFFKK-CYBMUJFWSA-N 287.743 2.015 10 20 CECD CN(C)c1ccc(OCCOCC(F)F)cc1C(=O)O 1606058857 QZAVKSFEENSOPH-UHFFFAOYSA-N 289.278 2.111 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccc(C)nc2)c1 161338129 KCXIOFQWKJBGGE-UHFFFAOYSA-N 287.319 2.426 10 20 CECD C[C@H](N[C@H](C)c1nncn1C)c1ccc(F)cc1O 62746964 XDYBETDOFFFZPI-DTWKUNHWSA-N 264.304 2.072 10 20 CECD CC(C)[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)N(C)C 106460894 JIIXIUHFSUGNSF-HNNXBMFYSA-N 295.402 2.094 10 20 CECD COc1cccc(C(=O)N(C)Cc2ccccc2O)c1O 119957092 NRXOGXISDWSWMF-UHFFFAOYSA-N 287.315 2.379 10 20 CECD CCOCc1cc(CNC[C@@](C)(O)CC)ccc1OC 171785664 WGTRHXPEIIXMHK-INIZCTEOSA-N 281.396 2.482 10 20 CECD CCCN(CC(=O)OCC)Cc1cc(OC)ccc1O 179826027 HMQOSYQNFOHDDU-UHFFFAOYSA-N 281.352 2.176 10 20 CECD C[C@@H]1CSCCN1Cc1cc2c(cc1O)OCO2 172515449 CNDKJTAEYWKIIA-SECBINFHSA-N 267.350 2.058 10 20 CECD COCC1(CNCc2cc(F)ccc2O)CCC1 282427519 IXSVSTUSIFFFGW-UHFFFAOYSA-N 253.317 2.438 10 20 CECD CCN(CC)CC(=O)NCc1c(O)ccc2c1CCCC2 75159701 UKHFKGGDHGEXCG-UHFFFAOYSA-N 290.407 2.229 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1cc(F)ccc1O 180195649 SBJIIRCDTUOPPZ-GFCCVEGCSA-N 267.300 2.059 10 20 CECD CCOc1ccc(N(C)CC[C@H]2CCOC2=O)cc1 120688604 RORWXYKUROQGPI-LBPRGKRZSA-N 263.337 2.475 10 20 CECD Cc1cnc(NC(=O)c2cccc(O)c2O)s1 126222429 AXMNMHJGKOTEOA-UHFFFAOYSA-N 250.279 2.115 10 20 CECD COc1ccc(CN[C@H](C)[C@H](CO)SC)cc1C 219070658 MJDOZKVMJSMPLJ-RISCZKNCSA-N 269.410 2.206 10 20 CECD C[C@@H]1C[C@H]1CNC(=O)NCc1ccc(N(C)C)cc1 48141305 IHKRITFLXQGLRY-YPMHNXCESA-N 261.369 2.208 10 20 CECD Cc1cncc(CNC(=O)NCc2ccc(N(C)C)cc2)c1 133900967 FWMQTGHIVXEAFI-UHFFFAOYSA-N 298.390 2.455 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCC(=O)NC2CC2)c1 92987192 CHZRGOFQBHMZIV-LLVKDONJSA-N 292.379 2.110 10 20 CECD C[C@H](NCc1nnc2n1CCC2)c1ccc(N(C)C)cc1 268789014 XBAVSYNVPBXZBV-LBPRGKRZSA-N 285.395 2.141 10 20 CECD CCCOc1ccc(CN[C@@H](C(=O)OC)C2CC2)c(O)c1 276408352 DZWNXRRQCJMVME-OAHLLOKOSA-N 293.363 2.222 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1c(O)cccc1Cl 271174186 GCNBYCFKHIQIQP-GFCCVEGCSA-N 282.771 2.146 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@H](C)CN)c1C 274392310 DMZAECNXXTUDHC-GFCCVEGCSA-N 285.391 2.480 10 20 CECD CO[C@H](C)CN(C)Cc1ccc(N(C)C)c(F)c1 289591475 KMITUAPIKZGEFU-LLVKDONJSA-N 254.349 2.358 10 20 CECD CCNC(=O)[C@@H](C)N[C@@H](C)c1c(C)cc(C)cc1O 293677666 KDZAZHUYONOCTP-NWDGAFQWSA-N 264.369 2.184 10 20 CECD COC(=O)c1cnc(S[C@@H](C(=O)OC)C(C)C)s1 295142563 DHELDWIAXOHYOI-MRVPVSSYSA-N 289.378 2.219 10 20 CECD CC[C@@H](NCc1cnn(CCOC)c1)c1ccccc1O 800494945 JIEVZZVLPTWEJI-OAHLLOKOSA-N 289.379 2.476 10 20 CECD Cc1cc(Br)cc([C@@H](C)NC2CNC2)c1O 817956258 VAYMXYRKDAAECS-MRVPVSSYSA-N 285.185 2.086 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@]2(C)CC2(F)F)cc1 817423533 MFAJKMFHGBRWGB-CYBMUJFWSA-N 268.307 2.414 10 20 CECD CCOCc1cc(CNC[C@@H](O)C2CCC2)ccc1OC 825240165 IKFKJJURLLIWPT-MRXNPFEDSA-N 293.407 2.482 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CC[C@H]2CCCCN12 901125509 YESIKYUBAGGYHU-KGLIPLIRSA-N 274.364 2.025 10 20 CECD CCc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)no1 907272140 FESJJDGZFWIJHF-VIFPVBQESA-N 290.319 2.009 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@H](CC(=O)O)C2)cc1 905810598 JNVXDZLSFZOPNC-UONOGXRCSA-N 276.380 2.486 10 20 CECD C[C@@H](O)C[C@H]1CCCCN1C(=O)c1cc(O)cs1 834740830 YSMKRNBAQRUJBK-NXEZZACHSA-N 269.366 2.219 10 20 CECD CC[C@H](O)[C@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 900026110 IWIYKLMESPPAPK-WFASDCNBSA-N 278.396 2.118 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)CC[C@H]1N 843050950 CGDRAHUVLRCKGR-LDYMZIIASA-N 272.751 2.354 10 20 CECD COc1ccc(CN[C@@]2(C(=O)O)CCSC2)cc1C 841800564 HFLRKVSRPNLMIL-AWEZNQCLSA-N 281.377 2.054 10 20 CECD CCON(C(=O)c1ccc(C)c(O)c1O)C(C)C 844077536 LKCLNOWZIKEINS-UHFFFAOYSA-N 253.298 2.208 10 20 CECD CCCc1[nH]ccc1C(=O)NCc1ccc(O)cc1O 910945811 ZHDKUIXZCFTYMX-UHFFFAOYSA-N 274.320 2.308 10 20 CECD Cc1cc(O)c(CNCCc2nnc3ccccn23)cc1C 742366083 HEVNMCIKRSZEOO-UHFFFAOYSA-N 296.374 2.384 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@H](C)c1ccc(Cl)cc1O 841756059 PLJPHZIXRMCLBL-YDEJPDAXSA-N 271.744 2.110 10 20 CECD CC1(NC(=O)/C=C\c2ccc(O)c(O)c2)CC=CC1 848269239 VVJGGHBZPONQMH-ALCCZGGFSA-N 259.305 2.336 10 20 CECD Cc1nnc(NCc2cc(Cl)ccc2O)nc1C 845709769 XBMSUXGYLQSJJC-UHFFFAOYSA-N 264.716 2.460 10 20 CECD CCOc1ccc(CN2CCC(C)(N)CC2)c(O)c1 843109550 XYTYFTYBXQGBEK-UHFFFAOYSA-N 264.369 2.104 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CS[C@H](C)C2)c(O)c1 840413292 GQBVRTYWPVSFRV-MWLCHTKSSA-N 296.392 2.094 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 842913311 ZHLNGEOQCZQKJO-UORFTKCHSA-N 281.327 2.083 10 20 CECD CC1(C)CN(C(=O)NCCc2ccc(N)cc2)CCS1 841956981 CPGQLEYRCTUDDV-UHFFFAOYSA-N 293.436 2.348 10 20 CECD Cc1ncc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)o1 840795412 ZILJLLRZBZWMPG-MRVPVSSYSA-N 277.280 2.448 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1cc(C)c(C)cc1O 759174525 VKBROIZFLQIAMQ-HOCLYGCPSA-N 279.380 2.293 10 20 CECD COc1ccc(N(C)C[C@H]2COC(C)(C)O2)cc1 852210014 WAPKXBYMXQUFOY-ZDUSSCGKSA-N 251.326 2.283 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3CCC[C@@]3(N)C2)c1 857226303 KISNRORGNISBMM-XJKSGUPXSA-N 276.380 2.104 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1csnn1 769292957 UAYWDEWATVZPPU-UHFFFAOYSA-N 277.349 2.296 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N(C1CC1)C1CC1 862852682 PHFMNULATQNKDH-WAPJZHGLSA-N 259.305 2.264 10 20 CECD COCC[C@@](C)(O)CNCc1cc(Cl)cc(F)c1O 776175441 LNQYLXQTXYGAEV-CYBMUJFWSA-N 291.750 2.062 10 20 CECD O=C(NCc1cccc(F)c1)c1c(F)ccc(O)c1O 789955262 QKEYBQSVKPMUNW-UHFFFAOYSA-N 279.242 2.306 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H]2[C@@H](O)CC[C@H]2C1 895780387 JIRIFNJHDQSVIV-UAGQMJEPSA-N 274.408 2.264 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCCC[C@H]2O)c1O 895225952 MPSDUUXSJXTNQV-CHWSQXEVSA-N 265.353 2.102 10 20 CECD COc1cc(C)cc(CNCCOC(C)C)c1O 894461099 MBBHSEOCIANFNR-UHFFFAOYSA-N 253.342 2.224 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@H]2CCO)c1O 189951076 PJGPTFHBFWIAQV-WCQYABFASA-N 265.353 2.042 10 20 CECD CC[C@H](C)NC(=O)CCN[C@@H](C)c1ccc(F)cc1O 62747825 OCKIPYMGIATOOZ-QWRGUYRKSA-N 282.359 2.487 10 20 CECD CC[C@H](N[C@@H](C)[C@H]1CN(C)CCO1)c1ccc(C)cc1O 794819421 WQBKLVZLNWDXLY-JLJPHGGASA-N 292.423 2.460 10 20 CECD CC[C@@H](NCc1nnnn1C1CC1)c1ccc(F)cc1O 796817709 KFUXDPMOCKYQMM-GFCCVEGCSA-N 291.330 2.094 10 20 CECD CCc1cccc(CN2CCCC[C@H]2C(=O)NC)c1O 692092220 JKWVGTMJJUFBCX-AWEZNQCLSA-N 276.380 2.055 10 20 CECD CC(C)CCS(=O)(=O)N[C@H](C)c1ccccc1O 867833939 IGBCYCXADMABIL-LLVKDONJSA-N 271.382 2.419 10 20 CECD CC(=O)NCCC1=CCN(c2cnc3ccccc3n2)CC1 1089802144 GHFJXPJCXCHILU-UHFFFAOYSA-N 296.374 2.293 10 20 CECD COc1cc(C(=O)NCc2ccc(N(C)C)cc2C)ccn1 1322902923 JWGXQEDHCMXFLZ-UHFFFAOYSA-N 299.374 2.395 10 20 CECD CCN(CC)C[C@H](C)N[C@H](C)c1cc(C(=O)O)ccc1O 1609999139 LYPITSKVDAOTOB-NWDGAFQWSA-N 294.395 2.471 10 20 CECD O=C(O)[C@@H](CC(F)F)NCc1cc(Cl)ccc1O 1601638998 CBLMSBKEEHUSRM-MRVPVSSYSA-N 279.670 2.244 10 20 CECD Cc1cc(O)c(CN[C@H]2CCC[C@@H]2C(=O)O)cc1C 1610475637 HDSAJACYDADZRF-STQMWFEESA-N 263.337 2.352 10 20 CECD Nc1ccc(NC(=O)NN2C[C@H]3CCC[C@H]3C2)cc1 1580449893 XDESQRGEVHGWNW-PHIMTYICSA-N 260.341 2.037 10 20 CECD C[C@@H](NCCc1ccc(N)cc1)c1ncc(C(=O)O)s1 1593274151 IFSFJKSZUQDWFD-SECBINFHSA-N 291.376 2.317 10 20 CECD Cc1cc(O)c(CNC[C@@H](C)C(=O)O)c(Cl)c1 1594327286 WBJCXRRUPGQJHV-MRVPVSSYSA-N 257.717 2.164 10 20 CECD O=C(O)c1ccnc(CNCc2cc(F)cc(F)c2O)c1 1777690527 BUXSOBFBWFNFGW-UHFFFAOYSA-N 294.257 2.053 10 20 CECD c1cc2c(cc1CN[C@@H]1CCCNCC1)CCCO2 904355026 KAIFPXXYYNCZCJ-OAHLLOKOSA-N 260.381 2.243 10 20 CECD c1cc2c(cc1CN[C@@H]1CC[C@@H]3CNC[C@H]3C1)CCO2 843341594 VSBSIHJELQFTLA-BZUAXINKSA-N 272.392 2.099 10 20 CECD CN(Cc1ccccc1O)C(=O)CCCCCCN 37823750 QKTGCTLFNVRSAU-UHFFFAOYSA-N 264.369 2.260 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCc1nncn1C 38007588 DNHNQDOVQBAUDG-WDEREUQCSA-N 272.352 2.167 10 20 CECD CO[C@@](C)(CNC(=O)Nc1ccc(N)cc1)C1CC1 311787223 ZPAVAIWEFFYDRJ-AWEZNQCLSA-N 263.341 2.205 10 20 CECD CC1(C)CCN(Cc2ccccc2O)CC[S@@]1=O 322096423 IHIKBVAYCOSOST-SFHVURJKSA-N 267.394 2.125 10 20 CECD O=C(O)C[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 708214579 CPRWTPSBQXOELQ-VIFPVBQESA-N 285.290 2.357 10 20 CECD C[C@@H](CCN(C)C)NCc1cc(F)cc(F)c1O 708440678 DVZMJBPZSPZUCZ-VIFPVBQESA-N 258.312 2.100 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NC(C)C)c1 103504812 NUZGPFDHMOKRML-SECBINFHSA-N 252.314 2.169 10 20 CECD Oc1ccc(CCNc2ncnc3ncccc23)cc1O 118993936 BVECFUSNLVQBHH-UHFFFAOYSA-N 282.303 2.091 10 20 CECD Oc1ccccc1CNC[C@H](O)c1ccc(F)cc1 60358327 IOBXNZYMZQFRMR-HNNXBMFYSA-N 261.296 2.355 10 20 CECD COCCN(CC(C)C)C(=O)/C=C/c1ccc(O)c(O)c1 180917929 VOFIOGRVQKDONR-FNORWQNLSA-N 293.363 2.242 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)C[S@](C)=O)c1 186540096 PTZOGMSTAVEPIP-RLFDGXBXSA-N 255.383 2.118 10 20 CECD O=C(O)c1ccc2c(c1)N(C(=O)/C=C/c1cccnc1)CC2 317177005 VGIVMFJZQOZMOB-ZZXKWVIFSA-N 294.310 2.382 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1COc2ccccc2C1 133769125 JLFWBUKQCLYILH-AWEZNQCLSA-N 283.327 2.260 10 20 CECD COCCN(Cc1ccon1)c1ccc(OC)c(OC)c1 81155992 PZLSEBRPDYCQOD-UHFFFAOYSA-N 292.335 2.345 10 20 CECD C[C@@H](NC1CCN(C)CC1)c1ccc(F)c(F)c1O 191187951 JGFUXVNNBFDIBC-SECBINFHSA-N 270.323 2.415 10 20 CECD COc1ccc([C@H]2NC(=O)c3ccccc3N2)c(O)c1 46836217 CREDPSQQSSSWEZ-CQSZACIVSA-N 270.288 2.255 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)Nc1cnn(C)c1 192773478 GLMIQIZHUJQOLM-UHFFFAOYSA-N 287.367 2.150 10 20 CECD COc1ccc(O)c(CN[C@@H](C)c2cnccn2)c1 89726298 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10 20 CECD CCn1ccnc1CN1CCCc2cc(CN)ccc21 700898700 KVEVMRGUFKWXDR-UHFFFAOYSA-N 270.380 2.315 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1cc(C)ccc1O 186223617 JUCZDWFYCRSGJI-NSHDSACASA-N 264.369 2.123 10 20 CECD CCCCN(CCO)Cc1cc(F)cc(F)c1O 893878268 TWAZBTCPPGXYEJ-UHFFFAOYSA-N 259.296 2.265 10 20 CECD CC1(CNCc2c(O)cccc2Br)COC1 706868289 AUIWSUWGNWPROK-UHFFFAOYSA-N 286.169 2.281 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)cc1C 792193223 UDMHSLZFUCPRHY-WURKVNMJSA-N 281.421 2.350 10 20 CECD CN[C@@H](C)CCNC1CCN(c2ccc(OC)cc2)CC1 1345469062 BDQABFLKVJXUGN-AWEZNQCLSA-N 291.439 2.252 10 20 CECD Nc1ccc(CNC(=O)c2ccc3cc[nH]c3n2)cc1 1580445754 UHBRLCJZBPUTTK-UHFFFAOYSA-N 266.304 2.075 10 20 CECD CCOc1cccc(CN[C@@H]2CC=C(C(=O)O)C2)c1O 1597155931 WHRHGQTVWBLEMV-GFCCVEGCSA-N 277.320 2.054 10 20 CECD COc1cccc(CNc2nc(C(=O)O)c(C)s2)c1O 1599675241 ATFVHWSNNDKYAN-UHFFFAOYSA-N 294.332 2.476 10 20 CECD CN(Cc1cncs1)c1ccc(OCC(=O)O)cc1 1598534728 WAQSUVKQUQNYRF-UHFFFAOYSA-N 278.333 2.243 10 20 CECD C[C@]1(C(=O)O)CC[C@H](NCc2cc(F)cc(F)c2O)C1 1776501993 XUHVEIDWCZNWIN-HZMBPMFUSA-N 285.290 2.403 10 20 CECD COc1ccc(N2CCC(NCC3(C)COC3)CC2)cc1 164403023 WIAOOLSSSGWZTM-UHFFFAOYSA-N 290.407 2.290 10 20 CECD COc1ccc(F)cc1C(=O)NCc1ccc(O)c(O)c1 159121290 YPHBZHSECLRKHH-UHFFFAOYSA-N 291.278 2.176 10 20 CECD COc1cc(O)c(CN(C)Cc2cscn2)cc1OC 159933624 LNDYVZBBPYMRML-UHFFFAOYSA-N 294.376 2.498 10 20 CECD C[C@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)CCN1 904356313 VPVSDZWSUMAVKI-WFASDCNBSA-N 260.381 2.242 10 20 CECD C[C@H](CC[S@@](C)=O)NCc1ccc2c(c1)CCCO2 921831467 WIYVHAMWXUXNGI-CWTRNNRKSA-N 281.421 2.258 10 20 CECD CC(C)N1CC[C@H](N(C)Cc2cc(F)ccc2O)C1 825337713 IPUKUKFOFVWNBW-AWEZNQCLSA-N 266.360 2.446 10 20 CECD COc1cccc(O)c1CNC[C@H](C)CC1(C)OCCO1 865675389 ZJFJYIIDJBZCNZ-GFCCVEGCSA-N 295.379 2.280 10 20 CECD C[C@H](NCCc1cnccn1)c1ccc(N(C)C)cc1 390245097 VOKTVDIEGYXIJD-ZDUSSCGKSA-N 270.380 2.436 10 20 CECD C[C@H]1C[C@@H](C(=O)O)CN(Cc2cc(F)ccc2O)C1 398830131 HEZBHUGZPMUYKJ-GXSJLCMTSA-N 267.300 2.074 10 20 CECD Cc1cccc(CNCCC(C)(C)C(=O)O)c1O 818629233 WLOOTNWQLBBURH-UHFFFAOYSA-N 251.326 2.291 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CSCCS1 175199028 SNOZOHCEWKTBPR-LBPRGKRZSA-N 283.418 2.199 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)CC[C@H]1N 251669777 HHVLUBIWWPDUAK-BXKDBHETSA-N 254.761 2.215 10 20 CECD CCC1=C(C(=O)NCc2cccc(OC)c2O)CCCO1 189552789 VEBCAWWTNBXTLS-UHFFFAOYSA-N 291.347 2.492 10 20 CECD Cc1cccc2c1C(=O)N[C@H](c1ccc(O)c(O)c1)N2 48619667 DKJLQPKWTBGMJU-CQSZACIVSA-N 270.288 2.260 10 20 CECD CC(C)c1nn(C)cc1C(=O)NCCc1ccc(N)cc1 269150137 PJGJMRXNGZFZDZ-UHFFFAOYSA-N 286.379 2.098 10 20 CECD C/C=C(\C)C(=O)NCc1ccc(N2CCOCC2)cc1 267534977 UZRXGNPOSBNILC-QLKAYGNNSA-N 274.364 2.106 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cccc(N)n1 269703309 RQZTYGNWYMABMZ-UHFFFAOYSA-N 285.347 2.422 10 20 CECD C[C@H](NC[C@H]1CCOC1)c1ccc(F)c(F)c1O 276916181 LRQWYRVTDLAYJQ-DTWKUNHWSA-N 257.280 2.358 10 20 CECD CO[C@H]1CCCC[C@@H]1NC(=O)c1ccc(C)c(O)c1O 272737997 LLCRLGFEOLMKEZ-RYUDHWBXSA-N 279.336 2.094 10 20 CECD Cc1cc(C)c([C@H](C)NCCCOCCO)c(O)c1 285054275 IPZBGGQLWPQNJM-ZDUSSCGKSA-N 267.369 2.059 10 20 CECD CC[C@H](NCc1ncn(C)n1)c1cccc(Cl)c1O 287625128 KAKPCVIJQBHSGX-NSHDSACASA-N 280.759 2.415 10 20 CECD CC(C)ONC(=O)NCc1ccc2c(c1)CCCN2C 297026391 BKQQLOSPXINSQY-UHFFFAOYSA-N 277.368 2.208 10 20 CECD Cc1cnn([C@H]2CCN(Cc3ccccc3O)C2)c1 290374987 ATDKUZCUZFPXAI-AWEZNQCLSA-N 257.337 2.344 10 20 CECD COc1cccc(O)c1CNCc1nccc(C(F)F)n1 808435536 ONQSPKWBFMGHPE-UHFFFAOYSA-N 295.289 2.418 10 20 CECD O=C(CCc1ncc[nH]1)NCCCSc1nccs1 806851218 JRLRJIPNIDNYSX-UHFFFAOYSA-N 296.421 2.097 10 20 CECD O=C1CCC(COC(=O)/C=C\c2ccc(O)c(O)c2)CC1 803400147 RWWPXXKJBVOZOZ-YWEYNIOJSA-N 290.315 2.414 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCC1(F)F 811780535 OKYWLVRPEXVOBP-TVQRCGJNSA-N 299.317 2.295 10 20 CECD COc1cc(C)nc(NCc2cc(C)ccc2O)n1 813354903 NANNWTQJYZIBGG-UHFFFAOYSA-N 259.309 2.420 10 20 CECD Oc1ccc(Cl)cc1CN1CCC[C@@H](O)CC1 816667891 YYDLDQFBEGUTGE-GFCCVEGCSA-N 255.745 2.392 10 20 CECD CCOc1cccc(CN2CC[C@H](CCCO)C2)c1O 825338886 WXLZVKJKIHBDKY-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD CC(C)c1nc(COC(=O)c2cc(O)cs2)no1 732354105 ZUOUCFHYNSCUMK-UHFFFAOYSA-N 268.294 2.317 10 20 CECD CC[C@H]1CN(CC)CCN1C(=O)c1cc(O)cs1 839785344 FPPQCWIIODMIKQ-JTQLQIEISA-N 268.382 2.010 10 20 CECD CCCCSCC(=O)NCc1ccc(O)cc1O 910951151 CQVZUEVJEAPICT-UHFFFAOYSA-N 269.366 2.247 10 20 CECD COc1cccc([C@@H](C)NCCc2cnn(C)c2)c1O 846145316 PHVDHVLQBKJAMX-LLVKDONJSA-N 275.352 2.028 10 20 CECD CCOc1cccc(CN2[C@H]3CCNC[C@H]2CC3)c1O 843058600 WLAHVVRSXYYPKV-ZIAGYGMSSA-N 276.380 2.117 10 20 CECD CC(C)(C)[C@@H](O)C(=O)NCc1cc(Cl)ccc1O 846474585 VRUJFGBXYOBLTG-NSHDSACASA-N 271.744 2.069 10 20 CECD CNC[C@@H]1CCN(Cc2ccc(N(C)C)cc2C)C1 843052147 HPQDHLSBQXRVHH-AWEZNQCLSA-N 261.413 2.102 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1C[C@H]1C=CCC1 925064610 BIYQJRJLXNONKD-LBPRGKRZSA-N 286.331 2.123 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCCOC(C)C)c1 858103317 OWVCBYFHVGDNGZ-UHFFFAOYSA-N 280.368 2.315 10 20 CECD CCOCc1cc(CN[C@H](C)C2(CO)CC2)ccc1OC 850361625 UGOOSKLVOWRXFO-CYBMUJFWSA-N 293.407 2.482 10 20 CECD CCCCN(C)Cc1cc2c(cc1O)OC[C@@H]2O 768441770 MTCVSCDAKGBWEB-ZDUSSCGKSA-N 251.326 2.050 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](C)Oc2cccnc2)c1 862759496 DYHINEMTDAQIQC-GFCCVEGCSA-N 286.331 2.179 10 20 CECD CCOc1ccc(CN2CCCC3(C2)OCCO3)c(O)c1 761215473 QDNGMDJUTQTMMK-UHFFFAOYSA-N 293.363 2.130 10 20 CECD C[C@H](NC(=O)C1CSC1)c1ccc(N(C)C)cc1 867503699 OVQGSSDUXDENRI-JTQLQIEISA-N 264.394 2.293 10 20 CECD Cc1cccc(O)c1CN(C)CC(=O)NCc1ccco1 876541662 DKGRBMFJQXMEOY-UHFFFAOYSA-N 288.347 2.042 10 20 CECD OC[C@H]1CCCN1Cc1ccc(N2CCCC2)cc1 1116436769 AQEHSHMFBWZBHR-MRXNPFEDSA-N 260.381 2.244 10 20 CECD C[S@@](=O)CCCNCc1cc(Cl)cc(F)c1O 776208367 ABZMQJWMWMKPDK-QGZVFWFLSA-N 279.764 2.043 10 20 CECD C[C@@H](NC(=O)C1(N)Cc2ccccc2C1)c1ccccc1O 877255463 DRQHDUOKUBSBDU-GFCCVEGCSA-N 296.370 2.066 10 20 CECD CN1CCN(c2ccc(/C=C/c3nccc(O)n3)cc2)CC1 771527074 ZPOQGVKSDCMFIM-QPJJXVBHSA-N 296.374 2.104 10 20 CECD Nc1ccc(CNC(=O)[C@H]2CCOC3(CCC3)C2)cc1 886920648 FQOYWOBFRCNYDN-ZDUSSCGKSA-N 274.364 2.234 10 20 CECD C[C@H](N[C@H]1CCc2n[nH]cc2C1)c1c(O)cccc1F 886551054 ANEYMLQKXCWKKY-ONGXEEELSA-N 275.327 2.463 10 20 CECD C[C@H](CO)N(C)Cc1cc(Br)cc(F)c1O 894769343 DTGAKEVIPAVVHX-SSDOTTSWSA-N 292.148 2.106 10 20 CECD COc1ccc(CNCCc2nccs2)c(O)c1OC 892760790 PYWRPCNVQPORTE-UHFFFAOYSA-N 294.376 2.198 10 20 CECD COc1ccc(CNC(=O)C[C@@H]2CCC(=O)[C@H]2C)c(O)c1 794374432 SYOKSGAZXHCHII-QWRGUYRKSA-N 291.347 2.022 10 20 CECD O=C(COC(F)F)Nc1c(Cl)ccc2nonc12 1327167163 OHVIEDXAZAZQIW-UHFFFAOYSA-N 277.614 2.054 10 20 CECD CC1(C)CN(Cc2ccc(N3CCCC3)cc2)C[C@@H]1O 1339516786 AQAYOJLXALUJIG-INIZCTEOSA-N 274.408 2.490 10 20 CECD O=C(O)c1nccnc1NCc1ccc2cccnc2c1O 1602579841 RKWVDAADXOYNQL-UHFFFAOYSA-N 296.286 2.041 10 20 CECD O=C(O)c1ccnc(NCCCSc2nccs2)n1 1602484106 RLXKYTYQWMFXCM-UHFFFAOYSA-N 296.377 2.226 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](CC(=O)O)C2CC2)c1O 1603103651 UUKMMUCYWPWDEH-CYBMUJFWSA-N 295.310 2.077 10 20 CECD CCCN(c1ccc(CN)cc1)[C@H](C)[C@H]1C[C@@H]1C(=O)O 1605320799 PSGIDBDYPPUPJL-DFBGVHRSSA-N 276.380 2.471 10 20 CECD CC[C@H](C)[C@@H](C(=O)O)N(C)Cc1ccccc1O 1604921928 CXNDKCQOKOTKJJ-GWCFXTLKSA-N 251.326 2.323 10 20 CECD C[C@H](NCCC(=O)O)c1cc(Br)ccc1O 1589126989 RSWYLVJADAMDJJ-ZETCQYMHSA-N 288.141 2.280 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccccc1F 159042912 OHNJTXGRLBZFGN-UHFFFAOYSA-N 261.252 2.167 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)c1nnc2n1CCC2 165016810 OEUZULHJYBTMDV-VIFPVBQESA-N 292.770 2.434 10 20 CECD CCOc1cccc(CNC[C@H]2CCCN(C)C2)c1O 44535079 XYAMJRBZWKBCHG-CYBMUJFWSA-N 278.396 2.222 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@](C)(O)C2CC2)c1 311694750 SVOXSPGLBPRYOL-ZUZCIYMTSA-N 265.353 2.212 10 20 CECD CCOc1cccc(CN2CCOC[C@@H](C)C2)c1O 370187149 WAQPAKWXCOHZQD-LBPRGKRZSA-N 265.353 2.259 10 20 CECD COc1cccc(CN2CCC[C@H](OC)CC2)c1O 377243200 ISCLNEFHDCXKMV-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD O=S(=O)(Nc1ccc(O)c(Cl)c1)c1ccco1 783531354 CRDSCYFTAYRYKM-UHFFFAOYSA-N 273.697 2.439 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2ccccc2O)C1 4590265 QUFAWTYLYGFDOF-ZDUSSCGKSA-N 263.337 2.167 10 20 CECD Cc1cnc(NC(=O)c2ccc(C)c(O)c2O)s1 177665414 MWAUGYWJQRLMHD-UHFFFAOYSA-N 264.306 2.423 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CC=CCC2)c1O 175093583 HJSNVYNUPDVNTM-LBPRGKRZSA-N 276.336 2.309 10 20 CECD NC(=O)[C@H]1CCCN1Cc1ccc(N2CCCCC2)cc1 179577498 ZMDUTHAYMNYCGN-MRXNPFEDSA-N 287.407 2.127 10 20 CECD CSC[C@](C)(O)CNCc1cccc(Cl)c1O 182430940 ZIGNBQKRYJNYIT-GFCCVEGCSA-N 275.801 2.249 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@H](C)c1ccc(N(C)C)cc1 37782525 ZMYGQYWRJQJOJR-UONOGXRCSA-N 289.423 2.414 10 20 CECD CC[C@H](N[C@@H](C)CS(=O)(=O)CC)c1ccccc1O 156562967 WKDVJAZHISCEDK-AAEUAGOBSA-N 285.409 2.256 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)[C@H](C)N 192026924 DFRKFSOZBAYXEJ-NEPJUHHUSA-N 264.369 2.114 10 20 CECD Cc1ccc(O)c(CNC[C@@H](O)c2ccc(C)o2)c1 265985895 NFWJROHFYCBVLC-CQSZACIVSA-N 261.321 2.425 10 20 CECD COc1cccc(CN2C[C@@H](C)O[C@H](C3CC3)C2)c1O 280671160 UFRRUVLAUYDFAW-ABAIWWIYSA-N 277.364 2.400 10 20 CECD CCCCN(Cc1ccccc1O)Cc1ncnn1C 282518193 SWCCQYMKIPAHFO-UHFFFAOYSA-N 274.368 2.323 10 20 CECD CCc1[nH]ccc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 285683711 BLLWUIXEPWSEHR-SNVBAGLBSA-N 288.347 2.349 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](C)CCCCO)c1 296337244 HQMVZVWORSXQMH-RYUDHWBXSA-N 295.379 2.381 10 20 CECD CCn1nc(C)c(CN(C)c2ccc(OC)c(F)c2)n1 295365890 JMEXUGOLEYQRQL-UHFFFAOYSA-N 278.331 2.391 10 20 CECD Cc1cc(O)c(CN(C)CC(C)(C)CO)cc1C 294785758 LOWXRFCSZJTVKH-UHFFFAOYSA-N 251.370 2.459 10 20 CECD C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cc(O)cs1 807694564 MUTWFBFRGYSXIJ-MNOVXSKESA-N 280.393 2.153 10 20 CECD C[C@@H]1C[C@@H](N[C@@H]2CCNC2)c2c(O)ccc(F)c21 817944426 BSKMDTSUETVQDL-FXPVBKGRSA-N 250.317 2.031 10 20 CECD Oc1cc(F)c(Cl)cc1CNCCc1cnccn1 816560603 UFFFUERBUIMLJN-UHFFFAOYSA-N 281.718 2.307 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1cc(Cl)c(C)cc1O 824895122 QRYKZVNFVHVMKR-ZDUSSCGKSA-N 296.798 2.455 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@]1(C)CO 827699087 DXFQZMJEGNKYCH-QMTHXVAHSA-N 269.772 2.496 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1C(F)(F)F)C(=O)O 901458875 BIDMHKPODXRYMI-QMMMGPOBSA-N 290.285 2.334 10 20 CECD Cc1cc(O)c(CNC2(CO)CCSCC2)cc1C 839178037 YONNMHAWGUYCFV-UHFFFAOYSA-N 281.421 2.357 10 20 CECD CSC[C@](C)(O)CNCc1ccc(N(C)C)cc1C 840933232 FWZCTIIIWMWLMV-OAHLLOKOSA-N 282.453 2.265 10 20 CECD Nc1ccc(NC(=O)c2cnn(C3CCC3)c2)cc1 911659868 GEEHGGOYRPQFES-UHFFFAOYSA-N 256.309 2.443 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1noc(C2CC2)n1 843349711 JMZZBGDZQOGBAK-UHFFFAOYSA-N 284.363 2.359 10 20 CECD C[C@H]1C[C@@H](NCc2cc(Cl)c(F)cc2O)CO1 843432934 RMLDUNKOSBUZKV-IONNQARKSA-N 259.708 2.452 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NC[C@@H](C)CN 841963995 ZBRMNMJTHACMFX-ZDUSSCGKSA-N 293.411 2.299 10 20 CECD CCOc1cccc(CN[C@@H](C)CCCCN)c1O 841081584 YGPSPTXTPFWVHO-LBPRGKRZSA-N 266.385 2.398 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCCN 843485753 NGAIVLDRQCHDNN-UHFFFAOYSA-N 277.412 2.229 10 20 CECD CCOCCOCCN[C@@H](C)c1cc(F)cc(F)c1O 927088304 YTIYDDDDTAUDIA-JTQLQIEISA-N 289.322 2.374 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCC[C@@H]([S@@](C)=O)C2)c1 850355817 LUWVGKPCTXOIEG-PJIJBLCYSA-N 281.421 2.480 10 20 CECD CCOc1ccc(CN2CCC(C)(CO)CC2)c(O)c1 762791865 YVSINFNFFCPVMV-UHFFFAOYSA-N 279.380 2.385 10 20 CECD O=C(CCc1ccncc1)NCc1ccccc1O 133754813 GYOHVGSYJDSNHR-UHFFFAOYSA-N 256.305 2.036 10 20 CECD Cc1ccc(CN[C@H](C)Cc2cnccn2)c(O)c1 876975387 FGHSHXKSOGVNSC-GFCCVEGCSA-N 257.337 2.211 10 20 CECD COc1ccc(O)c(CNC(=O)C2(F)CCCC2)c1 773403019 OKVOQGIYYWTLAD-UHFFFAOYSA-N 267.300 2.299 10 20 CECD COC(=O)[C@H](NCc1ccccc1O)c1cccs1 789570898 GZGJGIPGYVSCQE-CYBMUJFWSA-N 277.345 2.458 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(C)ccc2O)C1 896962329 LQSOHYHMFUUUSN-LBPRGKRZSA-N 263.337 2.086 10 20 CECD COc1cc(C)cc(CN2CC[C@@]3(CCN(C)C3)C2)c1O 793770996 XRUNLNGLSURWHX-QGZVFWFLSA-N 290.407 2.237 10 20 CECD C[C@H](NCc1c(O)ccc(Cl)c1F)c1nncn1C 790959985 QAJRKNYNYCIEIE-ZETCQYMHSA-N 284.722 2.164 10 20 CECD CCc1nnc2ccc(NCc3ccc(OC)cc3O)nn12 795288960 FFRSHPXYGBLTGY-UHFFFAOYSA-N 299.334 2.013 10 20 CECD Cc1ccc(O)c(CN[C@H]2CCn3ccnc3C2)c1 778188724 IDEYEZPSSXEIFK-ZDUSSCGKSA-N 257.337 2.002 10 20 CECD C[C@@H](CCNCc1ccc(N(C)C)cc1)CC(=O)O 1255786602 MPYLFHUTTHIVGD-LBPRGKRZSA-N 264.369 2.343 10 20 CECD C[C@]12CN(C(=O)Cc3ccc(N)cc3)C[C@H]1[C@H]1C=C[C@@H]2C1 1342992900 IQRLWZMIVJORNC-JSSFPYSZSA-N 282.387 2.482 10 20 CECD C[C@@H](CCC(=O)O)NCc1cc(F)cc(F)c1O 1350653327 NEAXEBXECTVCBW-ZETCQYMHSA-N 259.252 2.013 10 20 CECD CC[C@H](F)C(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1752892001 UPLQBNKNJQCIGP-OCCSQVGLSA-N 296.386 2.346 10 20 CECD Cc1cc(C)c(O)c(CN2CCS(=O)(=O)[C@@H](C)[C@@H]2C)c1 164347110 ZIENYHVJLADXAO-STQMWFEESA-N 297.420 2.016 10 20 CECD COc1ccc(N(C)C[C@H](O)CC(F)(F)F)cc1 844352739 FRTVIJOCYLDWEU-SNVBAGLBSA-N 263.259 2.445 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1ccn(C)n1 20351339 WLNDKFBVLKQTMK-GFCCVEGCSA-N 258.369 2.337 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)[C@H](C)N 156574696 JMGLBQOKJYOMHE-OLZOCXBDSA-N 277.412 2.084 10 20 CECD Cc1nc(N)sc1C(=O)NCc1ccc(N(C)C)cc1 55175172 VBASGFOVYXGWQG-UHFFFAOYSA-N 290.392 2.030 10 20 CECD Cc1ccc([C@H](C)NCCc2cncn2C)c(O)c1 401717353 HVUQSVPRSZYBPV-LBPRGKRZSA-N 259.353 2.327 10 20 CECD CCc1cccc(CN[C@H](C)CC[S@@](C)=O)c1O 691499882 JQYOKBSQRSUODL-ADLMAVQZSA-N 269.410 2.201 10 20 CECD CC[C@H](N[C@@H](CO)C[C@H]1CCCO1)c1ccccc1O 886669777 DOGICYOSKOLKMR-NFAWXSAZSA-N 279.380 2.363 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cccnc1 53251604 GFQQOZYMGAMERS-UHFFFAOYSA-N 298.390 2.489 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)C)cc1F 108996910 GWOQBXPHXOZLEN-UHFFFAOYSA-N 267.348 2.443 10 20 CECD COc1cccc(CN[C@@H](C)[C@H]2CCCO2)c1O 20206680 BNZNDJYMDCJRCN-CMPLNLGQSA-N 251.326 2.058 10 20 CECD Cn1ncnc1CN1CCCc2cc(OC(F)F)ccc21 177044559 DBLBKRWHGJYOST-UHFFFAOYSA-N 294.305 2.369 10 20 CECD CSC[C@H](CCO)N[C@@H](C)c1cc(C)ccc1O 185530176 GEJYENDEVSNJJN-RYUDHWBXSA-N 269.410 2.465 10 20 CECD CC[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCO1 31729792 ZTDLCAJYYYPCAW-OAHLLOKOSA-N 291.395 2.073 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1cccs1 183471302 SFBLCJATOQFUDN-JTQLQIEISA-N 291.372 2.449 10 20 CECD COC(=O)c1ccc(C(=O)N(C)Cc2ccccc2O)o1 126713233 WXTYRCDTXQOOHH-UHFFFAOYSA-N 289.287 2.044 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cccc(C)c2O)C[C@H]1C 188112914 ZSOKAMGKIZTMFK-TZMCWYRMSA-N 277.364 2.332 10 20 CECD CSC[C@H](CCO)N[C@H](C)c1cc(C)ccc1O 185530162 GEJYENDEVSNJJN-NEPJUHHUSA-N 269.410 2.465 10 20 CECD C[C@H]1OCC[C@@H]1NCc1ccc2c(c1)CCCN2C 120712913 RAEMXINPJMEBBT-DOMZBBRYSA-N 260.381 2.336 10 20 CECD CC[C@@]1(CO)CCCN1Cc1cc(OC)ccc1O 191957337 MVDZJRJYCXVROV-HNNXBMFYSA-N 265.353 2.138 10 20 CECD COc1cccc(CNCCCn2ccnc2C)c1O 263658675 GUPIGNCTUAOUFL-UHFFFAOYSA-N 275.352 2.086 10 20 CECD COCCO[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 193455301 GAOZSFABVJDIDG-KRWDZBQOSA-N 292.423 2.380 10 20 CECD CN1CCCc2cc(CNCc3cc[nH]n3)ccc21 50286807 UIIPBGGXSDYYQF-UHFFFAOYSA-N 256.353 2.082 10 20 CECD Nc1ccc(CC(=O)N[C@@H]2CCCc3nc(O)ccc32)cc1 269203618 JDAKPHYRYKZPSG-OAHLLOKOSA-N 297.358 2.106 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cnc[nH]2)cc1 263717025 WEUIBVDNAVQNRH-UHFFFAOYSA-N 272.352 2.186 10 20 CECD CCNC(=O)[C@@H](C)N[C@@H](C)c1cc2c(cc1O)CCCC2 273392028 LBFPGJGANNTBTL-NWDGAFQWSA-N 290.407 2.446 10 20 CECD CC[C@@H]1C[C@H]1CN1C(=O)CN(Cc2ccccc2O)C1=O 819169429 IVWKFJSYLIPTRK-YPMHNXCESA-N 288.347 2.203 10 20 CECD COc1ccc(CNC(=O)c2conc2C2CC2)c(O)c1 811484754 IXYTVHNBMPPYRG-UHFFFAOYSA-N 288.303 2.196 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H]2C[C@H](F)CN2)c(O)c1 817976799 ULDCZUWBKWSINN-AGIUHOORSA-N 266.360 2.360 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2ccn(C)n2)cc1 727306119 CMZGZFBGWNGHDB-UHFFFAOYSA-N 286.379 2.196 10 20 CECD CCN(C[C@@H]1CCCO1)C(=O)c1cc(O)cs1 731870030 IIRVSCGQIZFWTN-JTQLQIEISA-N 255.339 2.095 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H]3COC[C@@H]32)c1 839187828 PFEXZBXSBYCHJX-DOMZBBRYSA-N 277.364 2.402 10 20 CECD COc1cc(C)nc(N(C)Cc2ccc(N(C)C)cc2)n1 735487341 UEDICNRJKVLIDP-UHFFFAOYSA-N 286.379 2.496 10 20 CECD CN(C)c1ccc(/C=C\CN[C@@H](CC(F)F)C(=O)O)cc1 901811777 HKEBFYOLRDTGIX-SCOBNMCVSA-N 298.333 2.464 10 20 CECD COCC(COC)N[C@@H](C)c1cc(Cl)ccc1O 834891584 OXMXKLMQJXAHCV-VIFPVBQESA-N 273.760 2.358 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(N)cc2)n(C)n1 837303103 VAQYZPZSVSNGFZ-UHFFFAOYSA-N 272.352 2.056 10 20 CECD CC(C)CCO[C@@H](C)C(=O)NCc1ccc(N)cc1 837303581 YTPDPDWZBIJZJL-LBPRGKRZSA-N 264.369 2.336 10 20 CECD Cc1cc(CC(=O)NCCCSc2nccs2)on1 845507379 WSVVAXJRPYYOHY-UHFFFAOYSA-N 297.405 2.281 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1cc2c(cc1O)OCO2 842754602 QSWDLJPRPYGNJB-PWSUYJOCSA-N 281.352 2.008 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](OC(=O)N(C)C)C2)c1 840104060 GPXRNFBGPOMSNT-CQSZACIVSA-N 292.379 2.282 10 20 CECD CC[C@H](NC[C@H]1CCCNC1=O)c1ccc(F)cc1O 840826131 QLSPIQXFCYHFOT-MFKMUULPSA-N 280.343 2.098 10 20 CECD C[C@@H]1[C@H](CO)CCCN1Cc1cc(F)ccc1O 840978546 OIMYYEWHCWHKJV-MNOVXSKESA-N 253.317 2.124 10 20 CECD O=C(NCCNc1ccccc1)c1cc(O)cs1 743461349 SJDXRKSFOOMMFV-UHFFFAOYSA-N 262.334 2.296 10 20 CECD CC[C@@H](C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210238 SZOJGBLMWPHLJM-CYBMUJFWSA-N 290.407 2.310 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@@H](C)O[C@H]2C)c1 858540589 JGDAUNLBTWPZBX-AGIUHOORSA-N 292.379 2.313 10 20 CECD Cc1cc(CN2C[C@H]3CCC[C@@]3(N)C2)ccc1N(C)C 923398928 OSHCPQQPELHNPU-NVXWUHKLSA-N 273.424 2.374 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ncc[nH]1 854947996 JBGRSPJHDIFYRR-LBPRGKRZSA-N 286.379 2.145 10 20 CECD CN1CCCN(Cc2ccc(N3CCCC3)cc2)CC1 1116322354 DRMDXUJYZSENEH-UHFFFAOYSA-N 273.424 2.424 10 20 CECD Cc1ccc(C(=O)N2C[C@@H](C)S[C@H](C)C2)c(O)c1O 770498777 GCDBGUZADJSGIY-NXEZZACHSA-N 281.377 2.372 10 20 CECD CCOC(=O)[C@H]1CSCCN1Cc1ccc(C)cc1O 876562954 WRMZZZWSFOXSCT-CYBMUJFWSA-N 295.404 2.181 10 20 CECD CC[C@H](N[C@H]1CCC[C@@H]1C(=O)NC)c1ccccc1O 775523916 BAWQNVOWYZOJAP-IHRRRGAJSA-N 276.380 2.348 10 20 CECD COC[C@H](C)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773145558 NOLICTTZHSPRBE-NWDGAFQWSA-N 279.384 2.148 10 20 CECD CC[C@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 789956246 DBELUERMUNFGEF-VIFPVBQESA-N 267.300 2.499 10 20 CECD CC(C)C[C@]1(CO)CCCN1C(=O)c1cccc(O)c1O 789874529 LBMHJMQBQGACSZ-INIZCTEOSA-N 293.363 2.111 10 20 CECD CCOC[C@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898450369 QMRPDDLFGSVJRP-WMLDXEAASA-N 293.455 2.370 10 20 CECD CCCCN(CCCO)Cc1ccc(OC)c(OC)c1O 894473915 ASQQHCMRHPOQDK-UHFFFAOYSA-N 297.395 2.394 10 20 CECD COc1ccc(CNCC(C)(C)CCCO)c(O)c1OC 893287027 XYJCUHBBJDPEIT-UHFFFAOYSA-N 297.395 2.298 10 20 CECD COc1cccc(CN2CCO[C@@H](C(C)C)C2)c1O 709028501 OIZGIHOYQONLGS-CQSZACIVSA-N 265.353 2.258 10 20 CECD CCc1cccc(CN[C@@H](C)c2n[nH]c(C)n2)c1O 691460811 SJAXWKQHJUOKDQ-VIFPVBQESA-N 260.341 2.232 10 20 CECD CN(CCOCCN)Cc1cc(Cl)cc(Cl)c1O 699506396 LVQOTTDKQOCZCC-UHFFFAOYSA-N 293.194 2.106 10 20 CECD C[C@@H](N1CCN(Cc2ccc(N)cc2)CC1)C(F)(F)F 1336116437 DITKMJWNTZOWPN-LLVKDONJSA-N 287.329 2.337 10 20 CECD COc1ccc(O)c(CNCc2cnn(C)c2C2CC2)c1 1355254065 GCRPUKRDAHVVTG-UHFFFAOYSA-N 287.363 2.302 10 20 CECD CN(C(=O)/C=C/c1cn(C)cn1)c1cccc2c1CCCN2 1358173766 ZBRLWVPFWMGGGQ-CMDGGOBGSA-N 296.374 2.454 10 20 CECD C[C@@H](NC(=O)[C@H]1CCC[C@H](C(=O)O)C1)c1ccccc1O 1607420399 WOMXRXPCVYRHMN-WOPDTQHZSA-N 291.347 2.460 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1C[C@@H]2C[C@]2(C(=O)O)C1 1600236325 SQOLDMOQLNXLIC-KEYYUXOJSA-N 288.391 2.404 10 20 CECD Cc1cc(CN[C@@H](C(=O)O)C2CC2)ccc1N(C)C 1607645921 BYEWXZKCQPJRGT-CQSZACIVSA-N 262.353 2.014 10 20 CECD CO[C@@H]1CCN(Cc2ccc(Cl)cc2O)[C@H](C(=O)O)C1 1599123010 GARSFWMRFCMLLG-NEPJUHHUSA-N 299.754 2.110 10 20 CECD Oc1ccc(Br)cc1CNCc1ccon1 165147429 WOYTZIUKQHTOKL-UHFFFAOYSA-N 283.125 2.433 10 20 CECD Cc1cccc(CN2CCCC[C@H]2CS(C)(=O)=O)c1O 824914314 PEJWYBNYCOQCAD-AWEZNQCLSA-N 297.420 2.100 10 20 CECD COc1cccc(O)c1CNCC[C@H]1CCCN(C)C1 839183826 ZQXBQWNIDGBIKD-CYBMUJFWSA-N 278.396 2.222 10 20 CECD C[C@@H](NC[C@](C)(O)C(F)(F)F)c1ccccc1O 272861332 MXZVZROCIBONSB-KCJUWKMLSA-N 263.259 2.356 10 20 CECD CSC1(CNCc2cc3c(cc2O)OCO3)CCC1 193650622 PIRRCRLZLVVXDA-UHFFFAOYSA-N 281.377 2.496 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2C[C@@H]2C2CC2)cc1 176564099 CNNRQLBCBPYNHS-CABCVRRESA-N 258.365 2.415 10 20 CECD C[C@@H](Cn1ccnc1)NCc1cccc(Cl)c1O 124706668 CLNFURASAYBPLR-JTQLQIEISA-N 265.744 2.420 10 20 CECD CCOC(=O)N1CC[C@H](NCc2cc(C)ccc2O)C1 185779525 LZBHDRYPQZZJSA-ZDUSSCGKSA-N 278.352 2.021 10 20 CECD CCc1nc(CN[C@@H](C)c2cc(OC)ccc2O)no1 182367571 OYLSWIAPRMVJON-VIFPVBQESA-N 277.324 2.197 10 20 CECD CCOC(=O)[C@H](C)[C@H](C)NCc1ccccc1O 185220147 NDLZYQDUEIZHKD-MNOVXSKESA-N 251.326 2.070 10 20 CECD C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CCOCC1 181206237 UVQPCPXWPGAOKD-JOAKQRRISA-N 291.347 2.042 10 20 CECD CCO[C@@H]1C[C@](CO)(NCc2cc(C)ccc2O)C1(C)C 186590055 XRBGLKOSUAWNJC-NVXWUHKLSA-N 293.407 2.356 10 20 CECD CC[C@H](COC)NCc1cc(Cl)cc([N+](=O)[O-])c1O 120229305 PWEOOECSNZKXOU-SNVBAGLBSA-N 288.731 2.468 10 20 CECD Nc1ccc(CCNC(=O)COC2CCCCC2)cc1 238126010 RBENFFLJSDIRKI-UHFFFAOYSA-N 276.380 2.277 10 20 CECD CCOC(=O)[C@H](C)NCc1cc(Cl)ccc1O 49368181 CAUBDNUZMVHARB-QMMMGPOBSA-N 257.717 2.087 10 20 CECD COc1ccc(NC(=O)NCc2ccc(O)c(O)c2)cc1 80780651 FRZIJDJZMQKGTG-UHFFFAOYSA-N 288.303 2.428 10 20 CECD CC[C@@H](C)N(C)CCNCc1cc(F)ccc1O 226590700 IFEUMPBWLUBVEG-LLVKDONJSA-N 254.349 2.351 10 20 CECD C[C@H](CC(=O)N(C)Cc1ccccc1O)C1CCNCC1 237500164 XGUDUQOBDBFMAN-CYBMUJFWSA-N 290.407 2.376 10 20 CECD CN(Cc1ccccc1O)C(=O)CC1C[C@@H]2CC[C@H](C1)N2 93677266 ZOIDZHVDILTASX-LQDVMPOASA-N 288.391 2.271 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCc3nc(C)ncc3C2)c1 361991435 NYFJDSORELUJEK-CQSZACIVSA-N 299.374 2.146 10 20 CECD C[C@H]1OCC[C@]12CN(Cc1c(O)cccc1Cl)CCO2 279745841 XZBIFOWSHVFIRA-ABAIWWIYSA-N 297.782 2.425 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@H]1CCCC[C@@H]1O 280856586 WQRSUXZNSSCRCG-OCCSQVGLSA-N 277.364 2.292 10 20 CECD C[C@@H](N[C@@H]1CCCN(CCCO)C1)c1ccc(F)cc1O 297404050 SRJDWBFDLAATEE-TZMCWYRMSA-N 296.386 2.029 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)NOCC1CC1 297173128 BFAKEUYNBUIUMR-UHFFFAOYSA-N 287.363 2.204 10 20 CECD COc1cccc(O)c1CN1CC[C@H](c2nccn2C)C1 809757243 LNCVVPLDMGXFMK-LBPRGKRZSA-N 287.363 2.124 10 20 CECD CCC(N)(CC)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 817960913 UDZCZTDFWXVPAT-SNVBAGLBSA-N 281.356 2.469 10 20 CECD Cc1cc(O)c(CNCCN2CCCC2=O)cc1Cl 826143431 ZJGBZLHADMVVSI-UHFFFAOYSA-N 282.771 2.066 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@H](C)c1ccc(N(C)C)cc1 834881019 JONYWMNGCZLFMP-UKPHBRMFSA-N 292.423 2.455 10 20 CECD CSC(C)(C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 831930862 JUODUAWOYCJCGF-SECBINFHSA-N 283.393 2.287 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H](C)CCCO)c1 834871331 NDNKHAWBJHLDMZ-NWDGAFQWSA-N 295.379 2.238 10 20 CECD COc1ccccc1OCCNC(=O)c1cc(O)cs1 731867978 GDSFDNIVSZUYDF-UHFFFAOYSA-N 293.344 2.271 10 20 CECD Cc1ccc(O)c(CNC[C@@H](C(=O)O)C(C)C)c1 848640660 UCIBTSJUCOEJEP-GFCCVEGCSA-N 251.326 2.147 10 20 CECD COc1ccc(CNC(=N)NCCc2ccccc2)c(O)c1 849095308 RNPUYDMCKDACPM-UHFFFAOYSA-N 299.374 2.257 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](O)C2CCC2)c1O 846170299 WKVRVXZNYISYRH-ZWNOBZJWSA-N 265.353 2.212 10 20 CECD C[C@H](NC[C@H]1CNC(=O)C1)c1cc2c(cc1O)CCCC2 840834650 YZEVLBDOJIMMES-RYUDHWBXSA-N 288.391 2.058 10 20 CECD COC[C@H](NCc1ccc(N(C)C)cc1C)[C@@H]1CCCO1 840941111 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Nc1ccc(CNC(=O)N2CCCC3(CC3)C2)cc1 1346739855 VAWTUDYSZANXCF-UHFFFAOYSA-N 259.353 2.354 10 20 CECD Cc1ncsc1/C=C\C(=O)N1C[C@H](N)Cc2ccccc21 1353918500 PZWRFVKGMMCRNS-FMFIFOJESA-N 299.399 2.381 10 20 CECD CC[C@H](N[C@H](C)c1cc(C(=O)O)ccc1O)C(C)(C)O 1605089919 NXOOIFYFIVUMLE-RNCFNFMXSA-N 281.352 2.291 10 20 CECD Cc1ccc(N2Cc3cccc(O)c3C2)nc1C(=O)O 1607794272 MUYDBZFJHYVBDX-UHFFFAOYSA-N 270.288 2.314 10 20 CECD Cc1ncc(S(=O)(=O)N[C@H](C)c2ccccc2O)s1 867835029 ZOXCKCIXVUHMNF-MRVPVSSYSA-N 298.389 2.197 10 20 CECD Cc1ccc(CN(C)[C@@H]2CCN(C)C[C@H]2C)c(O)c1 877530984 HFDWRDIIQHJVIZ-UKRRQHHQSA-N 262.397 2.473 10 20 CECD CCCCOCCNCc1cc(OC)ccc1O 40506683 NJGZCKBCHZIFAV-UHFFFAOYSA-N 253.342 2.307 10 20 CECD Oc1cccc(Br)c1CNCCn1ccnc1 706809030 GZVXHFRGAIXKPC-UHFFFAOYSA-N 296.168 2.141 10 20 CECD CC(=O)NCCCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 383500457 XSXLJJUTAKPGEE-YPMHNXCESA-N 276.380 2.365 10 20 CECD CCN1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(N)cc1 394279707 DJXYOHUVQOCXNS-CVEARBPZSA-N 259.397 2.327 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2ccccn2)c1 114543349 IVELGXZHOBRPNF-UHFFFAOYSA-N 286.331 2.045 10 20 CECD Cc1cc(CN2CCN(Cc3ccccc3O)CC2)no1 179554027 DXSJPLVTOKUSMD-UHFFFAOYSA-N 287.363 2.006 10 20 CECD CCCOc1ccc(CN[C@@H]2C[C@H](O)C2(C)C)c(O)c1 189346590 YXXVVGSRVMLFET-CABCVRRESA-N 279.380 2.430 10 20 CECD C[C@H](N[C@H](C)CN1CCOCC1)c1cc(Cl)ccc1O 185028654 JAUQQINCCNMSAX-NEPJUHHUSA-N 298.814 2.417 10 20 CECD Cc1ccc(C(=O)NCCCN2CCCCC2)c(O)c1O 181784491 PBUKVIYZSXICPY-UHFFFAOYSA-N 292.379 2.012 10 20 CECD Cc1cccc2c1CCN2C(=O)/C=C/c1cnn(C)c1 49490525 XGXHXAACLITHSQ-VOTSOKGWSA-N 267.332 2.331 10 20 CECD CC(C)OCCN1CCOc2cc(N(C)C)ccc21 175025650 YSIHGZTVGHNRHF-UHFFFAOYSA-N 264.369 2.376 10 20 CECD CC(=O)c1cc(F)cc(CN2CCOCC23CCC3)c1O 135511378 SGWGPQDLLVUKNB-UHFFFAOYSA-N 293.338 2.489 10 20 CECD COc1ccc(CN[C@@H](C(=O)O)C(C)C)cc1C 43431114 NZELUZMSWOEQRL-CYBMUJFWSA-N 251.326 2.202 10 20 CECD COC(=O)[C@@H](C)N(Cc1ccccc1O)C1CCC1 191641107 MCOJOFSQMVLCPE-LLVKDONJSA-N 263.337 2.308 10 20 CECD C[C@@H](NCC(C)(C)N1CCOCC1)c1cc(F)ccc1O 94616810 BADDUXIZSVINCI-GFCCVEGCSA-N 296.386 2.293 10 20 CECD CCN(Cc1cncn1C)c1ccc(OC)c(OC)c1 267595299 KEYDFYJEHLSSAZ-UHFFFAOYSA-N 275.352 2.464 10 20 CECD CCN(Cc1ncnn1CCF)c1ccc(OC)cc1 281539483 XDEIQMHHNGNJHA-UHFFFAOYSA-N 278.331 2.283 10 20 CECD OC[C@@H]1CN(Cc2ccccc2O)CC[C@@H]1C(F)(F)F 289685255 OCCXOPSSMVIIRD-RYUDHWBXSA-N 289.297 2.385 10 20 CECD C[C@@H](CF)NC(=O)NCc1ccc(N(C)C)c(F)c1 287261557 QDGOFTOTJUPECW-VIFPVBQESA-N 271.311 2.049 10 20 CECD COC(=O)[C@@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@H]1C 294199049 RIRNORBMIIAXHC-UKRRQHHQSA-N 290.407 2.302 10 20 CECD CN1CCCc2cc(CNC(=O)NOCC3CC3)ccc21 297501513 VGHLUHDQXHNCPE-UHFFFAOYSA-N 289.379 2.210 10 20 CECD CC(C)COCCOC(=O)/C=C\c1ccc(O)c(O)c1 800186639 GBQOOFLDWRVDTN-XQRVVYSFSA-N 280.320 2.327 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(F)c[nH]1 814818691 DYLJQJQLYXMOFH-UHFFFAOYSA-N 275.327 2.492 10 20 CECD CC[C@H](C)CONC(=O)NCc1cc(OC)ccc1O 813642380 ITRIYQOGDHDAGO-JTQLQIEISA-N 282.340 2.178 10 20 CECD Cc1ccnc(CNC(=O)/C=C/c2ccc(O)c(O)c2)c1 818440251 YIWRFYMTMIUQOJ-HWKANZROSA-N 284.315 2.131 10 20 CECD NC(=O)C[C@@H](NCc1cc(F)ccc1O)c1ccccc1 816652795 UPLQFLDMKYVNLB-CQSZACIVSA-N 288.322 2.238 10 20 CECD CCC[C@@](C)(N)C(=O)NCc1ccc2c(c1)CCCN2C 827913695 HIDGHRWWHFVNQH-QGZVFWFLSA-N 289.423 2.203 10 20 CECD COc1cc(C)cc(C(=O)NCc2ccccc2O)c1O 730281979 ZNPHPJWSWQESRY-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CCCCNC(=O)CCN[C@H](C)c1cc(OC)ccc1O 839538399 CGEDMJVDSYLZED-GFCCVEGCSA-N 294.395 2.358 10 20 CECD CCOc1ccc(CN[C@H](C)CCCN)c(O)c1 841078382 CEPNAIQQRWCPCW-LLVKDONJSA-N 252.358 2.008 10 20 CECD CCNC(=O)C(C)(C)CNCc1ccc(N(C)C)cc1C 840936532 KGMLYHGFLKVUTB-UHFFFAOYSA-N 291.439 2.313 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@]2(CCCN2)C1 841105646 VFLGDPBHFOPAES-CQSZACIVSA-N 266.772 2.374 10 20 CECD Cc1ccc([C@H](C)N[C@@H](CO)CCF)c(O)c1C 846209336 QJEANJRWWPHIRQ-NWDGAFQWSA-N 255.333 2.380 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@H]1CCCCNC1=O 840912914 PABHPPZDMVUFPK-INIZCTEOSA-N 289.423 2.162 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@@H]1CO 840952038 PTWDORODROKISK-GDBMZVCRSA-N 262.397 2.312 10 20 CECD CN(C)c1ccc(CN2CC[C@@](C)(C(=O)O)C2)cc1F 840998419 COWXJGYEOJJXHR-OAHLLOKOSA-N 280.343 2.188 10 20 CECD CC(C)C(=O)NCCN[C@@H](C)c1ccc(Cl)cc1O 841743462 HEQBUSHTWVDINW-JTQLQIEISA-N 284.787 2.468 10 20 CECD CN(C)c1ccc(OCCc2nnn(C(C)(C)C)n2)cc1 853693192 OYZPCHWGSOUYQI-UHFFFAOYSA-N 289.383 2.116 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C)c2nc(C)no2)c1O 754685960 LSGLZGFNEOYHJS-ZETCQYMHSA-N 293.298 2.276 10 20 CECD CCS(=O)(CC)=NC(=O)/C=C/c1ccc(O)c(O)c1 925881601 JSJLYTXLIMFSPC-SOFGYWHQSA-N 283.349 2.145 10 20 CECD Cc1cc(C(=O)NOCC(F)F)c(C)n1-c1ccccn1 759352473 UTBVQQLJLAYMBJ-UHFFFAOYSA-N 295.289 2.416 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1cc(Cl)ccc1O 759174910 ZTDFIXSNHLWKOU-JSGCOSHPSA-N 285.771 2.329 10 20 CECD CN1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(N(C)C)cc1 931721579 RHWHBYPNCIECPA-SJORKVTESA-N 273.424 2.421 10 20 CECD Cc1ccc(CN2CCC[C@H](N3CCCC3=O)C2)c(O)c1 876715733 RWLPAWGKNHJNDL-HNNXBMFYSA-N 288.391 2.287 10 20 CECD C[C@H]1COCCN1Cc1cc(Cl)cc(F)c1O 775655062 TZNZPBMBYRKLRD-QMMMGPOBSA-N 259.708 2.405 10 20 CECD CCN(C)c1ccc(CN(C)C[C@@H](C)C(=O)OC)cc1 773728547 DAUNONBCOULGRR-CYBMUJFWSA-N 278.396 2.384 10 20 CECD COc1ccc(N2CCN(c3ncncc3C)CC2)cc1 881745547 ZVIOMFIJZSUDJA-UHFFFAOYSA-N 284.363 2.120 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCCN(C)C2)c1O 894254024 LBKKIWMTYVEZME-CYBMUJFWSA-N 278.396 2.141 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC(F)CC2)c1O 895547085 KWIYZVYLPPOXBR-UHFFFAOYSA-N 284.287 2.243 10 20 CECD C[C@H]1CSC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 796396566 SMUTZHJHACFWFP-KWQFWETISA-N 268.338 2.142 10 20 CECD COc1ccc(CN[C@H](C)C2CC2)c(O)c1OC 892449175 OJKROUZMCRIYJX-SECBINFHSA-N 251.326 2.298 10 20 CECD CC[C@@H](NCCN1CCOC[C@@H]1C)c1ccc(F)cc1O 796751600 AGLMHVBVFUJKMA-SWLSCSKDSA-N 296.386 2.293 10 20 CECD CCOc1cccc(CNC2(COC)CC2)c1O 765263701 QLTFFLLFZIDKQO-UHFFFAOYSA-N 251.326 2.060 10 20 CECD COc1ccc2c(c1)CCCN2CN1CC2(CC2)CC1=O 1325546829 SNGLRQLCJFLJSO-UHFFFAOYSA-N 286.375 2.418 10 20 CECD COc1cccc(O)c1CN1CCCC2(CCNCC2)C1 1326516104 BJLMGIIOTQPNGJ-UHFFFAOYSA-N 290.407 2.366 10 20 CECD CNc1snc(C)c1C(=O)NCc1ccc(N)cc1 1578764512 YDBCPNWQFBYCAC-UHFFFAOYSA-N 276.365 2.005 10 20 CECD CC[C@H](NCC1(C(=O)O)CCOCC1)c1ccccc1O 1589571422 ZGRGIAYEWHCSRR-ZDUSSCGKSA-N 293.363 2.314 10 20 CECD CN1CCc2cc(/C=C/c3ncc(C(=O)O)c(O)n3)ccc21 1777093531 AFCWKQVSLUQAOU-HWKANZROSA-N 297.314 2.043 10 20 CECD COc1cccc(CNC(=O)c2cccnc2Cl)c1O 155368284 KYOVMCKDQNIKHP-UHFFFAOYSA-N 292.722 2.379 10 20 CECD C[C@H](N[C@H](C)Cc1cnn(C)c1)c1ccccc1O 834895399 BHQKRNMIWFEYIT-NEPJUHHUSA-N 259.353 2.408 10 20 CECD CCn1cnnc1CN[C@H](C)c1ccc(N(C)C)cc1 158384256 WWSWNXTWKBYRTE-GFCCVEGCSA-N 273.384 2.215 10 20 CECD CCOCC(C)(C)CNCc1cc2c(cc1O)OCO2 288701404 YOTLUGOSUWZNCV-UHFFFAOYSA-N 281.352 2.273 10 20 CECD CC[C@H]1CN(C(=O)Nc2ccc(N)cc2)CCCO1 311262138 OFZXTNIRWHPJOJ-ZDUSSCGKSA-N 263.341 2.302 10 20 CECD c1n[nH]cc1CCNCc1ccc(N2CCCC2)cc1 379575930 YQBYGWNDFWIXFW-UHFFFAOYSA-N 270.380 2.342 10 20 CECD Cc1cccc(CN[C@H](CCO)C(F)(F)F)c1O 894851925 RFDDYZARUSJVJS-SNVBAGLBSA-N 263.259 2.104 10 20 CECD COCC[C@H](C)NC(=O)N[C@H](C)c1cc(OC)ccc1O 103515420 HBUJTTRTUYMIEE-WDEREUQCSA-N 296.367 2.186 10 20 CECD COC(=O)COC(=O)c1sccc1-n1c(C)ccc1C 56231492 AZPNEHYLMMJZCF-UHFFFAOYSA-N 293.344 2.485 10 20 CECD CC[C@@H](NCCO)c1cc(Br)ccc1O 20597022 NMEMWGIOECCRQW-SNVBAGLBSA-N 274.158 2.188 10 20 CECD CCC(C)(C)C(=O)NCc1cc(OC)ccc1O 114542896 GLJAOUGIYAOYGE-UHFFFAOYSA-N 251.326 2.453 10 20 CECD COc1cccc(CN(C)Cc2cscn2)c1O 120245136 YKSKRQLYXRUNRU-UHFFFAOYSA-N 264.350 2.489 10 20 CECD CCC[C@]1(C)C(=O)NCCN1Cc1cc(C)ccc1O 189038786 KRHHINGUTSQDOQ-MRXNPFEDSA-N 276.380 2.191 10 20 CECD CO[C@H](C)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 182431072 WVAFCWFNBOYPBC-KGLIPLIRSA-N 278.396 2.209 10 20 CECD CO[C@H](C)CC(=O)NCc1ccc(N2CCCC2)cc1 195435004 ILBBQFPIAQUACG-CYBMUJFWSA-N 276.380 2.328 10 20 CECD OCCN(Cc1cc2c(cc1O)OCO2)c1ccccc1 191971524 QCDFXKOKNBSHGC-UHFFFAOYSA-N 287.315 2.120 10 20 CECD CC(C)N(CCCNC(=O)c1cccc(O)c1O)C(C)C 193118117 LOMUHKXGBMEMMR-UHFFFAOYSA-N 294.395 2.337 10 20 CECD CCN(C)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 264751980 OPYNLCWUGXJJMD-RMKNXTFCSA-N 274.364 2.015 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1C 368963199 IOSZHQATWLYBJD-BJJXKVORSA-N 288.391 2.095 10 20 CECD Cc1cc(O)c(CN2CC[S@@](=O)C[C@@H](C)C2)cc1C 277442675 KEOYKJGADDLXAU-JEOXALJRSA-N 281.421 2.209 10 20 CECD C[C@H](NCC1([S@](C)=O)CC1)c1ccc(F)c(F)c1O 282175499 FIHPWSODRSFOCV-RLBGWGEZSA-N 289.347 2.232 10 20 CECD COc1ccc(N(CCN2CCNC2=O)CC(C)C)cc1 808737013 GFGAENFERDNCEW-UHFFFAOYSA-N 291.395 2.183 10 20 CECD CC(=O)C(=O)COC(=O)c1cc(Cl)cc(Cl)c1 808488209 CCWLRPJOWQCIGI-UHFFFAOYSA-N 275.087 2.308 10 20 CECD COc1ccc(CNC(=O)c2cc(C)cc(C)n2)c(O)c1 801300193 WXQULDDIYUIXGW-UHFFFAOYSA-N 286.331 2.343 10 20 CECD CC(C)COc1ccccc1NC[C@H](O)Cn1cccn1 819416046 KVDCPRHBPLOOJJ-AWEZNQCLSA-N 289.379 2.391 10 20 CECD C[C@@H](NCc1cc([N+](=O)[O-])ccc1O)c1ccnc(O)c1 815148139 NGHIUDMXJYMWBE-SECBINFHSA-N 289.291 2.252 10 20 CECD C[C@H](NC[C@@H]1CCCCN1)c1cc([N+](=O)[O-])ccc1O 817950028 QHEMOVVKBSBLIT-QWRGUYRKSA-N 279.340 2.093 10 20 CECD C[C@H](N[C@H]1CC12CCNCC2)c1cc(F)cc(F)c1O 817976583 OGDVTOLMXNWHRQ-ZANVPECISA-N 282.334 2.463 10 20 CECD Cc1ccn(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 828860735 GLBPHPYLMBBLLA-ZDUSSCGKSA-N 286.379 2.135 10 20 CECD C[C@@H](NC(=O)/C=C/[C@H]1CCOC1)c1ccccc1O 827952565 XRGJCYUNOGJJFD-JIVBQCDMSA-N 261.321 2.162 10 20 CECD COc1cccc(O)c1CNC[C@H](c1ccco1)N(C)C 725841776 ZKQYHWKQEMNFCM-CYBMUJFWSA-N 290.363 2.386 10 20 CECD CC1=NO[C@H](CNCc2cc(Br)ccc2O)C1 820265210 LFHAQLMUXUTCEF-NSHDSACASA-N 299.168 2.409 10 20 CECD C[C@H](O)CN(Cc1cccc(Cl)c1O)CC(F)F 825098523 KETZPJKXMZLWDY-QMMMGPOBSA-N 279.714 2.494 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H](O)C2)cc1Cl 824491844 XMJGZJGIWOROFA-LLVKDONJSA-N 255.745 2.311 10 20 CECD Cc1ccc(C(=O)OCc2ccc(C(=O)O)o2)c(O)c1O 738546441 BRCDCNBLAHOOKJ-UHFFFAOYSA-N 292.243 2.054 10 20 CECD FC1(F)CCNC[C@H]1NCc1ccc2c(c1)CCCO2 904354640 IBNBLJSAYLQPQD-CQSZACIVSA-N 282.334 2.098 10 20 CECD CC[C@H](CN1CCOCC1)N[C@H](C)c1cc(F)ccc1O 903343188 NJCZFRCMHLGPMO-TZMCWYRMSA-N 296.386 2.293 10 20 CECD O=C(NCc1ccccc1O)c1ccc(C(=O)O)c(F)c1 833146419 FINSCWPEIZNYNY-UHFFFAOYSA-N 289.262 2.160 10 20 CECD COc1cc(O)c(CN2[C@H]3CC[C@H]2CC(=O)C3)cc1OC 839132256 XBRZWUMRBSYTIY-RYUDHWBXSA-N 291.347 2.105 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)CCC2CC2)cc1 832274826 ZGXORPZONXYMBR-HNNXBMFYSA-N 275.396 2.059 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H](C)C[C@H](C)N 831211271 FEDHDSYDIJNCIB-STQMWFEESA-N 293.411 2.440 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1N 843052330 OPTXIDQXOITQHN-DZGCQCFKSA-N 279.403 2.451 10 20 CECD CCc1cccc(CN2CCC[C@H]2c2nncn2C)c1O 848889977 PTMQHCCSPXCEOC-AWEZNQCLSA-N 286.379 2.420 10 20 CECD Cc1cc(COC(=O)c2cc(O)cs2)nc(C)n1 849728468 SQJIIXDQDSVIPV-UHFFFAOYSA-N 264.306 2.218 10 20 CECD Nc1ccc(Cc2noc(CCCn3cccn3)n2)cc1 843158360 BVLSCZYKSIJANL-UHFFFAOYSA-N 283.335 2.072 10 20 CECD CCC[C@H](O)CC(=O)NCc1cc(Cl)ccc1O 846476777 QAGPHNHNJJTINB-NSHDSACASA-N 271.744 2.213 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CO[C@H](C)C2)c1 842775293 LYAJEGROQJHUSB-ZYHUDNBSSA-N 251.326 2.058 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCNCC2(C)C)c1O 843352556 NBYMROZUNLNOQW-UHFFFAOYSA-N 296.798 2.432 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1[C@H]1CCCOC1 844147703 YPJIPTSYJZUWQN-CMPLNLGQSA-N 281.377 2.485 10 20 CECD CCn1cc([C@@H](C)NC(=O)Nc2ccc(N)cc2)cn1 841297932 LRUMUTASTYSJHK-SNVBAGLBSA-N 273.340 2.368 10 20 CECD CN(C)c1cc(F)c(CNC[C@H]2CCCN2C)cc1F 858109751 WPHVABWHNLDWAJ-GFCCVEGCSA-N 283.366 2.215 10 20 CECD C[C@@H](CO)[C@@H]1CCCCN1C(=O)c1cc(O)cs1 855468112 ZFNBMVVCEZKIRI-ONGXEEELSA-N 269.366 2.077 10 20 CECD Cc1ocnc1C(=O)NCc1cc(Cl)ccc1O 857547550 JSUFAHXIGNNYIB-UHFFFAOYSA-N 266.684 2.272 10 20 CECD C[C@H](NC[C@@](C)(O)C(F)F)c1ccc(N(C)C)cc1 698562045 DNFLIUYRVCZUCC-IINYFYTJSA-N 272.339 2.419 10 20 CECD CC[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768440112 SQUNGPIHHUTTGV-IAQYHMDHSA-N 277.364 2.440 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)CCC(C)(F)F)c1 867558834 CBRIGKBYISMFJR-UHFFFAOYSA-N 293.335 2.165 10 20 CECD C[C@@H]1CN(CCN[C@H](C)c2ccc(N(C)C)cc2)CCO1 765789094 OWVSXOMMYYTSJM-HUUCEWRRSA-N 291.439 2.124 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cccc(F)c1F 768903367 DJEMXCBSROCNEI-UHFFFAOYSA-N 293.269 2.349 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H]2CCO[C@H]2C)cc1 878805376 KTVIJBHXZOJCJC-GJZGRUSLSA-N 292.423 2.488 10 20 CECD CCN(C)c1ccc(CN2CCC3(C2)OCCO3)cc1 773771036 HQYHHXPLGJEUHY-UHFFFAOYSA-N 276.380 2.092 10 20 CECD Cc1ccc2c(c1)N[C@@H](c1ccc(O)c(O)c1)NC2=O 877864220 NTBFGYCPKBUBDK-CQSZACIVSA-N 270.288 2.260 10 20 CECD Cc1cccc(O)c1CN1CCC(N2CCOC2=O)CC1 877641424 ZRZBQXFQIIIENQ-UHFFFAOYSA-N 290.363 2.117 10 20 CECD C[C@@H]1CCN(Cc2ccc(N3CCN(C)CC3)cc2)C1 775660555 GERRWVSCOFDNMK-OAHLLOKOSA-N 273.424 2.280 10 20 CECD Cc1cccc(CNCCC(=O)Nc2ccccn2)c1O 776078571 ZIMNJRAXZGYEAY-UHFFFAOYSA-N 285.347 2.214 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H](C)c1c(O)cccc1F 886530737 PMYFJVFZNYDXRQ-KBVBSXBZSA-N 273.373 2.294 10 20 CECD COc1ccc(CN(C)CCCF)c(O)c1OC 896069856 KIYRSXWBMYITCP-UHFFFAOYSA-N 257.305 2.201 10 20 CECD COc1ccc(CN[C@H](C)[C@@H]2CCCOC2)c(O)c1OC 893471019 BMCMWAKXCITAHS-DGCLKSJQSA-N 295.379 2.314 10 20 CECD COc1cccc(CN2CCn3nc(C4CC4)cc3C2)c1O 896939391 GFPOCAABWOGMBR-UHFFFAOYSA-N 299.374 2.491 10 20 CECD COc1cccc(CN(CCO)[C@@H]2C[C@H]3CC[C@H]2C3)c1O 793329831 YGPSZMNARNSIAK-KCQAQPDRSA-N 291.391 2.384 10 20 CECD CCOC(CN[C@@H](C)c1cc(OC)ccc1O)OCC 93447040 NQELOQHWAQQZOF-NSHDSACASA-N 283.368 2.451 10 20 CECD COc1cc(C)cc(CN2CCOC[C@@H]2C2CC2)c1O 1331988707 DZRXICBLQRCXQO-CQSZACIVSA-N 277.364 2.320 10 20 CECD CC(F)(F)C1(C(=O)NCc2ccc(O)cc2O)CC1 1339585007 OJCNAKIAWKVIRO-UHFFFAOYSA-N 271.263 2.149 10 20 CECD O=C(O)[C@]1(F)CCN(Cc2cc(Cl)cc(F)c2O)C1 1601716814 ISMQXDYYHVMLHU-LBPRGKRZSA-N 291.681 2.183 10 20 CECD CCN(CC)c1ccc(CNCCCOCC(=O)O)cc1 1776861084 QXKBWXOCFVULHW-UHFFFAOYSA-N 294.395 2.114 10 20 CECD COc1cc(O)c(CN2C[C@@H](C)OC(C)(C)C2)cc1OC 159941636 HADYJGIXBJWAIA-LLVKDONJSA-N 295.379 2.409 10 20 CECD COCC1(CNCc2c(O)cccc2OC)CCC1 800279610 JPUOMSQWBRMMMP-UHFFFAOYSA-N 265.353 2.307 10 20 CECD Cc1nn(C(C)C)cc1C(=O)NCc1ccccc1O 847590085 ULJDULRBLWWLEI-UHFFFAOYSA-N 273.336 2.408 10 20 CECD C[C@@H](N[C@H](C)c1cc(F)ccc1O)C(=O)NC(C)(C)C 181234807 RATOBHMDTIGVPI-NXEZZACHSA-N 282.359 2.485 10 20 CECD CC[C@H](COC)NCc1ccc(N2CCOCC2)cc1 79737186 OVESWIIWKJWISV-OAHLLOKOSA-N 278.396 2.038 10 20 CECD COc1ccc(O)c(CNC[C@H](c2ccco2)N(C)C)c1 20122464 DYJMFHWHBLTQMF-CQSZACIVSA-N 290.363 2.386 10 20 CECD CC(C)[C@@H](C)NC(=O)CN1CCCc2cc(CN)ccc21 62801626 MOVLBUQHPIGSPL-CYBMUJFWSA-N 289.423 2.059 10 20 CECD C[C@H](N[C@@H]1CCCCNC1=O)c1cc(Cl)ccc1O 184982064 MCLWOCXWDZAYEF-JOYOIKCWSA-N 282.771 2.365 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@H]2CCCO2)c1 170900719 DIGHETLKZIDBHY-ZYHUDNBSSA-N 279.336 2.147 10 20 CECD Oc1ccccc1CN1CCS[C@@H]2COCC[C@@H]21 179585229 FBLQHAPGKGNXGL-GXTWGEPZSA-N 265.378 2.099 10 20 CECD COc1cc(NCc2ccc(N(C)C)c(F)c2)ncn1 122931809 OKEVIJZGKURCPD-UHFFFAOYSA-N 276.315 2.302 10 20 CECD COc1cccc(CN[C@H]2CCO[C@H](C)C2)c1O 219886742 SMISRQXKBQMJBK-PWSUYJOCSA-N 251.326 2.058 10 20 CECD CCOCCC(=O)NCc1ccc2c(c1)CCCN2C 76802963 XVHCRLJWEDRBCT-UHFFFAOYSA-N 276.380 2.112 10 20 CECD CC(C)N(CCNCc1cc2c(cc1O)OCO2)C(C)C 42879091 JEYJZZXWMSVBBJ-UHFFFAOYSA-N 294.395 2.329 10 20 CECD CCOC(=O)[C@@H](CC)N1CCOc2cc(N(C)C)ccc21 130413323 USZHBGIOPKSPQJ-CYBMUJFWSA-N 292.379 2.293 10 20 CECD Nc1ccc(NC(=O)NC[C@@H]2CCSC2)cc1 228580165 JMYMBVLLFQDZIK-VIFPVBQESA-N 251.355 2.143 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)[C@@H](C)CN1 83407790 VJFTZCWYIRDLBS-UWVGGRQHSA-N 254.761 2.228 10 20 CECD CCCOC(=O)[C@H](C)N(C)c1ccc(OC)cc1OC 131800823 ITVUUWYXFQGIJW-NSHDSACASA-N 281.352 2.482 10 20 CECD C[C@@]1(C(=O)NCCCSc2nccs2)CCCNC1 237495017 VVVYVKBHAOCDQU-CYBMUJFWSA-N 299.465 2.131 10 20 CECD COc1ccc(N(C)CC2CCNCC2)cc1F 178976179 DHCRHZHLNQNQMJ-UHFFFAOYSA-N 252.333 2.270 10 20 CECD COc1cccc(CN2CC[C@@H]3[C@H](CCCN3C)C2)c1O 246073895 ZRYRIZJAVFJRRV-UKRRQHHQSA-N 290.407 2.317 10 20 CECD CS[C@@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 42998858 TXJXGHLMZHJHKJ-NSHDSACASA-N 266.410 2.463 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H](C)CN)c1C 262448078 DMZAECNXXTUDHC-LBPRGKRZSA-N 285.391 2.480 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2nccs2)c1 273379330 HWBKCCHPXSWKFM-SECBINFHSA-N 292.360 2.486 10 20 CECD Cc1cc(C(=O)N[C@H](C)CN)c(C)n1-c1ccccc1 274438922 PSAUXRSEOZCKIB-LLVKDONJSA-N 271.364 2.171 10 20 CECD COc1cccc(CN2C[C@H](O)Cc3ccccc32)c1O 279361976 HCVXPXDDYSLUBE-CQSZACIVSA-N 285.343 2.324 10 20 CECD Cc1cccc(CN[C@H]2CCO[C@@]3(CCOC3)C2)c1O 378459980 UZWFNWGBVYKCEK-HOCLYGCPSA-N 277.364 2.128 10 20 CECD CC(C)(C)n1ncnc1COC(=O)c1cc(O)cs1 801262246 OXLJWTJPHBAFEQ-UHFFFAOYSA-N 281.337 2.157 10 20 CECD OCC1([C@H](NCc2ccccc2O)C2CC2)CCOCC1 293518893 AWTIVCZJLYDYNT-MRXNPFEDSA-N 291.391 2.050 10 20 CECD CC[C@H](NCc1ccc(N2CCOCC2)cc1)C(C)(C)O 394010603 DBKKQBFZXVCOQT-INIZCTEOSA-N 292.423 2.162 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)C(C)(C)n1cncn1 810214773 IQSVHGHIGMJCOE-LBPRGKRZSA-N 286.379 2.126 10 20 CECD Oc1ccc(F)cc1CNCCCC1(O)CCC1 817415547 YSUMLFDKGIUAFI-UHFFFAOYSA-N 253.317 2.316 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc2nc(O)[nH]c12 816889190 PDQBXLZDSBRHLR-UHFFFAOYSA-N 297.314 2.246 10 20 CECD CCOc1ccc(CNC2(COC)CCOCC2)c(O)c1 814302104 OSXAYMYAYUHOJK-UHFFFAOYSA-N 295.379 2.076 10 20 CECD CCCCOc1ccccc1NC[C@@H](O)COC 819421043 ZYHSLZIIGIMVSN-GFCCVEGCSA-N 253.342 2.285 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCN1 817901732 XTFCRDHAQHBQBF-BXUZGUMPSA-N 265.376 2.122 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCC[C@@H]3C[C@@H]32)c(O)c1 827600169 LYSITXSDHAYVTP-DDTOSNHZSA-N 290.363 2.389 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccoc2)c1 728979590 IXBFEANRROQBLH-SECBINFHSA-N 261.277 2.485 10 20 CECD C[C@@H]1CCN(CN(C)Cc2ccc(N(C)C)cc2)C1=O 839954348 VSDIEFGGCYOCMW-CYBMUJFWSA-N 275.396 2.010 10 20 CECD O=C(NCCc1cccc(O)c1)c1cc(O)cs1 731872829 SCEJPIDREUXUFC-UHFFFAOYSA-N 263.318 2.132 10 20 CECD CO[C@H]1C[C@@H](NC(=O)c2ccc(C)c(O)c2O)C12CCC2 838118391 UUFDITMBOCTKAE-NEPJUHHUSA-N 291.347 2.094 10 20 CECD CN(Cc1ccccc1O)C(=O)CCn1cccc1 748026946 IXDFQWKWWDQQOY-UHFFFAOYSA-N 258.321 2.242 10 20 CECD Cc1cc(Br)cc(CN[C@@H]2CCCNC2)c1O 841042247 HEKVCWAOVJEGSZ-GFCCVEGCSA-N 299.212 2.305 10 20 CECD CCN(CC)C(=O)[C@H](C)N1CCCc2cc(CN)ccc21 843349899 LWIJTDIDZJXKQN-ZDUSSCGKSA-N 289.423 2.155 10 20 CECD O=C1CC2(CCCCCC2)N(C(=O)c2cc(O)cs2)N1 912267138 HWWPYQYOSVEXSG-UHFFFAOYSA-N 294.376 2.424 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)CCCO)c1O 846150472 POCPKWMVJCFMJZ-WDEREUQCSA-N 253.342 2.212 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCN[C@@H](C)C1 841062536 MQVXTKATEMGYLI-ZFWWWQNUSA-N 261.413 2.291 10 20 CECD C[C@@H]1CCCc2ncc(C(=O)NCCc3ccc(N)cc3)n21 846664719 AVOYRNCFLGXUCP-GFCCVEGCSA-N 298.390 2.335 10 20 CECD COc1ccc(N(C)CCN(C)CC2CCOCC2)cc1 844401112 KJVUCGBPYQAYSH-UHFFFAOYSA-N 292.423 2.490 10 20 CECD Cn1c(COC(=O)c2cccc(O)c2O)nc2ccccc21 758571069 BXUAPWKSNUVACG-UHFFFAOYSA-N 298.298 2.342 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCSC)c1 756352251 SAXCEVJYCVRQGT-SECBINFHSA-N 269.366 2.192 10 20 CECD CCC[C@H](OCC)C(=O)NCc1ccc(N)cc1 859593983 MLIOBGCTUAFQNF-ZDUSSCGKSA-N 250.342 2.090 10 20 CECD Cc1noc(C)c1[C@H](C)C(=O)NCc1ccc(O)c(O)c1 768914787 JRNYOABBXJIKLS-QMMMGPOBSA-N 290.319 2.123 10 20 CECD CCN(CC)CCN(CCOC)Cc1c(C)cccc1O 876692750 FWHLRHPROMNFCF-UHFFFAOYSA-N 294.439 2.491 10 20 CECD Cc1ncc(CCNC(=O)NCc2ccccc2O)s1 772005581 HTIJHZYXRSLATK-UHFFFAOYSA-N 291.376 2.199 10 20 CECD CCCOc1ccc(CNC[C@@]2(O)CCOC2)cc1C 873097563 CJLRLNUYMAJAHI-INIZCTEOSA-N 279.380 2.025 10 20 CECD CCCN1CCC[C@H]1C(=O)N(C)c1ccc(N)cc1 877077329 DGCGCEKYPXTSLH-AWEZNQCLSA-N 261.369 2.106 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2C[C@H](N)C2)c2c(O)ccc(F)c21 873255565 HRGDXMLYXKFHRT-BFLSOPEQSA-N 264.344 2.407 10 20 CECD CCC(=O)c1cn(Cc2ccc(N(C)CC)cc2)nn1 881313815 UQXKDKLJKDJTLT-UHFFFAOYSA-N 272.352 2.375 10 20 CECD C[C@@H](NCCC(C)(C)O)c1cc(F)cc(F)c1O 775586484 QEHRJYJZYUXESW-MRVPVSSYSA-N 259.296 2.482 10 20 CECD C[C@H](N[C@H](CO)CC1CC1)c1c(O)cccc1F 886554927 GZSMCJXMCJPRCA-ONGXEEELSA-N 253.317 2.343 10 20 CECD COCc1nccc(N[C@@H](C)Cc2ccc(O)c(O)c2)n1 893113045 TUBMTWRRYACTJW-JTQLQIEISA-N 289.335 2.077 10 20 CECD COc1cc(C)cc(CNC[C@H](CO)CC2CC2)c1O 895278552 MPUOCOHZCYOJFW-CYBMUJFWSA-N 279.380 2.207 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1C[C@]12CCOC2 1329520786 XXHHUPFZDUENTC-UHLUBPPHSA-N 293.710 2.241 10 20 CECD COC[C@@H](CNC(=O)NCCc1ccc(N)cc1)C(C)C 1336125677 VTLRQQGMMVIJLM-CQSZACIVSA-N 293.411 2.029 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCC(C)=O 201703523 FJCCGFJWGKYIQI-UHFFFAOYSA-N 276.380 2.470 10 20 CECD CCN(CC)c1ccc(CN=c2nc[nH]n2CC)cc1F 1336916440 PTWFQILHWCMUGP-UHFFFAOYSA-N 291.374 2.317 10 20 CECD CC(C)(C)[C@@H]1CN(C(=O)NCc2ccc(N)cc2)CCO1 1336290392 MUFCXZFUIYMBQS-AWEZNQCLSA-N 291.395 2.225 10 20 CECD COc1ccc(O)c(CN[C@H]2CCCC[C@H]2N(C)C)c1 1341800918 BQQZKELCQUKMBX-LSDHHAIUSA-N 278.396 2.363 10 20 CECD c1cc2c(cc1CN[C@@H]1CCN3CCCC[C@@H]13)CCO2 218430580 WRNHFEGCICMEFG-CVEARBPZSA-N 272.392 2.338 10 20 CECD CCN(CC)C[C@@H](C)N[C@@H](C)c1cc(C(=O)O)ccc1O 1609999138 LYPITSKVDAOTOB-NEPJUHHUSA-N 294.395 2.471 10 20 CECD Cc1cccc(CN2CC[C@H](C)C[C@H]2C(=O)O)c1O 1607850192 BNEZJTWRXRYXBC-GWCFXTLKSA-N 263.337 2.386 10 20 CECD CCOc1cccc(CNC[C@@H]2CCC[C@H](O)C2)c1O 230670180 BEOSBYUVAOYIMV-OCCSQVGLSA-N 279.380 2.432 10 20 CECD C[C@@H]1OCC[C@@H]1COc1ccc(N(C)C)c(C(=O)O)c1 1594646481 XYLPIYAHFDHTEK-WDEREUQCSA-N 279.336 2.255 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2cc(C)cc(C)c2O)C1 164218956 OAAHIKFQYUAEDW-OAHLLOKOSA-N 290.407 2.357 10 20 CECD COCC(C)(C)C(=O)NCc1ccc(N(C)C)cc1 159733412 IALQZNRKTSQBEX-UHFFFAOYSA-N 264.369 2.041 10 20 CECD CCCN(CC(=O)N(C)C)Cc1c(C)cccc1O 876632196 PYJYGGKRZMLGOL-UHFFFAOYSA-N 264.369 2.001 10 20 CECD Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C)c(O)c1 876764497 PUZWUEJGPJUELB-CABCVRRESA-N 260.381 2.369 10 20 CECD CCOc1cccc(CN2CCC[C@@H](N(C)C)C2)c1O 156072861 AGIUXZGIVVQRFD-CQSZACIVSA-N 278.396 2.317 10 20 CECD Oc1c(Cl)cccc1CNC[C@]1(O)CCSC1 271807303 KCABLXANDNRKNP-GFCCVEGCSA-N 273.785 2.003 10 20 CECD CCOC(=O)[C@@H](C)N(Cc1ccc(N)cc1)C1CC1 49955153 LLXRMXCDZJGNSG-LLVKDONJSA-N 262.353 2.185 10 20 CECD COc1ccc(O)c(CN2CCCC[C@@H]2[C@H](C)N)c1 63191911 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284277547 XGABCKVNMXJGBC-XJKSGUPXSA-N 281.396 2.447 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](n3cccn3)C2)c1 291270817 NUSKCUWDUHSTLV-CQSZACIVSA-N 287.363 2.434 10 20 CECD COc1cccc(CNC(=O)c2occ3c2CCC3)c1O 802782081 IKRQTHSULJJBPL-UHFFFAOYSA-N 287.315 2.413 10 20 CECD Oc1ccc(-c2csc(-c3nc[nH]n3)n2)cc1O 818030022 ZWDBMBRGKFKLDN-UHFFFAOYSA-N 260.278 2.006 10 20 CECD C[C@H](NC[C@H](C)CN)c1ccc(Br)cc1O 817963016 QFUTXYMEFYOXBG-BDAKNGLRSA-N 287.201 2.400 10 20 CECD Cc1c(CNC(=O)[C@@H]2CN(C)C[C@H]2C)n(C)c2ccccc12 487554677 RULYFMSEMDHBPI-IUODEOHRSA-N 299.418 2.301 10 20 CECD CCN(Cc1cc(Cl)cc(F)c1O)[C@@H](C)CO 816653874 LKJVRCKRANDPPO-QMMMGPOBSA-N 261.724 2.387 10 20 CECD Cc1cc(O)c(CNCCn2ccnc2)cc1Cl 825058785 MCIKNCFCCWVVBU-UHFFFAOYSA-N 265.744 2.340 10 20 CECD COc1cc(Cl)cc(CN(C)C2(CO)CC2)c1O 827903824 QHQLROMULUFLDA-UHFFFAOYSA-N 271.744 2.011 10 20 CECD CCC1(C)CN(C(=O)c2c(F)ccc(O)c2O)C1 832299216 ZREGLQHGGDRUCR-UHFFFAOYSA-N 253.273 2.109 10 20 CECD O=C(NCc1cn2ccsc2n1)c1cc(O)cs1 731868018 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O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](F)C1 846630125 IVMHLWAZZCLKEU-DUMNWFOQSA-N 265.284 2.072 10 20 CECD C[C@@H](CCCCN)NC(=O)NCc1ccc(N(C)C)cc1 841654895 QGAGAVDROPESMZ-ZDUSSCGKSA-N 292.427 2.069 10 20 CECD CCOc1ccc(CNC[C@@](C)(O)c2ccco2)c(O)c1 742375771 VVYPBHATWNOSKE-MRXNPFEDSA-N 291.347 2.381 10 20 CECD CCC/C=C\C(=O)NCc1ccc(N2CCOCC2)cc1 920743330 AUXTXZKLCBAQMN-PLNGDYQASA-N 288.391 2.496 10 20 CECD C[C@H](NCc1ccc(N2CCCC2)cc1)c1cnnn1C 924650361 XEKWXBSPFQYTLN-ZDUSSCGKSA-N 285.395 2.266 10 20 CECD CCC[C@H](OCC)C(=O)OCC(=O)c1ccc(O)c(O)c1 859837116 BDOZQJBPPANQQK-AWEZNQCLSA-N 296.319 2.029 10 20 CECD COCC[C@@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 756524586 HJNQXPOOINVAKD-NXEZZACHSA-N 268.313 2.376 10 20 CECD C[C@@H]1C[C@@H](NCC(C)(C)O)c2c(O)ccc(F)c21 756564900 TZSJZCFFMCNYGZ-PSASIEDQSA-N 253.317 2.440 10 20 CECD CC1(C)CCN[C@H]1C(=O)NCCCSc1nccs1 852840169 KVCXSNXZPJNCIV-JTQLQIEISA-N 299.465 2.130 10 20 CECD CCCCN(CC[N+](=O)[O-])Cc1ccccc1O 930349747 AMQWUWVLALIWRL-UHFFFAOYSA-N 252.314 2.271 10 20 CECD Cc1ccc(O)c(CNC(=O)C2CC(F)(F)C2)c1 862758018 LZEVRYRJWGSBMD-UHFFFAOYSA-N 255.264 2.362 10 20 CECD CO[C@@]1(CNCCCSc2nccs2)CCOC1 877062144 YYLPVLGJCAAOFQ-GFCCVEGCSA-N 288.438 2.020 10 20 CECD COC(=O)NC1CCN(Cc2ccc(C)cc2O)CC1 877644046 LBKSOVKNUTXPJD-UHFFFAOYSA-N 278.352 2.021 10 20 CECD O=S(=O)(NCc1cc(Cl)ccc1O)C1CCC1 882321051 PBMDJRCQSYOEIY-UHFFFAOYSA-N 275.757 2.018 10 20 CECD CCN1CCC[C@H](CNCc2cc(F)cc(F)c2O)C1 882942497 FFWIXSCLHNCOHH-LLVKDONJSA-N 284.350 2.492 10 20 CECD COC(=O)C[C@H](NC(=O)c1cc(O)cs1)C(C)(C)C 889171704 BTNUQGNNFPCHJF-JTQLQIEISA-N 285.365 2.161 10 20 CECD Cc1cc(O)c(CNc2nnc(C(C)(C)O)o2)cc1C 788450425 ZVMHXSISZOESGQ-UHFFFAOYSA-N 277.324 2.232 10 20 CECD C[C@H]1C[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)CO1 784143795 HPBNEUKHTQXSNB-ZFWWWQNUSA-N 288.391 2.328 10 20 CECD CO[C@H](C)[C@@H](C)NCc1ccc(N2CCOCC2)cc1 268868446 UMJTUVBNOWDGMA-ZIAGYGMSSA-N 278.396 2.036 10 20 CECD COc1cc(C)cc(CN(C)C[C@@H]2CCC[C@H]2O)c1O 894089335 RRHRAZKVPZNUHY-GXTWGEPZSA-N 279.380 2.302 10 20 CECD COc1cc(C)cc(CN(CC(C)(C)O)C2CC2)c1O 894492633 DPQZWPAKYUUWFF-UHFFFAOYSA-N 279.380 2.445 10 20 CECD O[C@@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1204320379 WJMWTCNOCLWEGE-MRXNPFEDSA-N 260.381 2.244 10 20 CECD C[C@H](N[C@@H]1CCCN(C)C1=O)c1ccc(N(C)C)cc1 704370984 JFLJFPXRXNYNAY-SWLSCSKDSA-N 275.396 2.024 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@@H](O)C(F)(F)F 790953853 GTRJRMJCUIJWCT-MRVPVSSYSA-N 287.640 2.198 10 20 CECD CC(C)(O)CC(=O)NCc1ccc(N2CCCCC2)cc1 792096115 HDOJVUZQXNDSLQ-UHFFFAOYSA-N 290.407 2.454 10 20 CECD CC[C@H](NC(=O)c1cccc(O)c1O)C1CCOCC1 790827577 UVLGULKIKFEDRI-LBPRGKRZSA-N 279.336 2.033 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CO)CC2CC2)c1 756768668 FXXLYPGOPZJIIW-JQWIXIFHSA-N 265.353 2.212 10 20 CECD COc1ccc(O)c([C@H](C)NCCN2CC[C@H](C)C2)c1 775370866 XAHZYVGHEBKTBZ-STQMWFEESA-N 278.396 2.393 10 20 CECD C[C@@H]1CC[C@H](NCCc2ccc(N)cc2)[C@@H](n2cncn2)C1 1327841085 VDQTUYZGLUFUKF-COXVUDFISA-N 299.422 2.422 10 20 CECD COc1ccc(O)c(CNCc2nccs2)c1 41012396 DVKHVYJDQSXPNO-UHFFFAOYSA-N 250.323 2.147 10 20 CECD Nc1ccc(CNC(=O)NC[C@@H]2C[C@H]3C=C[C@H]2C3)cc1 1335708625 PZSIYMSYAPPUGA-IHRRRGAJSA-N 271.364 2.280 10 20 CECD CC(C)Cn1nccc1C(=O)NCc1ccc(N)cc1 1346210461 RPZBBZFXOXCCFC-UHFFFAOYSA-N 272.352 2.051 10 20 CECD C[C@H](NC[C@H]1CCSC1)c1cc(C(=O)O)ccc1O 1604336747 AZTILGZYQZQRKF-VHSXEESVSA-N 281.377 2.494 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N(C)CCN)cc1 1579673644 BFFASZCQPZAHDT-UHFFFAOYSA-N 271.364 2.125 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@@H]2C(=O)O)cc1F 1574553507 KGHOQJZFNQDDQG-GFCCVEGCSA-N 284.306 2.080 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@H]1C[C@H](N)C1 1577458151 XBZUKQRYLHZAJZ-HDJSIYSDSA-N 276.380 2.258 10 20 CECD CCN1CCc2cc(CN[C@@H](C(=O)O)C3(C)CC3)ccc21 1776884791 XMMXEOFCVPZQFK-HNNXBMFYSA-N 288.391 2.412 10 20 CECD COc1cc(O)c(CN2CCC[C@H](OC)C2)cc1OC 160125510 PSVCUJUWSIJMGK-LBPRGKRZSA-N 281.352 2.020 10 20 CECD C[C@H](O)C[C@@H](C)NCc1cccc(Br)c1O 164499157 JRKIYGVWWQLXSL-BDAKNGLRSA-N 288.185 2.404 10 20 CECD C[C@@H]1C[C@H](C(=O)O)CCN1Cc1ccc(N(C)C)cc1 235360886 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2.180 10 20 CECD Cc1cc(C)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)[nH]1 183480561 YONMQMMZGYEOTR-LLVKDONJSA-N 288.347 2.404 10 20 CECD C/C=C/C[C@@H](CO)NCc1cccc(OCC)c1O 185828511 IOKSJAKINQZJBD-LQPUYASZSA-N 265.353 2.208 10 20 CECD Nc1ccc(CC(=O)Nc2cccc3cn[nH]c23)cc1 37044381 JSKOJDXSWWHQAT-UHFFFAOYSA-N 266.304 2.326 10 20 CECD CC[C@H](CSC)NC(=O)/C=C/c1ccc(O)c(O)c1 181314475 MEMGOGNAYBXPPR-OKPNEXGHSA-N 281.377 2.369 10 20 CECD C[C@H]1[C@@H](C(=O)O)CCN1Cc1ccc(N(C)C)cc1 92941445 VHEPSSFIRALJFF-FZMZJTMJSA-N 262.353 2.048 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccn(C)c1 268652003 GPNJWJGVFWADLS-UHFFFAOYSA-N 285.347 2.130 10 20 CECD COC(=O)N1CC(N[C@H](C)c2ccc(C)c(C)c2O)C1 273451668 GCNBCKBQUMPLDN-LLVKDONJSA-N 278.352 2.110 10 20 CECD COC[C@H](N[C@@H](C)c1cc(F)ccc1O)[C@@H]1CCCO1 278620809 CFVMYACKCUKUTE-XEGUGMAKSA-N 283.343 2.376 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2c(O)cccc2Cl)C1 271193922 RQFGEWKDULQHAG-CQSZACIVSA-N 283.755 2.431 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)C[C@H](C)[S@@]1=O 289699238 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CN1CCCc2cc(CNC(=O)CCCF)ccc21 824682471 FXJDIAVHAQUWCP-UHFFFAOYSA-N 264.344 2.435 10 20 CECD CC(C)(CN1CCCC1)NCc1cc([N+](=O)[O-])ccc1O 825328052 XKDYZDNVKNTYCZ-UHFFFAOYSA-N 293.367 2.264 10 20 CECD C[C@H](NC(=O)[C@]1(C(=O)O)CC1(C)C)c1ccccc1O 902516199 BZZFDPYLIWYBBQ-VFZGTOFNSA-N 277.320 2.070 10 20 CECD COc1cc(O)c(CNCCC[C@@H]2CCOC2)cc1OC 825144801 RJPZDSMJJBAVGP-GFCCVEGCSA-N 295.379 2.316 10 20 CECD C[C@H](CN(C)Cc1ccc(N(C)C)c(F)c1)C(=O)O 901597334 NMFSZVMCSDTCIR-SNVBAGLBSA-N 268.332 2.044 10 20 CECD C[C@H](N[C@H]1C[C@H]2CCCCN2C1=O)c1ccc(F)cc1O 834916162 VRIWYWBFONDWME-SUHUHFCYSA-N 292.354 2.335 10 20 CECD O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccc(Cl)nc1 748999324 VKBPAIYFUIKGND-WQLSENKSSA-N 299.717 2.196 10 20 CECD CN(C)c1ccc(CN2CC[C@@H]3NCC[C@H]3C2)cc1F 843128906 YYBLETVZXCMMJT-ZFWWWQNUSA-N 277.387 2.076 10 20 CECD COc1ccc(CN[C@@H]2CC23CCNCC3)cc1C 841080631 UTFXKZPDMJRIOJ-OAHLLOKOSA-N 260.381 2.235 10 20 CECD Cc1ccc(O)c(CNC[C@@H](N)c2ccccc2)c1 841036117 JYICQFGXZFXVAH-OAHLLOKOSA-N 256.349 2.490 10 20 CECD Oc1c(Cl)cccc1CNCC[C@]1(O)CCCOC1 846110282 XSMANXQRFUYMHA-CQSZACIVSA-N 285.771 2.067 10 20 CECD Cc1cc(O)c(CN2CCC[C@H]3CNC[C@H]32)cc1C 841027052 JJKTZMOGHOZPHJ-DZGCQCFKSA-N 260.381 2.193 10 20 CECD Cc1cc(CN2CCC[C@@H]2C(=O)O)ccc1N(C)C 846229616 VZXNYXDZEHDWFH-CQSZACIVSA-N 262.353 2.110 10 20 CECD CCc1cnc(CNC(=O)c2cc(O)cs2)s1 743738418 HGIAFQHZVFGHGB-UHFFFAOYSA-N 268.363 2.403 10 20 CECD O=C(NCc1ccccc1O)NC[C@H]1Cc2ccccc2O1 748460207 LJKRZTFTZPCBIT-CQSZACIVSA-N 298.342 2.195 10 20 CECD CCC(CC)(CCO)NC(=O)NCCc1ccc(N)cc1 841960237 YXZREQJXFTUNQW-UHFFFAOYSA-N 293.411 2.052 10 20 CECD CC(C)NC(=O)[C@H](C)NCc1c(O)ccc(Cl)c1F 840974334 GRORPQNOEGVUFH-QMMMGPOBSA-N 288.750 2.187 10 20 CECD COc1cccc([C@H](C)N[C@H](C)Cc2cnccn2)c1O 846142482 ULZPHEDQZBIGAW-NEPJUHHUSA-N 287.363 2.473 10 20 CECD CC(C)(F)CCNC(=O)NCCc1ccc(N)cc1 851662180 BNDVMWPNFKHVFQ-UHFFFAOYSA-N 267.348 2.249 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)OCCF 858899995 IBGSTVNACDCHDH-UHFFFAOYSA-N 266.316 2.483 10 20 CECD COc1cc(C(=O)N(C)Cc2ccccc2O)ccc1O 756777344 HYJDJZDPUWHRHL-UHFFFAOYSA-N 287.315 2.379 10 20 CECD CC[C@H](NCCN1CC[C@H](O)C1)c1cccc(Cl)c1O 858602235 UNHMCWKLSXZDRE-FZMZJTMJSA-N 298.814 2.153 10 20 CECD CC1(C)CN(C(=O)C2CC2)CCN1Cc1ccccc1O 761226853 WCIWIBYZFFNMIQ-UHFFFAOYSA-N 288.391 2.225 10 20 CECD COCC1(NCc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 765261953 KYKJPLFVHQXZNM-UHFFFAOYSA-N 286.715 2.222 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)CCn2cccn2)c1 862475902 BFHQUVWSNICGNA-ZDUSSCGKSA-N 259.353 2.466 10 20 CECD Cc1cc(=NC(=O)NCc2ccccc2O)c(C)c[nH]1 767944992 AYCFJRAQBQEZFU-UHFFFAOYSA-N 271.320 2.148 10 20 CECD COCn1ncc(C)c1CN[C@H](C)c1ccccc1O 1119288321 AMSHABSUNOMNCN-GFCCVEGCSA-N 275.352 2.352 10 20 CECD Cc1ccc(CN(C)CCCN(C)CCN(C)C)c(O)c1 877536236 MGTJJCLGFIHMCY-UHFFFAOYSA-N 293.455 2.016 10 20 CECD Cc1cnccc1CNC(=O)NCc1ccccc1O 779551573 RJEDVTMODLJHLX-UHFFFAOYSA-N 271.320 2.095 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)c1 388663114 OQGALDINENZMJD-WCQYABFASA-N 263.337 2.243 10 20 CECD CCOC1(CNC(=O)NCc2ccc(N)cc2)CCCC1 1120624059 MWQHNQVCGAYHIT-UHFFFAOYSA-N 291.395 2.417 10 20 CECD Cc1cc(C)c([C@@H](C)NCCCS(C)(=O)=O)c(O)c1 788643804 HKMNQQKRVPZFGX-GFCCVEGCSA-N 285.409 2.094 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3F)CC2)cc1 1123767387 IRDCEDCVNRQWJZ-LSDHHAIUSA-N 292.354 2.092 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)CCS(C)(=O)=O)c(O)c1 185791279 ZNTZQFOTXADCFR-NWDGAFQWSA-N 285.409 2.174 10 20 CECD C[C@H]1OCCN(Cc2cc(F)cc(F)c2O)[C@@H]1C 708399237 KIZUTVOZORYKIP-RKDXNWHRSA-N 257.280 2.280 10 20 CECD CCOC(=O)C[C@H](C)Sc1ncc([N+](=O)[O-])s1 799937788 GEGYMUPTFVVIBF-LURJTMIESA-N 276.339 2.485 10 20 CECD Oc1cc(Br)ccc1CNCCn1ccnc1 691478102 VRDZPENPXISWEN-UHFFFAOYSA-N 296.168 2.141 10 20 CECD COc1ccc(O)c(CNC[C@@H]2C[C@H](C)O[C@H]2C)c1 686511660 HBJLKSIBUQRNDP-SRVKXCTJSA-N 265.353 2.304 10 20 CECD CC[C@@H](O)CN(CC)c1ccc(OC)c(OC)c1 760830527 UCZGJDJYYCDCNA-GFCCVEGCSA-N 253.342 2.301 10 20 CECD CN(C)c1ccc(CN[C@@H](C(=O)O)C2(C)CC2)cc1 1777039701 QPYARDVMHQQUDS-ZDUSSCGKSA-N 262.353 2.096 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 1334937442 RQEZRTWEWXDNLC-UTUOFQBUSA-N 292.379 2.247 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)cc1 1336863089 JOLXDKDNQGWXIQ-XSXPHNMFSA-N 271.364 2.113 10 20 CECD COC(=O)N1CCCN(Cc2cc(C)cc(C)c2O)CC1 1341109707 CRBFJXVPYBXXPI-UHFFFAOYSA-N 292.379 2.283 10 20 CECD CCOCc1cc(CNC[C@@H](CC)C(=O)O)ccc1OC 1343426925 DWPRXSXOMXPFPQ-CYBMUJFWSA-N 295.379 2.432 10 20 CECD C[C@H](N[C@@H]1CCOC1(C)C)c1cc(C(=O)O)ccc1O 1604330648 YHDRDSSLLLUQHI-TVQRCGJNSA-N 279.336 2.309 10 20 CECD O=C(O)[C@H](CC1CC1)NCc1cccc(Cl)c1O 1608533132 DVOROUWYBNLZND-NSHDSACASA-N 269.728 2.389 10 20 CECD COc1cc(C)cc(CN2CC[C@@](C)(C(=O)O)C2)c1O 1599391568 ACZAEPMWZLWEEQ-OAHLLOKOSA-N 279.336 2.006 10 20 CECD Cc1noc([C@H](NC(=O)Cc2ccc(N)cc2)C(C)C)n1 157602320 XFDYVKIJTIBLIG-CQSZACIVSA-N 288.351 2.016 10 20 CECD CC(C)NC(=O)[C@@H](C)NCc1ccc2c(c1)CCCO2 922183185 ARABCGYWFJGFKT-GFCCVEGCSA-N 276.380 2.014 10 20 CECD 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127971386 GDXHGRBLPVFZMU-JTQLQIEISA-N 282.340 2.349 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C(C1CC1)C1CC1 182522900 IPXHWOYIKDEKIN-UHFFFAOYSA-N 261.321 2.150 10 20 CECD CN(Cc1cccc(C(N)=O)c1)c1ccc2c(c1)OCO2 121400332 JAWPYSIHIKRKGG-UHFFFAOYSA-N 284.315 2.151 10 20 CECD CC[C@]1(C)CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCO1 135441975 OGTCBPVGLGAJIJ-BIENSFFJSA-N 291.347 2.139 10 20 CECD COC[C@H]1CN(Cc2cc(C)cc(C)c2O)C[C@H](C)O1 249851805 PNOUJDFXCMUURG-DZGCQCFKSA-N 279.380 2.245 10 20 CECD COCCN(CCCC(=O)O)c1ccc(OC)c(OC)c1 269663290 UWASHKAWMFXGCZ-UHFFFAOYSA-N 297.351 2.021 10 20 CECD C[C@H](C(=O)NCCc1ccc(N)cc1)[C@H](N)c1ccccc1 262583174 RJMFASYWBCUFBX-GUYCJALGSA-N 297.402 2.264 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCOC(C)C)c1 273448021 OCYQXPUGFWDMPJ-LLVKDONJSA-N 281.352 2.254 10 20 CECD Cn1ccnc1[C@H]1OCCC[C@@H]1NCc1ccccc1O 275713175 YMIAQDKZYSLKQZ-ZFWWWQNUSA-N 287.363 2.136 10 20 CECD COc1cc(O)c(CN2CCC[C@@H](OC)CC2)cc1OC 377242722 HVLUKYKDCAJXAE-CYBMUJFWSA-N 295.379 2.410 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)N1CCSCC1 285248085 WSPOHPDGTNRXJU-UHFFFAOYSA-N 293.436 2.353 10 20 CECD CCCOc1ccc(CNCC2([S@@](C)=O)CC2)c(O)c1 282296362 JJPXWNMWUCWCRF-HXUWFJFHSA-N 297.420 2.182 10 20 CECD CC(=O)C(=O)CSc1ncnc2sc3c(c12)CCC3 289590388 JHTUUJBADSFYFM-UHFFFAOYSA-N 292.385 2.430 10 20 CECD CCO/C=C/C(=O)NCc1ccc2c(c1)CCCN2C 816910941 XGSGZFXAJWUSCJ-CSKARUKUSA-N 274.364 2.235 10 20 CECD C[C@@H](N[C@H](CN)C1CC1)c1cc(F)cc(F)c1O 817959580 HGEKQLIMBABFBL-JMCQJSRRSA-N 256.296 2.058 10 20 CECD O=C(N[C@@H]1[C@H]2[C@H]3CC[C@@H](C3)[C@H]21)c1c(F)ccc(O)c1O 826947830 WLVBHHAKJAOHAX-WOARRREPSA-N 277.295 2.011 10 20 CECD O=C(O)/C=C\c1ccc(N2C[C@H]3C=C[C@H]2C3)c([N+](=O)[O-])c1 906151180 AYEKPEKQORROQB-QGILPKKRSA-N 286.287 2.457 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)CCCC3)C[C@@H]1C(=O)O 833630863 XUKSYJQVBSRZHI-ABAIWWIYSA-N 289.375 2.424 10 20 CECD Cc1ccccc1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832292517 HZSOAWBTKURXMJ-KRWDZBQOSA-N 297.402 2.491 10 20 CECD O=C(CC1COC1)NCc1ccc(N2CCCCC2)cc1 900405594 YXJGAGIDOWIVFF-UHFFFAOYSA-N 288.391 2.330 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C(=O)N(C)C)C2)cc1 839635346 HISQOGRCGMZUEX-OAHLLOKOSA-N 289.423 2.053 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(O)cc2O)on1 910951222 PDELWAHUIIHHMM-UHFFFAOYSA-N 276.292 2.139 10 20 CECD COCC[C@]1(NCc2ccc(N(C)C)cc2C)CCOC1 840940871 MYNZDGYPPHLYKY-KRWDZBQOSA-N 292.423 2.346 10 20 CECD C[C@]1(NC(=O)Nc2ccc(N)cc2)CCO[C@H]1C1CC1 841295572 BLTIKVFVMHCVSZ-ZFWWWQNUSA-N 275.352 2.348 10 20 CECD COCCN(CC(C)C)C(=O)NCCc1ccc(N)cc1 841963153 XQRQCGVCQWKILU-UHFFFAOYSA-N 293.411 2.125 10 20 CECD Cc1noc([C@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)n1 759595959 SJRHJRFRDATMOQ-HORMHSFOSA-N 290.275 2.107 10 20 CECD C[C@H]1C[C@@H](N[C@H]2CCNC2)c2c(O)ccc(F)c21 854223279 BSKMDTSUETVQDL-ATZCPNFKSA-N 250.317 2.031 10 20 CECD CCCN1CC[C@H](NCc2ccc(N(C)C)c(F)c2)C1 850395262 QGZRYIGUTMTRRS-AWEZNQCLSA-N 279.403 2.466 10 20 CECD C[C@H](N[C@H](C)C1(CO)CC1)c1cc([N+](=O)[O-])ccc1O 850515994 JKRXNPVNYCGOFI-VHSXEESVSA-N 280.324 2.112 10 20 CECD CCOCCNC(=O)CSc1ncc(Cl)s1 850000158 LEUNDWWDONTJEQ-UHFFFAOYSA-N 280.802 2.041 10 20 CECD COC(=O)N1CCC[C@H](N[C@@H](C)c2ccc(F)cc2O)C1 756526069 FHFUHPJQTOYGGO-JQWIXIFHSA-N 296.342 2.413 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@H]2CCO)cc1F 862333811 WEWDMEHLKWUJLQ-LBPRGKRZSA-N 284.350 2.378 10 20 CECD CO[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862246645 LYELFXGDIVYPMH-LLVKDONJSA-N 270.323 2.252 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@@H](C)N)c1O 863566197 DSWYRPIFRNAASJ-MRVPVSSYSA-N 270.760 2.027 10 20 CECD CCOC(=O)C(C)(C)CC(=O)N(C)c1ccc(N)cc1 877076753 UXAPSQZBWNVNJC-UHFFFAOYSA-N 278.352 2.211 10 20 CECD CCN(CC)c1ccc(CN2C(=O)NC(C)(C)C2=O)cc1 777600815 RFBHAJSZNCWBPM-UHFFFAOYSA-N 289.379 2.363 10 20 CECD CCc1nnc2ccc(NCc3cc(OC)ccc3O)nn12 771213707 OZDPNXXSUHPYLA-UHFFFAOYSA-N 299.334 2.013 10 20 CECD C[C@@H](NC(=O)NCCCN(C)C)c1ccc(N(C)C)cc1 776096645 OMJNKTFRRGAAPS-CYBMUJFWSA-N 292.427 2.065 10 20 CECD CCOc1cccc(CNCCO[C@@H]2CCCCO2)c1O 894801148 WBCULWFDMQXHIT-OAHLLOKOSA-N 295.379 2.424 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H](CO)CC2)c1O 894866033 FDPPAKLHFHGLBN-CYBMUJFWSA-N 279.380 2.304 10 20 CECD CC(C)[C@@H](CO)NCc1ccc(N2CCCC2)cc1 92392707 ACOKGRVSVXIBOS-MRXNPFEDSA-N 262.397 2.393 10 20 CECD COCC1CN(Cc2cc(Cl)cc(OC)c2O)C1 895971524 SAKASONCZSYVJE-UHFFFAOYSA-N 271.744 2.132 10 20 CECD CC[C@H](C[C@H](C)CO)NCc1ccc(OC)c(OC)c1O 893074142 KXWPMOAMNMHWBO-WCQYABFASA-N 297.395 2.296 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@@H](C(F)(F)F)C1 708382788 HWPDMBQHVHQTSU-SNVBAGLBSA-N 297.223 2.434 10 20 CECD Cc1cc([C@H]2CCCN2C(=O)c2cccc(O)c2O)on1 790538298 HDRSFZTXJLUGPX-LLVKDONJSA-N 288.303 2.372 10 20 CECD COc1cccc(O)c1CNCc1cnn2ccccc12 1323700985 RKPIDILHLLDHPK-UHFFFAOYSA-N 283.331 2.338 10 20 CECD COc1ccc(CNC(=O)NC/C=C/C2CC2)c(O)c1 1325484779 LLBVRHCTURQCRR-NSCUHMNNSA-N 276.336 2.166 10 20 CECD CC[C@H](C)[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 1604944735 IJGPKAWOGAXTIL-IINYFYTJSA-N 263.337 2.210 10 20 CECD Cc1ncc(CSc2ncc(C(=O)O)s2)cn1 1600738184 YOJVUPRINDVLGA-UHFFFAOYSA-N 267.335 2.232 10 20 CECD C[C@H](CN(C)Cc1cc(Cl)c(F)cc1O)C(=O)O 1604158656 JWSAHAGHSMJICZ-SSDOTTSWSA-N 275.707 2.337 10 20 CECD COc1cccc(CN2CC[C@@H](C)C[C@@H]2C(=O)O)c1O 1599672552 IFDOIONXNAVJGU-ZYHUDNBSSA-N 279.336 2.086 10 20 CECD C[C@H](Cc1cnn(C)c1)NCc1cc(Cl)ccc1O 825046020 OGIVYONZPHOXEV-SNVBAGLBSA-N 279.771 2.500 10 20 CECD CC(C)(O)C(C)(C)CNC(=O)Nc1ccc(N)cc1 841297888 JOLIKICWZGAQGO-UHFFFAOYSA-N 265.357 2.187 10 20 CECD CCc1cccc(CN(C)[C@@H]2CCC(=O)N(C)C2)c1O 862428132 LMZIFABIOXGZHO-CQSZACIVSA-N 276.380 2.007 10 20 CECD Cc1cccc(O)c1CN1CCO[C@@H](C(F)(F)F)C1 876756000 NUDUQZGLTWUAQL-GFCCVEGCSA-N 275.270 2.464 10 20 CECD C[C@H]1CC[C@@H](C)N1[C@@H](C)C(=O)NCc1ccccc1O 263696162 NLOMJAQNUFAERQ-XQQFMLRXSA-N 276.380 2.270 10 20 CECD Cc1cccc(CN2CCO[C@@H]([C@H]3CCCO3)C2)c1O 245939869 UDUFRDGOFBHYJV-HUUCEWRRSA-N 277.364 2.080 10 20 CECD CC[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)N(C)C 177850648 NSUGFRBONSXIOD-INIZCTEOSA-N 289.423 2.243 10 20 CECD CCN(CC)c1ccc(CNC[C@@]2(OC)CCOC2)cc1 122998046 HAPOXFSVDVWTIK-KRWDZBQOSA-N 292.423 2.428 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCN(C(C)C)C2=O)c1 182436022 ZYDGHQRSWPXDDU-BXUZGUMPSA-N 292.379 2.061 10 20 CECD C[C@@H](NCC1(CO)COC1)c1ccc2ccccc2c1O 186146266 UTXIBRMSUAFURW-GFCCVEGCSA-N 287.359 2.205 10 20 CECD COc1cccc(CN(CC(C)(C)O)C2CC2)c1O 189941213 WGQDZTOZMKYKIQ-UHFFFAOYSA-N 265.353 2.136 10 20 CECD COC[C@@H](C)N[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 131890193 LWRDNYNVFKEPTM-OLZOCXBDSA-N 296.386 2.348 10 20 CECD NC(=O)c1cnccc1NCc1ccc(N2CCCC2)cc1 184055007 LLFISABNCSHGPQ-UHFFFAOYSA-N 296.374 2.393 10 20 CECD C[C@H]1C[C@@H](NCc2cc(F)ccc2O)CCN1C 226612775 WRGSLHMGTXPBLZ-GWCFXTLKSA-N 252.333 2.104 10 20 CECD COCCOC1CCN(Cc2ccccc2O)CC1 179573969 BCMNUVPCWAIHKB-UHFFFAOYSA-N 265.353 2.020 10 20 CECD C[C@H](NC[C@H]1CN2CCC[C@H]2CO1)c1cc(F)ccc1O 251791526 VZBKCRZSEROYNE-UBHSHLNASA-N 294.370 2.045 10 20 CECD Cc1c(CNC(=O)CN(C)C(C)C)n(C)c2ccccc12 352134798 LIAVMVYIRNVFDX-UHFFFAOYSA-N 287.407 2.443 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@H](C)CO)cc1 269548069 NKGAXEUEWIZWRQ-LBPRGKRZSA-N 286.375 2.452 10 20 CECD C[C@@H]1c2nncn2CCN1Cc1ccc(N(C)C)c(F)c1 276752595 FRMLDMCSLGARRC-LLVKDONJSA-N 289.358 2.060 10 20 CECD CC[C@H]1CN(Cc2cccc(C)c2O)C[C@@H](C)S1(=O)=O 289970761 ZCFVQSUQLXCDHS-OCCSQVGLSA-N 297.420 2.098 10 20 CECD NC(=O)c1cccc(CCN[C@H]2CCc3cccc(O)c32)c1 296847782 NBZQOARVIHZRSP-HNNXBMFYSA-N 296.370 2.311 10 20 CECD COC[C@H](CCO)N[C@@H](C)c1cc(Cl)cc(C)c1O 808697835 WTCKVEBFYYLOHK-JQWIXIFHSA-N 287.787 2.402 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)NC1CC1 394848814 TYIPLERZAHSACJ-ZDUSSCGKSA-N 289.423 2.242 10 20 CECD C[C@H](N[C@H](CN)C1CC1)c1cc(Cl)ccc1O 817959428 FWPAWXKWAIFRKX-QPUJVOFHSA-N 254.761 2.434 10 20 CECD COC[C@@H](O)CNc1ccccc1OCC(C)C 819415576 GOJYVEYTSLWLRM-LBPRGKRZSA-N 253.342 2.141 10 20 CECD COc1ccc(O)c([C@H](C)Nc2ncnc3c2ncn3C)c1 728908786 CALMWEKRCBNNCD-VIFPVBQESA-N 299.334 2.251 10 20 CECD O=C(O)[C@H]1CN(C(=O)c2cc(O)cs2)c2ccccc21 739613946 MEXOGQZHDWAHRS-JTQLQIEISA-N 289.312 2.282 10 20 CECD O=C(NC[C@@H]1CC1(Cl)Cl)c1cc(O)cs1 732267011 AWSXZJOPJUBUFQ-YFKPBYRVSA-N 266.149 2.377 10 20 CECD Oc1cccc2c1[C@@H](N[C@H]1CCc3c[nH]nc3C1)CC2 834620986 ZTXMVVSAOPZDTH-STQMWFEESA-N 269.348 2.250 10 20 CECD CCOc1ccc(CN2CC(C(F)F)C2)c(O)c1 839140159 AVJLXMVWLJARAL-UHFFFAOYSA-N 257.280 2.488 10 20 CECD COc1ccc(N(CC(C)C)C[C@@H]2CCC(=O)N2)cc1 844305139 OWRBRTSDVWFDBI-ZDUSSCGKSA-N 276.380 2.436 10 20 CECD C/C=C(\C)C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 911360025 LKNNSOHHPQWTJX-YCRREMRBSA-N 297.738 2.425 10 20 CECD COC(=O)C(C)(C)N(C)Cc1ccc(N(C)C)cc1C 840915601 KDUNLYLBBBULTP-UHFFFAOYSA-N 278.396 2.444 10 20 CECD COc1cccc([C@@H](C)N[C@@H](CO)CC(F)(F)F)c1O 846157901 PFOWYRPGLCWBLQ-RKDXNWHRSA-N 293.285 2.365 10 20 CECD CCC(N)(CC)CNC(=O)NCc1ccc(N(C)C)cc1 841654586 NLBRIABDKLJWIP-UHFFFAOYSA-N 292.427 2.069 10 20 CECD CCc1cccc(CN[C@H](C)CO[C@@H]2CCOC2)c1O 848898542 DWSBIVSJCWHNDT-IUODEOHRSA-N 279.380 2.238 10 20 CECD Cc1cc(O)c(CNC[C@@H](C(=O)O)C(C)C)cc1C 848639791 LOMMFSLWZRVXLY-CYBMUJFWSA-N 265.353 2.455 10 20 CECD C[C@@H](NCC1(N(C)C)CC1)c1cc([N+](=O)[O-])ccc1O 841761459 FPXRQQGFRICHAQ-SNVBAGLBSA-N 279.340 2.045 10 20 CECD CC[C@@](C)(CC(=O)OC)NCc1cc(F)ccc1O 757919997 OEYPFFVGKIBKBU-AWEZNQCLSA-N 269.316 2.353 10 20 CECD Cc1cc(CN2CC[C@]3(CCNC3)C2)ccc1N(C)C 923330652 BVDUALNLVMQQCG-KRWDZBQOSA-N 273.424 2.246 10 20 CECD COC(C)(C)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756645642 HPKFFWDVYCTTCT-SECBINFHSA-N 268.313 2.376 10 20 CECD COc1ccc(CNC2COC(C)(C)OC2)cc1C 758010612 QLLYBAAXZAOHBU-UHFFFAOYSA-N 265.353 2.245 10 20 CECD C[C@@]1(C(=O)NCCCSc2nccs2)CCOC1 755315385 FQLXPELDGCCXRN-GFCCVEGCSA-N 286.422 2.168 10 20 CECD CC[C@@](C)(O)CNCc1cc(F)c(N(C)C)cc1F 858131354 SDHFBMUXQXDAES-CQSZACIVSA-N 272.339 2.281 10 20 CECD CN(Cc1noc2c1COCC2)c1ccc2c(c1)OCO2 930094081 OYEMUOKDRMOQII-UHFFFAOYSA-N 288.303 2.112 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1cnc(N)s1 765657022 SXQHMQMNXIIDAN-UHFFFAOYSA-N 290.392 2.190 10 20 CECD CC(C)[C@@H]1NC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 761362390 PGNPOPADJNCXSY-HNNXBMFYSA-N 299.374 2.139 10 20 CECD COc1ccc(N(C)Cc2cnc(N)s2)cc1OC 761219679 ARNSPJPDOKWJQC-UHFFFAOYSA-N 279.365 2.379 10 20 CECD C[C@H](NC(=O)[C@@H]1CCO[C@@H]1C)c1ccc(N(C)C)cc1 772997306 FZSAKSLAHMYGCJ-YWPYICTPSA-N 276.380 2.355 10 20 CECD CCCN(c1ccc(CN)cc1)[C@H]1CCNC(=O)CC1 877478243 LIAURCSMBREQBA-OAHLLOKOSA-N 275.396 2.030 10 20 CECD CC(=O)Nc1ccc(OC(=O)c2cccc(O)c2O)cc1 776615640 ZQWMZQHIKPWVMP-UHFFFAOYSA-N 287.271 2.275 10 20 CECD CO[C@@H](C)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773012105 FWGJZRSBMQAZBF-RYUDHWBXSA-N 264.369 2.355 10 20 CECD Cc1cccc(O)c1CNCC(=O)N(C)Cc1ccccc1 876948852 VQHNKTMWZSHTMC-UHFFFAOYSA-N 298.386 2.449 10 20 CECD CCOC(=O)[C@H](CC)N(C)Cc1ccccc1O 72629598 VGXVHQQVLZGKNA-LBPRGKRZSA-N 251.326 2.166 10 20 CECD COc1ccc(N2CCN(Cc3nccs3)CC2)cc1 269655262 NGWZSSZKHADADO-UHFFFAOYSA-N 289.404 2.474 10 20 CECD COc1cc(C)cc(CN[C@@H]2C[C@@H](C)N(C3CC3)C2)c1O 894340513 OZMVJLXNXNFGLH-TZMCWYRMSA-N 290.407 2.424 10 20 CECD Oc1ccc(CCNc2cncc(Cl)n2)cc1O 302856657 LZGOZPWZMNYGRX-UHFFFAOYSA-N 265.700 2.196 10 20 CECD CC[C@@H](N[C@@H](C)CC(N)=O)c1ccc(C)cc1O 794810574 LWONYQYUTMRRJN-CMPLNLGQSA-N 250.342 2.005 10 20 CECD COc1ccc(CNC(=O)CC2(O)CCCCC2)c(O)c1 794388549 WOHNNGZLTFGTFV-UHFFFAOYSA-N 293.363 2.102 10 20 CECD CC[C@]1(C)CN(Cc2c(O)cccc2OC)CCO1 785984556 LLFXIMUEDWFFKJ-OAHLLOKOSA-N 265.353 2.402 10 20 CECD CCOc1cccc(CNCC2(N(C)C)CCC2)c1O 97929428 YDIWNQVEGKGNQO-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CN(CCC1CCOCC1)C(=O)NCc1ccc(N)cc1 1353538912 FRKBOITURDBIHX-UHFFFAOYSA-N 291.395 2.227 10 20 CECD CC(C)(NCc1ccc(N)cc1)C(=O)NCC1CCCC1 1352788605 FOOOTYMPXAXXOW-UHFFFAOYSA-N 289.423 2.443 10 20 CECD C[C@@H](Nc1cccc(-c2nn[nH]n2)n1)c1ccccc1O 1591729657 AQIGALQHDQDQKO-SECBINFHSA-N 282.307 2.140 10 20 CECD COc1cc(C)c(CNCc2cc(C(=O)O)co2)c(O)c1 1599391287 PJYCKWOEXBNBJH-UHFFFAOYSA-N 291.303 2.290 10 20 CECD COc1cc(C)cc(CN[C@@H](CC(C)C)C(=O)O)c1O 1599392570 NYPHCKYZEZWBHX-LBPRGKRZSA-N 281.352 2.298 10 20 CECD CCN1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 157418597 MKWMCUFHKBAWEY-UHFFFAOYSA-N 299.758 2.091 10 20 CECD CCCc1ncc(C(=O)NCc2ccc(O)c(O)c2)s1 159144494 HRZGDASXFFSTJY-UHFFFAOYSA-N 292.360 2.437 10 20 CECD CCOc1cccc(CN[C@H](C)CC[S@@](C)=O)c1O 125567162 BGCMNPWYVLVSIQ-WYRIXSBYSA-N 285.409 2.038 10 20 CECD CC[C@H]1C[C@H](NCc2cccc(OC)c2O)CCO1 824383924 WMCRKCJNSVSJNL-OLZOCXBDSA-N 265.353 2.448 10 20 CECD CC[C@@H](C)[C@@H](O)CNCc1cc(F)cc(F)c1O 882993707 FPQZSWGYJXNWGR-PELKAZGASA-N 259.296 2.167 10 20 CECD COC(=O)c1cnc([C@@H](C)NCc2ccccc2O)s1 314581410 AITYGQFRKYDPMH-SECBINFHSA-N 292.360 2.486 10 20 CECD Cc1noc(C)c1CC(=O)N(C)c1ccc(N)cc1 702119718 HBSQPKITTGRQHB-UHFFFAOYSA-N 259.309 2.079 10 20 CECD O=C(N[C@@H]1CCC(F)(F)C1)c1cccc(O)c1O 394676085 VRWVWCCUEFBMOA-SSDOTTSWSA-N 257.236 2.015 10 20 CECD O[C@@H](CNCc1ccc2c(c1)CCCO2)C(F)(F)F 921590128 YDVFXFBHDKGRGC-LBPRGKRZSA-N 275.270 2.024 10 20 CECD CN(CCC(=O)NC1CCCC1)Cc1ccccc1O 109773238 CXQVCPBZNCZEOU-UHFFFAOYSA-N 276.380 2.273 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C1=COCCO1 170732224 PUFJUEADKMSODL-UHFFFAOYSA-N 277.320 2.019 10 20 CECD CCN(CC)c1ccc(CNC[C@](C)(O)CCOC)cc1 172069063 RJOJJTTWWBUMIX-QGZVFWFLSA-N 294.439 2.410 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCCOC1 171030286 CBTUTYWPZGUBCR-OAHLLOKOSA-N 288.391 2.330 10 20 CECD Cc1cc(C(=O)NCc2ncc[nH]2)c(C)n1-c1ccccn1 114339533 LAMOBYABDQNEFB-UHFFFAOYSA-N 295.346 2.142 10 20 CECD COc1ccc(CN[C@@H](C)CC[S@@](C)=O)cc1C 125440816 KJKXJVQYPUQIOI-SGTLLEGYSA-N 269.410 2.250 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](C)N(C)C)c1 38088603 DAXLOCSNWZXRGZ-WDEREUQCSA-N 252.358 2.002 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)NCC(F)F 73149308 QEESEXNJWOWOJG-UHFFFAOYSA-N 284.306 2.335 10 20 CECD O=C(Cc1ccsc1)NCc1ccc(O)c(O)c1 182542343 VEGUHHBDYMMWES-UHFFFAOYSA-N 263.318 2.018 10 20 CECD CC1(C)C[C@H](NC(=O)c2cccc(O)c2O)C(C)(C)O1 189560432 UFZCKWUBVIUIFO-NSHDSACASA-N 279.336 2.174 10 20 CECD CCCCOCCNC(=O)NCc1ccc(N(C)C)cc1 195259659 NVKNWMPYALBJLA-UHFFFAOYSA-N 293.411 2.369 10 20 CECD CCOc1ccc(O)c(CN[C@H](C(=O)OC)C(C)(C)C)c1 136871729 OJDHTLVSORRJFN-CQSZACIVSA-N 295.379 2.468 10 20 CECD CO[C@@H]1[C@H]2C[C@@H]3CN(Cc4ccccc4O)[C@@H]1[C@H]3C2 289752872 QRQGVONXDJKCSF-XNHWPECASA-N 259.349 2.247 10 20 CECD CCCN(CCN1CCO[C@H](C)C1)Cc1ccccc1O 192750047 HUNWALNTWMPXDQ-OAHLLOKOSA-N 292.423 2.325 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ccncc2)cc1 82270003 BDQNBRWKTCKGDJ-UHFFFAOYSA-N 269.348 2.007 10 20 CECD COC(=O)CCN(Cc1cc(C)ccc1O)C(C)C 93384058 QDSAETIJYSBXTC-UHFFFAOYSA-N 265.353 2.474 10 20 CECD CCN(Cc1cc(C)c(C)cc1O)[C@H](C)CS(C)(=O)=O 93390538 LYUURJKGNHVPBT-CYBMUJFWSA-N 299.436 2.264 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@H](C)O[C@@H](C)[C@H]2C)c(O)c1 529228375 NHZKEKPGQARFRF-LMCGPQHNSA-N 293.363 2.077 10 20 CECD CC[C@@H](NC[C@H](C)CO)c1ccc(N(C)C)cc1 268799316 AOQBFNOKJGZUTD-SWLSCSKDSA-N 250.386 2.422 10 20 CECD CCO[C@@H]1C[C@H](NCc2c(O)cccc2Cl)[C@@H]1OC 273813031 WXHMOZLARJAACE-YUTCNCBUSA-N 285.771 2.328 10 20 CECD CN1CCCc2cc(CNC(=O)C(C)(C)F)ccc21 271065603 IXMQQFILJHSXDZ-UHFFFAOYSA-N 264.344 2.433 10 20 CECD CCc1cccnc1C(=O)NCCc1ccc(O)c(O)c1 271119485 NRJRPEYXABTWHR-UHFFFAOYSA-N 286.331 2.028 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C/c1c[nH]cn1 276754680 WKONPDMFZLHEPT-RMKNXTFCSA-N 284.363 2.148 10 20 CECD COc1c([N+](=O)[O-])ccc(CNc2cnoc2C)c1O 278531880 VHIXSQPBSVSOQR-UHFFFAOYSA-N 279.252 2.218 10 20 CECD Oc1ccccc1CN1CCC[C@@H](c2ncc[nH]2)C1 271352584 LRJGEYXBLMPDSJ-CYBMUJFWSA-N 257.337 2.495 10 20 CECD C[C@@H](C[S@@](C)=O)N(C)Cc1ccc(N(C)C)c(F)c1 275321148 SIQHJYGTSMJPQV-JEOXALJRSA-N 286.416 2.091 10 20 CECD CC(C)[C@@H](NCc1cc(F)ccc1O)c1nncn1C 289316139 FFCNUVNSBKVHII-CYBMUJFWSA-N 278.331 2.147 10 20 CECD COc1ccc(CNC(=O)NCCSC(C)C)c(O)c1 806010719 CUPVSLHXWCBZIQ-UHFFFAOYSA-N 298.408 2.342 10 20 CECD O=C(O)/C=C\c1ccc(N2CC[C@@H]3C[C@H]32)c([N+](=O)[O-])c1 706901878 PJKSOAVLKPFWMM-INLBZTQWSA-N 274.276 2.291 10 20 CECD CC(C)OC[C@@H](C)NCc1ccc(N2CCOCC2)cc1 800224818 OZXFHLDTWOXFCO-OAHLLOKOSA-N 292.423 2.426 10 20 CECD Cn1cncc1CNCc1cc(Cl)c(F)cc1O 293888546 KEEOZGLZZMAHPV-UHFFFAOYSA-N 269.707 2.208 10 20 CECD C[C@H](O)CNc1ccccc1OC[C@@H]1CCCCO1 819426991 QKYCAPBQMDAOOQ-STQMWFEESA-N 265.353 2.427 10 20 CECD COc1cccc(O)c1CNCCCC1(O)CCC1 817415220 VCLHNOSHWPDXRA-UHFFFAOYSA-N 265.353 2.186 10 20 CECD Cc1c(CNC(=O)[C@H](C)N2CC(C)C2)n(C)c2ccccc12 579141681 OPLYOGRTVIBKES-AWEZNQCLSA-N 299.418 2.443 10 20 CECD Cc1cc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)ccc1N(C)C 831632521 VJZJFSWQGAGWCL-CWLKWCNXSA-N 284.403 2.446 10 20 CECD CCNC(=O)CN(CC1CC1)c1ccc(OC)cc1 831582962 MBTWBZNSYHKYAC-UHFFFAOYSA-N 262.353 2.048 10 20 CECD CC(C)n1cc(NC(=O)NCc2ccccc2O)cn1 747563203 TYFREUMNTMNMBH-UHFFFAOYSA-N 274.324 2.491 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)Cn2cccn2)c1O 846146781 LLENTPHDJSUDAF-VXGBXAGGSA-N 275.352 2.337 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@@H](C)c1cccc(OC)c1O 846163129 KXUAFCWSXCTXGE-CORIIIEPSA-N 295.379 2.245 10 20 CECD COc1cccc([C@@H](C)N[C@H](CCO)C2CC2)c1O 846152655 BNCMGDGBDYIBSM-ZWNOBZJWSA-N 265.353 2.212 10 20 CECD CC[C@](C)(CC(=O)OC)NCc1cccc(OC)c1O 748241577 AEZDPDAZQUNSOC-OAHLLOKOSA-N 281.352 2.222 10 20 CECD C[C@H]1CCCN1S(=O)(=O)Nc1ccc(O)cc1Cl 849308830 VXRHGJPYHKHEBE-QMMMGPOBSA-N 290.772 2.187 10 20 CECD CCCNCCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 841881954 FSEBNJAZXTVQFN-ZDUSSCGKSA-N 292.427 2.112 10 20 CECD COC[C@H](CN[C@@H](C)c1ccc(Cl)cc1O)OC 841755004 XHTWKQXWUULLOT-ONGXEEELSA-N 273.760 2.358 10 20 CECD CCc1cnccc1CNC(=O)NCCc1ccc(N)cc1 841875537 UENADJDUWXDZBK-UHFFFAOYSA-N 298.390 2.268 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@H](N)C1 841058495 SANLXSAWVBVTAH-GJZGRUSLSA-N 261.413 2.421 10 20 CECD CC(C)[C@@](C)(O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756576305 MEPXOEBBVHGYKD-HZMBPMFUSA-N 282.340 2.358 10 20 CECD C[C@@H](NCc1ccnc(N(C)C)n1)c1ccc(F)cc1O 756788270 CELDURWKRWSRBJ-SNVBAGLBSA-N 290.342 2.238 10 20 CECD COc1ccc(N(C)C[C@@H]2COC(C)(C)O2)cc1OC 851734363 GBAQJHRTEVAPOX-GFCCVEGCSA-N 281.352 2.292 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H]3NC(=O)CC[C@H]3C2)c1 853554669 BZTJFXHPTFKPNY-DZGCQCFKSA-N 288.391 2.110 10 20 CECD CO[C@@]1(C)C[C@H]1NCc1c(O)ccc(Cl)c1F 850410501 OIMDJPDCTIZYBF-PWSUYJOCSA-N 259.708 2.452 10 20 CECD Oc1ccccc1CN(C[C@H]1CCCO1)c1cnccn1 853462041 HULSLSIVVRZIRV-CQSZACIVSA-N 285.347 2.368 10 20 CECD CCOC[C@H]1CN(Cc2ccc(N(C)C)c(C)c2)CCO1 859770499 BKNPVSZMJKZQAQ-MRXNPFEDSA-N 292.423 2.298 10 20 CECD CCN1C[C@@H](C)N(Cc2cccc(OC)c2O)C[C@H]1C 769465542 HEBSJBBSLMAZPI-CHWSQXEVSA-N 278.396 2.315 10 20 CECD Cc1cccc(CN2CC[C@@H](C)[S@](=O)CC2)c1O 763491061 MKLUAOLWNWGYEE-KZULUSFZSA-N 267.394 2.044 10 20 CECD O=C(N[C@H]1CCO[C@H](C2CC2)C1)c1cc(O)cs1 765864424 JJGNTSYXRUGGAE-ONGXEEELSA-N 267.350 2.141 10 20 CECD CCOc1ccc(CN2CCC[C@@H]2CC(=O)OC)c(O)c1 769483440 NFVJDWWEMYHYDL-CYBMUJFWSA-N 293.363 2.318 10 20 CECD COc1ccc(O)c(CN(C)CC[C@H](N)C(C)C)c1 133390024 LVDYHQLETMMSCG-AWEZNQCLSA-N 266.385 2.206 10 20 CECD CN1CCC[C@@H]1CNCc1cc(Cl)cc(F)c1O 776099454 RMSWKDUSGKIJKY-LLVKDONJSA-N 272.751 2.369 10 20 CECD COc1cccc(CNC(=O)[C@H](F)C(C)C)c1O 784440813 CSZHXRSRXNVFMS-LLVKDONJSA-N 255.289 2.011 10 20 CECD CN(Cc1ccccc1O)c1cncc(-n2cccn2)n1 786796916 MQKDTNNUMJSPTP-UHFFFAOYSA-N 281.319 2.004 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1ccccn1 700898706 KWCCFRIQLVMEIQ-UHFFFAOYSA-N 253.349 2.493 10 20 CECD COCc1nc(COC(=O)c2cccc(O)c2O)cs1 784788164 QBPBXCQLNLDXDO-UHFFFAOYSA-N 295.316 2.058 10 20 CECD Cc1nc([C@H](C)NCc2c(O)ccc(Cl)c2F)n[nH]1 894774452 SMPZZLKXGUZBQV-LURJTMIESA-N 284.722 2.462 10 20 CECD CC(C)[C@H](F)C(=O)N1CCOc2cc(N(C)C)ccc21 784124946 JFCYFMUNFQGOGA-AWEZNQCLSA-N 280.343 2.472 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](c3n[nH]c(C)n3)C2)c1 895007929 PTDRBPZLNZHGMP-GFCCVEGCSA-N 272.352 2.117 10 20 CECD CCOc1ccc(CN[C@@H](C)c2n[nH]c(C)n2)c(O)c1 894771427 ISQNRLBNHBWKIH-VIFPVBQESA-N 276.340 2.068 10 20 CECD C[C@@H]1OCC[C@@]12CN(Cc1cc(F)cc(F)c1O)CCO2 894603524 ZJNMPHYIKJQCKE-ZUZCIYMTSA-N 299.317 2.050 10 20 CECD CN(C)c1ccc([C@@H](CN[C@@H]2CCSC2)N(C)C)cc1 898451350 YCKGEXWUAOYKAK-GDBMZVCRSA-N 293.480 2.450 10 20 CECD COc1ccc(CNCCNC(=O)C[C@H]2C[C@@H]2C)cc1C 1133357361 XEJDDESSABZSTA-SWLSCSKDSA-N 290.407 2.256 10 20 CECD CC[C@@H](O)CNCc1cc(Br)cc(F)c1O 715723938 XTECINJZVBVNTF-SECBINFHSA-N 292.148 2.154 10 20 CECD COc1cc(CN(C)C[C@@H](C)OC)c(O)cc1C 795748666 DMFKEEOXZSOUSS-LLVKDONJSA-N 253.342 2.176 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@H](C)O[C@]3(CCOC3)C2)c1 794705802 QYLYMBVQLPHUQJ-WMLDXEAASA-N 291.391 2.389 10 20 CECD CC1(C)CN(C(=O)NCc2ccc(N)cc2)CC(C)(C)O1 1335725907 OKWFUCMWMJADDC-UHFFFAOYSA-N 291.395 2.368 10 20 CECD CC(C)[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)O 1609943255 MLIKXZJSBKAHBV-PELKAZGASA-N 282.296 2.060 10 20 CECD CCC(CC)(CO)CNCc1cccc(OC)c1O 229210076 ASGLITYZGCOYMP-UHFFFAOYSA-N 267.369 2.289 10 20 CECD CC(C)c1ccc(O)c(CN2CC[C@H](C(=O)O)C2)c1 1588968896 SRRCPCCKASKFEU-LBPRGKRZSA-N 263.337 2.422 10 20 CECD C[C@H](NC[C@H]1CCC[C@H](O)C1)c1cc(C(=O)O)ccc1O 1593252115 NZPLQNGLOVSVJT-GVXVVHGQSA-N 293.363 2.292 10 20 CECD CN(C)c1ccc(CN2CCC3(CCNCC3)C2)cc1 843120189 PFSHCPCYODSDJY-UHFFFAOYSA-N 273.424 2.328 10 20 CECD CCc1cccc(CNC[C@@H](O)[C@@H](C)CC)c1O 848894409 FAPGMTFAARWJQB-SMDDNHRTSA-N 251.370 2.451 10 20 CECD Cc1ccoc1CN(C)C(=O)c1cccc(O)c1O 311862413 VIKNRERUDTZXHK-UHFFFAOYSA-N 261.277 2.271 10 20 CECD Oc1cccc2c1[C@@H](NC[C@@H]1CCN(C3CC3)C1)CC2 313395060 SOJYKKGPVQKIER-WFASDCNBSA-N 272.392 2.453 10 20 CECD C[C@H]1C[C@H](NCc2cc(F)cc(F)c2O)CCN1C 708505693 ZQGWNDQLLDRVFR-JOYOIKCWSA-N 270.323 2.243 10 20 CECD C[C@@H](NC(=O)CC[C@@H]1CCCNC1)c1ccccc1O 870988744 YHISYCWJDHQPEZ-OLZOCXBDSA-N 276.380 2.349 10 20 CECD CN[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 53201291 JQYDFMVFBNCICX-LBPRGKRZSA-N 254.761 2.229 10 20 CECD CC[C@H](C)[C@](C)(O)CNCc1cc(OC)ccc1O 305757000 APSCCYZAHNFYCM-XHDPSFHLSA-N 267.369 2.288 10 20 CECD CN(CCC1CCOCC1)Cc1cc2c(cc1O)OCO2 121232271 IUNPHTWTIRYJJI-UHFFFAOYSA-N 293.363 2.369 10 20 CECD CCCCCS(=O)(=O)N(C)Cc1ccccc1O 184535388 TZWZDUBFPUCTTK-UHFFFAOYSA-N 271.382 2.344 10 20 CECD C[C@@H](C[S@](C)=O)N[C@@H](C)c1ccc(F)c(F)c1O 187913394 GUHHQVJEYKRRLL-KEJSXXJDSA-N 277.336 2.088 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)Nc1ncccc1C#N 183599446 LTKAVTARFARARN-SNVBAGLBSA-N 269.304 2.408 10 20 CECD CCCN(CCS(=O)(=O)CCC)Cc1ccccc1O 174372210 YGINIEZNLRCPMZ-UHFFFAOYSA-N 299.436 2.429 10 20 CECD CC[C@@H](CSC)NC(=O)/C=C/c1ccc(O)c(O)c1 181314456 MEMGOGNAYBXPPR-ZRQQLDRUSA-N 281.377 2.369 10 20 CECD C[C@@](O)(CNCc1ccccc1O)c1ccccc1 134650527 BQELPOWFSPLSDT-MRXNPFEDSA-N 257.333 2.390 10 20 CECD Nc1ccc(CC(=O)Nc2ccc(-n3nccn3)cc2)cc1 237924356 COXGSWNBWAEUPZ-UHFFFAOYSA-N 293.330 2.031 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnn(C)c1C1CC1 149840225 CPHKGABIWFCAEE-UHFFFAOYSA-N 285.347 2.275 10 20 CECD Oc1cc2c(cc1CNC1Cc3ccccc3C1)OCO2 231032127 XXZQCNCSDVPKRQ-UHFFFAOYSA-N 283.327 2.378 10 20 CECD COc1cccc(CNC(=O)[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)c1O 528861574 NMIPIMOEEYGTII-RMIALFOJSA-N 293.363 2.077 10 20 CECD COc1cccc(CNC(=O)CCc2nccs2)c1O 264280796 QKBXWAHLDXDBOD-UHFFFAOYSA-N 292.360 2.106 10 20 CECD CC(=O)C(=O)COC(=O)Cc1cccc2ccccc12 808488932 VRFSTPWJYXMYHW-UHFFFAOYSA-N 270.284 2.084 10 20 CECD COc1cccc(CN2CC[C@@H](SC)C2)c1O 294910367 ACMPLAWSZKSXKG-LLVKDONJSA-N 253.367 2.338 10 20 CECD CC(C)[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCCO1 295431963 UXPCWYHHYCLKBD-GFCCVEGCSA-N 297.326 2.124 10 20 CECD CC1(C)CN(C(=O)c2cccc(O)c2O)[C@@H]1C1CC1 291102857 LWRYOWSDLNBPCR-CYBMUJFWSA-N 261.321 2.358 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(F)c[nH]1 815629609 HROXEEZTKGIHHE-UHFFFAOYSA-N 275.327 2.458 10 20 CECD COc1ccc(N2CC[C@@H](CNCC3(O)CCC3)C2)cc1 819379009 BVMNTODKZRMXNY-AWEZNQCLSA-N 290.407 2.026 10 20 CECD COc1ccc(O)c([C@H](C)NCCCCC(=O)O)c1 820845754 AYLJYWAMQIJQHZ-JTQLQIEISA-N 267.325 2.306 10 20 CECD CCOc1ccc(CN(C)Cc2nnc(C)o2)c(O)c1 827039016 DHVXLVSNWBGAHO-UHFFFAOYSA-N 277.324 2.114 10 20 CECD Cc1c(CCC(=O)N[C@H](C)c2ccccc2O)cnn1C 827940926 KQOJYSANIOLFFY-LLVKDONJSA-N 287.363 2.244 10 20 CECD CCC[C@@H](OC)C(=O)NCc1ccc(N(C)C)cc1C 825873905 QETMBRXXFPKFCK-OAHLLOKOSA-N 278.396 2.492 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)NC(CF)CF 836320770 SLSYDZDZEDBISE-UHFFFAOYSA-N 295.333 2.170 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C(=O)C(C)(C)C)c1 735858299 LDNRGPSTLIXTGS-SECBINFHSA-N 279.336 2.193 10 20 CECD CC1(C)C[C@@H](CNC(=O)c2cc(O)cs2)CCO1 839793170 SWQPLSQJDGGNLT-VIFPVBQESA-N 269.366 2.389 10 20 CECD COC1([C@@H](C)NCc2ccccc2O)CCOCC1 834555006 JPEAGTYGXRGKFL-GFCCVEGCSA-N 265.353 2.066 10 20 CECD COc1cccc([C@@H](C)NCCC[C@H](C)O)c1O 846169293 ZSTJJDRIDMZXIC-WDEREUQCSA-N 253.342 2.212 10 20 CECD CN(C)c1ccc(CN(C)C2CNC2)c(C(F)(F)F)c1 843127465 RFDATOGDZXQXCG-UHFFFAOYSA-N 287.329 2.175 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2cccc(OC)c2O)C1 846144309 CDWHGHDNLPQIRU-NWDGAFQWSA-N 292.379 2.062 10 20 CECD CN(C(=O)C(=O)Nc1ccc(N)cc1)[C@H]1CCC(C)(C)C1 841120485 LPRQKAXERWIQFF-ZDUSSCGKSA-N 289.379 2.244 10 20 CECD CCOc1ccc(CN2CCC[C@H]([C@H](C)N)C2)c(O)c1 843051494 JKEOGGIBAKQEGZ-STQMWFEESA-N 278.396 2.350 10 20 CECD C[C@@H](NC[C@@H](O)COCC1CC1)c1ccc(Cl)cc1O 841748812 ZDMXSNRGPDQYPX-ZWNOBZJWSA-N 299.798 2.484 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@H]2CC(=O)N(C3CC3)C2)c1 846205710 KIGFJJXZHXFXGM-CHWSQXEVSA-N 288.391 2.362 10 20 CECD C[C@H](N[C@H]1C[C@H](CO)C1)c1ccc(Cl)cc1O 927142601 CNIKDMUZUWQNKB-QXEWZRGKSA-N 255.745 2.467 10 20 CECD CN(C)c1cc(F)c(CNCCN2CCCC2)cc1F 858088082 PJKMLRKRUVUEER-UHFFFAOYSA-N 283.366 2.216 10 20 CECD C[C@H](NC[C@H](C)N(C)C)c1cc(F)cc(F)c1O 756533450 HUBOOKDLNXWMJN-IUCAKERBSA-N 258.312 2.271 10 20 CECD Cc1c[nH]nc1C(=O)NCc1cc(Cl)ccc1O 857548206 IMZGAORNVFBINL-UHFFFAOYSA-N 265.700 2.007 10 20 CECD C[C@@H]1CSCCN(C(=O)c2cc(O)cs2)C1 754493941 IBFBPQJKHDXUEY-QMMMGPOBSA-N 257.380 2.279 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@]2(CO)CCOC2)cc1 862426802 OZEHLOLRKYVASA-QGZVFWFLSA-N 292.423 2.116 10 20 CECD CC[C@@H](N[C@@H]1COCC[C@H]1O)c1cc(Cl)ccc1O 866497513 HRBIUEPAWDDJJR-YRGRVCCFSA-N 285.771 2.236 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCSC2)cc1F 762168552 RUUPYBGCKDPWBP-LLVKDONJSA-N 282.384 2.261 10 20 CECD C[C@@H]1CN(CCN[C@H](C)c2ccccc2O)C[C@@H](C)O1 879649319 NCICXCDKOFQFGR-MGPQQGTHSA-N 278.396 2.152 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCC[C@@H](N)C2)c1 870882193 VSKFKLHIFKAIMS-IJLUTSLNSA-N 292.379 2.096 10 20 CECD Cc1ccc(CNCCN(C)CC(F)(F)F)c(O)c1 877026833 GFMUFYZWHOMLTK-UHFFFAOYSA-N 276.302 2.284 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@@]3(CCCOC3)C2)c(O)c1 877495552 YLSTWCCXUIPOEA-YOEHRIQHSA-N 291.391 2.471 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3cc(C)ccc32)cn1 773865841 NYIGIJMRWBKWMJ-XQRVVYSFSA-N 295.342 2.396 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2c3c[nH]nc3CC[C@H]2C)c1 880837961 WKLDKXSMCJUSRU-BZNIZROVSA-N 299.374 2.406 10 20 CECD COCc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1 776745991 SEYCDXMVANGQRI-UHFFFAOYSA-N 293.344 2.339 10 20 CECD CC(C)[C@](C)(O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 775402681 FSLNWLXCQSQPRB-WBMJQRKESA-N 278.396 2.337 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)[C@@H]1OC 893593818 PEZUENGGCMLEKV-OIISXLGYSA-N 291.391 2.294 10 20 CECD C[C@@H](NC[C@@H](CO)Cc1ccco1)c1ccccc1O 783519999 OFKYTAASNHPGRR-OLZOCXBDSA-N 275.348 2.487 10 20 CECD C[C@H]1C[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)CO1 784312042 JOMLDRQSYASELD-GXTWGEPZSA-N 276.380 2.136 10 20 CECD COc1ccc(CN[C@H](C)[C@H](OC)C2CC2)c(O)c1OC 894755448 QVDUTJUORPTRKY-BMIGLBTASA-N 295.379 2.313 10 20 CECD COc1ccc(O)c([C@@H](C)NCCOC2CC2)c1 714982091 IHJWNWWUCXZVJA-SNVBAGLBSA-N 251.326 2.230 10 20 CECD OC[C@H](CC(F)(F)F)NCc1cccc(Cl)c1O 717714212 WZDHGDSCAMMEFS-QMMMGPOBSA-N 283.677 2.449 10 20 CECD CN(Cc1ccc(N(C)C)cc1)CN1CC2(CC2)CC1=O 1325260349 XEVZMKKNSONTQS-UHFFFAOYSA-N 287.407 2.154 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC[C@H]1C[C@H]2C=C[C@H]1C2 1334816025 PBYSJNNZGJFKSE-VMKDJIABSA-N 285.343 2.439 10 20 CECD CCCCN(C(=O)C1=CC[C@@H](N)C1)c1ccccn1 1577442164 YJVVXZBYLDXBSN-CYBMUJFWSA-N 259.353 2.262 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CC=C(C(=O)O)C2)c1 1597130205 MLMVUEKRYQGHGS-GFCCVEGCSA-N 277.320 2.054 10 20 CECD CCN1CCCc2cc(CNC3CC(C(=O)O)C3)ccc21 1776876018 MFRNDIVFPVWBCV-UHFFFAOYSA-N 288.391 2.412 10 20 CECD CC[C@H](NCCN(C)CCCOC)c1ccccc1O 156028089 SCXUKGYPGNIPQC-HNNXBMFYSA-N 280.412 2.401 10 20 CECD COc1ccc(CNCCC(=O)NC(C)C)cc1C 42225399 FXBCPOJWCBNIIW-UHFFFAOYSA-N 264.369 2.008 10 20 CECD C[C@@H]1C[C@@H](CNCc2cc3c(cc2O)OCO3)CCO1 271363222 ISJIDIQYSHVHII-MNOVXSKESA-N 279.336 2.026 10 20 CECD COc1cccc(CNCc2ccc(F)cn2)c1O 763523182 VQIQIPOGFRAAJG-UHFFFAOYSA-N 262.284 2.225 10 20 CECD C[C@H]1CCCN(C(=O)CN(C)Cc2ccccc2O)C1 111236479 RPFFRVNXDPJMMV-ZDUSSCGKSA-N 276.380 2.083 10 20 CECD O=C(CSCC(F)(F)F)NCc1ccc(O)c(O)c1 182541965 NHUYXEXEBKXMAE-UHFFFAOYSA-N 295.282 2.010 10 20 CECD C[C@H](CN1CCOCC1)N[C@H](C)c1ccc(N(C)C)cc1 37273390 RQFSOJJWCMUCQC-HUUCEWRRSA-N 291.439 2.124 10 20 CECD CCN(C)c1ccc([C@H](C)NC2CN(C(=O)OC)C2)cc1 181473661 IDFWGFNPSMOEJA-LBPRGKRZSA-N 291.395 2.244 10 20 CECD CN(Cc1cccc(Cl)c1O)[C@@H]1CCCCNC1=O 367725071 RCDGQFZHILSYSC-GFCCVEGCSA-N 282.771 2.146 10 20 CECD O=C(CC[C@@H]1CCCCO1)NCc1ccc(O)c(O)c1 182531614 MBECYCISZLIKOC-LBPRGKRZSA-N 279.336 2.063 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1 37823739 HDWRBWKRONVASR-QEJZJMRPSA-N 288.391 2.271 10 20 CECD CCC(CC)(CO)NCc1cc(OC)c(OC)cc1O 182209179 OELMHEPRLMELSD-UHFFFAOYSA-N 283.368 2.050 10 20 CECD COc1cccc(CNC(=O)c2c(O)cccc2F)c1O 184977456 ZHPXEEXSXXQUCZ-UHFFFAOYSA-N 291.278 2.176 10 20 CECD CC(C)[C@@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 131276283 WWQDPRRVXYHHOF-WFASDCNBSA-N 250.386 2.420 10 20 CECD COC(=O)[C@H]1CC[C@@H](N[C@@H](C)c2cc(OC)ccc2O)C1 193889596 OPLQBBVUSVXUJV-SDDRHHMPSA-N 293.363 2.393 10 20 CECD CN(C)c1nnc(Sc2ncc([N+](=O)[O-])s2)s1 192452675 SHOLOELRIACXCW-UHFFFAOYSA-N 289.367 2.120 10 20 CECD CC(=O)NC1CCC(NCc2ccc3c(c2)CCO3)CC1 263709932 UCXRWBLLXXRRDZ-UHFFFAOYSA-N 288.391 2.158 10 20 CECD CCCCOCCNC(=O)NCc1ccccc1O 263663954 APEISPDOFPQYNC-UHFFFAOYSA-N 266.341 2.008 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CCSC2)cc1 278806339 WWFHQVPSSWAOOO-GFCCVEGCSA-N 295.404 2.428 10 20 CECD COc1ccc(O)c(CN2CCCC23CCN(C)CC3)c1 375471797 IESZCJPNBKMQFM-UHFFFAOYSA-N 290.407 2.461 10 20 CECD COc1cccc(CNC[C@H]2CCOC[C@H]2C)c1O 285655836 YRKHMGYFWPYWDV-VXGBXAGGSA-N 265.353 2.163 10 20 CECD CC(C)c1nc(CN(C)Cc2ccccc2O)n[nH]1 293052487 FWWFCZKNVUKWLS-UHFFFAOYSA-N 260.341 2.266 10 20 CECD CC(=O)C(=O)CSc1nc(C)nc2ccccc12 808010025 HGYLSPABQWXUGU-UHFFFAOYSA-N 260.318 2.188 10 20 CECD CN(C)c1ccc(CN(C(=O)c2cnccn2)C2CC2)cc1 298381602 OLZSWLCVQZAJJO-UHFFFAOYSA-N 296.374 2.347 10 20 CECD CC(=O)C(=O)COC(=O)c1ccc(C(C)(C)C)cc1 808488215 CGADUOFIKTWBDC-UHFFFAOYSA-N 262.305 2.299 10 20 CECD C[C@H](N[C@@H]1CCC[C@@H](N)C1)c1cc([N+](=O)[O-])ccc1O 817969901 HWOLFWQFFVUMIG-HBNTYKKESA-N 279.340 2.221 10 20 CECD Cc1cc(C)c([C@@H](C)NCc2nnnn2C2CC2)c(O)c1 815595512 TVVHXOCZGKFOHL-LLVKDONJSA-N 287.367 2.181 10 20 CECD COC[C@H](C)[C@H](C)C(=O)N[C@H](C)c1cc(OC)ccc1O 812498265 KCRLUWXNNPIKAE-SDDRHHMPSA-N 295.379 2.497 10 20 CECD CC1(CN[C@@H]2CCc3cccc(O)c32)CCNCC1 817965251 RZDPPBZHABRWCW-CYBMUJFWSA-N 260.381 2.359 10 20 CECD CCn1ccnc1[C@@H](C)NCc1cc2c(cc1O)OCO2 825005852 UBZJMNQWFLQUJI-SNVBAGLBSA-N 289.335 2.188 10 20 CECD COc1cc(CCC(=O)N[C@H](C)c2ccccc2O)on1 827956262 ITXPYZWWXVXCOL-SNVBAGLBSA-N 290.319 2.199 10 20 CECD C[C@H]1C[C@H]1CNCc1ccc(N2CCC(O)CC2)cc1 827662398 QISXTXJJFXGONV-ZFWWWQNUSA-N 274.408 2.393 10 20 CECD CCc1nocc1CN(C)C(=O)c1c(F)ccc(O)c1O 832894229 LHYZOMWAHKRQRR-UHFFFAOYSA-N 294.282 2.060 10 20 CECD CC1(C)C[C@@H]1CNCc1cc([N+](=O)[O-])ccc1O 732819803 AKOYONHQBZWDNZ-SNVBAGLBSA-N 250.298 2.436 10 20 CECD C[C@H]1C[C@@H](C)N(CC(=O)NCc2ccc(N(C)C)cc2)C1 839495664 UALSJOLRPLHLDJ-UONOGXRCSA-N 289.423 2.099 10 20 CECD CC[C@H](N)CNC(=O)N(CC)Cc1ccc(N(C)C)cc1 842008289 TUJYZAROCQHSMQ-AWEZNQCLSA-N 292.427 2.021 10 20 CECD COCC(COC)N[C@@H](C)c1ccc(Cl)cc1O 841756881 LBCFSRMXDWWCET-VIFPVBQESA-N 273.760 2.358 10 20 CECD CS[C@@H](C)CCC(=O)NCc1ccc(O)cc1O 910949772 OXTBGURJNRIRRY-VIFPVBQESA-N 269.366 2.246 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NS(=O)(=O)C1CC1 841568625 DBMBRGRQTRGYEC-LBPRGKRZSA-N 296.436 2.074 10 20 CECD C[C@H]1C[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)CC[C@H]1C 841088433 WKRQFWXUIRGWSR-UHIISALHSA-N 289.379 2.148 10 20 CECD CC[C@@H](N[C@H](C)C(=O)NC(C)C)c1ccc(F)cc1O 840888811 CRMWUTMKTYSXIX-ZWNOBZJWSA-N 282.359 2.485 10 20 CECD CCOc1ccc(O)c(CNC[C@H]2CCCCN2)c1 841033613 XSPNCIQHADYEQD-CYBMUJFWSA-N 264.369 2.023 10 20 CECD C[C@H]1NCCN(Cc2cccc(Br)c2O)[C@@H]1C 843056854 AZMBWBPQWOXUGE-NXEZZACHSA-N 299.212 2.337 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H](C)[C@@H]2CN)c1 843051751 LJUHNVOYJRBRIY-DOMZBBRYSA-N 278.396 2.350 10 20 CECD Cc1cc(/C=C2/SC(N3CCCCC3)=NC2=O)nn1C 840713324 MUJOXHQRVAUPMS-FMIVXFBMSA-N 290.392 2.185 10 20 CECD C[C@H](NCCNc1cnccn1)c1cc(F)ccc1O 756646954 QZVNZCDJKBVEAQ-JTQLQIEISA-N 276.315 2.084 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)C1CCC1 759578338 HVALMRFVDQELLE-FNORWQNLSA-N 276.288 2.023 10 20 CECD Cc1cc(NC(=O)N(C)Cc2ccccc2O)nnc1C 758241408 BLLWDQRFGUKPFP-UHFFFAOYSA-N 286.335 2.463 10 20 CECD O=C(NCCSCC(F)(F)F)c1cccc(O)c1O 698557766 FDSWGUYTQYFPRN-UHFFFAOYSA-N 295.282 2.123 10 20 CECD COc1cccc(CNc2cc(CO)cc(C)n2)c1O 853259288 XCSCQZXFKFDAPK-UHFFFAOYSA-N 274.320 2.209 10 20 CECD CC[C@](C)(CC(=O)OC)NCc1cc(OC)ccc1O 757918800 GDGCSRFXRHNORV-OAHLLOKOSA-N 281.352 2.222 10 20 CECD O=C(OCC[C@@H]1CCCC1=O)c1cccc(O)c1O 758564032 ZHPURBMUMIORGJ-VIFPVBQESA-N 264.277 2.014 10 20 CECD CN(CCCNC(=O)C1CCC1)Cc1cc(F)ccc1O 763620989 ABYOZUQFWZXPTM-UHFFFAOYSA-N 294.370 2.270 10 20 CECD Cc1nocc1C(=O)NCCCSc1nccs1 865784622 HNCYGDLGJYLUNJ-UHFFFAOYSA-N 283.378 2.352 10 20 CECD COC[C@@H](C)NC(=O)NCc1ccc(N2CCCC2)cc1 769714716 WMOLSFGKYBDQSB-CYBMUJFWSA-N 291.395 2.121 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2ccc(C)cc2O)C1 876782184 NBYMTYQQEFERIC-HNNXBMFYSA-N 263.337 2.086 10 20 CECD Cc1ccc(CNc2ccc(N(C)CCO)cn2)c(O)c1 877095948 WDYJMBGHOHCNCS-UHFFFAOYSA-N 287.363 2.136 10 20 CECD COc1nc(C)ccc1C(=O)NCc1ccccc1O 777420878 ZYRDNCNGTRZHBN-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc(O)c(C)c2)c1 779381712 PZRWSSXDUIZWSG-UHFFFAOYSA-N 287.315 2.345 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)[C@H](C)CN1C 775983106 BCEMKENWEYEHSW-CHWSQXEVSA-N 279.403 2.416 10 20 CECD C[C@@H]1CC[C@@H](COC(=O)/C=C/c2ccc(O)c(O)c2)O1 789071755 CVMBBEPULXMUIN-STBQQDIQSA-N 278.304 2.222 10 20 CECD COC[C@@H](C)NCc1ccc(Br)cc1O 701016171 VCFMRJQJDZXFIE-MRVPVSSYSA-N 274.158 2.279 10 20 CECD COc1ccc(CNC2C[C@@H](C)O[C@H](C)C2)c(O)c1OC 893260175 LKXBGCHJLKRYRD-GHMZBOCLSA-N 295.379 2.455 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1cc(Cl)cc(F)c1O 793323950 GNPSMDVCKQCDCG-SSDOTTSWSA-N 275.707 2.178 10 20 CECD Oc1ccc(Cl)c(F)c1CNCc1nnc2n1CCC2 790949803 IMGXLTHCCVNIHQ-UHFFFAOYSA-N 296.733 2.012 10 20 CECD CC[C@H](NCC1(CO)CC1)c1ccc(F)cc1O 796778151 FVEYHXAEIDGYIP-LBPRGKRZSA-N 253.317 2.345 10 20 CECD O=C(O)[C@@H]1[C@H](CNCc2cc(Cl)ccc2O)C1(F)F 715243245 APCCOTDWIASCOD-WPRPVWTQSA-N 291.681 2.101 10 20 CECD CCC(C)(C)N[C@H](C)C(=O)NCc1ccc(OC)cc1O 794388242 SDWWQOLKSJORDL-LLVKDONJSA-N 294.395 2.184 10 20 CECD CCOc1ccc(N2CCN(c3ncccn3)CC2)cc1 1324598469 BCCLSSYYCPJFFZ-UHFFFAOYSA-N 284.363 2.202 10 20 CECD COc1ccc(N2CCC(NC(=O)[C@@H]3C[C@@H]3F)CC2)cc1 1337092683 NUWRNYUIHDZKKX-CABCVRRESA-N 292.354 2.138 10 20 CECD Cc1nc(C)c(CC(=O)NCc2ccc(N)cc2)s1 1346208992 DCTWEULCAUFFOD-UHFFFAOYSA-N 275.377 2.201 10 20 CECD CN(C)c1ccc(CNc2ncnc3c2cnn3C)cc1 12486364 LRICNLQKDSCPLI-UHFFFAOYSA-N 282.351 2.041 10 20 CECD COc1cccc(CC(=O)Nc2ccc(N)cc2)c1 19398060 CAAPRHJECWEEGD-UHFFFAOYSA-N 256.305 2.459 10 20 CECD COc1cccc(CN2CC[C@H](OC)[C@@H](C)C2)c1O 824814711 DUNRWSBJLLUGNF-AAEUAGOBSA-N 265.353 2.258 10 20 CECD c1cc2c(cc1CN[C@H]1CCNC3(CCC3)C1)CCO2 841089452 NJDUYDYMLKFWQA-HNNXBMFYSA-N 272.392 2.386 10 20 CECD CC[C@@H](NCCC(=O)NC(C)C)c1ccccc1O 135734339 ZKSMMQNWCGWBFX-CYBMUJFWSA-N 264.369 2.348 10 20 CECD CC[C@@H](C)[C@H](NCc1ccc2c(c1)CCO2)C(=O)OC 37363451 ROGZPTOOBJGUIA-ABAIWWIYSA-N 277.364 2.299 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2ccc(C)nn2)c1 396576848 PZCOLNLVHSYLTM-LLVKDONJSA-N 273.336 2.350 10 20 CECD Cc1ccc(-n2nnnc2N(C)Cc2ccccc2O)cc1 302593537 AROGZLSSXYCKCY-UHFFFAOYSA-N 295.346 2.313 10 20 CECD CCCOc1ccc(CNC[C@@](C)(O)CCOC)c(O)c1 172069795 CCVCRQZOBXLZOX-INIZCTEOSA-N 297.395 2.058 10 20 CECD CC[C@H](O)CCNC(=O)NCc1ccc(N(C)C)cc1C 305085415 TZYXNDUYCWTFHT-HNNXBMFYSA-N 293.411 2.021 10 20 CECD CCOc1ccccc1N(C)C(=O)/C=C/c1cnn(C)c1 121340207 VYYONHHFTZOOEY-MDZDMXLPSA-N 285.347 2.495 10 20 CECD CCOc1ccc(O)c(CNCC2(CO)CCCC2)c1 185806523 YPZXEZMXPLVLPW-UHFFFAOYSA-N 279.380 2.433 10 20 CECD CN(Cc1cc(C(N)=O)cs1)c1ccc2c(c1)OCO2 180759327 ZAQQLKFCJMPBDY-UHFFFAOYSA-N 290.344 2.212 10 20 CECD CO[C@]1(C)C[C@@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 237266302 ISRRGZGMBMCEAU-RHSMWYFYSA-N 290.407 2.473 10 20 CECD Cc1c(CNC(=O)Cc2ccnn2C)n(C)c2ccccc12 348706034 MMCGNGKCASECFA-UHFFFAOYSA-N 296.374 2.079 10 20 CECD CCn1nncc1CNCc1c(O)ccc(Cl)c1F 527727657 IXHOIRDBLQMABT-UHFFFAOYSA-N 284.722 2.086 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCOC2)cc1F 264500404 LZYLTSJNIACVDK-ZDUSSCGKSA-N 294.370 2.325 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cocn1 264128905 DTLKSFSYNNWLEA-UHFFFAOYSA-N 273.336 2.403 10 20 CECD CCN1CCN(Cc2c(O)ccc3ccccc23)CC1=O 273502646 PKCCYHDWNPDIQK-UHFFFAOYSA-N 284.359 2.210 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)CN2CCOCC2)c(O)c1C 273379298 HVOUXOVEEPISAC-DZGCQCFKSA-N 292.423 2.380 10 20 CECD CO[C@H]1CCCC[C@@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272721481 ZNRQJLQVFQMVLR-PSZCTONISA-N 291.347 2.185 10 20 CECD CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@H](C)S1(=O)=O 289966742 YUYJVHRIPCQRHV-GXTWGEPZSA-N 297.420 2.098 10 20 CECD OC[C@]1(F)CCCN(Cc2cccc(Cl)c2O)C1 289775475 KWBAMRBJINLMGZ-ZDUSSCGKSA-N 273.735 2.342 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCC2(C)C)c1O 288139065 YDFMDMDINNPSFL-GFCCVEGCSA-N 278.352 2.389 10 20 CECD COCC1(CCNCc2cc3c(cc2O)OCO3)CCC1 292987986 NRLOQRBRQFSJMG-UHFFFAOYSA-N 293.363 2.417 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@@H](O)C1CC1 809752213 PKDQATOHPOUNBH-OAHLLOKOSA-N 266.360 2.094 10 20 CECD COCC[C@H](CO)N[C@H](C)c1cc(Cl)cc(C)c1O 808717601 FVRMRDNFTKJKKK-ZYHUDNBSSA-N 287.787 2.402 10 20 CECD CCNCCCN[C@H](C)c1cc(OC)ccc1O 817942614 BJIKYUMUDXITRE-LLVKDONJSA-N 252.358 2.051 10 20 CECD C[C@@H]1CN(Cc2ccc3ccccc3c2O)C[C@@H](CO)O1 816588170 HTUWQVKTPFTUND-DOMZBBRYSA-N 287.359 2.127 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2CNCCCO2)c2c(O)ccc(F)c21 817982507 UFNNYIZWZVEVQT-WZRBSPASSA-N 294.370 2.048 10 20 CECD C[C@H](N[C@H]1CCC[C@@H](N)C1)c1cc([N+](=O)[O-])ccc1O 817969898 HWOLFWQFFVUMIG-AXFHLTTASA-N 279.340 2.221 10 20 CECD CCCN1C[C@H](CN[C@H]2CCc3cccc(O)c32)CC1=O 817589903 RELKNDQVEJPLDC-JSGCOSHPSA-N 288.391 2.228 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCCSC)c1 729053498 JQHOPNOBPAIWKR-SECBINFHSA-N 284.381 2.124 10 20 CECD COCCN1CC[C@@H](NCc2cc(Cl)c(C)cc2O)C1 825292017 SJLYBZUJLUTSHN-CYBMUJFWSA-N 298.814 2.164 10 20 CECD CCOc1ccc(CNC[C@@H]2CC[C@H](C)O2)c(O)c1 835086399 GZYPSBKLUHZFLQ-FZMZJTMJSA-N 265.353 2.448 10 20 CECD CO[C@@H]1COC[C@@H]1NCc1ccc(N2CCCCC2)cc1 839191550 AGFJBNKHYOHORB-DLBZAZTESA-N 290.407 2.180 10 20 CECD CC[C@H](CN(C)Cc1ccc(N2CCOCC2)cc1)OC 842146919 FBLPZSBACHXBMO-QGZVFWFLSA-N 292.423 2.380 10 20 CECD Oc1ccc2ccncc2c1CN1CCO[C@H](CF)C1 840173586 ZYICJEDEFROWJY-GFCCVEGCSA-N 276.311 2.111 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1c(O)ccc(Cl)c1F 844936550 IKMADYTVNVKDDV-VIFPVBQESA-N 275.707 2.480 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1C[C@H]1c1ccco1 840275218 AYLFEBHWPUFJDK-VXGBXAGGSA-N 272.304 2.341 10 20 CECD C[C@H](NC[C@@H]1CCCNC1=O)c1cc(Cl)ccc1O 840825311 DURUSNQEEXTTFL-UWVGGRQHSA-N 282.771 2.222 10 20 CECD COc1cccc([C@H](C)NC[C@@H](C)CCCO)c1O 846170559 OTKZQMGRITVHJP-RYUDHWBXSA-N 267.369 2.460 10 20 CECD CC[C@@H](N)CNCc1ccc(N(CC)CC)c(F)c1 841073362 WEGUVIVZCBPEKY-CYBMUJFWSA-N 267.392 2.499 10 20 CECD CCOc1cccc(CNC[C@@H](O)c2ccco2)c1O 747098891 CXDKJKRAWJDGEI-GFCCVEGCSA-N 277.320 2.207 10 20 CECD C[C@H](N[C@H]1C[C@H](CO)C1)c1cc(Cl)ccc1O 927149413 YZDHHFIEHNETBY-QXEWZRGKSA-N 255.745 2.467 10 20 CECD Cc1cc(O)c(CN[C@H](CO)CC(F)F)cc1C 758614006 FSZBHACWTQMGFJ-NSHDSACASA-N 259.296 2.115 10 20 CECD CCOCc1cc(CNCC[C@H](C)O)ccc1OC 758480621 KBFOKXNLXPAILZ-LBPRGKRZSA-N 267.369 2.092 10 20 CECD COC1CC(C(=O)NCc2c(O)ccc3c2CCCC3)C1 860243693 USEVPBSHZHGIOC-UHFFFAOYSA-N 289.375 2.312 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@@H](C)c1ccc(F)cc1O 760883549 CEIWMARKRCRJHI-PSOPSSQASA-N 283.343 2.376 10 20 CECD CN(Cc1ccccc1)Cc1cc2c(cc1O)OC[C@@H]2O 768437722 FIUPTOVXXKJUKE-INIZCTEOSA-N 285.343 2.450 10 20 CECD CCN(C)c1ccc([C@H](C)NCCCC(=O)NC)cc1 765406330 VAUYJGJFSSKINE-ZDUSSCGKSA-N 277.412 2.320 10 20 CECD Cc1noc(C)c1NC(=O)/C=C\c1ccc(O)c(O)c1 779503462 PFEMDPHHGABGJA-XQRVVYSFSA-N 274.276 2.355 10 20 CECD Cc1ccc(CN2CCO[C@H](c3ccnn3C)C2)c(O)c1 897566960 BBDPSMXBVJNRHX-INIZCTEOSA-N 287.363 2.008 10 20 CECD COc1cc(C)cc(CNCCN2CC[C@H](C)C2)c1O 894394194 UXNXBWGYXHXFHH-LBPRGKRZSA-N 278.396 2.141 10 20 CECD COc1ccc(CNC(=O)c2ccoc2C)c(O)c1 794387323 IVRXZLHYZMOHMO-UHFFFAOYSA-N 261.277 2.232 10 20 CECD CC[C@]1(NC(=O)NCc2ccc(N(C)C)cc2)CCOC1 790119919 FRYQZYAJPXRWOH-INIZCTEOSA-N 291.395 2.121 10 20 CECD COc1ccc(CNC(=O)CC[C@H]2CC[C@H](C)O2)c(O)c1 794383332 LFSRZQYFNZRGRX-WCQYABFASA-N 293.363 2.365 10 20 CECD CC[C@@H](N[C@H](CO)CC(F)F)c1ccccc1O 717749539 KJPQHSVBVUABLL-GXSJLCMTSA-N 259.296 2.449 10 20 CECD CO[C@H]1CC[C@H](NC(=O)NCc2cc(C)ccc2O)C1 1332649065 ATQYWIGHLRGLDK-STQMWFEESA-N 278.352 2.067 10 20 CECD C[C@H](N[C@@H](CO)CC(F)(F)F)c1c(O)cccc1F 1262077944 URJCVEUQRWOHPA-JGVFFNPUSA-N 281.249 2.495 10 20 CECD CC(C)(CNC(=O)Cc1ccc(N)cc1)C1CCOCC1 1358388744 OBJCJBGVGQMTEQ-UHFFFAOYSA-N 290.407 2.380 10 20 CECD C[C@H](N[C@H]1CCCC[C@@H]1CN)c1cc(C(=O)O)ccc1O 1609778124 MWRNWHYHSAQTKD-SUHUHFCYSA-N 292.379 2.259 10 20 CECD CC(C)(C)CC[C@H](CO)NC(=O)NCc1ccc(N)cc1 1575125961 QTAUXQYCNRTBRH-CQSZACIVSA-N 293.411 2.255 10 20 CECD C[C@H](NC(=O)[C@H]1CC[C@H]1C(=O)O)c1ccc(N(C)C)cc1 1589114415 MXUWYDZONPXSHB-LEWSCRJBSA-N 290.363 2.041 10 20 CECD Cc1cc(CN[C@@H](C(=O)O)C(C)C)ccc1N(C)C 1594303738 FGPYOHIIYXUJDA-CQSZACIVSA-N 264.369 2.260 10 20 CECD CC(C)C[C@H](O)CN[C@H](C)c1cc(C(=O)O)ccc1O 1591183722 LZCZXJIZZQJARR-PWSUYJOCSA-N 281.352 2.148 10 20 CECD C[C@@H](N[C@H]1CC[C@@H](CO)CC1)c1cc(C(=O)O)ccc1O 1593360033 NFSGCSHCDGELQE-WZRBSPASSA-N 293.363 2.292 10 20 CECD CCOC(=O)N[C@@H]1CCCN(Cc2cc(C)ccc2O)C1 154010261 XRPTWACNSOSLQL-CQSZACIVSA-N 292.379 2.411 10 20 CECD CC[C@@H]1C[C@H](NCc2cc(OC)ccc2O)CCO1 823871921 RPICZBHKWONUSS-CHWSQXEVSA-N 265.353 2.448 10 20 CECD COc1cccc(O)c1CN[C@@H](C)CN1CCCCC1 850028704 QSLUDCXOCYYEMJ-ZDUSSCGKSA-N 278.396 2.365 10 20 CECD Nc1ccc(CC(=O)Nc2ccc3c(c2)CCO3)cc1 37045114 VKQBGPPLVGGSHX-UHFFFAOYSA-N 268.316 2.385 10 20 CECD CC(C)N1CC[C@H](N[C@H](C)c2cc(F)ccc2O)C1=O 186048825 DXLLWGGYJQNATR-MFKMUULPSA-N 280.343 2.191 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@@H]2NCC[C@H]2C1 381332405 BTZNKBSPVGNBTI-GWCFXTLKSA-N 266.772 2.229 10 20 CECD CCC1(NCc2cc(OC)ccc2O)CCOCC1 389454013 JFWWKNWWJXYXMI-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Fc1ccc(CNCc2ccc3c(c2)CCO3)nc1 763523047 UIVOBWZDJHXISC-UHFFFAOYSA-N 258.296 2.445 10 20 CECD CCOC(=O)c1cnc(SCCCC(=O)O)s1 1605578049 OJGQOFHAQBXMFW-UHFFFAOYSA-N 275.351 2.277 10 20 CECD COc1cc(CN2CCC(C)(O)CC2)c(O)cc1C 179447271 DRPSPLFJBHAUSD-UHFFFAOYSA-N 265.353 2.056 10 20 CECD CS[C@@H]1CC[C@H](NC(=O)Cc2ccc(N)cc2)C1 226374491 XWTPMLYYTZAMBB-QWHCGFSZSA-N 264.394 2.212 10 20 CECD Cc1ccc(C(=O)N2CCOC[C@@H]2CC(C)C)c(O)c1O 179499133 ABKCVJZABQJMNO-LBPRGKRZSA-N 293.363 2.293 10 20 CECD C[C@H]1CN(Cc2cc(Br)ccc2O)C[C@@H](C)N1 116131153 QDWNCWOOKKQAAM-AOOOYVTPSA-N 299.212 2.337 10 20 CECD CC(=O)NC1CCN(Cc2cc(C)c(C)cc2O)CC1 50899530 NCJPDSQYEMNSTL-UHFFFAOYSA-N 276.380 2.110 10 20 CECD O=C(NCc1cccc(O)c1O)C(C1CC1)C1CC1 1352658272 RAZIZDSMPLJLRE-UHFFFAOYSA-N 261.321 2.150 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 126801572 SNLQXCVZMLVHCW-VHSXEESVSA-N 254.761 2.215 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCOCCN(C)C 219323515 LQQCCNCPLOWFSE-KGLIPLIRSA-N 292.423 2.417 10 20 CECD COc1ccc(O)c(CNc2ncc([N+](=O)[O-])s2)c1 192455630 INDKWBVDPRBMNU-UHFFFAOYSA-N 281.293 2.378 10 20 CECD CC[C@]1(C(=O)NCCCSc2nccs2)CCCN1 134499363 PWEJDBHTHOGJLO-CYBMUJFWSA-N 299.465 2.274 10 20 CECD CCOCCC1(CNC(=O)c2cccc(O)c2O)CC1 193145332 HVDWTABPBJSXNC-UHFFFAOYSA-N 279.336 2.034 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](N(C)C)C2)c1O 91393744 UTPRFSNSCVJAAN-AWEZNQCLSA-N 294.370 2.260 10 20 CECD Cc1cnc2c(c1)N(C(=O)/C=C\c1cncc(F)c1)CCO2 255198329 AGHWRNBQUDODQU-IHWYPQMZSA-N 299.305 2.363 10 20 CECD CC(C)[C@@H]1CN(C)CCN1Cc1cc(F)ccc1O 184740061 BXJLZGRUOWPOND-AWEZNQCLSA-N 266.360 2.303 10 20 CECD Cc1ccc([C@@H](C)N[C@H]2CC(=O)N(C(C)C)C2)c(O)c1 273529600 WANXKJKSXCRVFW-OLZOCXBDSA-N 276.380 2.361 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2ccc(N(C)C)c(F)c2)C1 271191266 QGRXHTGBSAACTI-INIZCTEOSA-N 294.370 2.277 10 20 CECD C[C@H](N[C@@H]1CCCC[C@H]1N)c1cc([N+](=O)[O-])ccc1O 818615117 LYXGQONQOLCKDC-ZWKOPEQDSA-N 279.340 2.221 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C1(F)CCCCC1 813489088 OAEZVVLZAFMAHK-UHFFFAOYSA-N 267.300 2.386 10 20 CECD Cn1ncc(C2CC2)c1CNCc1cc(F)ccc1O 827251791 NPNCIMUMDMBLKD-UHFFFAOYSA-N 275.327 2.432 10 20 CECD Cc1cc(CC(=O)N[C@H](C)c2ccccc2O)no1 827937442 WWGMEXBQQIUYOI-SNVBAGLBSA-N 260.293 2.109 10 20 CECD Cc1cc(O)c(CNCc2nc(N(C)C)no2)cc1Cl 825543439 VYGDDNKBPYAVGU-UHFFFAOYSA-N 296.758 2.093 10 20 CECD COc1ccc(O)c(CNC(=O)NC[C@H]2CC2(C)C)c1 734070021 RBJMRGMPCXAJGT-LLVKDONJSA-N 278.352 2.246 10 20 CECD CN(C)c1ccc(/C=C/CN2CC[C@](F)(C(=O)O)C2)cc1 901513757 CVCIMGFNRPRNFE-QDLOVBKTSA-N 292.354 2.264 10 20 CECD COc1ccc(CN[C@@H](CC(F)(F)F)C(=O)O)cc1C 901780729 TVTVZBDOMWYSDS-JTQLQIEISA-N 291.269 2.499 10 20 CECD COc1ccc(N(C)Cc2nonc2C)cc1OC 733897338 AWZZCIVJPHBGNE-UHFFFAOYSA-N 263.297 2.032 10 20 CECD CC(C)(CCN[C@@H]1CCc2cccc(O)c21)S(C)(=O)=O 840876857 PNAQLMWXQAYKAJ-GFCCVEGCSA-N 297.420 2.182 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H](N)CC 842003430 BOWVBTSUTYRYGU-ZDUSSCGKSA-N 279.384 2.051 10 20 CECD Cc1cc(CN(CC(=O)O)C2CC2)ccc1N(C)C 846224938 DOXDADRYLZVQTD-UHFFFAOYSA-N 262.353 2.110 10 20 CECD CO[C@](C)(C(=O)NCc1cc(Cl)ccc1O)C1CC1 846476418 LWLQRFGSPBNAIZ-AWEZNQCLSA-N 283.755 2.477 10 20 CECD O=C1CCC(=O)N1CCSc1ncc(Cl)s1 849998081 AQGCPGCHWMBFTN-UHFFFAOYSA-N 276.770 2.038 10 20 CECD CC(C)C[C@H](CCO)CNC(=O)Nc1ccc(N)cc1 841300418 RHROXHVNGHZUGX-LBPRGKRZSA-N 279.384 2.435 10 20 CECD CC(C)NC(=N)NCc1ccc(N2CCCC2)cc1 848993210 IZSFHIDMFQGJGS-UHFFFAOYSA-N 260.385 2.309 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1cc(Cl)ccc1O 840956674 BMIQHICYDMXCGU-LBPRGKRZSA-N 283.755 2.477 10 20 CECD CN(C)[C@H](CNCc1ccc2c(c1)CCCO2)C1CC1 921555314 FQBBFCKOVZTEMP-MRXNPFEDSA-N 274.408 2.441 10 20 CECD CCOc1ccc(CN[C@]2(C)CCOC2)c(O)c1 756040703 BAKZXTSWDBFUBQ-CQSZACIVSA-N 251.326 2.060 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(N)CCCC2)c1 854222655 JLPAVCHXYNWXOH-LLVKDONJSA-N 264.369 2.323 10 20 CECD C[C@H](NCC1(N)CCCC1)c1cc(F)ccc1O 854222653 JLKXUJAVVAMJQX-JTQLQIEISA-N 252.333 2.453 10 20 CECD CCOC(=O)[C@@H](NCc1cccc(OC)c1O)C(C)(C)C 768522978 ADJSSRZNVGIFFO-CQSZACIVSA-N 295.379 2.468 10 20 CECD CC(C)(C)c1cnc(S[C@H]2CCC(=O)NC2=O)s1 765827825 LTDFUJAXNRTFAP-ZETCQYMHSA-N 284.406 2.338 10 20 CECD CCCN(CC(=O)NC)Cc1ccc(N(C)CC)cc1 773748143 XBEWXRAWRQBQSW-UHFFFAOYSA-N 277.412 2.101 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)[C@@H](O)c1cccc(F)c1 777534564 RNVMBKWLKMANID-AMIZOPFISA-N 295.335 2.445 10 20 CECD Cc1c(C(=O)NCc2ccccc2O)cnn1C(C)C 770793261 UZPSMNOBFPRVTD-UHFFFAOYSA-N 273.336 2.408 10 20 CECD CCCN(CC)C[C@@H](C)NC(=O)NCc1ccc(N)cc1 1120623781 XHTJZHUDZMHEDX-CYBMUJFWSA-N 292.427 2.188 10 20 CECD COc1ccc(O)c(CN(C)Cc2cccn2C)c1 775711984 CPRKUDNZSZEQHU-UHFFFAOYSA-N 260.337 2.371 10 20 CECD CCOc1ccc(CN2CCN(C)[C@H](C)[C@@H]2C)c(O)c1 775987884 WVMPTMHZJYPARV-OLZOCXBDSA-N 278.396 2.315 10 20 CECD COc1ccc(N2CCC(N[C@H](CO)C3CC3)CC2)cc1 772989033 WIWAAINAKTVPHU-QGZVFWFLSA-N 290.407 2.025 10 20 CECD Cc1cc(CN2CCOc3cc(N(C)C)ccc32)on1 270548224 AHGIAHKMZCAOIH-UHFFFAOYSA-N 273.336 2.448 10 20 CECD CCN1CCC[C@@H](NCc2cc(Cl)c(C)cc2O)C1=O 896728514 AJOSRFAAYYEVET-CYBMUJFWSA-N 296.798 2.455 10 20 CECD COc1cc(C)cc(CNCc2ccn(C)c2)c1O 894322758 DEVBNBVXLVMVFD-UHFFFAOYSA-N 260.337 2.338 10 20 CECD C[C@H](NC(=O)C1CCC(O)CC1)c1ccc(N(C)C)cc1 792333048 OHWQQEUSNFLWAI-YGONEPDPSA-N 290.407 2.481 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@@H]1O 897685592 OPIFTRBYZGVTAF-YOEHRIQHSA-N 274.408 2.490 10 20 CECD CCn1ncnc1CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 794841099 LNGFZUFVGOMJAU-ONGXEEELSA-N 290.342 2.481 10 20 CECD CCN1C(=O)/C(=C\c2cccnc2N(C)C)SC1=S 1323087614 LKFGSLUHDUDYSL-CSKARUKUSA-N 293.417 2.369 10 20 CECD CCC[C@](C)(O)CNCc1ccc(OC)c(OC)c1O 1333722689 FVUTYDKLWVRYTO-HNNXBMFYSA-N 283.368 2.050 10 20 CECD COC(=O)[C@@H]1CC[C@H](N[C@@H]2CCc3cccc(O)c32)C1 1339191377 BNUZYGDGHGSDHP-FRRDWIJNSA-N 275.348 2.311 10 20 CECD Oc1cc2c(cc1CNCC[C@@H]1CCCCO1)OCO2 227338507 BDEZBPRDCZTRLN-LBPRGKRZSA-N 279.336 2.170 10 20 CECD COC[C@H](CN[C@@H](C)c1ccc(C)cc1O)OC 230672247 WHVWBJBMGHMEKN-RYUDHWBXSA-N 253.342 2.013 10 20 CECD COC(=O)C1CCN(Cc2c(O)cccc2Cl)CC1 159213487 QWXONPRJXNGBJJ-UHFFFAOYSA-N 283.755 2.431 10 20 CECD C[C@@H]1CCNCC[C@H]1NCc1ccc2c(c1)CCO2 817902324 NSXZFWKSCKEYAM-IUODEOHRSA-N 260.381 2.099 10 20 CECD C[C@H](Cc1cnn(C)c1)N[C@H](C)c1ccccc1O 834895407 BHQKRNMIWFEYIT-VXGBXAGGSA-N 259.353 2.408 10 20 CECD COc1cccc(CNCC[C@@H]2CCCN(C)C2)c1O 839181499 IZPAECPWRSEDKV-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCN2CCC[C@H]2C1 876940793 XTQMKNTZOYPKSY-KBPBESRZSA-N 260.381 2.417 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](C)C[C@H](C)O)c1 185521234 UREYOKZFOMPGCO-WOPDTQHZSA-N 267.369 2.458 10 20 CECD CC(C)[C@H](CO)CN[C@@H](C)c1cc(F)ccc1O 394073298 RTLVYMFYGKOFGO-QWRGUYRKSA-N 255.333 2.446 10 20 CECD C[C@H](N[C@H](CCO)C(F)(F)F)c1ccccc1O 886800861 CVGQEZBCYDYSGN-GZMMTYOYSA-N 263.259 2.356 10 20 CECD COc1ccc(O)c(CN[C@]2(CO)CCc3ccccc32)c1 305807299 ZQDXXONDMIUUGS-SFHVURJKSA-N 299.370 2.324 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H](CO)C2)c1O 184669919 UVGDCDNXMBAMST-SNVBAGLBSA-N 285.771 2.259 10 20 CECD CC[C@@H](C)[C@H](N)C(=O)N(CC)Cc1ccc(N(C)C)cc1 37807404 VFSGQGRCUZGBJT-CJNGLKHVSA-N 291.439 2.475 10 20 CECD C[C@H](N[C@H](C)[C@@H](C)N1CCOCC1)c1ccccc1O 183498191 DRWMFKZCMWEPPH-HZSPNIEDSA-N 278.396 2.152 10 20 CECD CCCN(Cc1nc(COC)no1)Cc1ccccc1O 182374159 SDRTWUPKJLCGDM-UHFFFAOYSA-N 291.351 2.334 10 20 CECD Cc1ccc(C(=O)N[C@H]2[C@H]3Cc4ccccc4[C@@H]32)c(O)c1O 182818794 AMOOOVSWESBBRV-KKUMJFAQSA-N 295.338 2.474 10 20 CECD C[C@H]1C[C@@H](CN)CN1Cc1cc(Cl)ccc1O 216020812 MLSJHRBHVAZBOQ-UWVGGRQHSA-N 254.761 2.215 10 20 CECD NC(=O)[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 157148771 ZAPPRWWUAOZYCG-ZETCQYMHSA-N 289.162 2.006 10 20 CECD COC(=O)[C@@H](C)N(Cc1cc(OC)ccc1O)C1CCC1 191649000 HOLOPCXFZQUVOW-LLVKDONJSA-N 293.363 2.317 10 20 CECD Cc1cc(C(=O)NCc2ccc(O)c(O)c2)oc1C 45372796 MVGGHOKPKRVPIN-UHFFFAOYSA-N 261.277 2.238 10 20 CECD CC[C@H](C)Oc1ncc[nH]c1=NCc1ccccc1O 527869482 NIKRYTSNWYGOOT-NSHDSACASA-N 273.336 2.394 10 20 CECD CN(C)c1ccc(CN(CCCCO)C2CC2)cc1 263988922 AQADIDLPKJQVFH-UHFFFAOYSA-N 262.397 2.490 10 20 CECD CN(Cc1ccccc1O)C(=O)CCn1cc(Cl)cn1 269159387 SAWGURFELVZTPD-UHFFFAOYSA-N 293.754 2.291 10 20 CECD COC[C@@H](NCc1ccc(OC)c(C)c1)[C@@H]1CCCO1 278616635 JHFJRBJULNNSFE-ZBFHGGJFSA-N 279.380 2.287 10 20 CECD CCN(CC)c1ccc(CNCN2CCC(=O)CC2)cc1 273057253 INHQOZYCOKWWPT-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COc1cccc(CN2CCC[C@](C)(O)CC2)c1O 279741581 XJGXBKJVVDGESG-HNNXBMFYSA-N 265.353 2.138 10 20 CECD COc1cc(N2CC[C@H](C)C2)c([N+](=O)[O-])cc1OC 271038790 MMFBDKQCVRVZLZ-VIFPVBQESA-N 266.297 2.458 10 20 CECD CCCN(Cc1ccccc1O)Cc1ncnn1CCF 281396308 DZAPLLPTMNBEPA-UHFFFAOYSA-N 292.358 2.365 10 20 CECD CCCOc1ccc(CNCCc2cn[nH]c2)c(O)c1 289981486 WVNLLYBONGOMJD-UHFFFAOYSA-N 275.352 2.236 10 20 CECD C[C@@]1(CNCc2ccc(N3CCOCC3)cc2)CCOC1 397168538 CXIVPXXWYUCIAE-KRWDZBQOSA-N 290.407 2.039 10 20 CECD CCOc1ccc(CNCC2=CCCOC2)c(O)c1 808429453 CSJTXFIBLINYDJ-UHFFFAOYSA-N 263.337 2.227 10 20 CECD Cc1nccc(CCC(=O)NCc2ccc(N(C)C)cc2)n1 814377602 ZFFZIEQBVGJEIF-UHFFFAOYSA-N 298.390 2.100 10 20 CECD COC(=O)[C@@H](C)NCc1ccc2ccccc2c1O 816596396 ACJTWNNIZYBDJR-SNVBAGLBSA-N 259.305 2.197 10 20 CECD C[C@H](N[C@H](C)CCCCN)c1cc([N+](=O)[O-])ccc1O 817976654 QMZIPGNAQRSQFA-MNOVXSKESA-N 281.356 2.469 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1cccc(C)c1O 824703196 XXFLVBMOUWQJHP-OLZOCXBDSA-N 263.337 2.132 10 20 CECD C[C@@H](CC(=O)O)NCCCSc1nccs1 820085901 YICZSKWKJRSEJA-QMMMGPOBSA-N 260.384 2.078 10 20 CECD O=C(NC[C@@H]1COc2ccccc2C1)c1cc(O)cs1 731871454 LLNICFJGCWJOSX-SNVBAGLBSA-N 289.356 2.435 10 20 CECD Cc1ccc(O)c(CNCCc2cnc(C)cn2)c1 835062746 WVPQEXJFUNFHLF-UHFFFAOYSA-N 257.337 2.131 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H]1CCOC1 739575074 GACXLMLCLDFUQG-ZDUSSCGKSA-N 276.380 2.104 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2CC[C@H](C)O2)c1 834915802 UEBNZWONGJISKD-GMXVVIOVSA-N 293.363 2.397 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H](C)c1cc(C)ccc1O 834904842 RPBPHUVYYWLJHE-UXIGCNINSA-N 265.353 2.155 10 20 CECD CC[C@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CC[C@H]1N 843376556 AXEXLBAIKFXIGQ-XHDPSFHLSA-N 294.370 2.293 10 20 CECD COCC1(C(=O)NCc2cc(Cl)ccc2O)CC1 846473049 HZHZMFVBTCHPMH-UHFFFAOYSA-N 269.728 2.088 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@H]2NCC[C@H]2C1 843127709 SIYWXYIARAGREP-GXFFZTMASA-N 266.772 2.229 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCC(=O)N(C)C 840932035 BVTQLPUSVMIJGQ-UHFFFAOYSA-N 277.412 2.019 10 20 CECD COc1cccc([C@@H](C)NCCC2(O)CCC2)c1O 846172661 OBPABRCDBOYZAD-LLVKDONJSA-N 265.353 2.357 10 20 CECD CCC1(CN[C@@H](C)c2cccc(OC)c2O)COC1 846168833 MMWVEGDVXUJXPR-NSHDSACASA-N 265.353 2.478 10 20 CECD N[C@@H]1CCC[C@@H](NCc2c(O)cccc2Cl)C1 841056919 FYUXGIGPEDWXGT-NXEZZACHSA-N 254.761 2.405 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC2(N)CCCC2)c1 854224666 YGFONYLAEHLYDJ-LLVKDONJSA-N 292.379 2.101 10 20 CECD CNC[C@@H](C)N[C@H](C)c1cc(Br)ccc1O 854232788 UENFLBOZJZJWPR-RKDXNWHRSA-N 287.201 2.413 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](O)CC(C)C)c1 756496338 GOKCJXPXMMQYRB-WCQYABFASA-N 295.379 2.236 10 20 CECD CCOc1ccc(CN[C@@H](CO)CC(F)(F)F)c(O)c1 756993442 AQGKRYQIJUEUJT-SNVBAGLBSA-N 293.285 2.194 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H]2CCC(=O)[C@H]2C)c1 862756128 QVUNYRZUYWMNFN-NWDGAFQWSA-N 275.348 2.322 10 20 CECD C[C@@H](N(C)Cc1cc2c(cc1O)OC[C@@H]2O)C1(C)CC1 768463648 KWTAFDQCZGECTJ-YGRLFVJLSA-N 277.364 2.438 10 20 CECD COC(=O)CCC(C)(C)NCc1cc(OC)ccc1O 762788772 XFYRMGQYOMOOJB-UHFFFAOYSA-N 281.352 2.222 10 20 CECD C[C@H](CCCC(=O)O)NCc1cc(F)cc(F)c1O 1119610644 BPEANIBXMRSBRN-MRVPVSSYSA-N 273.279 2.403 10 20 CECD Cc1ccc(CN2CCC(Cn3ccnn3)CC2)c(O)c1 876814313 LORMZNICVMYDDY-UHFFFAOYSA-N 286.379 2.204 10 20 CECD c1cc(N2CCCCC2)ccc1CN1C[C@H]2CNC[C@@H]2C1 770394824 NKMCEEORHNQQLP-IAGOWNOFSA-N 285.435 2.328 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CCCSC2)c1 875342495 LKYJVWAECXFZBA-LBPRGKRZSA-N 280.393 2.395 10 20 CECD Cc1ccc(CN[C@H]2C[C@H](C)N(C3CC3)C2)c(O)c1 877095509 ZXBOYBBPAKJSCX-JSGCOSHPSA-N 260.381 2.415 10 20 CECD CC1=C(C(=O)NCCc2ccc(N)cc2)CCCO1 876527479 HIVBNBJRIARMCB-UHFFFAOYSA-N 260.337 2.012 10 20 CECD CCN(C)C(=O)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 775586845 PRTAFHCSDOPOCE-MWLCHTKSSA-N 280.343 2.148 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2c(O)cccc2OC)C1 771928170 QKLPIELUMXXYSC-LBPRGKRZSA-N 293.363 2.176 10 20 CECD CSCC(C)(C)NC(=O)/C=C\c1ccc(O)c(O)c1 890873911 DNPSHSKPYAZJBG-ALCCZGGFSA-N 281.377 2.369 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](N3CCCC3=O)C2)c1 790457630 FOIAXUMDISATTI-HNNXBMFYSA-N 288.391 2.206 10 20 CECD CCn1cnc2c1CCN(Cc1cc(F)ccc1O)C2 897334239 PPFABQXQJIDWDG-UHFFFAOYSA-N 275.327 2.306 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](CO)CC(F)F)c1 717811251 LUIFUIKSSPRGJT-DTWKUNHWSA-N 275.295 2.068 10 20 CECD C[C@H](NCCCCCO)c1cc(F)cc(F)c1O 790498273 QYGQWUMSIJJEKD-VIFPVBQESA-N 259.296 2.484 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1cnccn1 70477686 SCVIYRPDSLBOIZ-GFCCVEGCSA-N 256.353 2.393 10 20 CECD c1ncn([C@H]2CCN(Cc3ccc(N4CCCC4)cc3)C2)n1 1325849924 JPDYXMLMTCCOOH-KRWDZBQOSA-N 297.406 2.325 10 20 CECD CCN1CCN(C(=O)/C=C/c2cn(C)cn2)c2ccccc21 1337778336 MLVKLNBDVDBDCC-CMDGGOBGSA-N 296.374 2.306 10 20 CECD O=C([C@@H]1C[C@@H]1F)N(Cc1ccccc1O)C[C@H]1CCCO1 1349356112 SONZDSBBLQQPGL-MCIONIFRSA-N 293.338 2.258 10 20 CECD O=C(O)C[C@@H](NCc1cc(F)cc(F)c1O)C1CC1 1262163256 MGRWPBIPOUJEBC-LLVKDONJSA-N 271.263 2.013 10 20 CECD C[C@@H](O)C[C@@H]1CCCCN1C(=O)NCc1ccc(N)cc1 1262603509 KZPZQGXEOFPUSY-DOMZBBRYSA-N 291.395 2.104 10 20 CECD O=C(O)c1ccc(/C=C/C(=O)N2Cc3cccc(O)c3C2)o1 1606482389 AJHBRORNHQPSQG-FNORWQNLSA-N 299.282 2.239 10 20 CECD Nc1ccc(NC(=O)NN2C[C@H]3CCC[C@@H]3C2)cc1 1580449889 XDESQRGEVHGWNW-GHMZBOCLSA-N 260.341 2.037 10 20 CECD COc1cccc(CN2CC[C@@H](C)C[C@H]2C(=O)O)c1O 1599672551 IFDOIONXNAVJGU-PWSUYJOCSA-N 279.336 2.086 10 20 CECD CC[C@H](N[C@H](C)CC)c1cccc(-c2nn[nH]n2)c1O 1590413559 ANXKNZZJQHUUTB-SKDRFNHKSA-N 275.356 2.412 10 20 CECD COCCCN(CCOC)Cc1cccc(C)c1O 124563017 PMIOVBIGKOYUGZ-UHFFFAOYSA-N 267.369 2.186 10 20 CECD CCN(C)c1ccc(CN[C@H](C(=O)O)C2CC2)c(C)c1 1776856074 IONCPQNEDQDFJK-HNNXBMFYSA-N 276.380 2.404 10 20 CECD COc1cc(C)cc(CN(C)[C@@H](C)C(=O)OC(C)C)c1O 164502086 ARWRNIPXFJYIDT-LBPRGKRZSA-N 295.379 2.481 10 20 CECD COc1ccc(N(C)CC2CCNCC2)cc1OC 259167400 YJIMLQNWQWSEIJ-UHFFFAOYSA-N 264.369 2.140 10 20 CECD CCOc1cccc(CN[C@H](C)CC[S@](C)=O)c1O 125566814 BGCMNPWYVLVSIQ-NSPYISDASA-N 285.409 2.038 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)C2CCS(=O)(=O)CC2)c1 862478444 HNYJHEACJCTIHS-LBPRGKRZSA-N 297.420 2.004 10 20 CECD C[C@H](NCCS(C)(=O)=O)c1ccc2ccccc2c1O 37740510 UKWAIRZCSCRLFB-NSHDSACASA-N 293.388 2.241 10 20 CECD COc1cccc(CNCCN2CCCCCC2)c1O 40767356 MUIKSTNQIDAVOY-UHFFFAOYSA-N 278.396 2.366 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@H]2OC)c1 50370255 UWTXPVUEWWWVQG-TZMCWYRMSA-N 251.326 2.058 10 20 CECD Cc1ccc(C(=O)N2CCOc3cc(N(C)C)ccc32)n1C 173192478 UJXVIHBIRSZMQZ-UHFFFAOYSA-N 299.374 2.439 10 20 CECD CC(C)NC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 65279014 SNKPEUDSAJKVGK-CYBMUJFWSA-N 291.395 2.292 10 20 CECD Cc1cc(C(=O)NCCCSc2nccs2)ncn1 162124520 OAITWIWUNXTAMT-UHFFFAOYSA-N 294.405 2.154 10 20 CECD COC(=O)COc1ccc(N(C)C/C=C/Cl)cc1 183804220 RIBJWDLRTJFYOA-FPYGCLRLSA-N 269.728 2.427 10 20 CECD COc1cccc(CNC(=O)Nc2ccc(F)nc2)c1O 125970852 REGWIRVAUUVALH-UHFFFAOYSA-N 291.282 2.257 10 20 CECD C[C@@H](NCCNC(=O)c1ccco1)c1ccccc1O 183395465 VLMRWURCWWWPOM-LLVKDONJSA-N 274.320 2.066 10 20 CECD Cc1nc(C)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)o1 186431114 RKBAAQMUXLWNAP-QMMMGPOBSA-N 290.319 2.064 10 20 CECD CC[C@H]1CO[C@H](C)CN1Cc1cccc(OC)c1O 131504624 CNMVDKRPJPKOBB-YPMHNXCESA-N 265.353 2.400 10 20 CECD COC[C@H](O)CCNCc1ccc(N2CCCCC2)cc1 231605714 ITQNHELWEIXMNJ-QGZVFWFLSA-N 292.423 2.164 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC2CCOCC2)c1 273576775 LWYVKOJAQXYFQW-NSHDSACASA-N 293.363 2.256 10 20 CECD CC[C@H](C)NCc1ccc([N+](=O)[O-])c(OC)c1O 278936576 WYYZKCALBDASHQ-QMMMGPOBSA-N 254.286 2.197 10 20 CECD CCOc1ccc(O)c(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)c1 271192908 MLPKOTCCMZCGIQ-PVUDRZGPSA-N 297.420 2.132 10 20 CECD COc1cccc(CNC(=O)C[C@H]2CCC(=O)[C@H]2C)c1O 280018853 TZKOCDHTVHRGAT-WDEREUQCSA-N 291.347 2.022 10 20 CECD COc1ccc(O)c(CNC(=O)C(C)(C)CSC)c1 800519135 LYBLHVLPDVBJTA-UHFFFAOYSA-N 283.393 2.406 10 20 CECD Cc1cc(CN2CCC[C@@H](O)CC2)ccc1N(C)C 293021095 FMMUASRSLWVBKF-OAHLLOKOSA-N 262.397 2.408 10 20 CECD Cc1cc(C)c([C@H](C)NCC2(O)CCN(C)CC2)c(O)c1 294841724 RXPWBLUIUNFDSF-AWEZNQCLSA-N 292.423 2.116 10 20 CECD Cn1cc(/C=C\C(=O)N2CCc3cc(F)ccc32)cn1 801075997 TXFNICZTKLJXMK-DJWKRKHSSA-N 271.295 2.162 10 20 CECD Cc1nc([C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)no1 811156224 JANFJLLJGFWWLV-YZCDNWJKSA-N 290.275 2.107 10 20 CECD COCC1(NCc2cc(Cl)c(F)cc2O)CC1 816558235 RSFQAUFMNLWUQV-UHFFFAOYSA-N 259.708 2.453 10 20 CECD Cc1cc(O)c(CN2C[C@H]3CCN(C)[C@H]3C2)cc1Cl 826063983 BQRVDZZKZJORIU-RISCZKNCSA-N 280.799 2.490 10 20 CECD CCn1ccc(NC(=O)N(C)Cc2ccccc2O)n1 824920619 SVTFDPNXEVNLTK-UHFFFAOYSA-N 274.324 2.273 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc3n(n2)CCCC3)cc1 823730089 QQOWFFRMHQKBRH-UHFFFAOYSA-N 298.390 2.215 10 20 CECD CN(C)c1ccc(CN(C(=O)Cc2ncc[nH]2)C2CC2)cc1 821032806 HFQQOHAHHBKLMA-UHFFFAOYSA-N 298.390 2.209 10 20 CECD CCC(C)(C)OCCNC(=O)c1c(F)ccc(O)c1O 839793994 RYAJLBLMIWIWPC-UHFFFAOYSA-N 285.315 2.172 10 20 CECD CCOc1ccc(CNCc2ccc(C(=O)O)o2)c(O)c1 737201931 BSPQAHRIXCGSGL-UHFFFAOYSA-N 291.303 2.372 10 20 CECD O=C(OCc1nccn1C(F)F)c1cc(O)cs1 732352665 AXWSTRSJMOOPKN-UHFFFAOYSA-N 274.248 2.402 10 20 CECD CCc1oc(C(=O)O)cc1COc1ccccc1C(N)=O 830395228 VXWAWOWGVFYTOP-UHFFFAOYSA-N 289.287 2.218 10 20 CECD C[C@@H]1C[C@H]1C(=O)NCc1ccc2c(c1)CCCN2C 746809270 QWBOIWZFGUBSIS-BXUZGUMPSA-N 258.365 2.341 10 20 CECD C[C@]1(CNCc2cccc(F)c2O)CCCNC1 841057044 LKGVPLANPMLQQU-AWEZNQCLSA-N 252.333 2.011 10 20 CECD C[C@H]1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)CO1 845282546 PKYWWLUKVOCUAE-KWQFWETISA-N 284.743 2.022 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CCc3c[nH]nc3C2)c1O 846144276 BXJMPEDPLYTPEZ-PWSUYJOCSA-N 287.363 2.332 10 20 CECD Cc1cc(Br)cc(CN(C)[C@H]2CCNC2)c1O 843049056 FDFFMOHNUTZIIV-LBPRGKRZSA-N 299.212 2.257 10 20 CECD C[C@@H](COCC1CC1)NCc1cc2c(cc1O)OCO2 846072214 DPFTVRCQDSSYBP-JTQLQIEISA-N 279.336 2.026 10 20 CECD Cc1cc(CN[C@@H]2CCCC[C@H]2N)ccc1N(C)C 923381596 JTMMLQGZZQZCRK-HUUCEWRRSA-N 261.413 2.421 10 20 CECD C[C@@H](NCC1(N)CCCC1)c1cc([N+](=O)[O-])ccc1O 854224369 VPIDQDNULMDGDG-SNVBAGLBSA-N 279.340 2.223 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC/C=C/Cl 759589817 UEOROGRYTDGZCO-ZHPPZSSHSA-N 254.669 2.407 10 20 CECD C[C@@H]1C[C@H](NCc2cc(F)c(N(C)C)cc2F)CO1 858185162 RNRNHHOBHUQEEV-KOLCDFICSA-N 270.323 2.298 10 20 CECD CCN(Cc1cc(OC)c(OC)cc1O)C[C@H]1CCOC1 768448617 SWGIDWCVJWKHLT-GFCCVEGCSA-N 295.379 2.268 10 20 CECD CCN(CCOC)Cc1ccc(N2CCOCC2)c(F)c1 768251781 KQZJRFDCCLXTEL-UHFFFAOYSA-N 296.386 2.131 10 20 CECD Cc1ccc(CN2CCNC(=O)[C@@H]2c2ccccc2)c(O)c1 876651876 IGOISYRCPKXNEX-KRWDZBQOSA-N 296.370 2.374 10 20 CECD CSCCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773144186 FDJNJHMUVUFVLU-NSHDSACASA-N 281.425 2.476 10 20 CECD CC1(C)[C@@H](O)C[C@@H]1NCc1cc(Cl)cc(F)c1O 779190735 GVRYDSKRUQBOKO-QWRGUYRKSA-N 273.735 2.434 10 20 CECD Cc1cc(=O)c(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)c[nH]1 773012424 BSZNGMOPRNGOJQ-GFCCVEGCSA-N 299.374 2.240 10 20 CECD CN(C)c1ccc(CNCc2cc(F)cc(F)c2O)cn1 882888224 UCNLBIDZUBCFEY-UHFFFAOYSA-N 293.317 2.421 10 20 CECD CCN1C[C@@H](CN[C@@H](C)c2c(O)cccc2F)CC1=O 886633466 WKTZTILKWIJWIK-WDEREUQCSA-N 280.343 2.050 10 20 CECD O=C(COC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)c1ccc(O)c(O)c1 782575348 QBSULIBJXHHSRN-JBLDHEPKSA-N 290.315 2.260 10 20 CECD CCC(=O)N1C[C@H](C)[C@@H](NCc2ccc(OC)c(C)c2)C1 1054307165 ICUCZZQKQGCKAY-ZFWWWQNUSA-N 290.407 2.350 10 20 CECD C[C@H](O)CCCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 789213628 REFGVMQHAAQYSO-STQMWFEESA-N 293.411 2.274 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCC(F)(F)C2)c(O)c1O 780983866 NEPBENNPNSICQM-QMMMGPOBSA-N 271.263 2.324 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](C3OCCO3)C2)cc1F 896385311 QTVGNZGRLMKGDU-CYBMUJFWSA-N 294.370 2.087 10 20 CECD COc1cccc(O)c1CN1CCCOC[C@@H]1C 769455401 AKWSCMDJBZWGJN-NSHDSACASA-N 251.326 2.012 10 20 CECD Cc1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 98074521 SHQJZUXDSZUMDT-UHFFFAOYSA-N 271.316 2.379 10 20 CECD C[C@H](C(=O)Nc1c(Cl)ccc2nonc12)n1cccn1 1329519960 SMGXFRSXECSAGA-SSDOTTSWSA-N 291.698 2.272 10 20 CECD Nc1ccc(CN2CCC[C@H]2[C@H](O)C(F)(F)F)cc1 1345159116 BXOYBCAIRBOXEU-RYUDHWBXSA-N 274.286 2.156 10 20 CECD Nc1ccc(CNc2ccc3c(c2)CNCCO3)cc1 1352791632 YPJGNJKOFXKRDH-UHFFFAOYSA-N 269.348 2.363 10 20 CECD N[C@H](C(=O)NCc1cc(Cl)ccc1O)c1ccccc1 1574262418 NEZCEPHQLUTXKS-AWEZNQCLSA-N 290.750 2.362 10 20 CECD Cc1ccc(CN[C@H]2C[C@H]3CC[C@@H](N3)[C@H]2C)c(O)c1 1579696904 LUZZPJXHHIBPME-NGFQHRJXSA-N 260.381 2.319 10 20 CECD CO[C@@]1(CN[C@H](C)c2ccc(N(C)C)cc2)CCOC1 123251153 PJNYLAHZQKRMEX-CZUORRHYSA-N 278.396 2.209 10 20 CECD COC[C@@H](C)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1599157332 RCWOGXVSMJPVNF-UWVGGRQHSA-N 267.325 2.024 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3C[C@@]3(C(=O)O)C2)cc1 1776855518 HSUPHXKFHGVCEW-CZUORRHYSA-N 274.364 2.049 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1CCC[C@H]1N 405191243 RIHARXCJKFGAAU-GOEBONIOSA-N 289.423 2.229 10 20 CECD CCCOc1ccc(CNCC(C)(C)O)c(O)c1 111385901 PGUALBNGUNGURD-UHFFFAOYSA-N 253.342 2.042 10 20 CECD CN(CCCCCO)Cc1ccc(N2CCOCC2)cc1 303361035 CFIHYQKIJVLRJG-UHFFFAOYSA-N 292.423 2.118 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1ccc(F)cc1O 185510979 UEZVMYHBEJZZAH-VYUIOLGVSA-N 273.373 2.294 10 20 CECD C[C@H](NC[C@@H](C)O)c1cc(Br)cc(F)c1O 134899397 YUYZSWHBMHJHRX-RQJHMYQMSA-N 292.148 2.325 10 20 CECD COc1ccc(N(C)Cc2noc(C)n2)c(OC)c1 131750081 WNSDHUKSBUVQFD-UHFFFAOYSA-N 263.297 2.032 10 20 CECD CC[C@]1(C(=O)O)CCCN(Cc2cc(OC)ccc2O)C1 86784857 BWMYWDFEBGNQDA-INIZCTEOSA-N 293.363 2.478 10 20 CECD CCOC(=O)[C@@H](C)N(Cc1ccccc1O)C1CC1 191713302 WJOGJUVAGHCJOZ-LLVKDONJSA-N 263.337 2.308 10 20 CECD CCN(C)CCNCc1cc(Cl)cc(OC)c1O 228672781 FAQWLJCQKKKCHV-UHFFFAOYSA-N 272.776 2.096 10 20 CECD Cc1ccc(C(=O)N2CCSCC[C@H]2C)c(O)c1O 190083456 HVNAHCLYIADBML-SNVBAGLBSA-N 281.377 2.374 10 20 CECD Cc1cccc(CNc2cnccc2-n2ccnn2)c1O 368042073 VIHPHRCQSHXRTA-UHFFFAOYSA-N 281.319 2.288 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCCS(C)(=O)=O)cc1 268927606 RXIWMPRTUZKZAU-CYBMUJFWSA-N 298.452 2.228 10 20 CECD C[C@@H](NCC1(C(N)=O)CCCC1)c1ccc(F)cc1O 273607409 UQHMDLWHUWDKNM-SNVBAGLBSA-N 280.343 2.228 10 20 CECD C[C@H](O)C[C@H](C)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273613426 WTZUMCJHJASDRT-DCAQKATOSA-N 282.340 2.358 10 20 CECD CC[C@@H](N[C@H](C)C(=O)NCCF)c1ccc(F)cc1O 287333277 GBKDTULKGSIIMW-BXKDBHETSA-N 286.322 2.046 10 20 CECD COc1ccc2oc(C(=O)OCC(=O)C(C)=O)c(C)c2c1 808483012 BMDRHOLKNOITHU-UHFFFAOYSA-N 290.271 2.065 10 20 CECD CC(C)n1cc(C(C)(C)NC(=O)c2cc(O)cs2)nn1 817771259 XIKRZUSVDAHLFV-UHFFFAOYSA-N 294.380 2.291 10 20 CECD CCOc1ccc(CN2C[C@@H](C(=O)O)C[C@@H](C)C2)c(O)c1 817881841 PTDSIZIPEATBHL-YPMHNXCESA-N 293.363 2.334 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1cc(Cl)c(C)cc1O 825745377 ZUKWEIROZXBPON-SECBINFHSA-N 271.744 2.347 10 20 CECD CCN(CC)c1ccc(CN2CCc3nn[nH]c3C2)cc1 827885353 YDJBMZFDFFIUON-UHFFFAOYSA-N 285.395 2.209 10 20 CECD COc1ccc(N(C)Cc2cncc(C(=O)O)c2)cc1 721497694 CVEYPEYVBWFOEQ-UHFFFAOYSA-N 272.304 2.425 10 20 CECD O=C(NCC(F)F)[C@@H]1CCCCN1Cc1ccccc1O 825068410 OWISZGZUQVULST-LBPRGKRZSA-N 298.333 2.128 10 20 CECD CC(C)(C)CCNC(=O)COC(=O)c1cc(O)cs1 732354318 JOHQHZAKMRSNGF-UHFFFAOYSA-N 285.365 2.163 10 20 CECD C[C@@H]1CCC[C@@H](OCC(=O)NCc2ccc(N)cc2)C1 837303369 JSWZRAWFIWJNEY-IUODEOHRSA-N 276.380 2.480 10 20 CECD CC[C@@H](COC(=O)/C=C\c1ccc(O)c(O)c1)OC 842086391 CRERATNUHLYVEB-XOIDGJRKSA-N 266.293 2.079 10 20 CECD C[C@@H](N)C[C@@H](C)NCc1cc(Cl)cc(F)c1O 843129051 LYMHNQONIDBXFC-HTQZYQBOSA-N 260.740 2.400 10 20 CECD CO[C@H](C)CC(=O)NCc1cc(Cl)ccc1O 846471991 DYEIXIVUFNTRHE-MRVPVSSYSA-N 257.717 2.087 10 20 CECD C[C@@H]1CCC[C@H]1NC(=O)NCCc1ccc(N)cc1 841795011 VQGKXJTURGCQJD-BXUZGUMPSA-N 261.369 2.299 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc(C(=O)O)c1 746335017 JWECXFRYMSPWGH-UHFFFAOYSA-N 285.299 2.363 10 20 CECD C[C@@](O)(CC(=O)NCc1cc(Cl)ccc1O)C1CC1 846476366 NYEPIVMJKLJYFR-CQSZACIVSA-N 283.755 2.213 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)NCC(C)C)cc1 844282130 UDOAMODHMSTWRH-UHFFFAOYSA-N 293.411 2.429 10 20 CECD COc1ccc(N(C)CCN(C)C[C@H](OC)C2CC2)cc1 844402271 RGRPVPSDIQQPNV-KRWDZBQOSA-N 292.423 2.488 10 20 CECD CCc1cccc(CN(CC(F)F)C[C@@H](C)O)c1O 848915072 SDOBJWQTEPXZSN-SNVBAGLBSA-N 273.323 2.403 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H]1COC[C@@H]1C 926001430 ZRZYHIPKPASYSS-GXTWGEPZSA-N 292.379 2.349 10 20 CECD Cc1ccc(C(=O)Nc2cnn(C(C)C)c2)c(O)c1O 751537705 HMXHBFHVLAZBOY-UHFFFAOYSA-N 275.308 2.436 10 20 CECD COCCCNCc1cc(F)c(N(C)C)cc1F 858086400 HMBHBPUXZWMXTB-UHFFFAOYSA-N 258.312 2.157 10 20 CECD C[C@H](NCCNc1cnccn1)c1ccc(F)cc1O 756644763 BWWXGLGYVNAKSH-JTQLQIEISA-N 276.315 2.084 10 20 CECD CC[C@@H](C)OCC(=O)NCc1cc(C)ccc1O 862758044 MVMDAEBTGOVVMM-LLVKDONJSA-N 251.326 2.132 10 20 CECD C[C@H](N[C@@H](CCO)C1CCOCC1)c1ccc(F)cc1O 763557096 BFQOVOHGNTVIRT-NHYWBVRUSA-N 297.370 2.360 10 20 CECD Cc1ccc(CN[C@@H]2CCN(CC3CC3)C2)c(O)c1 877024966 UVGYTFJSSHOBKG-OAHLLOKOSA-N 260.381 2.275 10 20 CECD OC[C@@H]1CSCCN1Cc1c(O)ccc(Cl)c1F 877779871 GUTXJNXJHQMXEY-MRVPVSSYSA-N 291.775 2.094 10 20 CECD C[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@@H](C)S1 1117793991 IDOYOXKSTVDJBK-OCAPTIKFSA-N 285.340 2.203 10 20 CECD COCC1(C)CCN(C(=O)c2cc(O)cs2)CC1 774397605 DZRXDIVKFDBHGB-UHFFFAOYSA-N 269.366 2.342 10 20 CECD Cc1ccc(CN[C@H]2CN(C3CC3)C[C@@H]2C)c(O)c1 877095210 PPRXNXLFSDBKMB-WFASDCNBSA-N 260.381 2.273 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCc2c[nH]nc2C1 883040807 OCXUXJGFALMPCD-NSHDSACASA-N 279.290 2.041 10 20 CECD CN1CCN(c2ccc(CNC[C@H]3C=CCC3)cc2)CC1 883238341 ZCKXGFXUFFICEO-INIZCTEOSA-N 285.435 2.494 10 20 CECD CS(C)(=O)=NC(=O)CSc1ncc(Cl)s1 882237172 GEUZHQKZTKYSIV-UHFFFAOYSA-N 284.815 2.143 10 20 CECD CN(CCC(F)(F)F)C(=O)Cc1ccc(N)cc1 88416263 VNWDSNIKQYYSOB-UHFFFAOYSA-N 260.259 2.222 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](COC)OC)cc1F 781415392 IJNWDWGHSRYXQI-AWEZNQCLSA-N 298.402 2.423 10 20 CECD COc1cc(C)cc(CNC2(C)CCOCC2)c1O 894355820 DEYSCYOXQLFVMN-UHFFFAOYSA-N 265.353 2.368 10 20 CECD COc1ccc(CNC(=O)C=C2CCSCC2)c(O)c1 794374373 QXJXOQBVUIVXJM-UHFFFAOYSA-N 293.388 2.470 10 20 CECD COc1ccc(CN[C@@H]2CCS[C@@H]2C)c(O)c1OC 895126128 SHIUKNHIKIFECM-MWLCHTKSSA-N 283.393 2.393 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1c(O)cccc1Br 706871597 LOTYYSWAMJNLBA-RKDXNWHRSA-N 288.185 2.404 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)C(F)(F)F)c(O)c1 794381220 MVEUZHPONCQPFP-SSDOTTSWSA-N 277.242 2.215 10 20 CECD CC(C)(CF)NCc1ccc(N2CCOCC2)cc1 1324046177 JAIUBAXGYMLWLR-UHFFFAOYSA-N 266.360 2.361 10 20 CECD COc1cccc(O)c1CN1CC[C@@](CO)(C(C)C)C1 1324207340 HMMYNLMVUSNHMY-MRXNPFEDSA-N 279.380 2.241 10 20 CECD COc1ccc(N2CC[C@@H](CNc3ccnc(N)n3)C2)cc1 1339751604 AQPNBSSOXKMUIP-LBPRGKRZSA-N 299.378 2.006 10 20 CECD Cc1cccnc1CCCNC(=O)NCc1ccc(N)cc1 1357669281 XXLWGXCXXCFLNP-UHFFFAOYSA-N 298.390 2.404 10 20 CECD C[C@H](N[C@@H]1CC=C(C(=O)O)C1)c1c(O)cccc1F 1604331017 SYDYYYVVJALTHI-WCBMZHEXSA-N 265.284 2.355 10 20 CECD O=C(O)[C@H](NCc1cc(Cl)cc(F)c1O)C1CC1 1601674502 OFBNGCNURHCYGT-SNVBAGLBSA-N 273.691 2.138 10 20 CECD C[C@](CC(=O)O)(NCc1cc(F)cc(F)c1O)C1CC1 1604091649 USBDXLONRSRYRK-CQSZACIVSA-N 285.290 2.403 10 20 CECD C[C@@H](NC(=O)[C@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 1589088164 IJXVZNMQZBFJNK-QMTHXVAHSA-N 290.363 2.041 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](CC(=O)O)OC)cc1 1776861374 IUMUALYNNPTTHZ-OAHLLOKOSA-N 294.395 2.112 10 20 CECD C[C@@H]1CCC[C@@]1(NCc1ccc2c(c1)CCO2)C(=O)O 1776639642 PSDZAOCJGXGTMD-BZNIZROVSA-N 275.348 2.355 10 20 CECD CN(C)c1ccc(CNC2C[C@@H]3CC[C@H](C2)N3C)cc1 20524019 KHSZYFDMMOCEMC-ZXFUBFMLSA-N 273.424 2.467 10 20 CECD Nc1ccc(CNC(=O)c2cc(C3CC3)on2)cc1 297159597 JRBQYHXEJBJXLF-UHFFFAOYSA-N 257.293 2.064 10 20 CECD CCCN(CC(=O)N(C)C)Cc1cc(C)c(C)cc1O 122034048 VPVGXQMNJUUQBG-UHFFFAOYSA-N 278.396 2.309 10 20 CECD CN(C)c1ccc(CN(C)S(=O)(=O)c2ccco2)cc1 188570669 AMMVJYHSIRYNSN-UHFFFAOYSA-N 294.376 2.166 10 20 CECD Cc1ccc(C(=O)NC[C@]2(C)CCCS2)c(O)c1O 182601496 KTOBIQKWTQKNCX-AWEZNQCLSA-N 281.377 2.422 10 20 CECD COc1cc(O)c(CN(C)[C@@H](CO)C(C)(C)C)cc1OC 180618234 KCAGWZYSMZFMBA-HNNXBMFYSA-N 297.395 2.248 10 20 CECD CO[C@@]1(C)C[C@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 193131168 MNALCRXRBAJENH-LRDDRELGSA-N 293.363 2.373 10 20 CECD C[C@H]1OCC[C@@]12CN(Cc1cccc(Cl)c1O)CCO2 279702514 RITZWNCYFBFARK-IAQYHMDHSA-N 297.782 2.425 10 20 CECD C[C@H](CCO)C1(CNC(=O)c2cccc(O)c2O)CCC1 279686107 BDNAXXFQLUIBBY-LLVKDONJSA-N 293.363 2.016 10 20 CECD CC[C@H](NCCN(C)CCOC)c1ccc(F)cc1O 286209829 RYYQFAJFYOWDLT-AWEZNQCLSA-N 284.375 2.150 10 20 CECD COc1ccc(O)c(CN2C[C@H](C)O[C@@H](C3CC3)C2)c1 280468451 CINXODORQOFUPV-MEDUHNTESA-N 277.364 2.400 10 20 CECD O=C(NCc1ccccc1O)c1cccn1C1CCNCC1 388533720 LCEPGHWVWOXGJG-UHFFFAOYSA-N 299.374 2.048 10 20 CECD CC(C)CO[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)C1 295141360 ORYWJKYZUCCLOH-SNVBAGLBSA-N 297.326 2.124 10 20 CECD CN(Cc1ccccc1O)C(=O)CSC1CC1 294991719 YZTOELFMJVOROP-UHFFFAOYSA-N 251.351 2.246 10 20 CECD COc1cccc(CN2CC[C@@H](O)C23CCCC3)c1O 293517625 AQOCQVANKSYRGZ-CQSZACIVSA-N 277.364 2.280 10 20 CECD O=C(Nc1ccc(OC(F)F)nc1)c1cccc(O)c1O 802402792 YPVUERKFZCDWHW-UHFFFAOYSA-N 296.229 2.347 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)C(C)(F)F)c1 815835305 PBPZNIXRZYDWPS-MRVPVSSYSA-N 273.279 2.308 10 20 CECD Cc1c[nH]nc1CNCCCSc1nccs1 810146733 VWSCOUMIYZCATO-UHFFFAOYSA-N 268.411 2.447 10 20 CECD CC[C@H](NCc1cc(Cl)cc(F)c1O)[C@@H](C)O 824920866 ADRZYUWHBNIKJF-HQJQHLMTSA-N 261.724 2.434 10 20 CECD Cc1cc(O)c(CNCC2([S@](C)=O)CC2)cc1Cl 825773742 OUQIISHAXPLDNK-SFHVURJKSA-N 287.812 2.355 10 20 CECD Cc1cc(O)c(CN2CCCC[C@@H]2C(N)=O)cc1Cl 824523267 XFLUNUHCDWZLKV-GFCCVEGCSA-N 282.771 2.194 10 20 CECD COC1(C)CN(Cc2ccc(Br)cc2O)C1 825935471 VFXSWEFSFYSMFA-UHFFFAOYSA-N 286.169 2.375 10 20 CECD Cc1oc(C(=O)N[C@H](C)c2ccccc2O)cc1CO 827956773 OWCOFZRTIOYEAM-SECBINFHSA-N 275.304 2.277 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](C)[C@@](C)(CO)C2)c1 827699839 MTPGZEOVMKMTFV-MLGOLLRUSA-N 279.380 2.241 10 20 CECD C[C@@H]1CCC[C@H](OCC(=O)NCc2ccc(N)cc2)C1 837303368 JSWZRAWFIWJNEY-DOMZBBRYSA-N 276.380 2.480 10 20 CECD C[C@H](N)C[C@H](C)NC(=O)N(C)Cc1ccc(N(C)C)cc1 831202542 IINUZQORUVJPHZ-STQMWFEESA-N 292.427 2.020 10 20 CECD CC(C)Oc1cncc(C(=O)NCc2ccc(N)cc2)c1 837302887 LFAXVSUCNJGJLX-UHFFFAOYSA-N 285.347 2.381 10 20 CECD COc1ccc(N(C)CCN(C)Cc2ccno2)cc1 844398755 BLZDKHOZHIKCFX-UHFFFAOYSA-N 275.352 2.251 10 20 CECD CN(C)c1ccc(CN2CC[C@]3(CCCN3)C2)cc1F 841105689 ZLORESMPWAWIIF-MRXNPFEDSA-N 277.387 2.220 10 20 CECD C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)Nc1ccc(N)cc1 841299617 LNDKCTQRFHWYGR-DOMZBBRYSA-N 288.395 2.359 10 20 CECD CN[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843048594 JIGRADKGQISKMD-ZDUSSCGKSA-N 265.376 2.076 10 20 CECD C[C@@H]1C[C@H](CN2CCOc3cc(N(C)C)ccc32)CCN1 841011247 FVJOXHDAFRONSJ-ZIAGYGMSSA-N 289.423 2.340 10 20 CECD COc1ccc(O)c(CNC(=S)NC2(C)CCC2)c1 840729064 LQQVKFUVEVMNKW-UHFFFAOYSA-N 280.393 2.308 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](C2CC2)N(C)C)c1 756433543 PWWHHUMLOBZVFJ-XHDPSFHLSA-N 278.396 2.392 10 20 CECD Cc1cc(CN2CC[C@@H](N)[C@H](C)C2)ccc1N(C)C 923291453 SQMIGAFBIGEWPD-UKRRQHHQSA-N 261.413 2.230 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1NCCC1(C)C 852870196 BNBAFIACMKWPTR-OAHLLOKOSA-N 289.423 2.065 10 20 CECD Cc1cccc(O)c1CN1CCCC[C@@H](S(C)(=O)=O)C1 877480735 GJLZRNPNXWEPRG-CYBMUJFWSA-N 297.420 2.100 10 20 CECD C[C@H]1C[C@H](NC[C@H]2C[C@H](N)C2)c2c(O)ccc(F)c21 873255738 HRGDXMLYXKFHRT-GMOBBJLQSA-N 264.344 2.407 10 20 CECD Cc1nccn1CCCNCc1ccc(N(C)C)cc1 69753979 DYXJNHPYPSCOAC-UHFFFAOYSA-N 272.396 2.437 10 20 CECD COC1(CO)CCN(Cc2c(O)cccc2Cl)CC1 775205319 XNSDMBMYXZLHPZ-UHFFFAOYSA-N 285.771 2.019 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@@H](C)C2CC2)c1O 774974911 LXKODWVLBONTJF-SECBINFHSA-N 280.324 2.445 10 20 CECD COc1cc(C)cc(CN[C@@]2(C)CCCOC2)c1O 894415999 OWYQSTXYBSTGQP-HNNXBMFYSA-N 265.353 2.368 10 20 CECD CCCOc1ccc(CN[C@H]2CCOC2=O)cc1C 895808603 QGNXHBHDBLIMDZ-ZDUSSCGKSA-N 263.337 2.189 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cccc(CC)c2O)C1 896958891 PWNNFOWWYGLBBH-CQSZACIVSA-N 277.364 2.340 10 20 CECD Cc1cc(N(C)C)ccc1CNC1CCC(O)CC1 796771150 JAFIJDIRCZHTOJ-UHFFFAOYSA-N 262.397 2.454 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2cccc(Cl)c2O)C1 792199262 CPULOKWYTGZIDT-KOLCDFICSA-N 283.755 2.477 10 20 CECD CCOc1ccc(CN[C@H](CO)CC2CCC2)c(O)c1 793321086 GGWZUAPIJUAKGH-AWEZNQCLSA-N 279.380 2.432 10 20 CECD COc1cc(Cl)cc(CNCCN2CC[C@H](C)C2)c1O 761215281 JAVJZCZYDIUXHE-NSHDSACASA-N 298.814 2.486 10 20 CECD COc1ccc(CN[C@H]2C[C@H](C)N(C(C)=O)C2)cc1C 987645280 OIKKODDYMLCVAJ-WFASDCNBSA-N 276.380 2.103 10 20 CECD C[C@H](NC[C@@]12CCC[C@@H]1C2)c1cccc(-c2nn[nH]n2)c1O 1603664491 PAKLPABBVMWOBE-USBNGQNGSA-N 299.378 2.413 10 20 CECD Cc1cc(O)c(CN2CCSC[C@H](C(=O)O)C2)cc1C 1600285480 CMQXKEIRSLYYDP-CYBMUJFWSA-N 295.404 2.259 10 20 CECD CS[C@@H](C)CN[C@H](C)c1cc(C(=O)O)ccc1O 1610380020 CZTQOGYQAUKIDU-DTWKUNHWSA-N 269.366 2.493 10 20 CECD CC(C)c1nsc(NC(=O)Cc2ccc(N)cc2)n1 1575893852 HPGDNJQRZKLWHA-UHFFFAOYSA-N 276.365 2.425 10 20 CECD CO[C@]1(CN[C@H](C)c2ccc(C)cc2O)CCOC1 123157466 DRQKFDKWMQODBT-DOMZBBRYSA-N 265.353 2.157 10 20 CECD Cc1cccc(CNC2CCN(C3CC3)CC2)c1O 124680685 FVIKPVXPJPRFMZ-UHFFFAOYSA-N 260.381 2.417 10 20 CECD CN(C[C@@H]1OCCC1(C)C)c1ccc(OCC(=O)O)cc1 1777054166 VXZKEUBZPCKYKZ-AWEZNQCLSA-N 293.363 2.401 10 20 CECD CC[C@@](C)(O)CNC1CCN(c2ccc(OC)cc2)CC1 154533313 PONLOGYCIRNNQI-QGZVFWFLSA-N 292.423 2.415 10 20 CECD CCCNC(=O)CN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 36780977 YPFZORUNNFCUJL-VXGBXAGGSA-N 276.380 2.365 10 20 CECD CN(CCCF)Cc1ccc(N2CCOCC2)cc1 119392294 RORZBBYLQPCVTC-UHFFFAOYSA-N 266.360 2.315 10 20 CECD Oc1ccccc1CNC[C@@H](O)c1ccccc1F 60358336 GETZZGBUQGSYET-OAHLLOKOSA-N 261.296 2.355 10 20 CECD Cc1nc(NCCc2ccc(O)c(O)c2)ccc1[N+](=O)[O-] 301624902 AKUKADGELRBXMJ-UHFFFAOYSA-N 289.291 2.364 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C/c2ccc[nH]2)c1 188553407 SBTIMPKBEWREAS-QPJJXVBHSA-N 272.304 2.059 10 20 CECD CCN1CCN(Cc2c(O)cccc2Cl)CC1 131705493 KUSDTDUXLRMQFX-UHFFFAOYSA-N 254.761 2.183 10 20 CECD CCN(CC)c1ccc(CN(C)CCS(C)(=O)=O)cc1 194442622 YXOMCAAQQQNTAZ-UHFFFAOYSA-N 298.452 2.009 10 20 CECD Nc1ccc(CC(=O)N[C@@H]2CCN(c3ccccc3)C2)cc1 237913234 YSUMNUGEWKUACF-MRXNPFEDSA-N 295.386 2.206 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CN3CCC[C@H]3CO2)c(O)c1 252538503 AQEPXKZNEPWJBO-SOUVJXGZSA-N 290.407 2.214 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCCSC2)c1O 267281471 HAUFXHBESPSMSA-LLVKDONJSA-N 296.392 2.096 10 20 CECD O=C(NCc1ccccc1O)c1cc2c(nc1O)CCCC2 264674419 MYVBZCDKUZGLPT-UHFFFAOYSA-N 298.342 2.302 10 20 CECD CN1CC[C@H]2CCN(Cc3cc(F)ccc3O)[C@H]2C1 272611756 KMDFKDDCTRXLOP-FZMZJTMJSA-N 264.344 2.057 10 20 CECD Cc1ccc([C@H](C)NC[C@H](O)c2cnn(C)c2)c(O)c1C 273555412 GUCYPLAFKLUZET-WFASDCNBSA-N 289.379 2.127 10 20 CECD CC[C@H](NCc1cc(F)ccc1O)[C@@H](O)C(F)(F)F 272520636 YFPDBPGHVAHJJS-GXSJLCMTSA-N 281.249 2.323 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C[C@H]2CCC[C@@H]2O)c1O 270064776 HLMZMLWBKOOUEJ-ABAIWWIYSA-N 295.354 2.327 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H](C)C(=O)NCCF)cc1 282650424 HZUGZOCBGPNEHY-STQMWFEESA-N 295.402 2.268 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C(C)(F)F)c1 808462143 UHOZWBGDQVRWOW-SSDOTTSWSA-N 259.252 2.233 10 20 CECD CN(Cc1c(O)cccc1Cl)C[C@H](O)C1CC1 809751578 IWYNYNCIWMEFPN-ZDUSSCGKSA-N 255.745 2.248 10 20 CECD CC(C)OC[C@H](C)NCc1ccc(N2CCOCC2)cc1 800224817 OZXFHLDTWOXFCO-HNNXBMFYSA-N 292.423 2.426 10 20 CECD C[C@H](NCC1CNC1)c1cccc(C(F)(F)F)c1O 817965350 PFIFDOLSEGHTRU-QMMMGPOBSA-N 274.286 2.281 10 20 CECD Cc1cc(CN(C)CC2(O)CCC2)ccc1N(C)C 815092972 YBRCGJCQUTXDLX-UHFFFAOYSA-N 262.397 2.408 10 20 CECD CC(C)=CCN1C(=O)CN(Cc2ccccc2O)C1=O 819167936 ITZKGWKDZYAMLV-UHFFFAOYSA-N 274.320 2.123 10 20 CECD Oc1cc2c(cc1CN1C[C@@H]3CCCC[C@@H]31)OCO2 826538415 DCCXCJCTAPNQAB-JQWIXIFHSA-N 261.321 2.495 10 20 CECD CN(C)[C@@H](CN[C@@H]1CCc2cccc(O)c21)C1CC1 834518682 MGNUFBIWZVKZNR-KGLIPLIRSA-N 260.381 2.309 10 20 CECD COc1ccc(NC(=O)c2cc(O)cs2)c(OC)n1 732280528 YSLDMRIXURHIDQ-UHFFFAOYSA-N 280.305 2.118 10 20 CECD CN1CCCc2cc(CNC(=O)NC(CF)CF)ccc21 836530380 VDXPDUHUGNGLHB-UHFFFAOYSA-N 297.349 2.176 10 20 CECD CN(C)[C@@H](CN[C@H]1CCc2cccc(O)c21)C1CC1 834518680 MGNUFBIWZVKZNR-KBPBESRZSA-N 260.381 2.309 10 20 CECD Cc1nc(NC(=O)NCc2ccc(O)c(O)c2)oc1C 749021920 MLJVKUQYOSSVAL-UHFFFAOYSA-N 277.280 2.024 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCCC(F)(F)[C@H]2O)c1 840971290 LAYWGZKXRXWVNF-YPMHNXCESA-N 287.306 2.039 10 20 CECD C[C@H](N)C[C@H](C)NCc1c(O)ccc(Cl)c1F 843127580 DZBQPCRNYCRSFR-YUMQZZPRSA-N 260.740 2.400 10 20 CECD C[C@@H](NC[C@@H]1CNC(=O)C1)c1cc2c(cc1O)CCCC2 840834651 YZEVLBDOJIMMES-VXGBXAGGSA-N 288.391 2.058 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)N1CCCc2cc(CN)ccc21 843350689 WQSNDNQNIVGUBS-QWHCGFSZSA-N 289.423 2.201 10 20 CECD CCC[C@@H](O)CN[C@H](C)c1cccc(OC)c1O 846142548 ARFPAZMPILBKDD-GHMZBOCLSA-N 253.342 2.212 10 20 CECD CCOc1ccc(CN2CCCC[C@H]2[C@H](C)N)c(O)c1 843045868 LHTNHQJKIBBPQM-WFASDCNBSA-N 278.396 2.493 10 20 CECD COc1cc(C)cc(CN(C)Cc2nc(C)no2)c1O 848503442 FGNAZNRNAYKPGY-UHFFFAOYSA-N 277.324 2.033 10 20 CECD CN(C)C1(CNCc2c(O)ccc(Cl)c2F)CC1 841890283 NPKXIJRHSQNSDW-UHFFFAOYSA-N 272.751 2.369 10 20 CECD COC[C@H](CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21)OC 757638542 QMVUTPGSBFJIOW-SCVCMEIPSA-N 283.343 2.331 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](CO)CC2CC2)c1 850544573 IHGQLBOLBWKUMN-AAEUAGOBSA-N 279.380 2.460 10 20 CECD CC(=O)N1CC[C@@H](N[C@H]2C[C@H](C)c3c(F)ccc(O)c32)C1 857084284 LNHZRPQLJXKUBG-NDMJEZRESA-N 292.354 2.290 10 20 CECD C[C@H](N[C@H](C(N)=O)c1ccccc1)c1cc(F)ccc1O 756382791 UJASNNUALBNBNP-BONVTDFDSA-N 288.322 2.409 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)CCS(C)(=O)=O)c(O)c1C 756658528 KSZOVJYQDYQOSJ-DGCLKSJQSA-N 299.436 2.483 10 20 CECD CC[C@H](NC(=O)NCc1cc(OC)ccc1O)C1CC1 853737051 YVTQWBYCRKBCJN-ZDUSSCGKSA-N 278.352 2.389 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCn2cccc2)c1 858287265 QJXSULZFOAVIOF-UHFFFAOYSA-N 273.336 2.002 10 20 CECD COc1ccc(O)c(CNC(=O)c2coc(C3CC3)n2)c1 763282323 ASSRLSFTYCOMEZ-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CCOc1ccc(CN2CCC(C(=O)OC)CC2)c(O)c1 768153381 VPXATSFPSKOUEI-UHFFFAOYSA-N 293.363 2.176 10 20 CECD COc1cccc(O)c1CN(C)[C@@H](C)C(=O)OC(C)C 769525613 WZXDGHKNZJLNQU-NSHDSACASA-N 281.352 2.173 10 20 CECD CCCCC[C@H](O)C(=O)NCc1cc(C)ccc1O 862755042 NOYGSAXJTPZHKP-AWEZNQCLSA-N 265.353 2.258 10 20 CECD Cc1ccc(CNCC[S@](=O)C(C)(C)C)c(O)c1 877055393 MPZKLRYMHVJMMT-SFHVURJKSA-N 269.410 2.337 10 20 CECD Oc1c(F)cc(Cl)cc1CN1C[C@@H]2CC[C@H](C1)N2 873216128 IZQULPGCPNHRLZ-PHIMTYICSA-N 270.735 2.121 10 20 CECD Cc1ccc(CN[C@H](C2CC2)[C@]2(CO)CCCO2)c(O)c1 877553599 AUHBTSYNTCHHAL-IAGOWNOFSA-N 291.391 2.110 10 20 CECD C[C@H](NCc1ccnc(N(C)C)n1)c1c(O)cccc1F 886561663 FRZJJOOVPDYGPB-JTQLQIEISA-N 290.342 2.238 10 20 CECD COC(=O)N1CCC[C@H](N[C@@H](C)c2c(O)cccc2F)C1 886521111 UQVZLBVKTJCFAD-QWRGUYRKSA-N 296.342 2.413 10 20 CECD COc1cc(O)c(CNC2CCC(C)(O)CC2)cc1OC 776222525 NPYZTGMXZJMOGO-UHFFFAOYSA-N 295.379 2.193 10 20 CECD Cc1cc(C(=O)NCc2ccno2)c(C)n1-c1ccccn1 777779712 RCTDSYSRFNKFSD-UHFFFAOYSA-N 296.330 2.407 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@H](OCC)[C@H]2OC)c(O)c1 775979195 RQKSQTJWRXBGJA-KBMXLJTQSA-N 295.379 2.073 10 20 CECD Oc1cccc(Cl)c1CNC1CCC(O)CC1 83551217 BTMQTWASQSKEFP-UHFFFAOYSA-N 255.745 2.439 10 20 CECD CCn1cnc2c1CCN(Cc1cc(OC)ccc1O)C2 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CN(C)c1cc(F)c(CNCC2(C)COC2)cc1F 858136267 KRDVGDHXGWSIFE-UHFFFAOYSA-N 270.323 2.157 10 20 CECD C[C@H](N[C@H](C)Cn1cccn1)c1cc([N+](=O)[O-])ccc1O 756672281 MVFCSAMZFHPILS-MNOVXSKESA-N 290.323 2.236 10 20 CECD C[C@@H](NC[C@@H]1CC2(CC2)C(=O)O1)c1ccc(N(C)C)cc1 763784427 ZQPHTIJJBIJLJL-DOMZBBRYSA-N 288.391 2.499 10 20 CECD COC(=O)c1cnc(SC[C@@H]2CCO[C@@H]2C)s1 865368916 GKBCAUAUBAIFRN-SFYZADRCSA-N 273.379 2.447 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C)[S@](=O)CC2)cc1 773888642 LEHUWWJCMCMIRO-JLTOFOAXSA-N 294.464 2.486 10 20 CECD C[C@@H](NCc1ccc(S(C)(=O)=O)o1)c1ccccc1O 877755803 NNXOVJDTXGLROJ-SNVBAGLBSA-N 295.360 2.240 10 20 CECD CCN(Cc1cnn(C)c1)Cc1ccc(C)cc1O 876635202 OZXIMBVCFHDQHQ-UHFFFAOYSA-N 259.353 2.456 10 20 CECD C[C@@]1(CO)CCCN1Cc1cccc(Cl)c1O 789558306 WEUSHSXRUIHFDF-ZDUSSCGKSA-N 255.745 2.392 10 20 CECD C[C@H]1CCc2[nH]nc(C(=O)N(C)c3ccc(N)cc3)c2C1 884441688 NHPDOUOFNFJWTQ-JTQLQIEISA-N 284.363 2.393 10 20 CECD COC[C@H](O)CN[C@@H](C)c1cccc(C(F)(F)F)c1O 788818118 NPPRNMCDERXPDM-DTWKUNHWSA-N 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CC(C)(CN)CC(=O)NCCCSc1nccs1 1263085365 YCQSVSJPQJMOQZ-UHFFFAOYSA-N 287.454 2.117 10 20 CECD O=C(CC1CCSCC1)NCc1cccc(O)c1O 1520510132 WTAUQLWMHNLPJB-UHFFFAOYSA-N 281.377 2.247 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1C[C@H]1c1ccco1 1521851335 LGANESLRZDCHDT-GHMZBOCLSA-N 273.288 2.111 10 20 CECD CCN(CC)c1ccc(CN[C@H](CF)C(=O)O)cc1F 1605435560 CLKCNFTTXCLGPD-GFCCVEGCSA-N 286.322 2.184 10 20 CECD Cc1nnc(CSc2ncc(C(=O)O)s2)s1 1600796562 NROJVIAGDSBYCJ-UHFFFAOYSA-N 273.364 2.294 10 20 CECD CN(Cc1cncc(F)c1)c1ccc(OCC(=O)O)cc1 1606173344 SRXVTLSNQWEOMT-UHFFFAOYSA-N 290.294 2.321 10 20 CECD Nc1ccc(CN2CC[C@H](OCc3ccccn3)C2)cc1 1580443526 NRTUGUABXYZDIC-KRWDZBQOSA-N 283.375 2.455 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)C[C@H](C)O1 160176250 AVRRQJKRJARSRE-WCQYABFASA-N 295.379 2.409 10 20 CECD C[C@H](CNC(=O)OC(C)(C)C)NCc1ccccc1O 235464588 LASYZQPRNFXXOK-LLVKDONJSA-N 280.368 2.395 10 20 CECD CC(C)(CO)CCCNC(=O)Nc1ccc(N)cc1 841300015 LLTWRCCFCMUMDZ-UHFFFAOYSA-N 265.357 2.189 10 20 CECD 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RVWBHBSUEUJVFT-JTQLQIEISA-N 282.340 2.360 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]3CN(C)CC[C@@H]32)c1 290611149 WPKIGHQENSOUCS-CJNGLKHVSA-N 290.407 2.317 10 20 CECD CCN(Cc1cc(Cl)cc(C(C)=O)c1O)[C@@H](C)CO 293405655 MATFRZAPIJUELA-VIFPVBQESA-N 285.771 2.451 10 20 CECD CC[C@H](NCCN1CCCOCC1)c1ccccc1O 809751940 YSXQXCGRTGQJTK-HNNXBMFYSA-N 278.396 2.155 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H](C3CC3)C1)[C@@H](O)CO2 808230838 RBAQYQOZOGFQKZ-WBMJQRKESA-N 289.375 2.440 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H](n3ccnn3)C2)cc1C 819895761 CKBYQHDIZCPWLB-OAHLLOKOSA-N 286.379 2.438 10 20 CECD CC[C@H](NCCc1ccc(N)cc1)c1ccn(C)n1 817956816 DKIFLTVBNSENBQ-AWEZNQCLSA-N 258.369 2.286 10 20 CECD COCCNCCN[C@H](C)c1ccc2ccccc2c1O 817965504 WEFILLARHKKTLX-CYBMUJFWSA-N 288.391 2.432 10 20 CECD CCN(C)c1ccc(CN2CC[S@](=O)CC2(C)C)cc1 815098133 BJAFEUWEHQROOF-FQEVSTJZSA-N 294.464 2.486 10 20 CECD C[C@H](CC(=O)O)NCc1ccc(N2CCSCC2)cc1 820085944 ZVGMSNSRIARXPT-GFCCVEGCSA-N 294.420 2.193 10 20 CECD Cc1nnc(CN(C)Cc2ccc(N(C)C)c(F)c2)o1 827039242 LMRRDYWITGMCMO-UHFFFAOYSA-N 278.331 2.215 10 20 CECD CC1(C(=O)NCc2ccc(O)c(O)c2)CC(F)(F)C1 821070635 IXNKFNFPXQSRBO-UHFFFAOYSA-N 271.263 2.149 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](N)C(C)C)cc1 826020025 NXIDUDDCDOMRQQ-MRXNPFEDSA-N 291.439 2.475 10 20 CECD C[C@@H](NC(=O)CCc1ccc(O)nc1)c1ccccc1O 827946593 NITJPZSGZIBMMI-LLVKDONJSA-N 286.331 2.303 10 20 CECD Cc1ncc2c(n1)CCC[C@@H]2NC(=O)c1cc(O)cs1 734876866 FBBJZGBGXIHETK-LBPRGKRZSA-N 289.360 2.360 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)c2cc(O)cs2)C12CCC2 839796893 FUTSQNGWAJYVRG-GHMZBOCLSA-N 267.350 2.141 10 20 CECD C[C@H](NCC(F)(F)CO)c1ccc(Cl)cc1O 841751226 GFEPPBSCEAJADI-ZETCQYMHSA-N 265.687 2.324 10 20 CECD CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)c1cc(O)cs1 743658693 BRXAWESJQPXNJG-WCQGTBRESA-N 281.377 2.387 10 20 CECD Oc1ccccc1CNc1cc(NC2CC2)ncn1 840253334 IPCBIUKMVQYXAN-UHFFFAOYSA-N 256.309 2.369 10 20 CECD CN(Cc1cccc(Br)c1O)C1(CN)CCC1 843124842 IYDPWHKVGHRZJX-UHFFFAOYSA-N 299.212 2.468 10 20 CECD C[C@@H](NC(=O)c1cnc(C2CC2)nc1O)c1ccccc1O 913763622 LNQPLFABOMGRIV-SECBINFHSA-N 299.330 2.256 10 20 CECD CC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)CCCO1 841958691 IJBNHBVCMFXKRA-HNNXBMFYSA-N 291.395 2.022 10 20 CECD C[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)CCS1 841959066 KGBFACUSPLLGFO-GFCCVEGCSA-N 293.436 2.348 10 20 CECD CC[C@H](C(=O)NCc1cc(Cl)ccc1O)[C@@H](C)O 846660824 IROBOPZOHQPVSV-KCJUWKMLSA-N 271.744 2.069 10 20 CECD CC[C@@H](C)CC[C@H](O)CC(=O)NCc1ccc(O)cc1O 910945987 GYDZTWHZAAUPJE-RISCZKNCSA-N 295.379 2.291 10 20 CECD CCCN(CC(=O)O)Cc1c(O)ccc(Cl)c1F 840997839 YEPSZCNHMIHAQT-UHFFFAOYSA-N 275.707 2.481 10 20 CECD CC(C)(C)C[C@@H]1C[C@H]1NC(=O)C(=O)Nc1ccc(N)cc1 846323513 VMZXSUQRDBXLFM-GXFFZTMASA-N 289.379 2.148 10 20 CECD COC[C@@H](NC(=O)NCc1cc(Cl)ccc1O)C1CC1 845069442 NLVHTRZOYWTJPZ-GFCCVEGCSA-N 298.770 2.270 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)[C@H]2CC=CCC2)cc1 846663984 UDCRSXGWVBCRFF-HOCLYGCPSA-N 287.407 2.225 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)CN1CCCC1=O 840929961 RNZNHSZUAVQBCO-CQSZACIVSA-N 289.423 2.162 10 20 CECD Cn1cnc(/C=C/C(=O)N2CCCc3ccccc32)c1 929096348 JQPJYDSBVQNVFK-CMDGGOBGSA-N 267.332 2.413 10 20 CECD CN(C)c1cc(F)c(CNCCc2ccn(C)n2)cc1F 858156765 MNOXMGYMXMLCID-UHFFFAOYSA-N 294.349 2.097 10 20 CECD CC(C)(C)CN(CC(=O)O)Cc1cc2c(cc1O)OCO2 854244071 OKSPQMNUIPZKGO-UHFFFAOYSA-N 295.335 2.054 10 20 CECD Nc1ccc(NC(=O)c2cnc3n2CCCCC3)cc1 856995314 VKKOVCLWQZOZOS-UHFFFAOYSA-N 270.336 2.444 10 20 CECD CCCSC[C@H](NCc1ccc2c(c1)CCO2)C(=O)O 756341326 WIYGCFFKMULNSI-ZDUSSCGKSA-N 295.404 2.308 10 20 CECD CCN(CC)C[C@H](C)NC(=O)NCc1cc(C)ccc1O 858278841 KDWXKMCIPNJCII-ZDUSSCGKSA-N 293.411 2.230 10 20 CECD C[C@@H](NC/C=C\CO)c1cc(Br)ccc1O 850507858 IJRGBSFOLWUEFH-PKRMOACSSA-N 286.169 2.354 10 20 CECD Oc1cc2c(cc1CN[C@@H]1CCCC[C@H]1F)OCO2 840961558 BIACYDQGLWDXFF-GHMZBOCLSA-N 267.300 2.491 10 20 CECD Cc1ccc(CN2CCNC(=O)[C@H]2c2ccccc2)c(O)c1 876651877 IGOISYRCPKXNEX-QGZVFWFLSA-N 296.370 2.374 10 20 CECD CSCCNCc1ccc(N2CCC(O)CC2)cc1 876892236 ICXCDVXVIAXCQX-UHFFFAOYSA-N 280.437 2.100 10 20 CECD CCCC(=O)NC1CCN(Cc2cc(F)ccc2O)CC1 779000552 ZDZYUZANJBVHKK-UHFFFAOYSA-N 294.370 2.412 10 20 CECD CCN(Cc1c(C)cccc1O)[C@H](C)CS(=O)(=O)CC 876734849 AQADETLJCRJPKM-CYBMUJFWSA-N 299.436 2.346 10 20 CECD CCOc1ccc(O)c(CN2Cc3cnn(C)c3C2)c1 877632845 PFELHHZVPDUAPU-UHFFFAOYSA-N 273.336 2.040 10 20 CECD Cc1noc(CCCNCc2cc(F)cc(F)c2O)n1 882986084 FUMJECYSIDZGJO-UHFFFAOYSA-N 283.278 2.084 10 20 CECD COc1ccc(N2CCC(N[C@H](C)C[C@@H](C)O)CC2)cc1 783535290 LKXNXNMRCKKNME-ZIAGYGMSSA-N 292.423 2.413 10 20 CECD CC[C@@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 789956129 DBELUERMUNFGEF-SECBINFHSA-N 267.300 2.499 10 20 CECD COc1cc(C)cc(CN2CCN(C)[C@H](C)[C@@H]2C)c1O 894487112 GJFZIOOOYHZVDU-OLZOCXBDSA-N 278.396 2.234 10 20 CECD CCOc1ccc(CNCc2nc(C(F)F)no2)c(O)c1 895726886 JQIJJISKXAHMCY-UHFFFAOYSA-N 299.277 2.401 10 20 CECD C[C@@H](NC(=O)[C@H]1CCN1C(C)(C)C)c1ccccc1O 899181401 BREZCXSZXWJQSW-DGCLKSJQSA-N 276.380 2.442 10 20 CECD CSCC(C)(C)NC(=O)c1ccc(C)c(O)c1O 890874032 IQVFXDDWWMXBAO-UHFFFAOYSA-N 269.366 2.278 10 20 CECD COc1cccc(O)c1CN[C@H]1CCN2CCC[C@@H]2C1 725845540 CRPLCPVOTZMWTN-QWHCGFSZSA-N 276.380 2.117 10 20 CECD Cc1cc(CN[C@H](C)c2cc(F)ccc2O)ncn1 756775947 NLOXXABNABZDAV-SNVBAGLBSA-N 261.300 2.481 10 20 CECD COc1cccc(O)c1CN1CCC2(CCOCC2)C1 769540397 OGUHLPDOABIICL-UHFFFAOYSA-N 277.364 2.403 10 20 CECD C[C@@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 91972363 QBGKWEQICNEAIZ-GFCCVEGCSA-N 261.369 2.253 10 20 CECD Cc1ccc(CN2CC[C@H](C(=O)O)[C@H](C)C2)c(O)c1 1605273103 GTSHINFEPAKGLF-YPMHNXCESA-N 263.337 2.243 10 20 CECD COc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)ccn1 1248688151 KQZGKRNWDYDURR-UHFFFAOYSA-N 299.374 2.428 10 20 CECD COc1cc(C)cc(CN[C@H](CO)CC(F)(F)F)c1O 1334359719 QBRKMWDZVBIDGU-JTQLQIEISA-N 293.285 2.112 10 20 CECD C[C@@H]1C[C@@H](C)N(c2nnc(-c3sccc3O)n2C)C1 1338086844 JHAKSDGIBPFCPY-RKDXNWHRSA-N 278.381 2.484 10 20 CECD CO[C@H]1CN(Cc2ccc(N3CCCC3)cc2)CCO1 1262367329 QXOOWZNQCVLUAQ-MRXNPFEDSA-N 276.380 2.092 10 20 CECD CCOc1cccc(CNC[C@@H](C)N(C)C2CC2)c1O 105488276 CVTWVAOONLZRKT-GFCCVEGCSA-N 278.396 2.363 10 20 CECD Cc1cccc(CN[C@H]2CCN3CCCC[C@@H]23)c1O 224543383 IYDYLPIRXCNAFK-GJZGRUSLSA-N 260.381 2.417 10 20 CECD Cc1ccc(CN[C@H](C)c2cccc(-c3nn[nH]n3)c2O)o1 1592165556 NHDSVQVJBFNUNN-SNVBAGLBSA-N 299.334 2.325 10 20 CECD CCc1cccc(CNCCOC[C@H]2CCCO2)c1O 848896748 ILHAXPPQQHUEQC-OAHLLOKOSA-N 279.380 2.240 10 20 CECD COC(=O)[C@H](NCc1ccc(OC)c(C)c1)C(C)C 40218989 MXYZDESSKHUHBO-CQSZACIVSA-N 265.353 2.291 10 20 CECD NCCCN(Cc1ccccc1)C(=O)Cc1ccc(N)cc1 262457802 LQMLEOFBVGRUJB-UHFFFAOYSA-N 297.402 2.189 10 20 CECD Cc1ccc(C(=O)N(C)CCc2ccncc2)c(O)c1O 179458886 QMNMSRIVIPFQCT-UHFFFAOYSA-N 286.331 2.116 10 20 CECD CCc1nnc2ccc(NCc3ccc(N(C)C)cc3)nn12 76664692 TTZNKQLGWVAZMD-UHFFFAOYSA-N 296.378 2.365 10 20 CECD COCC1=CCN(Cc2cc(C)cc(OC)c2O)CC1 185046404 CMPDBYRGOWAGFB-UHFFFAOYSA-N 277.364 2.488 10 20 CECD Cc1ccc(O)c(CN2CCC(Cn3cncn3)CC2)c1 189981312 YCCCTNXOXSPIDP-UHFFFAOYSA-N 286.379 2.204 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCNC1CC1 37807438 VTXVKFJCFJBIIA-UHFFFAOYSA-N 289.423 2.243 10 20 CECD COC(=O)CN(Cc1cc(OC)ccc1O)C1CCCC1 180498906 IAVLURFHPSDAFP-UHFFFAOYSA-N 293.363 2.318 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccco1 183428121 AGKCDLHVHCDVCW-VIFPVBQESA-N 261.277 2.052 10 20 CECD COc1ccc(CN[C@H]2CCN(C3CC3)C2)cc1C 44686973 DJEOMFAWAYRWFM-AWEZNQCLSA-N 260.381 2.330 10 20 CECD CNC[C@@H]1CCN(Cc2cc(Cl)cc(OC)c2O)C1 229103406 MOVCQBHVPPTCPR-JTQLQIEISA-N 284.787 2.096 10 20 CECD Cc1ccc(O)c(CNCCCn2ccnc2C)c1 264996393 YLTPBJBQFSVVKY-UHFFFAOYSA-N 259.353 2.385 10 20 CECD COC[C@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCO1 278757340 WZOCXDAUIKYBJL-HOTGVXAUSA-N 278.396 2.036 10 20 CECD Cc1cccc(CN2CCOC[C@H]2[C@H]2CCCC2=O)c1O 375472588 WZIBSEGEINBOLY-CABCVRRESA-N 289.375 2.271 10 20 CECD CCC(CC)(CCO)NCc1cc(OC)c(OC)cc1O 283081787 RFCXNODZEWCHJO-UHFFFAOYSA-N 297.395 2.440 10 20 CECD CC[C@H](N[C@H](C)c1ncn(C)n1)c1ccc(F)cc1O 287375846 HZGHJHJULFOYJD-SKDRFNHKSA-N 278.331 2.462 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@H]1CCCC[C@@H]1N 294944723 CXENDGZVRFLVNN-OCCSQVGLSA-N 276.380 2.258 10 20 CECD COC(=O)c1cnc(SCCCCCO)s1 295361029 RPOLPTYIINOJIV-UHFFFAOYSA-N 261.368 2.184 10 20 CECD C[C@H]1C[C@@H](CO)CN(Cc2ccc(N(C)C)c(F)c2)C1 817412775 OVXPWOHEGSPWPM-GXTWGEPZSA-N 280.387 2.342 10 20 CECD CCc1cc(NCc2cc([N+](=O)[O-])ccc2O)nn1C 817709027 OJSUWHAXHRRVKE-UHFFFAOYSA-N 276.296 2.208 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CC1(F)F 817559522 VAEWCLNTSXWQTB-SDBXPKJASA-N 285.290 2.190 10 20 CECD CC(=O)N1CCN(Cc2cc(Cl)c(C)cc2O)CC1 824484270 ANIAONWCBQZLGK-UHFFFAOYSA-N 282.771 2.018 10 20 CECD CCOC(=O)CN(CCSC)Cc1ccccc1O 823576272 KMTTVDYLFIVDNY-UHFFFAOYSA-N 283.393 2.120 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@@H](C)N(C)C 822757222 SXTUOCVFPMTKOC-CYBMUJFWSA-N 278.396 2.471 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](CN3CCCC3=O)C2)c1 827634536 SENTXEXYAUZMNQ-AWEZNQCLSA-N 288.391 2.145 10 20 CECD CCOC(=O)CN(CC1CC1)c1ccc(OC)cc1 831583250 SEXFIEJWLIGITI-UHFFFAOYSA-N 263.337 2.475 10 20 CECD CNC(=O)C[C@@H](C)N[C@H](C)c1c(C)cc(C)cc1O 834901991 YQWXJJDNTQSMNE-VXGBXAGGSA-N 264.369 2.184 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](CO)[C@@H]2C)c1O 839668894 JZVFRRIFDSJDPF-CMPLNLGQSA-N 295.354 2.327 10 20 CECD CC(C)(C)[C@H](O)C(=O)NCc1ccc(N2CCCC2)cc1 735847586 OYESEHVKFFWZPB-OAHLLOKOSA-N 290.407 2.310 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@H](C)c1cc(C)ccc1O 834880809 ROJLTCSPXNBOSX-XJKCOSOUSA-N 279.380 2.403 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@H](c2cccnc2)C1 843962354 BZJVHXDUHSFJGU-LBPRGKRZSA-N 284.315 2.123 10 20 CECD CN(C)c1ccc(CN[C@H]2CCN(C(C)(C)C)C2=O)cc1 842720374 GRKUPTGQWGEIEM-HNNXBMFYSA-N 289.423 2.242 10 20 CECD CC[C@H](C(=O)O)C(=O)N(CC)Cc1ccc(N(C)C)cc1 911118408 MMADODCZCPNWNA-AWEZNQCLSA-N 292.379 2.212 10 20 CECD C[C@H]1CCN1C(=O)NCc1ccc(N(C)C)c(F)c1 746976123 ZAVPVTODVUOPOL-JTQLQIEISA-N 265.332 2.196 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@@H](C)C[S@@](C)=O 840940082 VEMLYRNYDOYCSN-ORAYPTAESA-N 282.453 2.260 10 20 CECD COc1cccc(O)c1CN1C[C@@H]2[C@@H](C1)C2(F)F 846113492 YEQDXMQTWHDHSR-NXEZZACHSA-N 255.264 2.098 10 20 CECD CC(C)n1ncnc1CN1CCCc2cc(CN)ccc21 843350824 WAMVCNMFPQSCBP-UHFFFAOYSA-N 285.395 2.271 10 20 CECD CC(C)(CSc1nccs1)CS(C)(=O)=O 750542812 KCUMYLUQRYMPCK-UHFFFAOYSA-N 265.425 2.306 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CSC[C@@H]2C)c1 858450057 YFXZFQIBNLEAEE-JQWIXIFHSA-N 280.393 2.251 10 20 CECD CN1CCCC[C@@H]1CCOC(=O)c1cccc(O)c1O 758547262 JJOVRCXKJVBIPR-LLVKDONJSA-N 279.336 2.129 10 20 CECD CCN(Cc1cnon1)c1ccc(OC)c(OC)c1 851829647 ZCLGJWFDORWORN-UHFFFAOYSA-N 263.297 2.113 10 20 CECD CC[C@@](C)(CNC(=O)NCc1cc(C)ccc1O)OC 858514088 OIEPETZYDDKDNO-HNNXBMFYSA-N 280.368 2.315 10 20 CECD C[C@@H](Cc1cnn(C)c1)NCc1ccc2c(c1)CCCO2 922161593 DSLHSRAEOLWHSA-ZDUSSCGKSA-N 285.391 2.466 10 20 CECD Cc1noc([C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)n1 759595961 SJRHJRFRDATMOQ-JQTRYQTASA-N 290.275 2.107 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2cc(F)cc(F)c2O)C1 756656599 YVQSTACGGQTFPW-MWLCHTKSSA-N 298.333 2.332 10 20 CECD C[C@@H](N[C@H]1CC(=O)N(C)C1)c1cc2c(cc1O)CCCC2 756528726 VYZDYAIGRWPABG-RISCZKNCSA-N 288.391 2.152 10 20 CECD CCC[C@@H](CCO)NC(=O)NCc1ccc(N(C)C)cc1 866037624 OSEMWZIZHBGCOL-AWEZNQCLSA-N 293.411 2.103 10 20 CECD CCN(CCCO)Cc1c(O)cccc1Br 862248739 QQQBMCXRIWAVMV-UHFFFAOYSA-N 288.185 2.359 10 20 CECD COCCCn1cc(C)c(NC(=O)c2cc(O)cs2)n1 1118705841 ZEKXTXBYEOFVLB-UHFFFAOYSA-N 295.364 2.247 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2CC[C@H](C(=O)O)C2)cc1F 1118920886 WYURGPWEKQQZIE-GXSJLCMTSA-N 298.333 2.374 10 20 CECD COc1cccc(O)c1CNc1ccc2c(c1)C(=O)NCC2 770579564 PYIVELHHGLQUHB-UHFFFAOYSA-N 298.342 2.299 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H](O)COCC2CC2)c(O)c1 788584286 NIFVZRJSEJXWJR-ZFWWWQNUSA-N 293.407 2.447 10 20 CECD COc1ccc(CNCCc2cnccn2)cc1C 390115977 MBCFOWOGLHEQAJ-UHFFFAOYSA-N 257.337 2.126 10 20 CECD Cc1ccc(C(=O)NCc2ccoc2C)c(O)c1O 780907313 OIQBVSAKBHQVTN-UHFFFAOYSA-N 261.277 2.238 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1 84950148 XLWMPEIUPZAYSH-AWEZNQCLSA-N 276.380 2.138 10 20 CECD CCOCc1cc(CNCC[C@@H](O)C2CC2)ccc1OC 898207039 YVTASFJFQCIDCW-MRXNPFEDSA-N 293.407 2.482 10 20 CECD C[C@@H]1C[C@@H](C)CN(C(=O)CN(C)c2ccc(N)cc2)C1 702069460 KVYSDOWKIDZPHE-CHWSQXEVSA-N 275.396 2.210 10 20 CECD COc1cc(C)cc(CN[C@H]2CC[C@H](CO)CC2)c1O 894340333 NHWYJTNTTWTPDG-MQMHXKEQSA-N 279.380 2.350 10 20 CECD C[C@@H](Cn1ccnc1)NCc1cc(F)cc(F)c1O 708494556 LSALTEOVMCOHMT-VIFPVBQESA-N 267.279 2.045 10 20 CECD CCN(CC)c1ccc(CNC(=O)/C=C\COC)cc1F 791361872 XBGCZFCLVSMZKF-SREVYHEPSA-N 294.370 2.491 10 20 CECD COc1cc(O)c(CN2CC[C@H](CF)C2)cc1OC 1331047042 RJLFXVNLRBQHFZ-SNVBAGLBSA-N 269.316 2.201 10 20 CECD Oc1ccc2ccncc2c1CN1C[C@H]2CC[C@H]1[C@H](O)C2 1337233828 CPDCKCCMSPTGDW-XNJJOIOASA-N 284.359 2.286 10 20 CECD C[C@H](NCCc1cnn(C)c1)c1c(O)cccc1F 1331255071 SHMTYSYAIMYQEE-JTQLQIEISA-N 263.316 2.158 10 20 CECD CCN(CC)[C@@H]1CCN(C(=O)Nc2ccc(N)cc2)C1 110380160 XQZLRSLGLNJYTO-CQSZACIVSA-N 276.384 2.217 10 20 CECD COc1cc(C)cc(CN(CC(=O)O)C(C)C)c1O 1604695320 MLAGNQYJIXKORZ-UHFFFAOYSA-N 267.325 2.004 10 20 CECD C[C@@H](CN1CCCCC1)NCc1cc(F)ccc1O 226584440 NAPLMFIRRMCRLE-LBPRGKRZSA-N 266.360 2.495 10 20 CECD O=C(CCCc1ccccn1)NCc1ccc(O)c(O)c1 159025711 GVEJPMMHCRSYLU-UHFFFAOYSA-N 286.331 2.132 10 20 CECD CCCC(=O)NC1CCN(Cc2ccc(N)cc2)CC1 586044816 NEKYCLQVFYEBAL-UHFFFAOYSA-N 275.396 2.150 10 20 CECD C[C@H](c1cccnc1)N(C)C(=O)Cc1ccc(N)cc1 831880384 CYXYDFBYMTVHCT-GFCCVEGCSA-N 269.348 2.426 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@H](O)C(F)(F)F)c1 866463375 NGQLYBXMURKFPW-SXMVTHIZSA-N 293.285 2.363 10 20 CECD C[C@H](NC(=O)CCCCC(=O)O)c1ccccc1O 868461426 FFZMJCJKJDFCMG-JTQLQIEISA-N 265.309 2.214 10 20 CECD COC(=O)CCCN[C@@H](C)c1ccc(N(C)C)cc1 37416446 UGNNVILOQRIYGS-LBPRGKRZSA-N 264.369 2.356 10 20 CECD C[C@H](NCCc1cncn1C)c1ccc(N(C)C)cc1 401877359 OFFJOHDDWMXCBN-ZDUSSCGKSA-N 272.396 2.379 10 20 CECD CCCCNC(=O)CCN(C)Cc1ccccc1O 116279508 YOVXJMPIHKLYCJ-UHFFFAOYSA-N 264.369 2.130 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H]2CCCO2)c1 170900716 DIGHETLKZIDBHY-PWSUYJOCSA-N 279.336 2.147 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2cccnc2)cc1 31726694 LDVYHBNHYBLGNZ-UHFFFAOYSA-N 284.363 2.147 10 20 CECD C[C@@H](NC[C@H](O)COCC1CC1)c1ccc(N(C)C)cc1 129855330 DFLFUXDFKJEHOH-DYVFJYSZSA-N 292.423 2.191 10 20 CECD Cc1cccc(CNCCC(=O)NC(C)(C)C)c1O 135779528 PGVHWKFHBOXSFB-UHFFFAOYSA-N 264.369 2.095 10 20 CECD CCOc1ccc(N(CC)C[C@H](O)Cn2cccn2)cc1 264510286 ZOXWRFOBIJHDCF-HNNXBMFYSA-N 289.379 2.169 10 20 CECD C[C@@H](NCC(C)(C)N(C)C)c1cc([N+](=O)[O-])ccc1O 273423077 SNGILFYYRDYVRM-SNVBAGLBSA-N 281.356 2.291 10 20 CECD COc1cc(O)c(CN2C[C@@H](C)[C@@H](C)C2)cc1OC 271121089 YDNUUYQYDNMGEK-PHIMTYICSA-N 265.353 2.497 10 20 CECD CCc1nnc(NCc2cccc(OC)c2O)nc1CC 277281478 TZLRTEZYHJWUGJ-UHFFFAOYSA-N 288.351 2.323 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cn(C)nc1C1CC1 292158983 NATQWLSELAUWMI-UHFFFAOYSA-N 285.347 2.275 10 20 CECD Cc1cc(CN(C2CC2)C2COC2)ccc1N(C)C 295427892 NXNGBNNCBFLOFA-UHFFFAOYSA-N 260.381 2.424 10 20 CECD CCN[C@H](C)CN[C@@H](C)c1cc(OC)ccc1O 817973996 XGVHWUDWQPNBNU-MNOVXSKESA-N 252.358 2.049 10 20 CECD Cn1ccnc1[C@@H](NCCc1ccc(N)cc1)C1CC1 817958529 WTAMAIQPILAMAX-HNNXBMFYSA-N 270.380 2.286 10 20 CECD OC[C@H]1CN(Cc2cc(Cl)ccc2O)CCC1(F)F 812775024 CLGDLQIVPRKZRR-SNVBAGLBSA-N 291.725 2.495 10 20 CECD CCOC(=O)CN(C)Cc1cc(Cl)c(C)cc1O 824556003 KTZJWQXEOHIMHW-UHFFFAOYSA-N 271.744 2.349 10 20 CECD C[C@@H]1C[C@@H](C)[C@H](C(=O)N[C@H](C)c2ccccc2O)O1 827946498 KCFWZQHIKXWTBY-ZHSDAYTOSA-N 263.337 2.383 10 20 CECD O=C(O)CCCCCNCc1cccc(F)c1O 821515620 GYHRVRYWLIDYPV-UHFFFAOYSA-N 255.289 2.266 10 20 CECD Cc1cc(CN2CCC[C@@]23CCNC3)ccc1N(C)C 903872292 YPKIESHXSJMPGX-KRWDZBQOSA-N 273.424 2.389 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc2nn[nH]c2c1 588406937 SMDRPLWZPIVBNE-KXFIGUGUSA-N 296.286 2.021 10 20 CECD Cc1cc(C)n(CCCNC(=O)c2cc(O)cs2)n1 732262850 GXUVVHHAILCLKY-UHFFFAOYSA-N 279.365 2.087 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCC[C@@H]1CCOC1 837063879 FEBJKXPOCFRBOQ-RYWCDNDXSA-N 291.347 2.044 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@@H](C)c1cc(F)ccc1O 834881022 YFPNTPITQMQABI-FIXISWKDSA-N 283.343 2.233 10 20 CECD Cc1cc(C)c(CNC(=O)NCc2ccccc2O)cn1 836654770 CCPMSQQHQMVDJS-UHFFFAOYSA-N 285.347 2.403 10 20 CECD Nc1ccc(CCNC(=O)N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)cc1 841955894 QTAFRWCSUZVEHF-NXNVCVFFSA-N 297.402 2.275 10 20 CECD C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)Nc1ccc(N)cc1 841299618 LNDKCTQRFHWYGR-IUODEOHRSA-N 288.395 2.359 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2cc(Cl)ccc2O)CO1 846473478 LPFUKDHZWUKLPE-WCBMZHEXSA-N 269.728 2.087 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H](CCN)C2)c1O 923493817 VYSCOHVESPECLZ-NSHDSACASA-N 296.798 2.419 10 20 CECD COc1ccc(N(C)CCCN2CCOC2=O)cc1F 757851841 FTKVGVCCZUOPDF-UHFFFAOYSA-N 282.315 2.113 10 20 CECD COc1cc(C)cc(CN(C)CC2=CCCOC2)c1O 853561919 VUEMKEFPUMQZSL-UHFFFAOYSA-N 277.364 2.488 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C)[C@H](CO)C2)c1O 856792238 LOTUOEOQUJTUAY-MFKMUULPSA-N 295.354 2.184 10 20 CECD CN(C(=O)c1cc(O)cs1)C(C)(C)CN1CCCC1 854959040 ZMQOFXJSTHVKHW-UHFFFAOYSA-N 282.409 2.400 10 20 CECD COCC1(NC(=O)NCc2ccc(N(C)C)cc2C)CC1 767018185 HSQMSMHGSUJBRQ-UHFFFAOYSA-N 291.395 2.039 10 20 CECD c1ccn(-c2ccc(-c3nc(Cn4cncn4)no3)cc2)c1 763351204 HDSMJZLFYKOOMZ-UHFFFAOYSA-N 292.302 2.167 10 20 CECD O=C1NC2(CCC2)C(=O)N1Cc1ccc(N2CC=CC2)cc1 761366599 ZIMKIVKEHDRGRD-UHFFFAOYSA-N 297.358 2.037 10 20 CECD O=C(OCc1nccn1C(F)F)c1cccc(O)c1O 776282538 SSSOFMLOUSNKDA-UHFFFAOYSA-N 284.218 2.046 10 20 CECD Cc1ccc(CNCc2ccc3c(c2)C(=O)NCC3)c(O)c1 877333386 UFTMOJOYJHNRLO-UHFFFAOYSA-N 296.370 2.276 10 20 CECD Cc1ncsc1/C=C\C(=O)N1CCc2ncccc21 776874879 PFOKMUMYESNOKG-PLNGDYQASA-N 271.345 2.449 10 20 CECD CC(C)[C@@H](C)NC(=O)CN[C@H](C)c1ccccc1O 879647864 OJJGDLXXJCJBLO-VXGBXAGGSA-N 264.369 2.204 10 20 CECD Cc1cccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)c1O 777219782 NCAYJAQHLRNCOJ-LBPRGKRZSA-N 278.396 2.436 10 20 CECD CCOC(=O)c1cc(NCc2ccccc2O)nc(C)n1 881873151 YMLYKOVHFLKTFS-UHFFFAOYSA-N 287.319 2.279 10 20 CECD CC(C)N1CC[C@H](N[C@@H](C)c2c(O)cccc2F)C1=O 886547825 RVYWHBMQRSVCFM-JQWIXIFHSA-N 280.343 2.191 10 20 CECD COc1ccc(CNC[C@@]2(O)CCC[C@@H]2C)c(O)c1OC 894642040 KJYALJKKHLIIHL-ZBEGNZNMSA-N 295.379 2.050 10 20 CECD C[C@@H]1OCC[C@H]1NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898449281 AJLIOLUBVPQVER-IAOVAPTHSA-N 291.439 2.122 10 20 CECD O[C@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1204320378 WJMWTCNOCLWEGE-INIZCTEOSA-N 260.381 2.244 10 20 CECD CCN(CCC(=O)NC)Cc1cc(Cl)ccc1O 897710596 YFBQAHIMJXOTQK-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CC(C)(NCc1ccc2c(c1)CCO2)C(=O)N1CCCC1 793394807 MAUUDHAUDVEKSX-UHFFFAOYSA-N 288.391 2.112 10 20 CECD COc1cc(Cl)cc(CNC[C@H]2CC(C)=NO2)c1O 895302855 CGIIDBLVAFMRHT-LLVKDONJSA-N 284.743 2.309 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCN2CCCC[C@H]12 708481629 RWSXYHXSFWCBFA-UONOGXRCSA-N 282.334 2.387 10 20 CECD CCOc1cccc(CN2CCC[C@H]([C@@H](C)N)C2)c1O 70171603 PNSSTLQJRWWKIR-OLZOCXBDSA-N 278.396 2.350 10 20 CECD CCN1CCC[C@@H](N[C@H](C)c2ccc(C)cc2O)C1=O 722361529 MUQVIBMPDBLDLI-TZMCWYRMSA-N 276.380 2.362 10 20 CECD COc1cccc(O)c1CN1C[C@@H](C)O[C@H](C2CC2)C1 793215939 YPQWQWZQVATBHI-BZNIZROVSA-N 277.364 2.400 10 20 CECD CCN1CCC[C@H](CNC(=O)Nc2ccc(N)cc2)C1 1326087507 AGNPCZVYQWXKML-GFCCVEGCSA-N 276.384 2.122 10 20 CECD Cc1nc(CN(C)c2ccc(OCC(=O)O)cc2)co1 1607957151 NBPMSFGKPVLENM-UHFFFAOYSA-N 276.292 2.083 10 20 CECD Cc1ccc([C@H](C)NCC(=O)NCC(C)C)c(O)c1 228691277 LHOSRESZPZOSDN-LBPRGKRZSA-N 264.369 2.123 10 20 CECD NC[C@]12CC[C@H]1CCN2Cc1cc(Cl)c(F)cc1O 1580253721 QZMJHHVLEXUTIH-IINYFYTJSA-N 284.762 2.498 10 20 CECD COc1ccc(CNCCCCCC(=O)O)c(O)c1OC 1594096210 SLZADHQFCSIERS-UHFFFAOYSA-N 297.351 2.144 10 20 CECD COc1cc2c(c(OC)c1)N(CCCC(=O)O)CCC2 1599462659 DFBYVLNURUUMBP-UHFFFAOYSA-N 279.336 2.321 10 20 CECD CCC(CC)N1C[C@@H](C(=O)Nc2ccc(N)cc2)CC1=O 160363889 AOZCLZBPOGIKKD-NSHDSACASA-N 289.379 2.244 10 20 CECD COc1ccc(O)c([C@H](C)NCCCn2cccn2)c1 126262594 LUTXKFOUKXFRNA-LBPRGKRZSA-N 275.352 2.338 10 20 CECD C[C@](O)(CNCc1ccc2c(c1)CCCO2)C(F)(F)F 921939612 ULILMYUOLQLJNA-ZDUSSCGKSA-N 289.297 2.415 10 20 CECD CN1CC=C(CNCc2ccc3c(c2)CCCO3)CC1 921969496 XFDIUBSMESYENZ-UHFFFAOYSA-N 272.392 2.363 10 20 CECD CN(C)c1ccc(CNc2ccnc(CO)c2)cc1 858324558 ANDNGODURZZLJO-UHFFFAOYSA-N 257.337 2.252 10 20 CECD Cc1ccc(CN(C)[C@H]2CCN(C)C[C@H]2C)c(O)c1 877530983 HFDWRDIIQHJVIZ-HIFRSBDPSA-N 262.397 2.473 10 20 CECD C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)c1ncn(C)n1 275700221 KPQWOARCLNKIKC-NEPJUHHUSA-N 273.384 2.293 10 20 CECD CN(Cc1ccccc1O)C(=O)CCC1CCNCC1 50947750 AASPQSRPJKUHQJ-UHFFFAOYSA-N 276.380 2.130 10 20 CECD C[C@H](CN[C@H](C)c1cc(F)ccc1O)CN(C)C 310777873 DZGUYMCKWAZKBY-GHMZBOCLSA-N 254.349 2.380 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCSC1)c1ccccc1O 827937395 VFIKLUGPECWQMC-NXEZZACHSA-N 251.351 2.323 10 20 CECD CCN(CC)C(=O)NCc1ccc(N(C)C)c(F)c1 57646824 OTZUQDTZUQAGHH-UHFFFAOYSA-N 267.348 2.443 10 20 CECD CCOC(=O)N[C@H]1CCCN(Cc2cc(F)ccc2O)C1 179933124 IQJHFZRCZAXGEH-ZDUSSCGKSA-N 296.342 2.242 10 20 CECD COC(=O)[C@@H](NCc1cc(F)cc(C(C)=O)c1O)C(C)C 119231530 KIFUNQFVZRBXCH-ZDUSSCGKSA-N 297.326 2.021 10 20 CECD CCCOc1ccc(CN[C@@](C)(CCO)COC)c(O)c1 175853428 RPQRCTKOXDJYHD-INIZCTEOSA-N 297.395 2.058 10 20 CECD CSCC[C@@H](C)NC(=O)Cc1ccc(N)cc1 157058978 XZBPODOVQWSVAI-SNVBAGLBSA-N 252.383 2.069 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cnns2)cc1 48703556 WFCFIOKMYOJRPE-UHFFFAOYSA-N 290.392 2.314 10 20 CECD CCCNC(=O)CCN[C@H](C)c1ccc(C)cc1O 45072330 VNSMIVMQDKBLQZ-GFCCVEGCSA-N 264.369 2.268 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1ncccc1O 194664773 VAVLSIDPTSKVCP-UHFFFAOYSA-N 297.358 2.317 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCCC[C@H]2O)c1 85962936 HDMYAPKIMRKFPA-SMDDNHRTSA-N 265.353 2.042 10 20 CECD C[C@H]1CCC[C@H](CO)N1Cc1ccc(N(C)C)cc1 193439794 NFULROIQMQAFPB-XJKSGUPXSA-N 262.397 2.488 10 20 CECD Cc1noc(C)c1CCC(=O)NCCc1ccc(N)cc1 237592343 WIKXLBSOMSBIGO-UHFFFAOYSA-N 287.363 2.165 10 20 CECD COc1cccc(CNc2cnc3c(c2)COCC3)c1O 360023717 ZPZXIRCCGKOQRQ-UHFFFAOYSA-N 286.331 2.481 10 20 CECD C[C@@H]1CCC[C@@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272476615 QGAFXYYMGZUUPG-LXIAQJANSA-N 261.321 2.416 10 20 CECD C[C@@H](CCO)C1(CNC(=O)c2cccc(O)c2O)CCC1 279686108 BDNAXXFQLUIBBY-NSHDSACASA-N 293.363 2.016 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@H](COC)OC)cc1 272642456 CXSHJFBFPAHGRT-CZUORRHYSA-N 280.412 2.455 10 20 CECD O=C(NCc1ccccc1O)NC[C@H]1CCCSC1 287132375 BYDOGDJPKHWQHS-LLVKDONJSA-N 280.393 2.335 10 20 CECD C[C@H]1C[C@@H](C)O[C@H]1C(=O)NCc1ccc(N(C)C)cc1 282353164 AGRROSAABFUZLP-YWPYICTPSA-N 276.380 2.182 10 20 CECD CCOCc1cc(CN[C@]2(C)CCOC2=O)ccc1OC 289751349 IDYOIGSBEVQJMQ-MRXNPFEDSA-N 293.363 2.027 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CC[C@@H](CO)C2)c1 295091209 RQJQQUAQBGRZRX-YPMHNXCESA-N 265.353 2.042 10 20 CECD CCOc1ccc(N(CC)Cc2nnnn2C2CC2)cc1 299384861 HYIOANQXJSNEPH-UHFFFAOYSA-N 287.367 2.433 10 20 CECD C[C@H](N[C@H]1CCc2cccc(O)c21)[C@H]1CCCNC1 817947503 OTMHCDQAECZQQF-UBHSHLNASA-N 260.381 2.357 10 20 CECD C[C@H](N[C@H](C)[C@@H]1CCCNC1)c1cc([N+](=O)[O-])ccc1O 817948294 WUMKMQKYRGQTAD-GRYCIOLGSA-N 293.367 2.339 10 20 CECD CCOCC[C@H](O)CNCc1ccc(N2CCCC2)cc1 818953775 MXEKSMQAGKNWBY-KRWDZBQOSA-N 292.423 2.164 10 20 CECD Cc1ccc2c(c1)/C(=C\c1cnccn1)C(=O)N2C 811700646 NQZCWQXDGXZCSE-MDWZMJQESA-N 251.289 2.302 10 20 CECD CCCN1C[C@H](CNCc2ccc(N(C)C)cc2)CC1=O 817411019 LEFMZGNEVIWIMQ-HNNXBMFYSA-N 289.423 2.101 10 20 CECD CCOc1ccc(CN(CC(F)F)C[C@H](C)O)c(O)c1 825098288 FWVPLCKJAAWUFK-JTQLQIEISA-N 289.322 2.239 10 20 CECD CCCCC[C@H](O)C(=O)N(C)Cc1ccccc1O 827081614 NJDDBRJOFQCMAN-AWEZNQCLSA-N 265.353 2.292 10 20 CECD O=C(OCCOCC1CCCC1)c1cccc(O)c1O 837648541 SPMRRJAQJJRFQI-UHFFFAOYSA-N 280.320 2.461 10 20 CECD Cc1csc([C@@H](C)C(=O)NCc2ccc(O)cc2O)n1 910946924 VVLOAWMBXMFZRJ-VIFPVBQESA-N 292.360 2.283 10 20 CECD O=C(COC1CCCCC1)NCc1ccc(O)cc1O 910952801 ZSOQNSJZGSUTGK-UHFFFAOYSA-N 279.336 2.063 10 20 CECD CCCn1cc(NC(=O)c2cc(O)cs2)cn1 743720285 YVRHGZDLTWPMPJ-UHFFFAOYSA-N 251.311 2.313 10 20 CECD COc1cccc(CN[C@@H](CN)C2CCCC2)c1O 841088249 UCRUNMQTEGEQKX-ZDUSSCGKSA-N 264.369 2.008 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CNCC[C@@H]1C 841059732 WIWRZHAOFBMBNS-LRDDRELGSA-N 261.413 2.149 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@@H]2[C@@H]2CCCOC2)cc1 843502223 BFKMAIDORBNZGN-GDBMZVCRSA-N 288.391 2.229 10 20 CECD CCN(C)C(=O)CN[C@@H](C)c1ccc(Cl)cc1O 841751274 HBPQFXPNQRHQPX-VIFPVBQESA-N 270.760 2.175 10 20 CECD C[C@H](NC[C@H]1COCCO1)c1ccc(Cl)cc1O 841746165 VVEOTQJJGBNYKU-ONGXEEELSA-N 271.744 2.112 10 20 CECD CN(C)c1ccc(CNC(=O)CN[C@H]2CCC2(C)C)cc1 846957609 JPUPOCVUKWFXPH-HNNXBMFYSA-N 289.423 2.147 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccon1 747512291 KKVHMQLAEBXTDZ-UHFFFAOYSA-N 288.351 2.048 10 20 CECD CCc1cccc(CNC[C@H]2CCCN(C(C)=O)C2)c1O 848908547 XCERSLHXAUPQRT-CQSZACIVSA-N 290.407 2.303 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 840827025 ZHLNGEOQCZQKJO-KYVBTAMFSA-N 281.327 2.083 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@@]2(CCNC2)C1 843120541 PBAYYRJCZIBYTP-CQSZACIVSA-N 266.772 2.231 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2CCCN(C)C2=O)c2c(O)ccc(F)c21 756637191 HCXGVRWFIPUXGB-ADEWGFFLSA-N 292.354 2.290 10 20 CECD CC(C)N(C)CCNCc1cc(F)c(N(C)C)cc1F 858120772 LZLWIJZBMKLDAP-UHFFFAOYSA-N 285.382 2.461 10 20 CECD CN(CCNCc1cc(Cl)ccc1O)CC(F)F 858336468 IWEJYYGYDAFKFV-UHFFFAOYSA-N 278.730 2.332 10 20 CECD Cc1ccc(O)c([C@H](C)NCc2ccc(C(N)=O)nc2)c1 756640177 KUZJFMZIJVKQMZ-NSHDSACASA-N 285.347 2.045 10 20 CECD Cc1cc(CN2CCC[C@@H]2[C@@H](C)O)ccc1N(C)C 852558040 FBWMDUBUGQGQPQ-CZUORRHYSA-N 262.397 2.406 10 20 CECD CC[C@]1(C)NC(=O)N(CCCSc2nccs2)C1=O 761296747 HEVRNZGXOBZLMX-LBPRGKRZSA-N 299.421 2.346 10 20 CECD C[C@@H](NC(=O)NCCOC1CCC1)c1ccccc1O 868323518 NDKKIRIAOVJRAN-LLVKDONJSA-N 278.352 2.322 10 20 CECD Cc1cc(Br)c(O)c(CNC2(C)COC2)c1 877691998 ZUCRTVBERUTOSH-UHFFFAOYSA-N 286.169 2.342 10 20 CECD CC[C@@H](NC[C@]1(O)CCOC1)c1cc(Cl)ccc1O 775522916 BQDGEZGNEGPESF-TZMCWYRMSA-N 285.771 2.238 10 20 CECD Cc1ccc(CN2CC(OC(=O)NC(C)C)C2)c(O)c1 877581956 BBPGSCKTUFMNKL-UHFFFAOYSA-N 278.352 2.019 10 20 CECD CC[C@H](NCc1nncn1C)c1cc(Cl)ccc1O 775491157 AXSQGFYCAWTWKE-NSHDSACASA-N 280.759 2.415 10 20 CECD C[C@H](NC(=O)[C@@H]1CCCCN1C)c1ccc(N(C)C)cc1 775402505 DUDLSUAQDJCDGF-BBRMVZONSA-N 289.423 2.414 10 20 CECD C[C@H](N[C@H](CCO)C1CC1)c1c(O)cccc1F 886549120 BUFWXAJNNKMBTD-JOYOIKCWSA-N 253.317 2.343 10 20 CECD COc1ccc(O)c(CNC(=O)c2ncc(C)cc2C)c1 780514169 DYABXNZYUWQSEV-UHFFFAOYSA-N 286.331 2.343 10 20 CECD Cc1nc([C@H](C)NCc2cc(F)c(N(C)C)cc2F)n[nH]1 894777824 NIQLKFZQFYQZNU-QMMMGPOBSA-N 295.337 2.308 10 20 CECD Cc1cc(O)c(CN[C@H]2COC[C@@H]2C)cc1Cl 896732569 IMRUGQXHSQUVCA-CABZTGNLSA-N 255.745 2.479 10 20 CECD COc1ccc(CNC(=O)[C@H](F)C(C)C)c(O)c1 794389070 ILSBJMIWILPFFR-GFCCVEGCSA-N 255.289 2.011 10 20 CECD C[C@H](CCC(=O)O)CNCc1cc(F)cc(F)c1O 1334841447 MTIUXPFIBWFPQE-MRVPVSSYSA-N 273.279 2.261 10 20 CECD O=C(O)C[C@H](NCc1cc(F)cc(F)c1O)C1CC1 1262163257 MGRWPBIPOUJEBC-NSHDSACASA-N 271.263 2.013 10 20 CECD C[C@H]1C[C@H](C(=O)Nc2c(Cl)ccc3nonc23)CO1 1346941258 PIFNHAUZQUNWPM-BQBZGAKWSA-N 281.699 2.240 10 20 CECD C[C@@H](CNCc1ccc(N(C)C)cc1)N(C)C1CC1 105489313 KQTTZKHFUCGFDX-ZDUSSCGKSA-N 261.413 2.325 10 20 CECD CCOc1cccc(CN[C@@H]2CCO[C@@H](C)C2)c1O 219906359 BZXDEKKCUYKNKM-WCQYABFASA-N 265.353 2.448 10 20 CECD CC(C)(CCCO)CNCc1cc(F)ccc1O 226618714 CKJGGPZPQQRQTD-UHFFFAOYSA-N 255.333 2.420 10 20 CECD C[C@@H](CC(=O)NCc1ccccc1O)[C@H]1CCCNC1 228423529 ZQGSEDRNSQLXEA-STQMWFEESA-N 276.380 2.034 10 20 CECD CN[C@H]1CCN(Cc2cc(OC)cc(C(C)(C)C)c2O)C1 1578609171 PGMBPBGFAWQVFN-ZDUSSCGKSA-N 292.423 2.492 10 20 CECD CCN1CCCc2cc(CNC3(C(=O)O)CC3)ccc21 1776876050 PGWNAFJESGRYES-UHFFFAOYSA-N 274.364 2.166 10 20 CECD COc1cccc(CN2CC[C@H](OC)[C@H](C)C2)c1O 824814716 DUNRWSBJLLUGNF-YPMHNXCESA-N 265.353 2.258 10 20 CECD COCC1(CNC(=O)c2cccc(O)c2O)CCCC1 837113245 VXLLCXMZLGCUQR-UHFFFAOYSA-N 279.336 2.034 10 20 CECD COc1cccc(O)c1CN1CC(F)(F)C(F)(F)C1 839160059 HVRJKKLKQJXXEO-UHFFFAOYSA-N 279.233 2.487 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H](C(=O)O)C(C)(C)C 852947005 DCLNOIZXCCLYSW-GFCCVEGCSA-N 279.336 2.098 10 20 CECD COCCOCCCCNCc1c(C)cccc1O 876996863 GPPSSRGYEMNWFN-UHFFFAOYSA-N 267.369 2.233 10 20 CECD C[C@H]1CN(C)[C@H](C)CN1Cc1cc(F)cc(F)c1O 894482281 BJVQHGVLABQZIC-ZJUUUORDSA-N 270.323 2.195 10 20 CECD CC(C)[C@H](NCc1ccc(N2CCCC2)cc1)C(=O)O 43430883 PZZZVOYDRXPKDT-HNNXBMFYSA-N 276.380 2.486 10 20 CECD Cc1c(CN[C@H](C)c2cc(F)ccc2O)cnn1C 186188482 JMGVXVUDFOICGM-SECBINFHSA-N 263.316 2.424 10 20 CECD CN1CCCC[C@@H](CNCc2ccc3c(c2)CCO3)C1 700813998 SPHBZVPBDNOUPT-HNNXBMFYSA-N 274.408 2.443 10 20 CECD C[C@H](N[C@@H]1CCN(C2CC2)C1)c1cc(F)ccc1O 94617977 NDHDVKSIXIUGRN-CMPLNLGQSA-N 264.344 2.419 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)c1ncn(C)n1 391879878 VFAONPDCINIBPI-QMMMGPOBSA-N 266.732 2.025 10 20 CECD CN(Cc1cnn(C)c1)Cc1cc(Cl)ccc1O 119691218 TVSFCXSJLGGGIQ-UHFFFAOYSA-N 265.744 2.411 10 20 CECD COc1cccc(CNC(=O)c2cccnc2C)c1O 170995067 DGMFZZIUSMIRAA-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CC=CCC2)c1 114541791 VZHHZZIQHBDKTK-LLVKDONJSA-N 261.321 2.373 10 20 CECD COc1ccc(/C=C2\SC(=S)NC2=O)s1 177889873 FTEJQNUHTBHIEU-XQRVVYSFSA-N 257.361 2.246 10 20 CECD CCCNC(=O)C1CCN(Cc2cc(C)ccc2O)CC1 125399784 HTRYKCAMDLMRCZ-UHFFFAOYSA-N 290.407 2.439 10 20 CECD COc1ccnc(CN(C)Cc2ccccc2O)c1OC 190861108 RDAVPZGZFYCNAH-UHFFFAOYSA-N 288.347 2.436 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2snnc2C)c1 293839085 WUQGVFSODGFMDK-MRVPVSSYSA-N 279.365 2.412 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC[C@H]2OCC[C@@H]12 268507139 WSAGFBSXMSZQIV-GZBFAFLISA-N 290.363 2.149 10 20 CECD Cn1nncc1CN1CCCc2cc(OC(F)F)ccc21 360332829 GHNLCNHXJONQLL-UHFFFAOYSA-N 294.305 2.369 10 20 CECD CCNC(=O)C1(CNCc2cccc(Cl)c2O)CCC1 277390882 YIJZRWHRXVWWBY-UHFFFAOYSA-N 296.798 2.442 10 20 CECD CCCNC(=O)CN[C@@H](CC)c1ccc(C)cc1O 279949811 BQHQWRHHNPKDBB-ZDUSSCGKSA-N 264.369 2.268 10 20 CECD CC[C@H](NCC(=O)N(C)CC)c1ccc(C)cc1O 280056281 JZNPSADZLLJUJM-ZDUSSCGKSA-N 264.369 2.220 10 20 CECD Cc1cc(C(=O)N2CCCCN2)c(C)n1-c1ccccn1 808096067 DYNLGZNWVQRPBG-UHFFFAOYSA-N 284.363 2.230 10 20 CECD Cc1ccc([C@H](C)NCCN2CCC(O)CC2)c(O)c1C 296078413 XDACFCXNTZZSHA-AWEZNQCLSA-N 292.423 2.116 10 20 CECD C[C@H](NC[C@H]1CCCCN1)c1ccc(F)cc1O 817949366 JWHPXMIDSRLWTH-CMPLNLGQSA-N 252.333 2.324 10 20 CECD COCC[C@@H]1COCCN1Cc1cc(C)cc(C)c1O 812299620 ODASZFGSPKFJOE-OAHLLOKOSA-N 279.380 2.246 10 20 CECD COc1ccc(N2CC[C@H](CNc3cnccn3)C2)cc1 819937081 ZDUBGAKRFTUPSZ-CYBMUJFWSA-N 284.363 2.424 10 20 CECD CCCc1nc(COC(=O)c2ccc(C)c(O)c2O)no1 727003886 FBOLPZLLPLHCED-UHFFFAOYSA-N 292.291 2.099 10 20 CECD C[C@@H](NCCCON)c1cc(Br)ccc1O 902426156 RNUXVTMILKKHEF-MRVPVSSYSA-N 289.173 2.086 10 20 CECD CCC[C@](C)(N)C(=O)NCc1ccc(N(C)C)cc1C 829764727 VLIFOHZOSVAAQF-INIZCTEOSA-N 277.412 2.195 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CC2(F)F)c1 825736552 CFOYGNQAZVBWMB-OIBJUYFYSA-N 271.263 2.233 10 20 CECD C[C@H]1C[C@@H](C)CN(C(=O)COC(=O)c2cc(O)cs2)C1 731910754 BVAAVTRBXRFYDR-AOOOYVTPSA-N 297.376 2.115 10 20 CECD Cc1oc(COC(=O)c2cc(O)cs2)cc1C(=O)O 738984493 VTBOZPTXYOBUPV-UHFFFAOYSA-N 282.273 2.410 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCC(C2CC2)CC1 832639241 FEWFHCGCHLIRKQ-UHFFFAOYSA-N 279.311 2.499 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H]2c2ncccn2)c(O)c1O 912645384 AOLKBNNVMDHYDR-GFCCVEGCSA-N 299.330 2.174 10 20 CECD N[C@@H]1CCC[C@@H]2CN(Cc3cccc(F)c3O)C[C@H]21 843059279 JBZZVXGKYFFZAD-MPKXVKKWSA-N 264.344 2.091 10 20 CECD C[C@@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 846205509 HTCFKGFJSBZDRU-NEPJUHHUSA-N 274.364 2.054 10 20 CECD C[C@H]1C[C@H](CN2CCOc3cc(N(C)C)ccc32)CCN1 841011246 FVJOXHDAFRONSJ-UONOGXRCSA-N 289.423 2.340 10 20 CECD COc1cccc(CNc2ccc(OCCN)cc2)c1O 841053207 NXFZLSOLOFDDQV-UHFFFAOYSA-N 288.347 2.350 10 20 CECD CN(Cc1ccccc1O)C(=O)Cn1cc2ccccc2n1 748027995 VOSVDOGWOCBOHC-UHFFFAOYSA-N 295.342 2.401 10 20 CECD COc1ccc(N(C)Cc2nnn(C(C)(C)C)n2)cc1F 846814657 DXHCQWFSQAKNQM-UHFFFAOYSA-N 293.346 2.212 10 20 CECD CC[C@H]1COC[C@@H]1NCc1ccc(N(C)C)c(F)c1 850383131 LFFJKAIVWFQKNN-JSGCOSHPSA-N 266.360 2.406 10 20 CECD C[C@@H]1C[C@@H](NC[C@@H]2COCCO2)c2c(O)ccc(F)c21 756433586 DLZMJWYGTUMHDW-CKYFFXLPSA-N 281.327 2.085 10 20 CECD C[C@H](NC[C@@](C)(O)C1CC1)c1cc([N+](=O)[O-])ccc1O 756570715 XKIRWBPGQXDQLO-LKFCYVNXSA-N 280.324 2.112 10 20 CECD C[C@H](C[C@@H]1CCOC1)NC(=O)NCc1ccccc1O 759768563 RTWGCCJRUTUXMV-NEPJUHHUSA-N 278.352 2.007 10 20 CECD COC(=O)N1CCC[C@H](N[C@H](C)c2ccc(F)cc2O)C1 756526072 FHFUHPJQTOYGGO-PWSUYJOCSA-N 296.342 2.413 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)O[C@@H]1CCCCC1=O 759588745 OEZSKLSDNUSXED-IQCBXXCUSA-N 276.288 2.166 10 20 CECD C[C@H](N[C@H](C)CCCO)c1cc(F)cc(F)c1O 756648725 YZVBRNKYNGMEKS-BDAKNGLRSA-N 259.296 2.482 10 20 CECD Cc1ccc(O)c(CNC(=O)c2c(C3CC3)cnn2C)c1 862754046 PGBVCFSPMDJDHR-UHFFFAOYSA-N 285.347 2.242 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2ccn(C(C)C)n2)c1 862760859 WROMFTHMXVKYDQ-UHFFFAOYSA-N 287.363 2.337 10 20 CECD O=C1CN(Cc2cc(Cl)ccc2O)CN1CC1CC1 789776461 QALOAYOJIMZYGB-UHFFFAOYSA-N 280.755 2.057 10 20 CECD C[C@H](N[C@H](C)CC(N)=O)c1cccc(C(F)(F)F)c1O 788633876 WOJPMVKAWIVTCW-SFYZADRCSA-N 290.285 2.326 10 20 CECD COc1cc(C)cc(CNC2CCC(C)(O)CC2)c1O 894317901 WWKSHNUAWXECJW-UHFFFAOYSA-N 279.380 2.492 10 20 CECD O=C(NCc1ccccc1O)[C@H]1[C@H]2[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]2[C@@H]53)[C@@H]41 793683789 YIADGTBJDVSAHG-MTTMPXCWSA-N 295.382 2.402 10 20 CECD CC(C)O[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)C1(C)C 790934204 HULBFKDSXQGKJV-STQMWFEESA-N 293.363 2.420 10 20 CECD COc1ccc(CNC(=O)CCc2ccco2)c(O)c1 794388907 BVQCKPAPXCSGBW-UHFFFAOYSA-N 275.304 2.243 10 20 CECD COc1ccc(CN[C@@H]2CCCC[C@H]2C(N)=O)cc1C 757911665 YTZZXKQTYSNGSH-ZIAGYGMSSA-N 276.380 2.137 10 20 CECD CCN(Cc1cc(F)ccc1O)C[C@@H]1CCOC1 778996972 XYDFBYSBKCAIQN-NSHDSACASA-N 253.317 2.390 10 20 CECD CCOC(=O)[C@@H](NCc1ccc(N(C)C)cc1)C1CC1 1321803951 NXLZTNZCTJHUOQ-HNNXBMFYSA-N 276.380 2.184 10 20 CECD Cc1ncsc1CCNC(=O)c1cc(O)cs1 1330818741 GDTOOMLGMVUTAX-UHFFFAOYSA-N 268.363 2.191 10 20 CECD Cc1cc(O)c(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1C 1262056650 VZWLNDWITWZOAO-NOLJZWGESA-N 261.365 2.354 10 20 CECD CC(C)Nc1ncccc1C(=O)NCc1ccc(N)cc1 1342699307 KMFZMVCQZMGUJE-UHFFFAOYSA-N 284.363 2.414 10 20 CECD CN(Cc1ccc(C(N)=O)cc1)Cc1cc(F)ccc1O 1347212462 QTICKFQIMCJZSU-UHFFFAOYSA-N 288.322 2.262 10 20 CECD O=C(O)[C@@]1(F)CCN(Cc2cc(Cl)cc(F)c2O)C1 1601716813 ISMQXDYYHVMLHU-GFCCVEGCSA-N 291.681 2.183 10 20 CECD COc1cc(CN(C)C[C@H]2CCOC2)c(O)cc1C 160363511 RBZGNIDGPNYQAV-GFCCVEGCSA-N 265.353 2.178 10 20 CECD Cc1cnn([C@H]2CCCN(C(=O)Cc3ccc(N)cc3)C2)c1 168350744 YMAFUHYIOLPIMJ-INIZCTEOSA-N 298.390 2.180 10 20 CECD C[C@@H](NCc1cccc(Cl)c1O)[C@@H](O)C(F)(F)F 877693645 MRBRHINHQSCMRF-LHLIQPBNSA-N 283.677 2.447 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H]2CCCOC2)c(O)c1 389071619 MINGBMOHPYURNX-WCQYABFASA-N 265.353 2.306 10 20 CECD OCC[C@H](N[C@@H]1CCc2cccc(O)c21)C(F)(F)F 886802871 AKPQQEQVCVQNKK-KOLCDFICSA-N 275.270 2.282 10 20 CECD CC(C)(CN1CCOCC1)NCc1cc(Cl)ccc1O 308637672 ALRDOFLMXUYKRC-UHFFFAOYSA-N 298.814 2.246 10 20 CECD COc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3C)CC2)cc1 55877682 WHCQHPCQDNNITR-BBRMVZONSA-N 288.391 2.390 10 20 CECD CCCN(Cc1cc(=O)c(O)co1)Cc1ccccc1O 112661613 MOCRRODCIUINDP-UHFFFAOYSA-N 289.331 2.463 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1ccncc1 115780480 KWPYFIXSPMSNEF-UHFFFAOYSA-N 298.390 2.455 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cn[nH]c(=O)c1Cl 301273027 IDONBCVLMWNSEV-UHFFFAOYSA-N 292.770 2.410 10 20 CECD COc1ccc(C(=O)NCc2cccc(OC)c2O)cc1 68488710 INOKNTVZWSVHLF-UHFFFAOYSA-N 287.315 2.339 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 126796786 XRVWDFNPFVPVKY-VHSXEESVSA-N 254.761 2.215 10 20 CECD CCc1nnc(CN[C@H](C)c2cc(OC)ccc2O)o1 182315372 OQSVLNGUARYXKH-SECBINFHSA-N 277.324 2.197 10 20 CECD CN1CCCc2cc(CNC(=O)c3coc(CN)c3)ccc21 188136399 ZZCAJSRFGYMKTE-UHFFFAOYSA-N 299.374 2.051 10 20 CECD Cn1cccc1C(=O)NCCCSc1nccs1 74136582 VUVNFAQXHJXDFD-UHFFFAOYSA-N 281.406 2.394 10 20 CECD COCCN(C)Cc1cccc(Br)c1O 132705959 NDVGZVCWPMSLMO-UHFFFAOYSA-N 274.158 2.233 10 20 CECD Cc1cnc(CNC(=O)N(C)Cc2ccccc2O)s1 80477527 WEGNHXKVPKNCOX-UHFFFAOYSA-N 291.376 2.499 10 20 CECD CN(C)c1ccc(CNC(=O)CNc2ccccc2)cc1 40419261 ANXOOHAKWKQWSU-UHFFFAOYSA-N 283.375 2.481 10 20 CECD CC(C)[C@@H](C)C(=O)NCCc1ccc(O)c(O)c1 179088460 LZNQZBOCJFIKTM-SNVBAGLBSA-N 251.326 2.049 10 20 CECD Oc1ccc(F)cc1CN1CC[C@H](N2CCCC2)C1 180025197 MDTSUWOOCGVGJG-AWEZNQCLSA-N 264.344 2.201 10 20 CECD CN1CCCc2cc(CNC(=O)Cc3cccnc3)ccc21 264705239 RGPZKGOMWBKOBH-UHFFFAOYSA-N 295.386 2.323 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@H](C)CCC[C@@H]2CO)c1O 272697741 VPHMXEKKOIMKPZ-QMTHXVAHSA-N 295.354 2.469 10 20 CECD CCOc1ccc(O)c(CN(C)C[C@H](C)OC)c1 289623755 LRJKHHWRWUKXRU-NSHDSACASA-N 253.342 2.258 10 20 CECD COc1ccc(O)c(CN[C@@]2(C)CCO[C@@H]2C2CC2)c1 273175720 NHPSVCBYGHDANU-CVEARBPZSA-N 277.364 2.448 10 20 CECD CC[C@H](NC[C@@]1(O)CCO[C@H]1C)c1ccc(N(C)C)cc1 278890242 TXZCBNJFWJLRSZ-JQFCIGGWSA-N 292.423 2.333 10 20 CECD COCC[C@H](CO)NCc1ccc(N2CCCCC2)cc1 282247675 OKLQFTPDXCROBP-MRXNPFEDSA-N 292.423 2.164 10 20 CECD CC[C@@H](NC[C@](C)(O)COC)c1cccc(Cl)c1O 806140723 ZOSPYCBZKMWRLU-OCCSQVGLSA-N 287.787 2.484 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C[C@H](O)c1cccnc1 294994166 QSSLEUPYYNTCIZ-INIZCTEOSA-N 299.374 2.080 10 20 CECD C[C@H](CCCCO)NCc1ccc(N2CCOCC2)cc1 398399333 ALEZIBXTNFCETN-OAHLLOKOSA-N 292.423 2.164 10 20 CECD COc1cccc(CNc2cccc3c2CNC3=O)c1O 808420270 WEIQFMZOEPTTHY-UHFFFAOYSA-N 284.315 2.256 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](CCO)CC1 817418972 MURNBSJGNDMAEH-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD Cc1cc(CN2CCC(OCCO)CC2)ccc1N(C)C 815075967 QKTGXDABLFLMMC-UHFFFAOYSA-N 292.423 2.034 10 20 CECD COC(=O)[C@@H]1[C@H]2CN(Cc3ccc4ccccc4c3O)C[C@H]21 816617456 ZSPQBWVNAIPYPC-ZSHCYNCHSA-N 297.354 2.396 10 20 CECD Cc1cc(O)c(CNCCOC[C@@H]2CCOC2)cc1Cl 825214563 HWYBKAONMLQDOV-GFCCVEGCSA-N 299.798 2.497 10 20 CECD Cc1cc(O)c(CN[C@H](CO)CC(F)F)cc1Cl 825697841 KNEXOCVUPPRURM-VIFPVBQESA-N 279.714 2.460 10 20 CECD CCC[C@@](C)(O)C(=O)N[C@H](C)c1ccccc1O 827940570 GCPVCPYXNAPNGT-QMTHXVAHSA-N 251.326 2.121 10 20 CECD C[C@@H](NC(=O)[C@@]1(C(=O)O)CC1(C)C)c1ccccc1O 902516198 BZZFDPYLIWYBBQ-RFAUZJTJSA-N 277.320 2.070 10 20 CECD COC1([C@H](C)NC(=O)c2cc(O)cs2)CCC1 839875365 KVFQPMCPYZAPNN-QMMMGPOBSA-N 255.339 2.141 10 20 CECD C[C@]1(CNCc2ccc3ccccc3c2O)CCC(=O)N1 835061373 RXFKOQPYRRNGGC-QGZVFWFLSA-N 284.359 2.304 10 20 CECD Cc1cc(O)c(CNC[C@]2(C)CCCNC2)cc1C 841057384 MEJJCZXKAHCMED-MRXNPFEDSA-N 262.397 2.488 10 20 CECD C[C@H](CNC(=O)NCc1ccccc1O)N1CCCCC1 748460323 NYNCATRWJNDKAM-CYBMUJFWSA-N 291.395 2.066 10 20 CECD O=C(COC(=O)c1ccccc1)c1ccc(O)c(O)c1 916617643 REPNEDGWQJGTLD-UHFFFAOYSA-N 272.256 2.138 10 20 CECD CCOc1ccc([C@H]2NC3(CCCC3)C(=O)N2C)c(O)c1 742441888 LYVZUJDHXIFHOL-AWEZNQCLSA-N 290.363 2.164 10 20 CECD CN[C@H]1CCCN(Cc2ccc(N(C)C)cc2C)C1 843048711 SCICYKBCCSHVCK-HNNXBMFYSA-N 261.413 2.245 10 20 CECD CN(C)c1ccc(CNC[C@]2(C)CCCNC2)cc1 841058335 VTWGBWQZFKMPAP-MRXNPFEDSA-N 261.413 2.232 10 20 CECD C[C@@H]1COC[C@@H]1NCc1ccc(N(C)C)c(F)c1 922641313 KIFDXQZPJYHHBO-MFKMUULPSA-N 252.333 2.016 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)CO[C@H]1CCOC1 840936802 GOZKOPSYGHIFQM-YOEHRIQHSA-N 292.423 2.345 10 20 CECD CC[C@H](CO)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756344285 SXLLIYFCAQYRFV-IQJOONFLSA-N 253.317 2.440 10 20 CECD CN1CC[C@]2(CCCN(C(=O)c3cc(O)cs3)C2)C1 854735513 RDCRQOBALKWYKK-CQSZACIVSA-N 280.393 2.012 10 20 CECD CC(C)(C)N1CC[C@@H](CNC(=O)Cc2ccc(N)cc2)C1 852838552 JWXAAGYRAFEZIP-AWEZNQCLSA-N 289.423 2.048 10 20 CECD COCc1nc(C(=O)NCc2cc(C)ccc2O)cs1 862759108 WGIFVKQHFZTSSP-UHFFFAOYSA-N 292.360 2.234 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](C)OCC2CC2)c1 862758579 DIVURLBRAISMEW-NSHDSACASA-N 263.337 2.132 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@](C)(O)CC)cc1F 932386646 UAYGZMATEUDSFR-MRXNPFEDSA-N 296.386 2.449 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1cc(C)no1 935945725 IMPMFYNTTKTAQB-UHFFFAOYSA-N 295.335 2.033 10 20 CECD c1csc(CCNCc2ccc3c(c2)CCO3)n1 60229699 IGTRKKVZODDYKZ-UHFFFAOYSA-N 260.362 2.410 10 20 CECD C[C@@H](NC(=O)NCc1cccnn1)c1ccc(N(C)C)cc1 767860887 NOUKEVHEWAKUPV-GFCCVEGCSA-N 299.378 2.103 10 20 CECD CCCOc1ccc(CNC[C@@]2(O)CCO[C@H]2C)cc1C 873116449 FTXJFEQLRZMUBR-YOEHRIQHSA-N 293.407 2.413 10 20 CECD CCc1nc(CNC(=O)NCc2cc(C)ccc2O)co1 875644889 JVIMAATYWUSLIR-UHFFFAOYSA-N 289.335 2.250 10 20 CECD C[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)n1cccc1 1116645831 PXRGDWXRNGFISS-NEPJUHHUSA-N 288.347 2.208 10 20 CECD CCN(CC)Cc1cn(Cc2ccc(N(C)C)cc2)nn1 881272014 JACFYFGLDCYNQX-UHFFFAOYSA-N 287.411 2.234 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cccc(Cl)c2O)[C@@H]1C 787420070 CULAUCYRRYZRPP-MWLCHTKSSA-N 283.755 2.429 10 20 CECD CC(=O)CSCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 784894054 QQTPLACQAMGULQ-LBPRGKRZSA-N 294.420 2.252 10 20 CECD C[C@H]1C[C@@H](CO)CN(Cc2cc(F)cc(F)c2O)C1 895032769 ALAHIVSCZSCDDA-VHSXEESVSA-N 271.307 2.121 10 20 CECD COc1ccc(O)c(CNCc2cc(C3CC3)n(C)n2)c1 897231377 DIJPLTHALSSUNU-UHFFFAOYSA-N 287.363 2.302 10 20 CECD CCC[C@@H](CCO)CNCc1ccc(OC)c(OC)c1O 893073437 KZQBIGMJENLURO-LBPRGKRZSA-N 297.395 2.298 10 20 CECD Cc1ccc(O)c(CNC(=O)NC/C=C/Cl)c1 899036409 YRPULYILWMPESA-GORDUTHDSA-N 254.717 2.252 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNc2cncc(F)c2)c1 798430242 IQGFOMNEUSJZOK-UHFFFAOYSA-N 263.228 2.447 10 20 CECD Nc1ccc(CNC(=O)N[C@@H](C2CC2)C(F)(F)F)cc1 1335723645 AUOCRKUBLKIBLB-NSHDSACASA-N 287.285 2.409 10 20 CECD NCCN(Cc1ccccc1)Cc1cc(F)ccc1O 220356674 ZUMWTOFKDZDQGU-UHFFFAOYSA-N 274.339 2.492 10 20 CECD O=C(O)CCCCCCNC(=O)c1c(F)ccc(O)c1O 1608711281 SKKKXXLALBWCBS-UHFFFAOYSA-N 299.298 2.002 10 20 CECD Cc1cc(N(C)C(=O)/C=C\[C@H]2CCCNC2)ccc1O 1579617049 KKQAYECCFVASOF-DMTLFAOVSA-N 274.364 2.219 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)C1CCNCC1 1579485893 WXPGNLNQVMKWLW-VIFPVBQESA-N 270.323 2.148 10 20 CECD C[C@H](NC[C@@H]1CCCN(C)C1)c1cc(C(=O)O)ccc1O 1593257153 LWSWVLMGOGGYLH-RYUDHWBXSA-N 292.379 2.083 10 20 CECD CCC[C@H](O)CCN[C@H](C)c1cc(C(=O)O)ccc1O 1595607521 LPEYXKRXACFNTJ-PWSUYJOCSA-N 281.352 2.292 10 20 CECD CC[C@@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@@H](C)O1 247514070 KAVPXYZNWDPPPX-ZYHUDNBSSA-N 279.336 2.120 10 20 CECD C[C@@H]1C[C@H]1[C@@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 1776602322 FGQFOSLCPBNXTP-NQYJQULFSA-N 287.718 2.384 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](N)C(C)C)cc1F 167742372 PXVSETRGMDFFGZ-HNNXBMFYSA-N 295.402 2.271 10 20 CECD C[C@@H](NCc1cc(Cl)ccc1O)[C@H](O)C(F)(F)F 865711811 RBBUYFJXUDIPQW-LDWIPMOCSA-N 283.677 2.447 10 20 CECD C[C@H](CC(N)=O)NCc1ccc(N2CCCCC2)cc1 135725295 KPKUKWMGZHLXAN-CYBMUJFWSA-N 275.396 2.030 10 20 CECD COc1ccncc1CNCc1ccc2c(c1)CCO2 292665465 LWAVKKODYFHBES-UHFFFAOYSA-N 270.332 2.315 10 20 CECD C[C@H](CCCCO)NCc1cc(F)cc(F)c1O 708481771 UMSQHWJDVCXHBJ-SECBINFHSA-N 259.296 2.311 10 20 CECD CCc1cccc(CNCCCCN(C)C)c1O 691485430 ZVAUQBUYTFYCGC-UHFFFAOYSA-N 250.386 2.386 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc[nH]2)cc1F 58972647 MMBXQTCRUZJVDD-UHFFFAOYSA-N 261.300 2.150 10 20 CECD CN(Cc1ccccc1O)C(=O)CC1CCOCC1 117412692 LVYFEMJKAAWLPB-UHFFFAOYSA-N 263.337 2.167 10 20 CECD CCCN(CC(=O)OC)Cc1cc(C)cc(C)c1O 178859990 ZVEKOIBSRUPYIS-UHFFFAOYSA-N 265.353 2.394 10 20 CECD C[C@]1(CNC(=O)c2cccc(O)c2O)CCCS1 126491842 XGCHQXWFLQDZME-CYBMUJFWSA-N 267.350 2.113 10 20 CECD COc1ccc(O)c(CN(C)C[C@H]2CCCC[C@H]2O)c1 305845606 SMFKHSYVTNXCFY-IUODEOHRSA-N 279.380 2.384 10 20 CECD C[C@]1(O)CCN(Cc2cc(Br)ccc2O)C1 180183244 CXUNEILEADBXNA-LBPRGKRZSA-N 286.169 2.111 10 20 CECD CC(C)N(CCO)Cc1cccc(Br)c1O 128049948 LKQMTHUAVNCQCX-UHFFFAOYSA-N 288.185 2.357 10 20 CECD COC(=O)CN(Cc1cc(Cl)ccc1O)CC1CC1 127026631 XUOCNEMYVTXBDY-UHFFFAOYSA-N 283.755 2.431 10 20 CECD CN(CCNC(=O)Cc1ccc(N)cc1)Cc1ccccc1 263290354 WGABPNKCEZYBBH-UHFFFAOYSA-N 297.402 2.060 10 20 CECD CCCS(=O)(=O)NCc1ccc(N2CCCC2)cc1 48955824 JTLXOSHZIBMDLB-UHFFFAOYSA-N 282.409 2.116 10 20 CECD CC(C)Oc1ccc(N(C)CC(=O)N2CCC2)cc1 277251035 QGJSNRXQJBSBIX-UHFFFAOYSA-N 262.353 2.142 10 20 CECD C[C@H](O)C[C@H](C)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273613427 WTZUMCJHJASDRT-GARJFASQSA-N 282.340 2.358 10 20 CECD COC(=O)[C@H]1C[C@@H](C)CCN1Cc1cc(C)ccc1O 274896521 GAQCAXXALIPWGW-GXTWGEPZSA-N 277.364 2.474 10 20 CECD CCOCCOCCN(C)Cc1cccc(OCC)c1O 276155363 GWIHGVKHCGCZOI-UHFFFAOYSA-N 297.395 2.276 10 20 CECD COc1cc(O)c(CNC[C@H]2CCOC[C@@H]2C)cc1OC 289236822 DJZGRXNPDOVMEI-NWDGAFQWSA-N 295.379 2.172 10 20 CECD CC[C@@H](NCC1(O)CCN(C)CC1)c1ccc(C)cc1O 280251889 WRZAARAPKMJSPD-OAHLLOKOSA-N 292.423 2.198 10 20 CECD COC(=O)c1cnc(S[C@H](C)c2noc(C)n2)s1 295164505 HJGMUBRETPDOQM-RXMQYKEDSA-N 285.350 2.474 10 20 CECD Cc1cc(NC(=O)c2cccc(O)c2O)nn1C(C)C 817702260 PJXCJSYXPCJEAO-UHFFFAOYSA-N 275.308 2.436 10 20 CECD C[C@H](NC1CNC1)c1cc(Cl)c(Cl)cc1O 817956139 RPLNHDNGTUDUEV-LURJTMIESA-N 261.152 2.321 10 20 CECD O=C1CC[C@H]2CN(Cc3ccc4ccccc4c3O)CCN12 816499607 VLFWOEUZQGZOKM-HNNXBMFYSA-N 296.370 2.352 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CNC[C@@H]3C2)cc1Cl 824948766 GZDDCABDAKFLHE-TXEJJXNPSA-N 266.772 2.005 10 20 CECD Cc1noc(Cl)c1CC(=O)NCc1ccccc1O 725895516 ISKYAUMCVLPBMH-UHFFFAOYSA-N 280.711 2.201 10 20 CECD Cc1cc(O)c(CN2CCOC[C@@]23CCOC3)cc1Cl 825773525 JEEGXSQMSFBNHD-HNNXBMFYSA-N 297.782 2.345 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](CCN)C1 904407733 ZXLVJDRNOOYBED-CQSZACIVSA-N 261.413 2.232 10 20 CECD CC(C)(C)c1n[nH]c(CNCc2cc(F)ccc2O)n1 839170744 PPTNOZAPYURZLW-UHFFFAOYSA-N 278.331 2.237 10 20 CECD CN(C)c1ccc(OCc2noc3c2COCC3)cc1 902733603 KSEUSTIIYAZVFI-UHFFFAOYSA-N 274.320 2.392 10 20 CECD CCOc1cccc(CNCCC(C)(C)N)c1O 903938884 OMVBBAQPJOLRGX-UHFFFAOYSA-N 252.358 2.008 10 20 CECD O=C(NCc1ccccc1O)C(=O)c1ccc2c(c1)CCC2 748569481 UIWLWXFWCROEDV-UHFFFAOYSA-N 295.338 2.380 10 20 CECD CC[C@H](C)C[C@@H](C)NC(=O)C(=O)Nc1ccc(N)cc1 841049570 LHIYKLBIIZTRIN-WDEREUQCSA-N 277.368 2.148 10 20 CECD CCN(C[C@@H](O)C(F)(F)F)C(=O)Nc1ccc(N)cc1 841296191 QGOAVTRPNMYJBS-SNVBAGLBSA-N 291.273 2.046 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNCCCNC2CC2)c1O 841091596 BLNHCPJMAIVKHY-UHFFFAOYSA-N 299.758 2.186 10 20 CECD NC[C@@H]1CC[C@H](NCc2c(O)ccc(Cl)c2F)C1 841085221 XBVLPBPKDYZOFL-BDAKNGLRSA-N 272.751 2.402 10 20 CECD CCOc1ccc(CN[C@@H]2CC[C@@H](CN)C2)c(O)c1 841084465 JXFYBLWTAHDUGH-DGCLKSJQSA-N 264.369 2.008 10 20 CECD CCCOc1ccc(CN2CCOC[C@H]2C)c(O)c1 132180037 QVCQWBLMXPLVLK-GFCCVEGCSA-N 265.353 2.402 10 20 CECD CCOCc1cc(CN[C@@H](C)C[C@@H](C)N)ccc1OC 843129882 SRPOCXLNAKUPHH-OLZOCXBDSA-N 280.412 2.447 10 20 CECD CC[C@@H]1CN(C)CCN1Cc1cc(C)cc(OC)c1O 840092620 CIUUODDZPMLHJP-CQSZACIVSA-N 278.396 2.235 10 20 CECD O=C1CC[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 843766729 QAFLQIUGKFXLLK-AWEZNQCLSA-N 286.375 2.272 10 20 CECD CC[C@@H](C[C@H](C)CO)NCc1cc([N+](=O)[O-])ccc1O 743500350 XZRLHXGUFNIEQD-JQWIXIFHSA-N 282.340 2.187 10 20 CECD O=C(O)c1cccc(C(=O)NCc2ccccc2O)c1 821549856 UUEZDJCYFHORTQ-UHFFFAOYSA-N 271.272 2.020 10 20 CECD O=C(Cc1ccc(F)cn1)NCc1cc(Cl)ccc1O 857548889 ZCWLCJXHXRSASK-UHFFFAOYSA-N 294.713 2.439 10 20 CECD COC[C@H](CCO)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756595696 YCRGDGJLMNGJND-NHCYSSNCSA-N 283.343 2.067 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2C[C@H]2C)cc1 754150439 RVTJYGZMRAUFHD-VXGBXAGGSA-N 263.337 2.331 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)[C@H]2CN(C)CCO2)c(O)c1C 756757865 FWCCERPFHNHHBV-OFQRWUPVSA-N 292.423 2.379 10 20 CECD C[C@H](N[C@H]1CC[C@H](O)CC1)c1cc([N+](=O)[O-])ccc1O 756769535 FVFVDAZEIDEJMG-NHCYSSNCSA-N 280.324 2.255 10 20 CECD Cc1ccc(O)c(CNC(=O)CCc2c(C)n[nH]c2C)c1 862757817 FJBRDULBVUBGFW-UHFFFAOYSA-N 287.363 2.290 10 20 CECD C[C@@H](NC(=O)CCCCO)c1ccc(N(C)C)cc1 867503416 KLRXABNZMARKOL-GFCCVEGCSA-N 264.369 2.092 10 20 CECD Cc1nn(CCO)c(C)c1CN[C@H](C)c1ccccc1O 1119303608 DXIUAMSYQWJNDA-LLVKDONJSA-N 289.379 2.049 10 20 CECD CCN(C)c1ccc(CN2CCCC[C@@H]2CO)cc1 773730216 MAFOBDZAHXWYOY-MRXNPFEDSA-N 262.397 2.490 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1c(C)cccc1O 877550151 UJVBXESKBLKNAP-CYBMUJFWSA-N 278.396 2.343 10 20 CECD CC[C@@H](C)[C@@](C)(O)CNCc1cc(F)ccc1O 779078611 SVECVRIDTXGOKN-YGRLFVJLSA-N 255.333 2.418 10 20 CECD CCN(C)c1ccc(CN[C@@H](CCO)C2CC2)cc1 773834978 CVAZPBXFAZGAPS-INIZCTEOSA-N 262.397 2.393 10 20 CECD CCc1cnccc1CNC(=O)/C=C\c1ccc(O)c(O)c1 779546604 PLVUJAOBSMIMAE-XQRVVYSFSA-N 298.342 2.385 10 20 CECD COC(=O)N1CCC[C@H](N[C@H](C)c2c(O)cccc2F)C1 886521110 UQVZLBVKTJCFAD-MNOVXSKESA-N 296.342 2.413 10 20 CECD Cc1nnsc1CN1CCCc2cc(CN)ccc21 700850687 MAPXOHSHKYTBTF-UHFFFAOYSA-N 274.393 2.258 10 20 CECD C[C@H]1CN(Cc2c(O)ccc(Cl)c2F)CC[C@@H]1O 792181283 ZSBVEHBTXQHOGB-KWQFWETISA-N 273.735 2.387 10 20 CECD O=C(O)[C@H]1CCCCCN1Cc1cc(F)cc(F)c1O 708091714 XFYSTSYTBNNERO-GFCCVEGCSA-N 285.290 2.500 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](N2CCCC2)C1 769229854 TVVRLRZAHJLJNP-CYBMUJFWSA-N 276.380 2.071 10 20 CECD Cc1cc(NCc2ccc3c(c2)CCCN3C)nc(CO)n1 1322685192 RTSDWPZMXHYTHA-UHFFFAOYSA-N 298.390 2.272 10 20 CECD Cc1ccnc(NC(=O)CN(C)Cc2ccc(N)cc2)c1 1334774601 LUYLPZTWDCHQIB-UHFFFAOYSA-N 284.363 2.043 10 20 CECD O=C(NC1(c2ncon2)CCCC1)c1cc(O)cs1 1347891080 FJJUMCGCPZEBHD-UHFFFAOYSA-N 279.321 2.036 10 20 CECD COc1cccc(O)c1CNC[C@H](CC(C)C)C(=O)O 1607326454 GXHZZZJLXQJICJ-NSHDSACASA-N 281.352 2.237 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CCC[C@H]2C(=O)O)cc1F 1606049920 FVHIHAGKJMTTAZ-MFKMUULPSA-N 298.333 2.374 10 20 CECD CCO[C@H]1C[C@H](N[C@@H](C)c2cc(C(=O)O)ccc2O)C1 1605653771 KCAFHTUDJJHGPO-DLOVCJGASA-N 279.336 2.309 10 20 CECD CC(C)c1nnsc1C(=O)NCc1ccccc1O 228425030 ITLPLIIUEFSJMD-UHFFFAOYSA-N 277.349 2.297 10 20 CECD CN(Cc1cscn1)c1ccc(OCC(=O)O)cc1 1777080636 FJNJTJNNTFWHKZ-UHFFFAOYSA-N 278.333 2.243 10 20 CECD COc1ccc(O)c(CN[C@@H](C)CC(C)(C)O)c1 295138052 ZBSIGHAPTSRBBK-JTQLQIEISA-N 253.342 2.040 10 20 CECD CCOc1cccc(CN2CCCC[C@H]2[C@@H](C)N)c1O 63191253 SUUMTMRUSUTGDK-OCCSQVGLSA-N 278.396 2.493 10 20 CECD COc1ccc(O)c([C@H](C)NCCc2cnccn2)c1 390228932 RJKLRZGVCHDXJJ-NSHDSACASA-N 273.336 2.084 10 20 CECD C[C@@H](NCCO)c1cc(Br)cc(Cl)c1O 134911153 VFPRFTVLSLWCJS-ZCFIWIBFSA-N 294.576 2.451 10 20 CECD Cc1ccc(CNC(=O)Cc2ccc(N)cc2)cc1 20185655 JHDOFPJFKSCVBO-UHFFFAOYSA-N 254.333 2.436 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCC(F)(F)C1 302196499 KEECNSFQDARYAJ-SECBINFHSA-N 255.264 2.444 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCc1cccnc1 122853670 AGHQKJWGMPPQJH-UHFFFAOYSA-N 285.347 2.171 10 20 CECD COc1ccc(N(C)CCN2CCCC2=O)cc1Cl 121909835 ZLUKUVZFFDLUTB-UHFFFAOYSA-N 282.771 2.407 10 20 CECD CC[C@H](N[C@@H](C)C[S@](C)=O)c1ccccc1O 183862854 AKEGKOYMPMGIPQ-ZMNCSTGQSA-N 255.383 2.200 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCCCO1 186423317 QMACMSRWQIDCDS-AAEUAGOBSA-N 293.363 2.104 10 20 CECD Cc1cc(C(=O)NCCCSc2nccs2)no1 74136344 LGFBVDVYUZTWLO-UHFFFAOYSA-N 283.378 2.352 10 20 CECD N[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1c1ccccc1 313905923 QEYLAIWCTNGNPN-JKSUJKDBSA-N 286.350 2.458 10 20 CECD CC[C@@H](OC)C(=O)NCc1ccc(N2CCCC2)cc1 49422627 VNWPZQZYNGSTMX-OAHLLOKOSA-N 276.380 2.328 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CC[C@H](C)N 193227083 JAIOQAPJCIVODI-LBPRGKRZSA-N 264.369 2.258 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](N(C)C)C2)cc1 92938207 GPFQEWMIPGUVPV-MRXNPFEDSA-N 261.413 2.279 10 20 CECD Cc1cc(C(=O)N2CCC[C@H]2CN)c(C)n1-c1ccccn1 237696900 YFRHKANGLRWWKY-AWEZNQCLSA-N 298.390 2.052 10 20 CECD COc1cccc(CNC(=O)[C@H]2[C@@H](C3CC3)[C@H]2C)c1O 528858158 AAKBZMQCIQZABH-OWYVNGRQSA-N 275.348 2.309 10 20 CECD COC[C@@H](O)CNCc1cc(-c2ccccc2)ccc1O 265447127 VYIBMNSXAMCBMK-INIZCTEOSA-N 287.359 2.156 10 20 CECD C/C=C/C[C@H](CO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 274598156 GYFXVDHRRRDGQZ-MJKAUQOVSA-N 280.324 2.278 10 20 CECD CC[C@@H]1CN(Cc2ccccc2O)C[C@@H](C)[S@@]1=O 289586367 KFAVSSOQVPJPMO-BVRBVLIYSA-N 267.394 2.124 10 20 CECD C[C@H](NCCC1(O)CCC1)c1cc([N+](=O)[O-])ccc1O 284193561 BEQLPBRQLMVTHT-JTQLQIEISA-N 280.324 2.256 10 20 CECD CC[C@@H](NCCCNC(C)=O)c1ccc(C)cc1O 280079074 LPSFSRZLUVGSPB-CQSZACIVSA-N 264.369 2.268 10 20 CECD Cc1cc(O)c(CN(C)[C@@H](CO)COC(C)C)cc1C 809768334 IFTPHYDDRXCFQP-HNNXBMFYSA-N 281.396 2.227 10 20 CECD CCc1csc(CC(=O)NCc2ccccc2O)n1 801172989 IMHFITFGGVMBSQ-UHFFFAOYSA-N 276.361 2.270 10 20 CECD CC[C@H](NCc1cnnn1C)c1cc(Cl)ccc1O 806660112 QMUHEJVMKZFUPQ-LBPRGKRZSA-N 280.759 2.415 10 20 CECD COC(=O)C(C)(C)N(C)Cc1ccc(N(C)C)c(C)c1 815070481 REMCMVQVXBWOBQ-UHFFFAOYSA-N 278.396 2.444 10 20 CECD CCNC(=O)[C@@H](NCc1cc(Cl)ccc1O)C(C)C 815145385 SLBPTXLVESIJAP-ZDUSSCGKSA-N 284.787 2.296 10 20 CECD COCCCN(CCO)Cc1ccc2ccccc2c1O 816586246 DLYKZNCBKCSWIC-UHFFFAOYSA-N 289.375 2.376 10 20 CECD CCNCCCN[C@@H](C)c1cc(OC)ccc1O 817942617 BJIKYUMUDXITRE-NSHDSACASA-N 252.358 2.051 10 20 CECD COC[C@@H]1CCCCN(C(=O)c2c(F)ccc(O)c2O)C1 828689020 YZRUFCVVFWYASF-SNVBAGLBSA-N 297.326 2.126 10 20 CECD CCCCC[C@@H](NC(=O)c1cc(O)cs1)C(=O)O 829326053 BVSRFDCQKNQXCI-SECBINFHSA-N 271.338 2.217 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1cn(C2CC2)nn1 906289971 NRFLNVWENLGXHU-UHFFFAOYSA-N 299.378 2.078 10 20 CECD C[C@H](CNC(=O)c1cc(O)cs1)CN1CCCCC1 731870623 LAOBVFBADVRWIR-LLVKDONJSA-N 282.409 2.306 10 20 CECD CC(C)C1(O)CN(Cc2cc(Cl)ccc2O)C1 839132782 LPCGWPIVVYMYLE-UHFFFAOYSA-N 255.745 2.248 10 20 CECD CC[C@](C)(CNC(=O)NCc1cccc(OC)c1O)OC 838661869 TXFWDBOKPZGYDZ-OAHLLOKOSA-N 296.367 2.015 10 20 CECD COC[C@@H](Cc1ccccc1)NC(=O)Cc1ccc(N)cc1 830993763 CMGAKDRZTLVOBM-QGZVFWFLSA-N 298.386 2.185 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@H](C)C(=O)O 901447877 JWLAIBZGHPSNFA-UWVGGRQHSA-N 268.332 2.091 10 20 CECD C[C@@H]1CCCC[C@H]1NC(=O)COC(=O)c1cc(O)cs1 731911234 GZZSQKBRZWZCGU-MWLCHTKSSA-N 297.376 2.305 10 20 CECD CC[C@H](NCc1nnn(C(C)(C)C)n1)c1ccccc1O 846845463 WNRWKLFMNKNPJB-LBPRGKRZSA-N 289.383 2.375 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)C(=O)NC(C)(C)C 840931226 VFXCNRQKEHITFY-CYBMUJFWSA-N 291.439 2.454 10 20 CECD COCCC1(NC(=O)NCCc2ccc(N)cc2)CCC1 841959442 OHEVFJFBMXYNPT-UHFFFAOYSA-N 291.395 2.070 10 20 CECD CCn1nc(C)c(CN(C)c2ccc(OC)cc2)n1 844354280 AAJWXMFVGHZZEB-UHFFFAOYSA-N 260.341 2.251 10 20 CECD CO[C@H](CNC(=O)c1ccc(C)c(O)c1O)C1CCCC1 856154184 HUCFUXUECCWCBJ-CYBMUJFWSA-N 293.363 2.341 10 20 CECD COC[C@@H](C)CC(=O)N[C@H](C)c1ccccc1O 827937472 XTOFRBBCBQVHRU-WDEREUQCSA-N 251.326 2.242 10 20 CECD CCN(Cc1cc(OC)ccc1O)C[C@@H]1CCCO1 132662831 CAIIBJQIZMDLKO-AWEZNQCLSA-N 265.353 2.402 10 20 CECD C[C@@H](NC(=S)NCC1CC1)c1ccccc1O 865269637 UTZZGBYNOMOJKI-SECBINFHSA-N 250.367 2.327 10 20 CECD Cc1cnc(CC(=O)N(C)Cc2ccccc2O)s1 765492738 PUVOUAOUTKLHAZ-UHFFFAOYSA-N 276.361 2.358 10 20 CECD C[C@H](C[C@H]1CCOC1)NC(=O)N(C)Cc1ccccc1O 760192791 ISJQSFZOTDLTGG-CHWSQXEVSA-N 292.379 2.349 10 20 CECD C[C@@H](NC[C@H]1C[C@H](N)C1)c1cc(F)cc(F)c1O 873256845 PCNGKUVGLHUOET-NQMVMOMDSA-N 256.296 2.058 10 20 CECD C[C@H](NC[C@H]1C[C@H](N)C1)c1cc(F)cc(F)c1O 873256847 PCNGKUVGLHUOET-NRPADANISA-N 256.296 2.058 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccc2c(c1)COC2 778927637 RLTJTAOGNRXAFS-UHFFFAOYSA-N 285.299 2.058 10 20 CECD Cc1cc(Cn2cc(CO)nn2)ccc1N1CCCCC1 881378345 AFHFZDWNLWGNGG-UHFFFAOYSA-N 286.379 2.117 10 20 CECD C[C@H](N[C@H](C)CO[C@@H]1CCOC1)c1c(O)cccc1F 886538914 PUJCNDSIRQVFAT-GRYCIOLGSA-N 283.343 2.376 10 20 CECD C[C@@H]1C[C@H](O)CN1Cc1cc(Cl)cc(F)c1O 788270794 RURAHZQUSDUWCY-XCBNKYQSSA-N 259.708 2.140 10 20 CECD COC[C@@H](NCc1cc(C)c(C)cc1O)[C@@H]1CCCO1 788534686 IEMHULIANNNXDB-ZBFHGGJFSA-N 279.380 2.293 10 20 CECD OC[C@H]1Cc2ccccc2N1Cc1ccccc1O 895244724 MQJVOTWTBTZHLD-CQSZACIVSA-N 255.317 2.316 10 20 CECD CC[C@@H](NCc1ccc(Br)cc1O)[C@@H](C)O 691486631 AYITYVZVHNWVKC-LDYMZIIASA-N 288.185 2.404 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)S(=O)[C@@H](C)C2)cc1C 792193219 UDMHSLZFUCPRHY-STQMWFEESA-N 281.421 2.350 10 20 CECD COc1ccc(CN[C@H]2CCCC23OCCO3)cc1C 715600454 XSOVCCKDUVVFLB-HNNXBMFYSA-N 277.364 2.389 10 20 CECD Oc1cc2c(cc1CN1CCO[C@@H]3C[C@@H]31)CCCC2 793608712 WXBZBYSXHSVQFK-GOEBONIOSA-N 259.349 2.244 10 20 CECD CCN1CCC(N(C)Cc2c(O)cccc2OC)CC1 768233004 HYDMDFCVFVFVSE-UHFFFAOYSA-N 278.396 2.317 10 20 CECD CCC1(C(=O)Nc2c(Cl)ccc3nonc23)COC1 1323708099 VXYJKOMVJZGHDR-UHFFFAOYSA-N 281.699 2.241 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2C=CCCC2)cc1 1328712524 BOPGUMSDDXZIMM-CQSZACIVSA-N 259.353 2.219 10 20 CECD CC(C)[C@H](NCc1cc(F)c(N(C)C)cc1F)C(=O)O 1329682059 MJJDWVZVEZQZQX-ZDUSSCGKSA-N 286.322 2.230 10 20 CECD CN(C)[C@H]1CCCC[C@H]1NCc1cc2c(cc1O)OCO2 1254184553 PECUEBRQYOAGRV-OLZOCXBDSA-N 292.379 2.083 10 20 CECD c1cc(N2CCCC2)ccc1CNCCO[C@@H]1CCOC1 1334329634 HLADYZVSDVLSPU-QGZVFWFLSA-N 290.407 2.182 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2nc(C)ncc2C)c1 1262018543 MELOJUUXVFZCJC-UHFFFAOYSA-N 286.335 2.429 10 20 CECD Cc1ncsc1CN(C)C(=O)NCc1ccc(N)cc1 1353538785 BJWMXSSJXPQSMS-UHFFFAOYSA-N 290.392 2.375 10 20 CECD Cn1cccc1[C@@H]1COCCN1C(=O)c1cc(O)cs1 1347752748 UWGDUDIOMRZNPK-LBPRGKRZSA-N 292.360 2.006 10 20 CECD Cc1nc(C)c(C(=O)CSc2ncc(C(=O)O)s2)o1 1600690217 OIESIYCXLKAGSQ-UHFFFAOYSA-N 298.345 2.421 10 20 CECD CCC[C@H](CNCc1c(O)cccc1OC)OC 824543187 FZMFEMIESTYHHX-LLVKDONJSA-N 253.342 2.306 10 20 CECD COc1cc(Cl)cc(CN2CCCC[C@H]2C(=O)O)c1O 229118109 JUOJMEACYUMHIL-NSHDSACASA-N 299.754 2.493 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CNCC2(C)C)cc1F 1578423029 NJYCWVUYCABCDS-AWEZNQCLSA-N 283.366 2.118 10 20 CECD CCN(CCN[C@@H](C)c1cc(C(=O)O)ccc1O)C(C)C 1596334685 AHJDKHCHPRPDAO-LBPRGKRZSA-N 294.395 2.471 10 20 CECD CC(C)NC(=O)CCNCc1ccc(N2CCCC2)cc1 158682139 MSYCETUDJWTCMS-UHFFFAOYSA-N 289.423 2.291 10 20 CECD Oc1cccc(Cl)c1CN1CCO[C@H](CF)C1 840955822 ZZMHWBOJRTYCOS-SECBINFHSA-N 259.708 2.216 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)[C@@H](O)C(F)(F)F)c1 866463377 NGQLYBXMURKFPW-YVZVNANGSA-N 293.285 2.363 10 20 CECD Oc1cc2c(cc1CNCCc1ccco1)OCO2 42879739 FNIJISLHXSULKJ-UHFFFAOYSA-N 261.277 2.046 10 20 CECD CCOc1cccc(CN2CCC[C@H](CNC)C2)c1O 40592626 FQWKBZRWVNTQOB-CYBMUJFWSA-N 278.396 2.222 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H]1CF)OCO2 294056450 PTRGRKCQULCVFG-JTQLQIEISA-N 253.273 2.055 10 20 CECD C[C@@H]1OCC[C@]1(C)NCc1cc(F)cc(F)c1O 708438538 WITQWWDZZMHQGV-SDBXPKJASA-N 257.280 2.328 10 20 CECD COc1ccc(O)c(CNCCOC2CCC2)c1 690705055 PJOOBYPETCVLGB-UHFFFAOYSA-N 251.326 2.060 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2cnccn2)c1 390228931 RJKLRZGVCHDXJJ-LLVKDONJSA-N 273.336 2.084 10 20 CECD Cc1nn2cccnc2c1C(=O)N(C)Cc1ccccc1O 102468374 KZFKHBUIZUHCMT-UHFFFAOYSA-N 296.330 2.016 10 20 CECD CCCCCN(CC(N)=O)Cc1cc(C)c(C)cc1O 180809044 BVNUUZNFXBOUKJ-UHFFFAOYSA-N 278.396 2.487 10 20 CECD C[C@@H](Nc1ccc(OCC(N)=O)cc1)c1ccccc1O 37041386 LTLDSGLSWXMECM-LLVKDONJSA-N 286.331 2.429 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)C[S@](C)=O)c(O)c1 186540828 ZTOHUEWDQBRXIX-AGKHESDQSA-N 255.383 2.118 10 20 CECD COc1ccc(O)c(CN2C[C@@H](N)[C@H](c3ccccc3)C2)c1 319387614 DBRCGQZYBQLONY-DLBZAZTESA-N 298.386 2.328 10 20 CECD O=C(CC[C@@H]1CCCCO1)NCCc1ccc(O)c(O)c1 122884389 AWKAIOYYJKRPDW-ZDUSSCGKSA-N 293.363 2.106 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H]2CCc3nc(C)nn3C2)c1 185317423 MEVRBKFAIOPGEU-AAEUAGOBSA-N 286.379 2.266 10 20 CECD CN(C)c1ccc(CNC(=O)NCCC2CC2)cc1 75457583 FZWVZEBDGZKKMQ-UHFFFAOYSA-N 261.369 2.352 10 20 CECD CS[C@H](CO)[C@H](C)N[C@@H](C)c1cc(C)ccc1O 185510828 ASDMJINHUITFHY-COPLHBTASA-N 269.410 2.464 10 20 CECD CC[C@@H](C)[C@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 195171610 IZYLWUQWHLELGN-CJNGLKHVSA-N 289.423 2.276 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)S(=O)(=O)CC2)cc1C 191320822 WAPOWOCZYPGRLS-ZDUSSCGKSA-N 297.420 2.018 10 20 CECD C[C@@H](CN[C@H](C)c1ccc(F)cc1O)CN(C)C 293387644 ISPHMYNNJISUTK-WDEREUQCSA-N 254.349 2.380 10 20 CECD CC(C)(C)c1cnc(CNC(=O)c2cccc(O)c2O)o1 276384222 DWSMAWZNRFRANC-UHFFFAOYSA-N 290.319 2.313 10 20 CECD CCO[C@H]1C[C@H](O)C12CCN(Cc1ccccc1O)CC2 271460286 XEHLABOXSYVVPS-HOTGVXAUSA-N 291.391 2.144 10 20 CECD CC[C@H](NCc1cccc(C)c1O)[C@H](O)C(F)(F)F 271767594 ATHKFBSDFUCPKD-JQWIXIFHSA-N 277.286 2.492 10 20 CECD Cc1ccc(O)c(CN2CCOC3(CCOCC3)CC2)c1 364229770 YKJBOCVUEGYDJB-UHFFFAOYSA-N 291.391 2.472 10 20 CECD C[C@H](CF)NC(=O)NCc1ccc(N2CC=CC2)cc1 287387277 IGEUARWWMNRZNZ-GFCCVEGCSA-N 277.343 2.220 10 20 CECD c1cc2c(cc1CNCc1cnc3n1CCCC3)CCO2 370262400 QMSHTOCIFXJUJV-UHFFFAOYSA-N 283.375 2.444 10 20 CECD CCCCN(CCCO)Cc1cc(OC)c(OC)cc1O 289456781 NXNFLYNLYYPCGJ-UHFFFAOYSA-N 297.395 2.394 10 20 CECD Cc1ncccc1CC(=O)NCc1ccc(N(C)C)cc1 285023718 OMNHAGQNJSUXKR-UHFFFAOYSA-N 283.375 2.315 10 20 CECD COc1ccc(O)c(CN(C)C2C[C@@H]3CC[C@H](C2)N3C)c1 289626281 LUWNLBRHKRATHL-YIONKMFJSA-N 290.407 2.458 10 20 CECD Cc1ccc(C(=O)NC[C@]2(O)CCCC2(C)C)c(O)c1O 294457917 QHNIBODIIUYRCP-MRXNPFEDSA-N 293.363 2.077 10 20 CECD COc1ccc(N(C)Cc2cnns2)cc1F 296739017 JMJSQLASXNZUQL-UHFFFAOYSA-N 253.302 2.322 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)C(C)(F)F 816028429 FUKFFESWRRMZJN-RKDXNWHRSA-N 287.306 2.436 10 20 CECD Cc1cccc(CNCC(C)(C)[C@]2(O)CCCOC2)c1O 827593713 ATWGNSOMQYCISH-KRWDZBQOSA-N 293.407 2.358 10 20 CECD CCO/C=C\C(=O)N1CCOc2cc(N(C)C)ccc21 493044228 HDCIQDFPYZRHMS-CLFYSBASSA-N 276.336 2.028 10 20 CECD CCCN(CC(N)=O)Cc1cc(Cl)c(C)cc1O 825992206 UCMHKVOJQGURNV-UHFFFAOYSA-N 270.760 2.051 10 20 CECD O=C(O)/C=C/c1ccc(N2CC[C@H](CF)C2)c([N+](=O)[O-])c1 906148931 NROUKFYFBLEHLZ-JRBALWBOSA-N 294.282 2.488 10 20 CECD C[C@@H]1CC[C@@H](CNC(=O)N(C)Cc2ccccc2O)O1 838741356 CNCPWPZESWCZPI-YPMHNXCESA-N 278.352 2.101 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H](C)C[C@H](C)N 831211269 FEDHDSYDIJNCIB-QWHCGFSZSA-N 293.411 2.440 10 20 CECD CCN1C[C@@H](N[C@H](C)c2ccc(Cl)cc2O)CC1=O 841759298 YJLZNTKSSOBCTI-KOLCDFICSA-N 282.771 2.317 10 20 CECD COC[C@@H](N[C@H](C)c1cccc(OC)c1O)C1CC1 846157674 OAHRJPHVABLYJQ-ZWNOBZJWSA-N 265.353 2.476 10 20 CECD COc1cc(N(C)C[C@H]2CCOC2)cc(OC)c1OC 741799325 YVUAHVSCZPJFKG-LLVKDONJSA-N 281.352 2.185 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](O)CC(C)C)c1O 846142314 RIJVZYVHZXWDKX-NEPJUHHUSA-N 267.369 2.458 10 20 CECD COCCCNC(=O)[C@@H](C)Sc1ncc(Cl)s1 849999219 PKEXADHFTHTNRJ-SSDOTTSWSA-N 294.829 2.430 10 20 CECD CNC[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843044040 ARXMFNYZVWCLFR-AWEZNQCLSA-N 279.403 2.323 10 20 CECD CCc1nc(CNCc2cc(F)c(N(C)C)cc2F)n[nH]1 858171115 UKWZJQGFBIIOLK-UHFFFAOYSA-N 295.337 2.001 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC1CCOCC1 759581239 UTCFECWGFVOXOY-RQOWECAXSA-N 278.304 2.081 10 20 CECD C[C@H](NC(=O)NCCOCCF)c1ccc(N(C)C)cc1 852261562 SDWKSVWJDPSWRW-LBPRGKRZSA-N 297.374 2.099 10 20 CECD CCC[C@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 930934211 IDTWKXNSAGXSKU-INIZCTEOSA-N 290.407 2.454 10 20 CECD CN(C)c1ccc(CNC(=O)CCC2(O)CCC2)cc1F 865051482 LVTCBWZIDASSGK-UHFFFAOYSA-N 294.370 2.203 10 20 CECD COC(C)(C)CCNCc1ccc(N2CCOCC2)cc1 865756096 CXLNKFIAGSSHOS-UHFFFAOYSA-N 292.423 2.428 10 20 CECD Cc1nc([C@H](C)NCc2ccc(N(C)C)c(F)c2)no1 1117645707 KCPNWJVVZGWJMH-VIFPVBQESA-N 278.331 2.434 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(c1)COC2 762267877 UPKCCGZMDHPWRU-UHFFFAOYSA-N 299.326 2.101 10 20 CECD COc1ccc(N(C)CCn2c([N+](=O)[O-])cnc2C)cc1 878802221 YDYDAQFLMCLZFR-UHFFFAOYSA-N 290.323 2.245 10 20 CECD CO[C@@H]1CCC[C@H]1CNC(=O)NCc1ccccc1O 774785314 FJHJDHYGUOJUNX-GXTWGEPZSA-N 278.352 2.007 10 20 CECD CN(Cc1ccccc1O)C[C@@H](O)CC1(O)CCCCC1 878242128 NCIPLYGNQGRKDY-HNNXBMFYSA-N 293.407 2.270 10 20 CECD Cc1cc(CN2CCOc3cc(N(C)C)ccc32)nn1C 774752835 MWHYRBCETQSFTA-UHFFFAOYSA-N 286.379 2.194 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)N(C)C)cc1F 874448586 VKFVWEQMMQXBAU-GFCCVEGCSA-N 295.402 2.238 10 20 CECD CCCCO[C@H](C)C(=O)N(C)c1ccc(N)cc1 877078520 SHUUEHGSIVFHLR-LLVKDONJSA-N 250.342 2.437 10 20 CECD CCOCc1cc(CNC2(C)COC2)ccc1OC 877691251 LXEHVMMTUYMBRX-UHFFFAOYSA-N 265.353 2.110 10 20 CECD COc1ccc(CNC[C@H]2CN(C(C)=O)C[C@H]2C)cc1C 1048092531 PHKJCIMWJQVKCJ-CJNGLKHVSA-N 290.407 2.208 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1cc(Cl)cc(F)c1O 775647914 HNPQGIPJBIOTNO-NSHDSACASA-N 287.718 2.322 10 20 CECD CC1(C)C[C@@H]1CNC(=O)/C=C\c1ccc(O)c(O)c1 779517307 PHQHKUZPRPTXPB-VLWUPBBWSA-N 261.321 2.273 10 20 CECD C[C@@H](NC[C@H](O)C(F)(F)F)c1c(O)cccc1F 886511010 GKSMNDKKLGWUGC-MUWHJKNJSA-N 267.222 2.105 10 20 CECD COc1cc(C)cc(CNC[C@H](O)c2ccc(C)o2)c1O 894293030 IHMZKCNFYOKJPI-ZDUSSCGKSA-N 291.347 2.434 10 20 CECD CCO[C@@H]1CCC[C@H]1NCc1ccc(OC)c(OC)c1O 894783319 VXVFTCOEHAPEOP-CHWSQXEVSA-N 295.379 2.457 10 20 CECD COc1ccc(N2CC[C@H](CNCc3cnc[nH]3)C2)cc1 895051882 SSEPCHPQCJTZHU-CYBMUJFWSA-N 286.379 2.034 10 20 CECD CC(C)O[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 701727119 BFXOFVQDWJLCQQ-GFCCVEGCSA-N 279.336 2.120 10 20 CECD COc1ccc(CN(C)Cc2ccncc2)c(O)c1OC 893538874 AUMMDVFIKNHBIY-UHFFFAOYSA-N 288.347 2.436 10 20 CECD Cc1cc(O)c(CN2CCn3cnnc3[C@H]2C)cc1C 792189867 UUEDMIUWWMEIQD-GFCCVEGCSA-N 272.352 2.177 10 20 CECD COC[C@H](C)NCc1cccc(Br)c1O 42411566 GKPBDOIAOLKOIX-QMMMGPOBSA-N 274.158 2.279 10 20 CECD CN(C)c1ccc(CN2CCSC[C@@H]2CC(=O)O)cc1 91133330 RUKGKACHTNXCAW-AWEZNQCLSA-N 294.420 2.145 10 20 CECD OC[C@@H]1CN(Cc2cc(F)cc(F)c2O)CCC1(F)F 1338273247 FYUQBMKMXPYAKU-VIFPVBQESA-N 293.260 2.120 10 20 CECD Nc1ccc(CN2CCc3ccccc3[C@H]2CO)cc1 1345160781 YTDNMNIBXOUVCW-QGZVFWFLSA-N 268.360 2.361 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(N)cc2)cc(O)n1 1342021816 OFOGAIFUSOOLAL-UHFFFAOYSA-N 285.347 2.423 10 20 CECD COc1ccc(O)c(CNCC(C)(C)CCCO)c1 224942022 DMVOXNPQBCDKIZ-UHFFFAOYSA-N 267.369 2.289 10 20 CECD COc1cc(C)cc(CN[C@H](CC2CC2)C(=O)O)c1O 1607149309 HFOZIIKKESZYLU-GFCCVEGCSA-N 279.336 2.052 10 20 CECD COC[C@H]1C[C@@H](N[C@H](C)c2cc(C(=O)O)ccc2O)C1 1599277619 MJDDXRGJVGBWTL-FOGDFJRCSA-N 279.336 2.166 10 20 CECD CC(C)C[C@H](CN)N[C@H](C)c1cc(C(=O)O)ccc1O 1591144638 RXJPUMLDWIKOGR-ZYHUDNBSSA-N 280.368 2.114 10 20 CECD COc1ccc(O)c([C@H](C)Nc2nccc(C(=O)O)n2)c1 1599598030 DYFVESAVBOMVRV-QMMMGPOBSA-N 289.291 2.062 10 20 CECD CCc1cccc(CN2C[C@@H](C(=O)O)[C@H](C3CC3)C2)c1O 1593641929 BAIHCXWSMIUCMX-LSDHHAIUSA-N 289.375 2.497 10 20 CECD Nc1ccc(NC(=O)COCCOc2ccccc2)cc1 19398719 VGUMNZXYAQXFRN-UHFFFAOYSA-N 286.331 2.303 10 20 CECD COc1ccc(O)c(CNCc2cncn2C(C)C)c1 818187660 PQCPUHLCRIZXMG-UHFFFAOYSA-N 275.352 2.468 10 20 CECD COc1cccc(O)c1CN(C)[C@H]1CCN(C(C)C)C1 825331246 ALMGAPIGKXXLHT-ZDUSSCGKSA-N 278.396 2.315 10 20 CECD CS(=O)(=O)Nc1ccc(NCc2ccccc2O)cc1 37076995 VGSYCTAWUCEQKY-UHFFFAOYSA-N 292.360 2.376 10 20 CECD COCCOCCCN[C@H](C)c1ccc(N(C)C)cc1 37237441 VWSIUHVPGAKZLP-CQSZACIVSA-N 280.412 2.456 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)CCN(C)C)c1 49553251 GGRPWUHBVLYWTI-NWDGAFQWSA-N 266.385 2.392 10 20 CECD CCOc1cccc(CNCCc2nnc(C)s2)c1O 289831535 MQRCVBLCLQJGHO-UHFFFAOYSA-N 293.392 2.283 10 20 CECD Oc1cccc2c1[C@H](NCCCn1ccnc1)CC2 295790335 BOBUBWROKSXYKE-CYBMUJFWSA-N 257.337 2.256 10 20 CECD CCc1nc(CN(C)C(=O)Cc2ccc(N)cc2)cs1 328416359 YIXZIJZPDHDXRT-UHFFFAOYSA-N 289.404 2.489 10 20 CECD CC[C@H](C)N(C)CCNCc1cc(F)cc(F)c1O 708517794 TVCOIEXIWYJKAL-JTQLQIEISA-N 272.339 2.490 10 20 CECD CCOc1cccc(CN[C@H](C)c2n[nH]c(C)n2)c1O 392439875 AKKAWGVMYQQWJL-SECBINFHSA-N 276.340 2.068 10 20 CECD Cc1ccc(O)c(CN2CCO[C@@H]([C@H]3CCCO3)C2)c1 245721539 DJLCDXSKEHYRHH-HZPDHXFCSA-N 277.364 2.080 10 20 CECD COc1ccc(N2CCCN(C(=O)NC(C)C)CC2)cc1 55339319 JSNPTPGZTUJRBJ-UHFFFAOYSA-N 291.395 2.325 10 20 CECD CNC(=O)c1cccc(C(=O)N(C)Cc2ccccc2O)c1 175505044 FWXVLKXKYCPKNY-UHFFFAOYSA-N 298.342 2.024 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C(=O)O)C(C)C)c1 43430579 MGFRQEVHTCSJQG-MFKMUULPSA-N 251.326 2.460 10 20 CECD C[C@@H](NCC(C)(C)C(N)=O)c1cc2c(cc1O)CCCC2 186220821 DWSSRHOOAYMWRH-LLVKDONJSA-N 290.407 2.433 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1[C@H]2CCC[C@@H]12 183432002 MZONBJUEBUWWNN-KSAAVIKPSA-N 275.348 2.191 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC1(C)C 186381346 JNWKZQYKQZUQCK-GXSJLCMTSA-N 263.337 2.191 10 20 CECD C[C@H]1OCC[C@@H]1NCc1cccc(Br)c1O 134240092 LCKQFJHWECTGSV-KCJUWKMLSA-N 286.169 2.422 10 20 CECD CCC(CC)[C@H](O)CNCc1cc(F)ccc1O 226609932 UYYNHWZHBBGVMY-CQSZACIVSA-N 255.333 2.418 10 20 CECD C[C@H](O)CCCNCc1cc(Cl)cc([N+](=O)[O-])c1O 278609366 IPZXYLOVLMLSRY-QMMMGPOBSA-N 288.731 2.204 10 20 CECD CCn1cc(NCc2ccc([N+](=O)[O-])c(OC)c2O)cn1 278499486 NMSXTSMHGQWJOC-UHFFFAOYSA-N 292.295 2.138 10 20 CECD CC(=O)N[C@@H]1Cc2ccccc2N(Cc2ccccc2O)C1 371584291 RUVFIMHIKMFXJI-MRXNPFEDSA-N 296.370 2.460 10 20 CECD Oc1ccc(Cl)cc1CN[C@H]1CCc2c[nH]nc2C1 374546553 VTJLFMSFOXDZCQ-LBPRGKRZSA-N 277.755 2.416 10 20 CECD C[C@@H](NCC1=CCCOC1)c1cc([N+](=O)[O-])ccc1O 287019520 LBXMFKOIOJQHET-SNVBAGLBSA-N 278.308 2.298 10 20 CECD CC[C@@H](NCCN(C)CCOC)c1ccc(F)cc1O 286209832 RYYQFAJFYOWDLT-CQSZACIVSA-N 284.375 2.150 10 20 CECD CC(=O)C(=O)CSc1ncnc2sc(C)cc12 808034792 IBWRPIMGPRHLKB-UHFFFAOYSA-N 266.347 2.250 10 20 CECD CCC(=O)[C@@H](C)Sc1ncc(C(=O)OC)s1 295151011 FGJFQFIFWPROTL-ZCFIWIBFSA-N 259.352 2.389 10 20 CECD CC(=O)CCC(=O)NCCCSc1nccs1 800491378 PDQLEEFNBXMEMF-UHFFFAOYSA-N 272.395 2.111 10 20 CECD CNC(=O)C1(NCc2ccc(N(C)C)c(C)c2)CCCC1 815069325 DVEVWJFISAUXMJ-UHFFFAOYSA-N 289.423 2.209 10 20 CECD C[C@@H]1CCN[C@H](C(=O)NCCCSc2nccs2)C1 817940732 KFVHONIOZJEUOA-MNOVXSKESA-N 299.465 2.130 10 20 CECD COC[C@@H](C)[C@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 812487532 BVLMZNAENMYYCC-NEPJUHHUSA-N 296.386 2.427 10 20 CECD COC(=O)[C@H](CNCc1cccc(OC)c1O)CC(C)C 813331448 JCAJBCNACODVFN-ZDUSSCGKSA-N 295.379 2.326 10 20 CECD CN(C)C(=O)c1cccc(CNCc2ccccc2O)c1 725843649 BABAQJZXEDFSNB-UHFFFAOYSA-N 284.359 2.384 10 20 CECD COC[C@H](C)[C@H](C)C(=O)NCc1ccc(N(C)C)cc1 812448910 FVMFTIXSJVISBS-STQMWFEESA-N 278.396 2.287 10 20 CECD O=C(C1CC1)N1CCN(Cc2cc(Cl)ccc2O)CC1 728299124 BMUQYLSUIQPFHW-UHFFFAOYSA-N 294.782 2.100 10 20 CECD Cc1cccnc1N(C)C(=O)/C=C\c1cccnc1 491994834 BXDOZCODORSIHM-FPLPWBNLSA-N 253.305 2.461 10 20 CECD Oc1c(F)cccc1CNCc1cccc(-c2nn[nH]n2)c1 826510716 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CN(C)c1ccc(CN[C@H]2[C@H]3OC[C@H]4C[C@@H]2C[C@@H]43)cc1F 924860664 DSLLCPIQHMCJHY-XRQSXFTLSA-N 290.382 2.405 10 20 CECD Cc1cc(N(C)C)ccc1CNCCn1cccn1 840929327 JVTTWVACENULIC-UHFFFAOYSA-N 258.369 2.047 10 20 CECD COc1ccc(N(C)Cc2nonc2C)cc1F 757851283 HUYZMGKOXBZBND-UHFFFAOYSA-N 251.261 2.162 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](O)C2CCOCC2)c(O)c1 756738297 NUMAFTSXYBUJDH-BLLLJJGKSA-N 279.380 2.139 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@]2(C)CCCO2)c1 756645399 JDIWHSTWPFQIOR-BDJLRTHQSA-N 293.363 2.399 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1c1ncc[nH]1 753436313 ZQSZOHIEPWQXKI-SECBINFHSA-N 263.322 2.154 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](CC(N)=O)C2)cc1Cl 857046012 DYZUNVVJDVSHBE-JTQLQIEISA-N 282.771 2.051 10 20 CECD COc1cc(CN[C@H]2CCN(C)C2)c(O)c(C(C)(C)C)c1 850119037 MQSXKACNFTYZHK-ZDUSSCGKSA-N 292.423 2.492 10 20 CECD CNC(=O)[C@H]1CCC[C@H]1NCc1cc(Cl)ccc1O 765794497 CQYHVLIZJBJZRQ-NWDGAFQWSA-N 282.771 2.050 10 20 CECD COc1ccc(O)c(CNc2cnn(CCF)c2)c1 862482882 CMVGTMPEKXGGGZ-UHFFFAOYSA-N 265.288 2.179 10 20 CECD CNc1snc(C)c1C(=O)NCc1cc(C)ccc1O 862760827 WYYQKEVSPJUBDM-UHFFFAOYSA-N 291.376 2.437 10 20 CECD COCc1cncc(C(=O)NCc2cc(C)ccc2O)c1 862753838 IORDOONRGUWUSJ-UHFFFAOYSA-N 286.331 2.172 10 20 CECD COc1cccc(O)c1CN1CCC[C@H]1C[C@H](C)O 769451869 NWQDOJBGISCRIS-RYUDHWBXSA-N 265.353 2.136 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCC(O)CC1 775643924 YOQAPZGDYOSXMY-UHFFFAOYSA-N 259.708 2.141 10 20 CECD C[C@H](NCCC1OCCO1)c1ccc(N(C)C)cc1 775830477 JZVJUGKWQVIXIN-LBPRGKRZSA-N 264.369 2.166 10 20 CECD CCCN(Cc1ccccc1O)[C@@H](C)C(=O)NC1CC1 76074213 PCMMKBMVVWRZFB-LBPRGKRZSA-N 276.380 2.271 10 20 CECD COc1ccc(CNCCNC(=O)C=C2CCC2)cc1C 1125556745 VAEDFLLXXSXCSC-UHFFFAOYSA-N 288.391 2.320 10 20 CECD Cc1cc(Cn2cc(-c3cncnc3)nn2)ccc1N(C)C 881378877 WIBOVILVHQPTLU-UHFFFAOYSA-N 294.362 2.158 10 20 CECD COc1cccc(CN2CC[C@H](C)C[C@H]2[C@@H](C)O)c1O 785988845 PLKQVJOIMRGUDQ-SCRDCRAPSA-N 279.380 2.382 10 20 CECD COCc1nccc(N(C)Cc2ccc(N(C)C)cc2)n1 891567870 SAXGPNVLXJWILU-UHFFFAOYSA-N 286.379 2.325 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](CF)C2)c1O 895574192 VADKKZVRFSRZML-VIFPVBQESA-N 284.287 2.100 10 20 CECD Oc1c(F)cc(F)cc1CNCCc1nccs1 708468502 VSGAVQSSXDLSRK-UHFFFAOYSA-N 270.304 2.459 10 20 CECD COc1ccc([C@@H]2C[C@H]2NC(=O)c2cccc(O)c2O)cc1 794158405 XFPRFZMFUHSFOD-UONOGXRCSA-N 299.326 2.392 10 20 CECD COc1ccc(CNC(=O)Nc2cccnc2)c(O)c1 794761971 NMQIOMDLVOMCMX-UHFFFAOYSA-N 273.292 2.118 10 20 CECD C[C@@H](NCCOC[C@@H]1CCCO1)c1ccc(F)cc1O 756583314 NBCXCZNKLXAJLV-YPMHNXCESA-N 283.343 2.378 10 20 CECD C[C@H](NCCOC[C@H]1CCCO1)c1ccc(F)cc1O 756583313 NBCXCZNKLXAJLV-WCQYABFASA-N 283.343 2.378 10 20 CECD CC[C@@H](F)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1336440280 YULKZOVQHQDXQO-SWLSCSKDSA-N 294.370 2.449 10 20 CECD Nc1ccc(CC(=O)NCc2ccccc2F)cc1 20185657 CLOKMFMSSXUVFG-UHFFFAOYSA-N 258.296 2.267 10 20 CECD Nc1ccc(CNC(=O)c2nccc3occc23)cc1 1580445675 OZWAKLQCNCJZLY-UHFFFAOYSA-N 267.288 2.340 10 20 CECD O=C(O)[C@]1(NCc2cc(F)cc(F)c2O)CC[C@H]2C[C@H]21 1777600589 CQBWWLNMURUQTR-WLGBHJCYSA-N 283.274 2.013 10 20 CECD CCN(CCCN(C)C)Cc1c(O)cccc1OC 809749998 OMZDHOKSIRQMLF-UHFFFAOYSA-N 266.385 2.174 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)cc2)nn1C 840874812 AKWXIFDADOIAGS-UHFFFAOYSA-N 258.369 2.084 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2C[C@H](O)C2(C)C)c1 128100209 OMBBBZUMIWSVCO-HERUPUMHSA-N 265.353 2.211 10 20 CECD C[C@@H](C(=O)NC(C)(C)C)N(C)Cc1ccc(N)cc1 35360569 FJZHZLACDPXHID-NSHDSACASA-N 263.385 2.004 10 20 CECD CCOC(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 49371336 AGBMHPRWZHELNE-VXGBXAGGSA-N 264.369 2.355 10 20 CECD Cc1nnsc1CNCc1c(O)cccc1Cl 291724076 MYJZYSVLQGWDOC-UHFFFAOYSA-N 269.757 2.495 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1ccc(C)cc1O 185467701 QNZIWECOGNTLQQ-DOMZBBRYSA-N 267.369 2.139 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCCCO1 178820895 ASGGPQAZOSRZCO-INIZCTEOSA-N 288.391 2.472 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1C(=O)O 251565284 BUESLUCQKLJYOI-GZMMTYOYSA-N 269.728 2.198 10 20 CECD COc1ccc(N(C)CCOC[C@@H]2CCCO2)cc1F 121787250 NHCFQQNCMOHIBK-ZDUSSCGKSA-N 283.343 2.466 10 20 CECD C[C@H](O)CCNCc1cccc(Br)c1O 78780336 CFYCCYLAKRCYEG-QMMMGPOBSA-N 274.158 2.015 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CC=CCC1 181103243 FILVEOLTMGUKCF-YPUOHESYSA-N 259.305 2.336 10 20 CECD O=C(O)CN(C(=O)/C=C\c1cccnc1)c1ccccc1 215332042 PCBOQCVAWQMTFM-HJWRWDBZSA-N 282.299 2.213 10 20 CECD CC[C@@]1(C(=O)NCc2ccc(N(C)C)cc2C)CCCN1 134607382 YXSHIWGMDHSJOQ-KRWDZBQOSA-N 289.423 2.209 10 20 CECD C[C@H](NCCN(C)C)c1cc(Br)ccc1O 286871802 BVUBDMYWADYXRF-VIFPVBQESA-N 287.201 2.367 10 20 CECD CO[C@H](CNC(=O)N(C)Cc1ccccc1O)C(C)C 80603057 HIBKJBXXGBSGKV-CQSZACIVSA-N 280.368 2.205 10 20 CECD CO[C@@]1(C)C[C@@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 193131154 MNALCRXRBAJENH-WBMJQRKESA-N 293.363 2.373 10 20 CECD Cn1c(-c2ccccc2)cnc1SCC1(CO)COC1 84853068 IAAMAZCRDFLULT-UHFFFAOYSA-N 290.388 2.188 10 20 CECD CCCC(=O)N1CCN(c2ccc(OC)cc2OC)CC1 242782283 DXOSWNOJFVCJAO-UHFFFAOYSA-N 292.379 2.153 10 20 CECD COc1ccc(N2CCN(Cc3ccncc3)CC2)cc1 248148394 UOVPJGYKDRCMIG-UHFFFAOYSA-N 283.375 2.412 10 20 CECD CCN(CC)c1ccc(CN(C)Cc2nncn2C)cc1 265621930 BPSGOMMXWAENBR-UHFFFAOYSA-N 287.411 2.293 10 20 CECD Cc1ccc([C@H](C)NC[C@@]2(O)CCO[C@H]2C)c(O)c1C 278866545 RODYTVFOEVUZMX-XEZPLFJOSA-N 279.380 2.200 10 20 CECD Cc1ccc(C(=O)N2C[C@H](C)O[C@@H](C3CC3)C2)c(O)c1O 279590379 APEJMQNADILVOF-GXFFZTMASA-N 291.347 2.046 10 20 CECD Cc1cc(O)c(CN2CCO[C@]3(CCO[C@H]3C)C2)cc1C 377272320 BLQAYBTWSHZDKF-WMLDXEAASA-N 291.391 2.389 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1cc(C)ccc1O 292517100 DOYBQCZWXPTHFV-CYBMUJFWSA-N 278.396 2.343 10 20 CECD COc1ccc(O)c([C@H](C)NCc2nnc(C(C)C)[nH]2)c1 294902377 XHFXJVLTIIRMCI-JTQLQIEISA-N 290.367 2.493 10 20 CECD COC[C@H](C)[C@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 812487536 BVLMZNAENMYYCC-RYUDHWBXSA-N 296.386 2.427 10 20 CECD Oc1ccc2ccncc2c1CN1CCn2cncc2C1 811787066 BONOQKGCINSMPL-UHFFFAOYSA-N 280.331 2.153 10 20 CECD CC(C)N(CC[S@](C)=O)Cc1ccc(N(C)C)cc1 827441763 CDKDZELBITUNSK-IBGZPJMESA-N 282.453 2.342 10 20 CECD C[C@@H](NC(=O)C1(C)COC(C)(C)OC1)c1ccccc1O 827941392 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CO[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)C12CCC2 834555497 YKJLSXXWQVJXNT-UONOGXRCSA-N 292.335 2.348 10 20 CECD O=C(NCc1ccc(O)cc1O)C1(C(F)(F)F)CCC1 910944115 KUXWZFTVLFTPLR-UHFFFAOYSA-N 289.253 2.447 10 20 CECD C[C@H](N[C@@H]1CO[C@H](C)C1)c1cc(F)cc(F)c1O 842928899 KSXGPGLWFDXTHH-WEDXCCLWSA-N 257.280 2.498 10 20 CECD CC[C@H](NCc1c(O)cccc1OC)[C@@H](O)C(C)C 840966478 GBWDDXLGQGAIQW-WFASDCNBSA-N 267.369 2.286 10 20 CECD CCC[C@H](O)[C@@H](CO)NCc1ccc(N(CC)CC)cc1 842224707 FBXVXNGDBXAWHY-SJORKVTESA-N 294.439 2.144 10 20 CECD COc1cccc([C@@H](C)N[C@@H](CO)CC(F)F)c1O 846164131 FPEPPQLHZAGETC-RKDXNWHRSA-N 275.295 2.068 10 20 CECD CCN(CC)c1ccc(CN2CCC[C@H](N)C2)cc1 843043826 JKXMCXAXBJJRGH-HNNXBMFYSA-N 261.413 2.456 10 20 CECD Nc1ccc(CCNC(=O)NC2Cc3ccccc3C2)cc1 841878612 RUIUVNRSMSCWTP-UHFFFAOYSA-N 295.386 2.278 10 20 CECD O=C(O)c1ccc(NCc2ccc(N3CC=CC3)cc2)nn1 740162070 ZXKIQWGXVRBOHW-UHFFFAOYSA-N 296.330 2.163 10 20 CECD C[C@@H](NC[C@H]1C[C@@H](O)C1)c1cc(Cl)ccc1O 858545907 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C[C@H](NC1CCC(N)CC1)c1cc(F)ccc1O 94618075 GIHJVDHVEHVDIA-GCVQQVDUSA-N 252.333 2.452 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)CCCO)c1 94941813 ANWWKFZPSRKPCU-MNOVXSKESA-N 253.342 2.212 10 20 CECD Cc1nccc(N(C)Cc2ccc(N(C)C)cc2)n1 266127287 CAIBRISPUFTXIY-UHFFFAOYSA-N 256.353 2.487 10 20 CECD CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)CC)cc1 268739538 RETFCABGMJFRJS-CHWSQXEVSA-N 277.412 2.318 10 20 CECD Oc1ccc(Cl)cc1CN1CCOC[C@@H]1c1ncon1 369840669 NPKLTTVPAYHRFQ-LLVKDONJSA-N 295.726 2.002 10 20 CECD COC1(C(=O)N2CCOc3cc(N(C)C)ccc32)CCC1 277276028 UIHWXIYDVNNLLD-UHFFFAOYSA-N 290.363 2.047 10 20 CECD Oc1ccccc1CNC[C@@H](O)CCc1ccccc1 273069846 GWJINWCYBFBCAB-INIZCTEOSA-N 271.360 2.476 10 20 CECD CC[C@@H]1CN(Cc2ccccc2O)C[C@H](C)[S@@]1=O 289586375 KFAVSSOQVPJPMO-SRBZOADZSA-N 267.394 2.124 10 20 CECD CCOC1CC(N(C)Cc2cc(OC)c(OC)cc2O)C1 288713756 VKWSNXKFQADKLH-UHFFFAOYSA-N 295.379 2.409 10 20 CECD CC[C@@H](NCC[C@@H](O)COC)c1ccc(C)cc1O 280151586 QGAKUUUVVMTLBK-TZMCWYRMSA-N 267.369 2.139 10 20 CECD CSCCCN(C)C(=O)/C=C/c1ccc(O)c(O)c1 281584278 MFZMIGPVCLFXHD-FNORWQNLSA-N 281.377 2.323 10 20 CECD O=C(NC[C@@H]1CCCSC1)c1c(F)ccc(O)c1O 295410763 HSUBUNGFQVXYAK-QMMMGPOBSA-N 285.340 2.110 10 20 CECD COC(=O)c1ccc(CNCc2cc(F)ccc2O)o1 809742574 DQNLDXDSYQRUQA-UHFFFAOYSA-N 279.267 2.201 10 20 CECD COC[C@@H](CO)N[C@H](C)c1cc(Cl)cc(C)c1O 808718545 NRIMWCRNCKAJRQ-MWLCHTKSSA-N 273.760 2.012 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](C)C[C@@H](C(=O)O)C2)c1 817881989 SXBWLSFAVAUUHI-WCQYABFASA-N 293.363 2.334 10 20 CECD CC(C)(C)C[C@@H](NCc1ccccc1O)C(=O)O 901804886 DLWJSNHSDSMTBE-LLVKDONJSA-N 251.326 2.371 10 20 CECD C[C@@H](NCc1ccccc1O)c1cccc(-c2nn[nH]n2)c1 820438921 ZRUAJIRWLDVQLA-LLVKDONJSA-N 295.346 2.423 10 20 CECD O=C(COC(=O)c1cc(O)cs1)c1ccccc1 731909173 BSUKICRLRHOITF-UHFFFAOYSA-N 262.286 2.493 10 20 CECD O=C(NCCOCC1CCCC1)c1c(F)ccc(O)c1O 839791302 JAGIMXAFVYFMES-UHFFFAOYSA-N 297.326 2.174 10 20 CECD COc1ccc(OC)c(CNC(=O)c2cc(O)cs2)c1 731867922 CEFNTSWZAYMTHA-UHFFFAOYSA-N 293.344 2.401 10 20 CECD 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2.112 10 20 CECD C[C@@H](N[C@@H]1CC=C(C(=O)O)C1)c1cc(F)ccc1O 1604330564 RBJBWWTWLZXBIH-LDYMZIIASA-N 265.284 2.355 10 20 CECD O=C(O)[C@]1(F)CCN(Cc2c(O)ccc(Cl)c2F)C1 1610728858 ZEXCAXRCEPDGJL-LBPRGKRZSA-N 291.681 2.183 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C(C)(C)CC(=O)O)c1O 1589271028 LYETZELVVMUQEM-UHFFFAOYSA-N 297.326 2.419 10 20 CECD C[C@H]1CC[C@H](CN2CCCc3cc(CN)ccc32)O1 232007583 ZTHJXHXSWHMBOA-SWLSCSKDSA-N 260.381 2.465 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C(=O)O)C(C)(C)C)c1 1597130261 OBFXPLYQBOBFHF-ZDUSSCGKSA-N 281.352 2.380 10 20 CECD C[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)OC(C)(C)C 158060475 HZGUGEGPOQZYOT-VIFPVBQESA-N 296.323 2.120 10 20 CECD CN(Cc1ccccc1O)C(=O)CCc1ccncc1 53916370 IGAKMDXLFRCVAK-UHFFFAOYSA-N 270.332 2.378 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CC[C@@H](O)C1 174582089 SSHFXWGJBWCVPJ-GFCCVEGCSA-N 290.388 2.362 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)c2nnnn2C2CC2)c(O)c1 189114196 VBIDRMAAWCUABO-GHMZBOCLSA-N 287.367 2.434 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Cc1ccsc1 183462881 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898451648 MMRVBPRUHBXYKF-MRXNPFEDSA-N 261.413 2.355 10 20 CECD CCO[C@]1(C(F)(F)F)CCN(CCN=[N+]=[N-])C1 409433406 MTFRUBDZEYPFRD-MRVPVSSYSA-N 252.240 2.340 10 20 CECD COc1ccc(CNC(=O)Nc2ncc(C)s2)c(O)c1 794760347 PIWKMMBBRCKANI-UHFFFAOYSA-N 293.348 2.487 10 20 CECD C[C@H]1C[C@H](C(=O)N(C)Cc2ccccc2O)CCO1 776466532 YVPGAKWNNPBLBK-NWDGAFQWSA-N 263.337 2.166 10 20 CECD O=[N+]([O-])CCNCc1ccc(N2CCCCC2)cc1 1353247119 MIYSYKDMVKVYBR-UHFFFAOYSA-N 263.341 2.043 10 20 CECD Nc1ccc(CNC(=O)NCC2(CCO)CCCC2)cc1 1357791935 QRIRJKQCXFHMOU-UHFFFAOYSA-N 291.395 2.011 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]2C(=O)O)cc1 1607766022 NHNOFXVHFMIOFB-HNNXBMFYSA-N 298.342 2.393 10 20 CECD Cc1nnc(CN[C@H](C)c2cc(C(=O)O)ccc2O)s1 1610571915 UBPGDBLPRIXFEL-SSDOTTSWSA-N 293.348 2.101 10 20 CECD O=C(O)[C@]1(NCc2ccc3c(c2)CCCO3)CC[C@@H]2C[C@H]21 1777600188 RDNXTEJQAAGUMR-MRRJBJDNSA-N 287.359 2.355 10 20 CECD COCCOCCCNCc1ccc2c(c1)CCCO2 921512179 INTLLXGEOVZLGD-UHFFFAOYSA-N 279.380 2.154 10 20 CECD CCO[C@H]1C[C@@H](NCc2cccc(OC)c2O)C1 839147521 LPDRIOATIRDNSW-TXEJJXNPSA-N 251.326 2.058 10 20 CECD CCc1cccc(CNCC2(S(C)(=O)=O)CCC2)c1O 848908553 XGZFLAWYRJRDBD-UHFFFAOYSA-N 297.420 2.012 10 20 CECD NC(=O)Cc1ccc(NCc2ccccc2O)cc1 37074824 DXNARSLCNPAKFF-UHFFFAOYSA-N 256.305 2.032 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCC(=O)N(C)C 37751637 OYYOYODILRPBDJ-NWDGAFQWSA-N 276.380 2.317 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CO[C@@H](C)C2)c1 402305791 KFDIEAYTLJVPEN-DCAQKATOSA-N 251.326 2.229 10 20 CECD CCN(CC)c1ccc(CN2C(=O)[C@@H](C)NC2=S)cc1 55179723 ZNIHOSHSEVUNIS-LLVKDONJSA-N 291.420 2.138 10 20 CECD CN1CCN(c2ccc(CNCC(F)(F)F)cc2)CC1 107797501 DUSWSRGZXPEHPQ-UHFFFAOYSA-N 287.329 2.090 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCO[C@@H](C)C2)c1O 37322689 IZKQGZWMHPPLGW-VIFPVBQESA-N 283.755 2.469 10 20 CECD Cc1c(CNCc2cc(Cl)ccc2O)cnn1C 156551653 HMVCPHZQMRJRQS-UHFFFAOYSA-N 265.744 2.377 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1cccnc1 42894998 QMIKXVYCHSKUJA-UHFFFAOYSA-N 271.320 2.129 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CCC=CO2)cc1 194626154 MOZNHBANGUSYFW-OAHLLOKOSA-N 291.347 2.367 10 20 CECD CC[C@@H](C)N(CCO)Cc1ccc(N(C)C)cc1 267153219 NCQWUVWQZNOKRX-CYBMUJFWSA-N 250.386 2.345 10 20 CECD CCn1cc(CCN(C)Cc2ccccc2O)cn1 276363451 ZFEHJRZIUKYQAP-UHFFFAOYSA-N 259.353 2.283 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCCC2(CC2)C1 295059044 VEHOSUPJXNILEA-UHFFFAOYSA-N 265.284 2.253 10 20 CECD COCC1(CN[C@@H](C)c2ccccc2O)CCNCC1 817974699 NTMLVSULYTUFRX-ZDUSSCGKSA-N 278.396 2.059 10 20 CECD CO[C@H]1COCC[C@@H]1CNCc1cc(C)c(C)cc1O 824710284 WXVCAPYTMPSERC-CJNGLKHVSA-N 279.380 2.150 10 20 CECD Cn1c(Cl)nc(Cl)c1/C=C1\SC(=S)NC1=O 726876142 HQTTZUYVQRLIBS-RQOWECAXSA-N 294.188 2.216 10 20 CECD CO[C@H]1COCC[C@H]1CNCc1cc(C)c(C)cc1O 824710280 WXVCAPYTMPSERC-BBRMVZONSA-N 279.380 2.150 10 20 CECD O=C(O)c1csc(NC(=O)c2cc(O)cs2)c1 833342552 DRENFQROYHBTLE-UHFFFAOYSA-N 269.303 2.466 10 20 CECD COc1ccc(N(CCCS(C)(=O)=O)CC2CC2)cc1 831588356 XQHBZRYKJHKISN-UHFFFAOYSA-N 297.420 2.346 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1c[nH]cc1C1CC1 901131541 LPDDALDFZAXTET-UHFFFAOYSA-N 272.304 2.233 10 20 CECD CC[C@H](O)[C@H](C)C(=O)NCc1ccc(N(C)C)cc1C 900732012 HSDZUBFLCBPOBF-WFASDCNBSA-N 278.396 2.084 10 20 CECD COc1ccc(O)c(CN2C[C@@H]3[C@H](C2)C3(F)F)c1 846112851 TVPNERYWZNWJQG-PHIMTYICSA-N 255.264 2.098 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](O)COCC(C)C)c1O 846142123 CADSAINHINDQOW-CHWSQXEVSA-N 297.395 2.085 10 20 CECD CCc1cccc(CN(C)C[C@@H](C)C(=O)OC)c1O 848882617 VXCIVVAAJQKTTM-LLVKDONJSA-N 265.353 2.196 10 20 CECD COc1ccc(N(C)CCN(C)CC2=CCCOC2)cc1 846052876 UKQDCKHSDQQLDK-UHFFFAOYSA-N 290.407 2.410 10 20 CECD CCC[C@H](C)S(=O)(=O)NCc1cccc(OC)c1O 845869585 IIBJIPLWLAYCJT-JTQLQIEISA-N 287.381 2.009 10 20 CECD CCOc1ccc(CN2CCC(C)(C(=O)O)CC2)c(O)c1 843040118 GKHLJXBYZYXSCK-UHFFFAOYSA-N 293.363 2.478 10 20 CECD CCOc1cccc(CN[C@@H](C)[C@@H]2CCCNC2)c1O 841033085 KGJIVTATVGTQFD-QWHCGFSZSA-N 278.396 2.269 10 20 CECD COC(=O)c1cc(CN2CCCc3cc(CN)ccc32)c[nH]1 843058001 KRKVKNULSOQOHH-UHFFFAOYSA-N 299.374 2.213 10 20 CECD CON(C)CCN[C@H](C)c1ccc(C)c(C)c1O 850479408 SDOHVWLLKAIJAS-GFCCVEGCSA-N 252.358 2.153 10 20 CECD C[C@H]1COC[C@H]1NCc1ccc(N(C)C)c(F)c1 922641312 KIFDXQZPJYHHBO-GXFFZTMASA-N 252.333 2.016 10 20 CECD Cc1ccc(O)c([C@H](C)NCCOC[C@H]2CCOC2)c1 756564204 RIQGVGMXKVXKRW-KBPBESRZSA-N 279.380 2.404 10 20 CECD Cc1ccc([C@@H](C)NCC(=O)NC2CCCC2)c(O)c1 756704048 DWUYPTDLKJOHKL-GFCCVEGCSA-N 276.380 2.410 10 20 CECD CC[C@H](N[C@@H]1CCOC[C@H]1O)c1cccc(Cl)c1O 858551586 KABPOSSDUACCHQ-YNEHKIRRSA-N 285.771 2.236 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCCOC1)c1ccccc1O 868123373 FRYGBKVPBZKFGN-VXGBXAGGSA-N 278.352 2.179 10 20 CECD COCCN(Cc1c(O)cccc1OC)CC(F)F 769306962 WZYOTNKBBRIWMI-UHFFFAOYSA-N 275.295 2.114 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C1CSC1 866598774 PCUMQZIVVOZTEO-UHFFFAOYSA-N 265.378 2.494 10 20 CECD CO[C@@]1(CN[C@H](C)c2cc(F)cc(F)c2O)CCOC1 763574322 YSCQSOIDIQKGHH-YMTOWFKASA-N 287.306 2.127 10 20 CECD Cc1ccc(CN[C@@H]2COc3ccccc3[C@@H]2O)c(O)c1 877537304 KPTHPTKAZLGSIJ-PBHICJAKSA-N 285.343 2.285 10 20 CECD COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1ccc(C)cc1O 877415978 FNZYRKQRPCDCCQ-JSGCOSHPSA-N 277.364 2.474 10 20 CECD CCOC1CC(CCNC(=O)c2cc(O)cs2)C1 789918450 GSSAOCFFFYNLMP-UHFFFAOYSA-N 269.366 2.389 10 20 CECD CN(Cc1ccccc1O)c1nnc(C(F)F)n1C 1121298173 SKGZATMMLXDZDH-UHFFFAOYSA-N 268.267 2.095 10 20 CECD C[C@H](NCC1([S@](C)=O)CCC1)c1c(O)cccc1F 886605616 VEXJVNARFXQISL-OVWNDWIMSA-N 285.384 2.483 10 20 CECD CO[C@H](C)CCC(=O)NCc1ccc(N(C)C)cc1C 782296788 PBMUQLTWFRYQOQ-CYBMUJFWSA-N 278.396 2.492 10 20 CECD COc1cc(C)cc(CNCC(C)(C)OC)c1O 894308894 TTZPBWOWSOIQTI-UHFFFAOYSA-N 253.342 2.224 10 20 CECD COc1ccc(CN2CCC[C@@H](CO)[C@@H]2C)c(O)c1OC 894941071 YQQWYHKTMDFPPF-AAEUAGOBSA-N 295.379 2.002 10 20 CECD O[C@]1(CNCc2ccc(N3CCCC3)cc2)CCSC1 702306942 BFKLQFRMXVQINP-INIZCTEOSA-N 292.448 2.244 10 20 CECD CCCn1ncnc1CN[C@H](C)c1cc(OC)ccc1O 790325168 PCBYRNRJXHGBDF-LLVKDONJSA-N 290.367 2.253 10 20 CECD Oc1c(F)cc(Br)cc1CN[C@@H]1CCOC1 715718418 MHLOTKBQZYWESK-SECBINFHSA-N 290.132 2.172 10 20 CECD CC[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)[C@@H](C)O 791207422 AKRNABVGPRZSGJ-CZUORRHYSA-N 290.407 2.310 10 20 CECD COc1ccc(CNC(=O)c2occc2C)c(O)c1 794387946 PMGMCCCRIBBVAJ-UHFFFAOYSA-N 261.277 2.232 10 20 CECD CN(Cc1cc(F)ccc1O)C(C)(C)CC(=O)O 1610117831 BDIMDEHMSIWXAT-UHFFFAOYSA-N 255.289 2.216 10 20 CECD CN(C)c1ccc(CCNC(=O)c2cc(O)cs2)cc1 1347322508 JHAOPFIYHZNNEE-UHFFFAOYSA-N 290.388 2.492 10 20 CECD CCCn1cc(C(=O)N(C)c2ccc(N)cc2)c(C)n1 1342331350 JFJVDQDKJJKXGS-UHFFFAOYSA-N 272.352 2.460 10 20 CECD COc1ccc(CN2CCC[C@@](C)(CO)C2)c(O)c1OC 1342845967 ACGDXNZXKRZECY-MRXNPFEDSA-N 295.379 2.004 10 20 CECD COC[C@H](CN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21)OC 230672213 UGLXOUKGIBTTCV-FRRDWIJNSA-N 279.380 2.500 10 20 CECD COc1cccc([C@@H](C)NCCCCC(=O)O)c1O 1594123375 IUOSAMRANGEONN-SNVBAGLBSA-N 267.325 2.306 10 20 CECD C[C@@H]1CC[C@@](NCc2cc([N+](=O)[O-])ccc2O)(C(=O)O)C1 1776629010 YBCJCFZXNKSQDN-OTYXRUKQSA-N 294.307 2.033 10 20 CECD COc1cc(CN2CC[C@@]3(CCOC3)C2)c(O)cc1C 160391049 JVURPNCRTQXCCJ-MRXNPFEDSA-N 277.364 2.322 10 20 CECD CC[C@@H](NCCCN1CCC(O)CC1)c1ccccc1O 155280396 CVAKHGFATHGFKO-MRXNPFEDSA-N 292.423 2.280 10 20 CECD CCOCCCNC(=S)NCc1ccc(N(C)C)cc1 18165319 DJPMJGHBHQKPHL-UHFFFAOYSA-N 295.452 2.143 10 20 CECD C[C@H](NCC1([S@](C)=O)CCC1)c1cc(F)ccc1O 281024389 MNUVIQSEAHVYII-OVWNDWIMSA-N 285.384 2.483 10 20 CECD COCC1(CC(=O)N(C)Cc2ccccc2O)CC1 401327203 CYYAOBQQKOFVKK-UHFFFAOYSA-N 263.337 2.167 10 20 CECD Oc1c(F)cc(F)cc1CNCCOC1CCC1 708518010 XXTAIXUHKQCTGC-UHFFFAOYSA-N 257.280 2.329 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1 37823741 HDWRBWKRONVASR-SNPRPXQTSA-N 288.391 2.271 10 20 CECD Oc1ccccc1CN1CCC[C@@H](c2cc[nH]n2)C1 39353606 OSFKCEOCOBZTEK-GFCCVEGCSA-N 257.337 2.495 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2(C3CC3)CC2)c1 126878211 CNJVKEMHWBUJIZ-UHFFFAOYSA-N 290.363 2.390 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N(C)CCO)c2C)c1 128086494 MABMNWRLFUCPRS-UHFFFAOYSA-N 286.375 2.467 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCOCCN(C)C 219323542 LQQCCNCPLOWFSE-UONOGXRCSA-N 292.423 2.417 10 20 CECD CC[C@@H](NC(=O)c1ccc(C)c(O)c1O)[C@@H]1CCCO1 182905422 METHRJGKNZCNPX-NEPJUHHUSA-N 279.336 2.094 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C\c2ccco2)c1 255422984 FKXYYUJIDUOGHJ-ALCCZGGFSA-N 273.288 2.323 10 20 CECD Cc1ccc([C@H](O)CNCc2ccc(N(C)C)cc2)o1 266028337 RWLIRDVJEJGMRR-OAHLLOKOSA-N 274.364 2.477 10 20 CECD CCOc1cccc(CN2CC[C@@H](C)[S@@](=O)CC2)c1O 277725609 SSPXCNRSHWQRSV-ODXCJYRJSA-N 297.420 2.134 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](N3CCCC3=O)C2)cc1C 276857014 JVRUHWVIAIQQKP-OAHLLOKOSA-N 288.391 2.206 10 20 CECD CO[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 371685286 KRGRKJBMGFUYTQ-VUDGCMKMSA-N 291.347 2.139 10 20 CECD COC(=O)[C@]1(F)CCN(Cc2cccc(Cl)c2O)C1 271879117 UODSFTNXRYJYDO-ZDUSSCGKSA-N 287.718 2.133 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)C1=COCCO1 282466421 KHTUDJPEPABBNO-UHFFFAOYSA-N 291.347 2.409 10 20 CECD Nc1ccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@H]3N2)cc1 294764990 MCDUTFQNRRBCEI-HONMWMINSA-N 259.353 2.128 10 20 CECD CCCc1nnc(NC(=O)c2c(F)ccc(O)c2O)s1 295514336 VCAYYBQNHPZZRG-UHFFFAOYSA-N 297.311 2.293 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N(C)CCN)c1C 818010664 RCDAKQBNNWYZRD-UHFFFAOYSA-N 285.391 2.433 10 20 CECD COC[C@]1(CN[C@@H](C)c2cc(Cl)ccc2O)CCCN1 817975890 ZFQJCUFJJWNQEJ-XHDPSFHLSA-N 298.814 2.465 10 20 CECD COC[C@H](O)CN1C[C@H](C(C)C)Cc2cc(OC)ccc21 817298684 OOYIKSVTHCBKHX-HUUCEWRRSA-N 293.407 2.337 10 20 CECD CC(C)(C)OC(=O)N1CC[C@H]1CNCc1ccccc1O 724920035 CRJYMUZZLIVBFE-ZDUSSCGKSA-N 292.379 2.491 10 20 CECD Cc1cccc(CN(CCO)C2CCSCC2)c1O 825133709 LJPHDXGNUVRLIM-UHFFFAOYSA-N 281.421 2.391 10 20 CECD C[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)CS1 840415833 IPWFSNJIPSAACB-JQWIXIFHSA-N 280.393 2.428 10 20 CECD COc1ccc(N(C)CCN(C)CCN2CCCC2)cc1 844400285 ZKXOBXUCJAKUGI-UHFFFAOYSA-N 291.439 2.159 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@H]1CCC(F)(F)C1 910946000 HMUHEEDRIIINAP-QMMMGPOBSA-N 271.263 2.149 10 20 CECD O=C(NCc1ccc(O)cc1O)c1coc(C2CCC2)n1 910945554 DBYAYGFVODEGSI-UHFFFAOYSA-N 288.303 2.283 10 20 CECD Cc1ccc([C@@H](C)NCc2nnn(C(C)(C)C)n2)c(O)c1 848560667 JDLHFVGSJYZEDV-LLVKDONJSA-N 289.383 2.293 10 20 CECD C[C@@H](CN)CNCc1ccc(N(C)C)cc1C(F)(F)F 841047664 AVCMIVBBEVBVDP-JTQLQIEISA-N 289.345 2.456 10 20 CECD COc1cccc([C@@H](C)NC[C@H]2CCCOC2)c1O 846143579 JPZBVYHWUHUFLD-VXGBXAGGSA-N 265.353 2.478 10 20 CECD CC[C@@H](CN(C)c1ccc(OCC(=O)OC)cc1)OC 842154503 UKDIWMJGJWXWNH-ZDUSSCGKSA-N 281.352 2.100 10 20 CECD COc1cc(Cl)cc(CNC[C@H]2CCCCN2)c1O 841033381 SKCFCNYLJAQWLA-GFCCVEGCSA-N 284.787 2.286 10 20 CECD COCC1(NC(=O)/C=C/c2ccc(O)c(O)c2)CCCC1 855217623 BZZXXAPVTKAWHH-FNORWQNLSA-N 291.347 2.186 10 20 CECD Cc1cc(CN(C)Cc2cnc[nH]2)ccc1N(C)C 852287790 GBXBVXZYHATGPR-UHFFFAOYSA-N 258.369 2.416 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCN(C(C)(C)C)C2)c(O)c1O 855287410 BYLMAKPMGJUKSG-NSHDSACASA-N 292.379 2.009 10 20 CECD Nc1ccc(NC(=O)c2ncc3n2CCCC3)cc1 867967058 YSSHWXPYYRQCJE-UHFFFAOYSA-N 256.309 2.054 10 20 CECD CC(C)(C)[C@@H](O)C(=O)NCCCSc1nccs1 765041209 HLSBTFQPGXFCOR-VIFPVBQESA-N 288.438 2.149 10 20 CECD CCCCCNC(=O)CN[C@H](C)c1ccccc1O 879647972 TYLCWRQPORWINB-GFCCVEGCSA-N 264.369 2.349 10 20 CECD Cc1cccc(O)c1CN1CCO[C@@]2(CCO[C@H]2C)C1 877485874 BMROHJBTOVITQN-BBRMVZONSA-N 277.364 2.080 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2c(C)cccc2O)C1 876816167 WDWRGMBCOFQJIS-AWEZNQCLSA-N 276.380 2.001 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](O)c2ccco2)c1 775369707 FTCZWILPZSCTBU-YGRLFVJLSA-N 277.320 2.378 10 20 CECD Cc1cccc(O)c1CN1CCC(OC(=O)N(C)C)CC1 877553517 UQZHBSCQVSCXPS-UHFFFAOYSA-N 292.379 2.363 10 20 CECD CC1=CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 779543716 YFXZWWQTJGDMBX-HYXAFXHYSA-N 259.305 2.290 10 20 CECD COCC[C@]1(NCc2ccc(N(C)C)c(F)c2)CCOC1 775031749 FXTUAKNQFCWYJL-INIZCTEOSA-N 296.386 2.177 10 20 CECD CCOC(=O)N(C)CCCC(=O)N(C)c1ccc(N)cc1 884442129 XFNDZQZVHYDULS-UHFFFAOYSA-N 293.367 2.100 10 20 CECD CCN(C)c1ccc(Cn2cc(CC(C)(C)O)nn2)cc1 881316608 WNXBLIPMKXBFQU-UHFFFAOYSA-N 288.395 2.096 10 20 CECD CC[C@H](NCC1(CO)COC1)c1cc(Cl)ccc1O 775522529 SLYXKEHSNGCBRL-LBPRGKRZSA-N 285.771 2.095 10 20 CECD CNC(=O)C1CCC(N[C@@H](C)c2c(O)cccc2F)CC1 886516647 RQTYNUPCYAJUQJ-UNXYVOJBSA-N 294.370 2.487 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)c2n[nH]c(C)n2)c1 894771418 IJSZORDIGSPGQF-VIFPVBQESA-N 276.340 2.068 10 20 CECD CC(C)[C@H](CNC(=O)c1cc(O)cs1)c1ccnn1C 788591355 IABZXRNCSWHTQP-NSHDSACASA-N 293.392 2.357 10 20 CECD Oc1cccc(Cl)c1CN1CCOC2(CCOCC2)C1 271228136 BGGVNYYXPCXOET-UHFFFAOYSA-N 297.782 2.427 10 20 CECD COc1ccc2c(c1)CCCN2CC(=O)N1CCCCC1 796306777 MXOZJVKJALIBMG-UHFFFAOYSA-N 288.391 2.460 10 20 CECD COC[C@@H](C)NCc1cccc(Br)c1O 42411567 GKPBDOIAOLKOIX-MRVPVSSYSA-N 274.158 2.279 10 20 CECD Nc1ccc(NC(=O)Cc2ccc3c(c2)CCO3)cc1 746478698 RJPORGSBGLQVRJ-UHFFFAOYSA-N 268.316 2.385 10 20 CECD Cc1ccc(CN2CCN(C(=O)CC(C)C)CC2)c(O)c1 1140950682 CLQZTHKNLPBCSE-UHFFFAOYSA-N 290.407 2.391 10 20 CECD CN(Cc1ccccc1O)C(=O)C1(C)CCOCC1 726801612 YOCPHDCNRKQNHN-UHFFFAOYSA-N 263.337 2.167 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1CCCCCN1 1329514248 SIFCKJLEYQMKFG-NSHDSACASA-N 299.465 2.274 10 20 CECD CC(C)(C)C(=O)C(=O)Nc1c(Cl)ccc2nonc12 1327167205 PNAOKTOFYZZXFR-UHFFFAOYSA-N 281.699 2.430 10 20 CECD CCC[C@@]1(NC(=O)NCc2ccc(N)cc2)CCOC1 1335737711 SMKVWTYNEREDCU-OAHLLOKOSA-N 277.368 2.027 10 20 CECD C[C@H]1C[C@H](CCNC(=O)NCc2ccc(N)cc2)CCO1 1337014976 GYUSQCBERTUAGH-QWHCGFSZSA-N 291.395 2.273 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2COC(C)(C)O2)c1 230206459 RBGIZOVBYZLWAR-CMPLNLGQSA-N 281.352 2.203 10 20 CECD CCc1cccc(CN2CC[C@H](C(=O)O)[C@H](C)C2)c1O 1573960970 OVTXXUBLNMHULT-RISCZKNCSA-N 277.364 2.497 10 20 CECD C[C@H](C(=O)O)C(=O)NCc1ccc(N2CCCCC2)cc1 1588573994 RJQHRDWGNNIYCH-LBPRGKRZSA-N 290.363 2.014 10 20 CECD C[C@H](N[C@@H](C)c1cc(C(=O)O)ccc1O)c1csnn1 1593199703 YPUNRSBLCNQCLQ-YUMQZZPRSA-N 293.348 2.354 10 20 CECD CCc1cccc(CN(C)[C@H](C)[C@@H](C)S(C)(=O)=O)c1O 848886421 FGROLYTUMQTHSD-VXGBXAGGSA-N 299.436 2.208 10 20 CECD Cc1ccc(CNCCCCn2ccnc2)c(O)c1 876958445 DDXDOMQGHJIRQS-UHFFFAOYSA-N 259.353 2.467 10 20 CECD Oc1cc2c(cc1CNCCc1ccccc1)OCO2 42879218 ZLJFXJWYCWTNIL-UHFFFAOYSA-N 271.316 2.453 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCc1nncn1C 38007586 DNHNQDOVQBAUDG-QWRGUYRKSA-N 272.352 2.167 10 20 CECD Cc1oc(C(=O)O)cc1COc1cccnc1[N+](=O)[O-] 51361055 QQNLXGNKOJDKCQ-UHFFFAOYSA-N 278.220 2.168 10 20 CECD OCCCSCCN[C@@H]1CCc2cccc(O)c21 297719270 NCOJFRLBEXSRTC-GFCCVEGCSA-N 267.394 2.085 10 20 CECD CN(C)c1ccc(CNCc2ncc(C(=O)O)s2)cc1 312839920 VEFPNOIKRMKPMQ-UHFFFAOYSA-N 291.376 2.197 10 20 CECD CS[C@H]1CC[C@@H](NC(=O)Cc2ccc(N)cc2)C1 226374488 XWTPMLYYTZAMBB-OLZOCXBDSA-N 264.394 2.212 10 20 CECD COc1cccc(CNCc2nc(C)cs2)c1O 38090777 SKNDFUVTWSMIDV-UHFFFAOYSA-N 264.350 2.456 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(O)CCC2)cc1F 184767443 FFVZOEGFGSDDJE-UHFFFAOYSA-N 294.370 2.203 10 20 CECD CNC[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 128315481 QYTFQCUPJHGXED-NSHDSACASA-N 268.788 2.477 10 20 CECD Cc1cc(O)c(CN2CCS(=O)(=O)[C@@H](C)[C@@H]2C)cc1C 122526830 CGUAVLZGRVCDAM-STQMWFEESA-N 297.420 2.016 10 20 CECD CN(C)CC[C@H](NC(=O)c1cccc(O)c1O)C(C)(C)C 185673203 VLOFCFYXPPMZNM-ZDUSSCGKSA-N 294.395 2.194 10 20 CECD C[C@@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(F)c(F)c1O 187792213 HWIKALZSQHLJEG-BDAKNGLRSA-N 296.317 2.084 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2cccnc2)cc1 82269883 RZYXJKPPVFSAOL-UHFFFAOYSA-N 269.348 2.007 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C(=O)O)C2CC2)c1O 229118476 BIWNPIQYAZMMEX-LLVKDONJSA-N 285.727 2.007 10 20 CECD CC(=O)OC1CCN(Cc2cc(C)ccc2O)CC1 93454085 FZIJYBGMIIAUSU-UHFFFAOYSA-N 263.337 2.228 10 20 CECD C[C@@H](NC[C@H](O)C1CCOCC1)c1ccc(N(C)C)cc1 90055585 AXVMVFLNRDNYIE-DYVFJYSZSA-N 292.423 2.191 10 20 CECD Cc1cc(NS(=O)(=O)C[C@H]2CCCCO2)ccc1O 182475373 PKHDCGBYWIJGTI-GFCCVEGCSA-N 285.365 2.011 10 20 CECD CN1CCCc2cc(CNC(=O)c3cccc(O)n3)ccc21 278840905 KMRXZTLCVMTAKA-UHFFFAOYSA-N 297.358 2.100 10 20 CECD COc1cccc(CN(C)C[C@H]2CCCC[C@H]2O)c1O 272632788 NILHDQHRPQYXIJ-TZMCWYRMSA-N 279.380 2.384 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCO[C@@H](C)C2)c1 271315510 XLSMQLXVARTJOZ-WCQYABFASA-N 265.353 2.448 10 20 CECD CO[C@H]1CCC[C@@H](CC(=O)NCc2ccc(O)c(O)c2)C1 279940752 OMYPOIMPFLCWAF-YPMHNXCESA-N 293.363 2.309 10 20 CECD Oc1cc2c(cc1CN1CCOCC3(CCC3)C1)OCO2 373392034 KNVVJPPJKRNRPO-UHFFFAOYSA-N 291.347 2.123 10 20 CECD CC[C@H](N[C@H](CO)COC)c1cccc(Cl)c1O 286942143 GXZDHJFYZOHUCY-SKDRFNHKSA-N 273.760 2.094 10 20 CECD CCN(Cc1cc(Cl)cc(C(C)=O)c1O)[C@H](C)CO 292174302 MATFRZAPIJUELA-SECBINFHSA-N 285.771 2.451 10 20 CECD COc1ccc(O)c(CN2CC[C@H](O)CC(C)(C)C2)c1 295232215 OBQRHXMBKGMNFV-ZDUSSCGKSA-N 279.380 2.384 10 20 CECD Cc1ccc(O)c(CN(C)C[C@H](O)C(F)(F)F)c1 809751314 QQHALNBTAUDJBU-NSHDSACASA-N 263.259 2.056 10 20 CECD CNC(=O)[C@H]1CCCCN1Cc1ccc(N(C)C)c(C)c1 292952089 CCGIWVOZOULGKG-MRXNPFEDSA-N 289.423 2.162 10 20 CECD CC[C@H](N)CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 817978836 FPKDJJPKDNVBRJ-QXEWZRGKSA-N 252.333 2.407 10 20 CECD CCC1(C(=O)NCCc2ccc(N)cc2)CCOCC1 818545178 NCJOXEXARSQEPQ-UHFFFAOYSA-N 276.380 2.134 10 20 CECD Oc1ccc(Cl)cc1CN1CCC[C@H](O)CC1 816667892 YYDLDQFBEGUTGE-LBPRGKRZSA-N 255.745 2.392 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@H](C)S(=O)(=O)[C@@H](C)C2)c1 811798361 MMCIUQKJTFLBEI-STQMWFEESA-N 297.420 2.016 10 20 CECD CC(C)[C@@H](C(=O)O)[C@H](C)NCc1ccc2c(c1)CCO2 819163585 KXVOBPALTWGOGT-XHDPSFHLSA-N 277.364 2.456 10 20 CECD C[C@H](NC(=O)[C@](C)(O)C1CCC1)c1ccc(N(C)C)cc1 813525326 QDHYTBSWKVAOSY-YVEFUNNKSA-N 290.407 2.481 10 20 CECD Cc1cc(O)c(CNCCCc2cnn(C)n2)cc1Cl 826013723 XZAYHIIPCKDZJX-UHFFFAOYSA-N 294.786 2.205 10 20 CECD Cc1ncsc1/C=C/C(=O)N1CCCc2n[nH]cc21 493607757 AXDCZEOPNZNMDM-SNAWJCMRSA-N 274.349 2.167 10 20 CECD CCC1(CN[C@@H](C)c2cc(C(=O)OC)ccc2O)COC1 834899665 LIHHCSIGMPIVTN-NSHDSACASA-N 293.363 2.256 10 20 CECD C[C@H](N[C@@H]1C[C@H]2CCCCN2C1=O)c1ccc(F)cc1O 834916164 VRIWYWBFONDWME-ZKYQVNSYSA-N 292.354 2.335 10 20 CECD CN(Cc1ccc(-c2nn[nH]n2)cc1)Cc1ccccc1O 736818046 LWISBEFHTFMADK-UHFFFAOYSA-N 295.346 2.204 10 20 CECD CN(Cc1cc(F)ccc1O)C(C)(C)CN1CCOCC1 840977972 OKBKBOHRLCTFIM-UHFFFAOYSA-N 296.386 2.074 10 20 CECD CCOc1ccc(CN(C)CC(C)(C)CN)c(O)c1 843056691 WOILQGGMQNYQJP-UHFFFAOYSA-N 266.385 2.208 10 20 CECD CCc1cccc(CN2C[C@@H]3CCCN[C@@H]3C2)c1O 848886850 JBZVVYDENGMUBV-DZGCQCFKSA-N 260.381 2.138 10 20 CECD C[C@H](CCCN)NCc1cc(Cl)cc([N+](=O)[O-])c1O 841078369 BSCKTNZYWBFEES-MRVPVSSYSA-N 287.747 2.171 10 20 CECD Cc1cc(O)c(CNCC2(C)CCNCC2)cc1C 841057054 LLCFEBVTDTXBAD-UHFFFAOYSA-N 262.397 2.488 10 20 CECD NC[C@H]1CC[C@@H](NCc2cc(Cl)cc(F)c2O)C1 841084651 MNQSMHHSVMEDJH-GZMMTYOYSA-N 272.751 2.402 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1nccs1 759598292 VRPNKIVCILDBOJ-RQOWECAXSA-N 277.301 2.311 10 20 CECD COc1cccc(O)c1CN(C)Cc1ccncc1 757886502 DEDIEPDSQKRVJT-UHFFFAOYSA-N 258.321 2.428 10 20 CECD Cc1cc(CN2CC[C@@H]([C@H](C)N)C2)ccc1N(C)C 923331445 MBXWYTNUCWKCGS-DZGCQCFKSA-N 261.413 2.230 10 20 CECD C[C@]1(C(=O)NCc2ccc(N3CCCC3)cc2)CCOC1 755046074 KHZPKTSYEMIUAG-KRWDZBQOSA-N 288.391 2.330 10 20 CECD COC(=O)N1CCC[C@H](N[C@H](C)c2cc(F)ccc2O)C1 756526104 FMDMJGYQXFWVBZ-PWSUYJOCSA-N 296.342 2.413 10 20 CECD Cc1ccc(C(=O)OCCCn2ccnc2C)c(O)c1O 767617572 XBFVZWROKQHNKP-UHFFFAOYSA-N 290.319 2.158 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)NCc1ccc(C)cc1O 877145743 BJHYLUPLBJQXKU-NWDGAFQWSA-N 264.369 2.093 10 20 CECD Cc1ccc(C(=O)OCCN2CCCCC2)c(O)c1O 770360313 SFVMFDYDIXLELS-UHFFFAOYSA-N 279.336 2.049 10 20 CECD COc1cc(N2CC[C@H](CF)C2)c([N+](=O)[O-])cc1OC 882840739 DALWYBZLWKALCL-SECBINFHSA-N 284.287 2.408 10 20 CECD CCOC(=O)C1(CNCc2cccc(C)c2O)CC1 770665195 GKADRSCAEVVVLF-UHFFFAOYSA-N 263.337 2.134 10 20 CECD O=C(CCNCc1cc(F)cc(F)c1O)N1CCCCC1 882900510 MHZZTRXBDVFIPJ-UHFFFAOYSA-N 298.333 2.163 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H]2C[C@H](N)C2(C)C)c1O 883442914 VWHJRZDGMIUNNC-QWHCGFSZSA-N 296.798 2.464 10 20 CECD Cc1cnc(C(=O)NCCc2ccc(O)c(O)c2)c(C)c1 780660398 RQRWBNFZQQNTJD-UHFFFAOYSA-N 286.331 2.082 10 20 CECD CCO[C@@H]1CCCN(Cc2ccc(OC)c(OC)c2O)C1 891400375 BHIYCGSPWVPBMT-CYBMUJFWSA-N 295.379 2.410 10 20 CECD COc1ccc(CN2CCC[C@H]([C@@H](C)O)C2)c(O)c1OC 893417116 BXUKMIXLOXYDRK-NEPJUHHUSA-N 295.379 2.002 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)c2n[nH]c(C)n2)c1 894771417 IJSZORDIGSPGQF-SECBINFHSA-N 276.340 2.068 10 20 CECD COc1ccc(CNC(=O)[C@@H]2Cc3ccccc32)c(O)c1 794373824 MSTRMQRJJHDLLP-OAHLLOKOSA-N 283.327 2.357 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](N3CCCC3)C2)c1 133950655 UQZRGRJFLJWQKQ-CQSZACIVSA-N 276.380 2.071 10 20 CECD Oc1cc2c(cc1CNCC1SCCS1)OCO2 692849791 DXEQCCMUOAFJMK-UHFFFAOYSA-N 285.390 2.017 10 20 CECD COc1cc(CN2CCc3ncncc3C2)c(O)cc1C 1333829493 AVJZIZZVEBFAPO-UHFFFAOYSA-N 285.347 2.058 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCc1nnnn1C1CC1 1342407574 IGHSFJMWHZXZDG-PWSUYJOCSA-N 299.378 2.360 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)C[C@@H](C(=O)O)C2)c1O 1604695472 ZMSJBBPZWHOHDE-DGCLKSJQSA-N 293.363 2.252 10 20 CECD Nc1ccc(OC(=O)c2csc(-c3ncc[nH]3)n2)cc1 1580449266 FYXUABZHBYUWAA-UHFFFAOYSA-N 286.316 2.335 10 20 CECD CCc1oc(/C=C2\SC(=S)N(C)C2=O)cc1C(=O)O 1597791375 NWPPMTIDSJQYBY-UITAMQMPSA-N 297.357 2.371 10 20 CECD Cc1nc(NCc2cc(Cl)ccc2O)ncc1C(=O)O 1777522839 WRMKBSNUKIFJAX-UHFFFAOYSA-N 293.710 2.454 10 20 CECD O=C1NC(=S)S/C1=C\c1c(Cl)nc2ccccn12 16406755 BPQMJQSUTWXVCF-ALCCZGGFSA-N 295.776 2.477 10 20 CECD C[C@H]1CCNCC[C@@H]1NCc1ccc2c(c1)CCO2 817902326 NSXZFWKSCKEYAM-WFASDCNBSA-N 260.381 2.099 10 20 CECD COc1ccc(O)c([C@H](C)NCC(=O)OC(C)(C)C)c1 151758217 KXCRHPSLOVOJII-JTQLQIEISA-N 281.352 2.393 10 20 CECD c1cc2c(cc1CNC[C@H]1CCN(C3CC3)C1)CCO2 37649483 FUNXFYLJHBBFAL-CQSZACIVSA-N 272.392 2.195 10 20 CECD COc1ccc(O)c(CN[C@@H]2CSC[C@H]2C)c1 397880406 KGZYWSXCCOTDQN-BXKDBHETSA-N 253.367 2.242 10 20 CECD O=C(O)c1cnc(SCCOCC2CC2)s1 1610863423 YSSCLIODOODNNU-UHFFFAOYSA-N 259.352 2.360 10 20 CECD C[C@@H](NC(=O)c1cnn(C2CC2)c1)c1ccccc1O 827956633 NVBVNNLJAKHZKY-SNVBAGLBSA-N 271.320 2.415 10 20 CECD COc1cccc(CNC(=O)c2ccoc2C)c1O 105652895 SYIPHMUWVKQJJJ-UHFFFAOYSA-N 261.277 2.232 10 20 CECD COc1cccc([C@H]2NC(=O)CN2Cc2ccccc2)c1O 112369580 WOQLPFBMZJDMQQ-KRWDZBQOSA-N 298.342 2.031 10 20 CECD COCCCCC(=O)N1CCOc2cc(N(C)C)ccc21 173208431 OJAHVEVRTOQQDP-UHFFFAOYSA-N 292.379 2.295 10 20 CECD CC(=O)c1cc(F)cc(CN(CCCCO)C2CC2)c1O 304716383 PSJNJBHNLFLNOR-UHFFFAOYSA-N 295.354 2.471 10 20 CECD CCO[C@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 69960271 MECQUZQJBMZDIL-GFCCVEGCSA-N 276.380 2.110 10 20 CECD CCN1CC[C@@H]2CC[C@@H](C1)N2Cc1cccc(OC)c1O 180516467 YRAAKVPYDRDUCY-GJZGRUSLSA-N 290.407 2.459 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](C)CN2CCOCC2)c(O)c1 185505274 CFFYKTKPCBHKPE-HUUCEWRRSA-N 292.423 2.320 10 20 CECD O=C(NCc1ccccc1O)c1ccc2nccnc2c1 133941954 VUZIEMAAPKIOGK-UHFFFAOYSA-N 279.299 2.265 10 20 CECD COc1ccc(O)c(CN[C@]2(C)CCCOC2)c1 225932088 SPASNORFQYNTPH-CQSZACIVSA-N 251.326 2.060 10 20 CECD Cc1ccc(O)c(CN2CCC(C)(C)S(=O)(=O)CC2)c1 195203367 ZLCIWDMCEOQASS-UHFFFAOYSA-N 297.420 2.100 10 20 CECD CC(C)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264614340 HPNAJVBJNWQAAZ-VMPITWQZSA-N 274.364 2.061 10 20 CECD CCCN(C)CC(=O)NCc1c(C)c2ccccc2n1C 352124291 XGMUFAOXYOKZBJ-UHFFFAOYSA-N 287.407 2.445 10 20 CECD C[C@@H](N[C@H]1CCc2c[nH]nc2C1)c1cc(F)ccc1O 359956885 FZFTVIOIWVGDDL-SKDRFNHKSA-N 275.327 2.463 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@H](n2cncn2)C1 364505094 DGDKKIGRJXVADM-NSHDSACASA-N 278.743 2.084 10 20 CECD CC[C@@H](NCCOCCOC)c1ccc(C)cc1O 279954605 BYWHVLDKRSAGFK-CQSZACIVSA-N 267.369 2.404 10 20 CECD CCOC1CC(CCNC(=O)NCc2ccccc2O)C1 276568076 NPLJMVMJKZBKPT-UHFFFAOYSA-N 292.379 2.397 10 20 CECD Cn1cc(C[C@@H]2CCN(Cc3cc(F)ccc3O)C2)cn1 376534869 IQPNZIIKLHBNCH-LBPRGKRZSA-N 289.354 2.329 10 20 CECD CC[C@H](NC[C@@H](O)C(F)(F)F)c1ccc(F)cc1O 286339455 YGPOYFXDVGMJQP-GXSJLCMTSA-N 281.249 2.495 10 20 CECD CSCCCN(C)C(=O)c1c(F)ccc(O)c1O 295223011 XYKWGXIRHOJAFC-UHFFFAOYSA-N 273.329 2.062 10 20 CECD CCOc1ccc(O)c(CNc2ccc(CCO)nc2)c1 808432357 JNQQNKGOUFCSMG-UHFFFAOYSA-N 288.347 2.333 10 20 CECD Cc1ncc(C(=O)NCc2ccc(N)cc2)c(C(C)C)n1 297132029 HMCYAMJQZCMKAV-UHFFFAOYSA-N 284.363 2.421 10 20 CECD COc1cccc(CNCc2c(O)cccc2OC)c1O 809740156 NFDNCRRHIQYJMQ-UHFFFAOYSA-N 289.331 2.405 10 20 CECD C[C@H](N[C@H]1CCCC[C@H]1CN)c1cc([N+](=O)[O-])ccc1O 817959849 JREXJMCJCDWLFS-MJVIPROJSA-N 293.367 2.469 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccn(C)n1 727375606 IDFDKZBNZFCKHX-UHFFFAOYSA-N 286.379 2.148 10 20 CECD C[C@@H]1SCC[C@@H]1NC(=O)NCc1ccccc1O 826036012 SKLCIUYJYNCTMR-ONGXEEELSA-N 266.366 2.085 10 20 CECD O=C(CCCF)NCCCSc1nccs1 827475316 XALRWMBHKFHDEK-UHFFFAOYSA-N 262.375 2.491 10 20 CECD Cc1cc(O)c(CN[C@@H]2C=C[C@H](CO)C2)cc1Cl 825436314 RQOXUSOEYFZGPM-CMPLNLGQSA-N 267.756 2.381 10 20 CECD CN(C)C(=O)CN(Cc1ccccc1O)C1CCCC1 732204295 HZXULQMVUIHIQE-UHFFFAOYSA-N 276.380 2.225 10 20 CECD CCCNC(=S)NCc1ccc(N(C)C)cc1C 734387106 WRHRDTBPENMWJV-UHFFFAOYSA-N 265.426 2.435 10 20 CECD Cc1csc(CNC(=O)c2cc(O)cs2)n1 731866614 UIRJSISODOTRSI-UHFFFAOYSA-N 254.336 2.149 10 20 CECD CCOCc1cc(CN[C@@H]2CCN[C@@H](C)C2)ccc1OC 841062081 SKESUYVWEXOPMS-XJKSGUPXSA-N 292.423 2.462 10 20 CECD CN(CCC1CC1)C(=O)NCCc1ccc(N)cc1 841956633 DFGDNGSLIUJKAE-UHFFFAOYSA-N 261.369 2.253 10 20 CECD CCOc1cccc(CN2CC[C@]3(CCCN3)C2)c1O 841105469 PFSCEIKWVZMHBG-MRXNPFEDSA-N 276.380 2.119 10 20 CECD CCN(CC)C[C@@H](C)NC(=O)N(C)Cc1ccccc1O 921117923 GDCBTQUKGRSXMZ-CYBMUJFWSA-N 293.411 2.264 10 20 CECD C[C@H]1CCCN(C(=O)c2cc(O)cs2)[C@H]1CCO 855541188 NPXTWESGSLRUIB-ONGXEEELSA-N 269.366 2.077 10 20 CECD C[C@@H](CN[C@H](C)c1cc(F)cc(F)c1O)N(C)C 756533448 HUBOOKDLNXWMJN-DTWKUNHWSA-N 258.312 2.271 10 20 CECD COc1cc(Cl)cc(CN2C[C@H]3CCC[C@@]3(N)C2)c1O 857226736 YGXJSOSILQBGOV-IAQYHMDHSA-N 296.798 2.367 10 20 CECD O=C1C[C@@H](CN(Cc2ccccc2O)C2CCCC2)CN1 851771601 JZFJWXYFHLNHLL-CYBMUJFWSA-N 288.391 2.273 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1Cc2cccc(O)c2C1 763482283 YJIHFSDWIZIKHC-CYBMUJFWSA-N 273.307 2.494 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CCC[C@@H]2CCO)c1 875515516 PYDIRVSXMNMUAH-OCCSQVGLSA-N 292.379 2.051 10 20 CECD CSCC[C@@H](O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 775409466 GGZSHESKMRLNTH-BXUZGUMPSA-N 296.436 2.044 10 20 CECD C[C@@H](NCC1([S@](C)=O)CC1)c1c(O)cccc1F 886607132 LMAMVCXKQSSUPX-LZVRBXCZSA-N 271.357 2.093 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1(F)CCCC1 773763373 UTAOWPLEACDMTE-SNVBAGLBSA-N 281.327 2.427 10 20 CECD CCc1nocc1CN(C)C(=O)NCc1ccc(N)cc1 1120592174 QUOAATIVOSSMOS-UHFFFAOYSA-N 288.351 2.161 10 20 CECD COC(=O)C(C)(C)CCNCc1cc(F)cc(F)c1O 883117445 ZSRPFQYQRQBYDV-UHFFFAOYSA-N 287.306 2.349 10 20 CECD CC(C)NC(=O)CCN[C@@H](C)c1c(O)cccc1F 886500066 DPOJMTACSBAWIL-JTQLQIEISA-N 268.332 2.097 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccns1 1120649415 SBWWSZYVKRWXGN-UHFFFAOYSA-N 283.349 2.264 10 20 CECD CCCc1nnc(NC(=O)Cc2ccc(N)cc2)s1 82699057 ZJDWFIPXLYYEPX-UHFFFAOYSA-N 276.365 2.254 10 20 CECD COc1ccc(CN2CCC[C@@](C)(OC)C2)c(O)c1OC 894141595 XYADGKIOMBUTHU-MRXNPFEDSA-N 295.379 2.410 10 20 CECD CCOc1ccc(O)c(CN[C@]2(C)CCO[C@@H]2C)c1 784641357 XQAWSJTWWIVMJA-IAQYHMDHSA-N 265.353 2.448 10 20 CECD CC1=NO[C@H](CNCc2c(O)ccc(Cl)c2F)C1 895304682 PGGOLANSLNPBRS-QMMMGPOBSA-N 272.707 2.439 10 20 CECD CC(C)=CC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891256904 BLWFMWBZBMXFAZ-INIZCTEOSA-N 289.423 2.438 10 20 CECD COc1ccc(CNC(=O)NC2CCCC2)c(O)c1 792764610 UVUZMJRMGNUYGF-UHFFFAOYSA-N 264.325 2.143 10 20 CECD CCc1cccc(CNCCC(=O)N[C@H](C)CC)c1O 691464608 IYWWMBTZWWSWPY-GFCCVEGCSA-N 278.396 2.349 10 20 CECD Oc1ccccc1CN1CCCC[C@H]1[C@@H]1CCCN1 63188447 VIBSKIJIGGZIKY-GJZGRUSLSA-N 260.381 2.499 10 20 CECD Cc1cccc(CN2C[C@@H](C)S(=O)[C@H](C)C2)c1O 792191990 HZRZSUIGUFUUNU-VXGBXAGGSA-N 267.394 2.042 10 20 CECD COc1cccc(CN(CC(=O)O)C2CCCC2)c1O 86749132 YCEVKTQLDJFAPI-UHFFFAOYSA-N 279.336 2.230 10 20 CECD C[C@@H](N[C@H](C)C1CCS(=O)(=O)CC1)c1ccccc1O 877755431 AXYFYPUTRJKCJI-VXGBXAGGSA-N 297.420 2.256 10 20 CECD NC[C@@H]1CN(Cc2ccc(N)cc2)CC[C@H]1C(F)(F)F 1337838936 VZAQQGOVFUFFNX-DGCLKSJQSA-N 287.329 2.228 10 20 CECD CC(C)NCc1ccc(N2CCOCC2)c(F)c1 34823054 LNFSZPPKAFHQNQ-UHFFFAOYSA-N 252.333 2.160 10 20 CECD CCc1cc(CN[C@@H](C)c2cc(C(=O)O)ccc2O)n[nH]1 1597478776 VCMSDYQOHHHPSU-VIFPVBQESA-N 289.335 2.227 10 20 CECD CC(C)(CCCO)CNC(=O)Nc1ccc(N)cc1 841296180 QCXMUXKIPOBESI-UHFFFAOYSA-N 265.357 2.189 10 20 CECD Cc1cccc(CN[C@@H](C)C(=O)NC(C)(C)C)c1O 135760949 SHOXBCLMJNJNEX-NSHDSACASA-N 264.369 2.093 10 20 CECD CC[C@@H](NC[C@](C)(O)CCOC)c1ccccc1O 186195996 FRPGZODYRGWMFZ-UKRRQHHQSA-N 267.369 2.220 10 20 CECD C[C@H](NCCN1CCCC1=O)c1ccc(N(C)C)cc1 405445690 SGFYASKZKYNZDS-ZDUSSCGKSA-N 275.396 2.026 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NC(C)C)c1 103504810 NUZGPFDHMOKRML-VIFPVBQESA-N 252.314 2.169 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cccc[n+]2[O-])cc1 57126492 GONHBVXXVCWDQG-UHFFFAOYSA-N 299.374 2.096 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCc1nccs1 51757330 HORVZSITINIPOM-UHFFFAOYSA-N 291.376 2.233 10 20 CECD CCN(CCC(=O)OC)Cc1cccc(Cl)c1O 179825860 NFOMBJQDJXOVLE-UHFFFAOYSA-N 271.744 2.431 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCC(=O)N(C)C)cc1 178293085 JQVBVBZUKRTLKB-CYBMUJFWSA-N 277.412 2.272 10 20 CECD O=C1CCCCN1C1CCN(Cc2ccccc2O)CC1 179581485 HIJMEQKQFPPKLJ-UHFFFAOYSA-N 288.391 2.369 10 20 CECD COc1ccc(N2CCN(C(C)C)CC2)cc1F 121979448 ZPWCTRHHJGSQKX-UHFFFAOYSA-N 252.333 2.365 10 20 CECD Nc1ccc(CC(=O)N2CCc3ccccc3CC2)cc1 79570035 ILHPGJWFHWAJTB-UHFFFAOYSA-N 280.371 2.439 10 20 CECD COC(=O)N1CC(N[C@@H](C)c2cc(Cl)ccc2O)C1 186137200 ONSYVDLWFPDMGQ-QMMMGPOBSA-N 284.743 2.147 10 20 CECD Cc1ccc(C(=O)Nc2ccc(F)cn2)c(O)c1O 182127633 FLLNWUPYXWKBST-UHFFFAOYSA-N 262.240 2.193 10 20 CECD Cc1ccccc1CC(=O)NCCc1ccc(O)c(O)c1 98076926 QQXYOCXXNCXFLW-UHFFFAOYSA-N 285.343 2.308 10 20 CECD CCNC(=O)C1(CNCc2cccc(C)c2O)CCC1 277269140 POJIPDQKHHXOJE-UHFFFAOYSA-N 276.380 2.097 10 20 CECD COc1ccc(N2CCC(NC[C@@H](O)C3CC3)CC2)cc1 377634044 WOKZYOQCVDPFOP-QGZVFWFLSA-N 290.407 2.025 10 20 CECD COc1cccc(CNC(=O)C[C@H]2CCC(=O)[C@@H]2C)c1O 280018842 TZKOCDHTVHRGAT-GHMZBOCLSA-N 291.347 2.022 10 20 CECD CC(C)N(C)C[C@@H](C)NCc1cc([N+](=O)[O-])ccc1O 289871698 RDYOEYUZOWMVRA-LLVKDONJSA-N 281.356 2.119 10 20 CECD CCC[C@@]1(CO)CCN(Cc2c(O)cccc2OC)C1 809790149 AONCKRGXWHUQSM-MRXNPFEDSA-N 279.380 2.385 10 20 CECD OC[C@@H]1CN(Cc2ccccc2O)c2ccccc21 293910885 LVIAFGOGNBSBQY-ZDUSSCGKSA-N 255.317 2.488 10 20 CECD Cc1nccnc1CCN[C@@H](C)c1ccccc1O 295071809 SCXTYYRKFJCDRG-NSHDSACASA-N 257.337 2.384 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H](O)C2CCOCC2)c(O)c1 294838148 RPPYVHGYCOUOIA-CZUORRHYSA-N 293.407 2.447 10 20 CECD C[C@@H](NC[C@@H]1C[C@H](F)CN1)c1cc(Cl)ccc1O 817976658 QNVHPTBIBJDPOS-MIMYLULJSA-N 272.751 2.396 10 20 CECD CCn1nc(C)c(CNCc2c(O)ccc(Cl)c2F)n1 818223142 QSEBMPRTOHOYKM-UHFFFAOYSA-N 298.749 2.394 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC2CCC(N)CC2)c1 817947792 RDWNZWGIAMCBKL-PKSQDBQZSA-N 292.379 2.099 10 20 CECD Oc1cc(F)c(Cl)cc1CNCc1cocn1 816551858 QTBNKZGHIOYRFD-UHFFFAOYSA-N 256.664 2.463 10 20 CECD CC(C)N1CC[C@@H](N(C)Cc2cc3c(cc2O)OCO3)C1 825331789 NGYIBOXRNQDVJO-CYBMUJFWSA-N 292.379 2.035 10 20 CECD CCCN1CCC[C@H]1C(=O)N[C@H](C)c1ccccc1O 827930890 TUHZYIGPAYGJJU-OCCSQVGLSA-N 276.380 2.444 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@@H]([S@](C)=O)C2)c1 826910385 GHQAQUJAOXQXJC-ZGLRSVDFSA-N 297.420 2.180 10 20 CECD Cc1ccncc1/C=C/C(=O)N(C)c1ccccn1 492503437 QUOKQAPBDIXWKL-VOTSOKGWSA-N 253.305 2.461 10 20 CECD COc1cccc(O)c1CN1CCN(C2CC2)C[C@@H](C)C1 824446224 TWUHQLVMNQXEKX-ZDUSSCGKSA-N 290.407 2.317 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 903391974 KDVIAXXSSDKXAP-BBRMVZONSA-N 289.423 2.414 10 20 CECD CO[C@H]1C[C@@H](N(C)C(=O)c2cc(O)cs2)C12CCC2 839786118 CLVCQURYQHTUHU-NEPJUHHUSA-N 281.377 2.483 10 20 CECD CN(C)c1ccc(CNC[C@]2(C)CCOC2)cc1F 733328536 ZVOCGZOZSILDFD-HNNXBMFYSA-N 266.360 2.408 10 20 CECD Cc1cnn(C)c1C(=O)NCc1c(O)ccc2c1CCCC2 839692103 NJOSOONKBRNSMY-UHFFFAOYSA-N 299.374 2.243 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3[C@H](C2)C3(F)F)cc1 844461156 ITDWAWRZQMJVKV-BETUJISGSA-N 252.308 2.450 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCNC2)cc1F 841045493 WONKDZFBAAICIW-ZDUSSCGKSA-N 265.376 2.123 10 20 CECD COCC[C@H](C)CNCc1ccc(N2CCOCC2)cc1 840954710 IROZAYYDDKMFLO-HNNXBMFYSA-N 292.423 2.285 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)c1ncnn1C 840942077 RNTUIPHFXCKYNA-GFCCVEGCSA-N 273.384 2.040 10 20 CECD Cc1ccc([C@@H](C)NCC[C@@]2(O)CCCOC2)c(O)c1 846212877 NIASVGDXEBVLKQ-CJNGLKHVSA-N 279.380 2.283 10 20 CECD COCCN(CCOC)Cc1c(O)ccc2ccncc12 747451899 WCICFUMPPMJUHR-UHFFFAOYSA-N 290.363 2.035 10 20 CECD CN(C)c1ccc(CN2CCNCC2(C)C)cc1F 843054247 HLYBFWHABXYBFB-UHFFFAOYSA-N 265.376 2.076 10 20 CECD C[C@H]1C[C@H](C)N(C(=O)NCCc2ccc(N)cc2)C1 841955254 XKLJSRJDAPMJHH-RYUDHWBXSA-N 261.369 2.251 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)cc2C)C[C@H]1O 840920014 CPMKNXPSNTXMCH-CZUORRHYSA-N 262.397 2.264 10 20 CECD C/C=C\C(=O)N(C)CCN(C)c1ccc(OC)cc1 844851726 FDYSGYLBKADIGV-WAYWQWQTSA-N 262.353 2.166 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 840892045 XKRAPBNOOYUUOR-DTWKUNHWSA-N 286.322 2.234 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H]2CC(=O)N(C3CC3)C2)c1 846205713 KIGFJJXZHXFXGM-STQMWFEESA-N 288.391 2.362 10 20 CECD C[C@H](NC(=O)OCCF)c1ccc(N2CCOCC2)cc1 858918082 NUDDWIMJRHWCNY-LBPRGKRZSA-N 296.342 2.280 10 20 CECD CC(=O)CCCOC(=O)/C=C\c1ccc(O)c(O)c1 759589273 QUDGHCHVCRBWGA-ALCCZGGFSA-N 264.277 2.023 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc3c(nc2O)CCC3)c1 862758719 IPEPCSXAXWQLHR-UHFFFAOYSA-N 298.342 2.220 10 20 CECD CC[C@@](COC)(NCc1ccc(OC)c(C)c1)C(=O)OC 930684124 LXPCHCQOGMPXLU-INIZCTEOSA-N 295.379 2.061 10 20 CECD Cc1ccc(O)c(CN2CCC(O[C@@H]3CCOC3)CC2)c1 769526475 LTUUDGCQIUFADW-MRXNPFEDSA-N 291.391 2.471 10 20 CECD OC[C@H]1C[C@@H](NCc2c(O)ccc(Cl)c2F)C1 865663224 SYOHVWHXUJOCSY-OCAPTIKFSA-N 259.708 2.045 10 20 CECD Cc1nn(C)c(C)c1[C@H](C)C(=O)N(C)c1ccc(N)cc1 877077614 OUHVDNIIVXELDG-JTQLQIEISA-N 286.379 2.386 10 20 CECD CCC[C@](C)(O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775411144 PFTJVUOMFYGXIP-LRDDRELGSA-N 278.396 2.481 10 20 CECD C[C@@H]1CCCN1Cc1ccc(N2CCN(C)CC2)cc1 775691863 HDFTULZJKDKSNY-OAHLLOKOSA-N 273.424 2.423 10 20 CECD CCCN(Cc1noc(C)n1)Cc1ccccc1O 68973717 DCXWHNLDKGPMRY-UHFFFAOYSA-N 261.325 2.496 10 20 CECD O=C(/C=C\c1cccnc1)N1CCCc2ncccc21 880430248 RKZKDRADEVHDNE-FPLPWBNLSA-N 265.316 2.469 10 20 CECD C[C@H](N[C@H](C)C1(CO)CC1)c1c(O)cccc1F 886636348 LXRLIGCSZQAJBP-VHSXEESVSA-N 253.317 2.343 10 20 CECD COC(=O)[C@@](C)(CNCc1ccc(N)cc1)c1ccccc1 1120269430 SIOPFYYUUVLIEA-SFHVURJKSA-N 298.386 2.489 10 20 CECD COc1ccc(CN[C@]2(C)CCO[C@H]2C)c(O)c1OC 893521419 NJTISQLLBCVIBI-ZUZCIYMTSA-N 281.352 2.067 10 20 CECD CC[C@H](C)[C@H](OC)C(=O)NCc1ccc(N(C)C)cc1 792849083 OKCIENKULABDEW-WFASDCNBSA-N 278.396 2.430 10 20 CECD O=C(O)[C@H]1CC[C@H](NCc2cc(F)cc(F)c2O)CC1 708215150 IFELXDVVBWPIPH-JLIMDTESSA-N 285.290 2.403 10 20 CECD O=C(NCCc1nc2ccccc2o1)c1cccc(O)c1O 790818312 LJSNXTIBOUZKMU-UHFFFAOYSA-N 298.298 2.212 10 20 CECD CC[C@@H](NCCN1CCO[C@H](C)C1)c1ccc(C)cc1O 794807784 LQWXMJLZNMHVRR-GDBMZVCRSA-N 292.423 2.462 10 20 CECD CCOC(=O)[C@H](CC)N[C@H](C)c1ccccc1O 879648269 HVPRPEQDYVEUCG-PWSUYJOCSA-N 251.326 2.385 10 20 CECD C[C@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1319702177 PCIBHYBDOVQQQB-AWEZNQCLSA-N 291.414 2.419 10 20 CECD CN[C@@H](C)CCN[C@@H](C)c1cc(OC)ccc1O 1326037806 YHQVOBXMMAZZAC-QWRGUYRKSA-N 252.358 2.049 10 20 CECD Cc1nnc(O)c(CN[C@@H](C)c2c(O)cccc2F)c1C 1333466170 JYKPROCGEPYBPL-JTQLQIEISA-N 291.326 2.495 10 20 CECD CC[C@@H](F)C(=O)N[C@@H](C)c1cc(OC)ccc1O 1335820777 PCGDUVSCCJRUMS-GZMMTYOYSA-N 255.289 2.326 10 20 CECD CCC(O)(CC)CCNC(=O)NCc1ccc(N)cc1 1346649101 PVXSDQDMJHCLBI-UHFFFAOYSA-N 279.384 2.009 10 20 CECD C[C@H]1CCCCN1C(=O)NCCc1ccc(N)cc1 841962635 QCHHMGOKENMQRZ-LBPRGKRZSA-N 261.369 2.395 10 20 CECD Cc1ccc(CNCc2ccc(CO)cc2)c(O)c1 877604016 GVKYVYWJZAYPSX-UHFFFAOYSA-N 257.333 2.483 10 20 CECD C[C@@H](NCCc1ccnn1C)c1cc(F)ccc1O 184025848 CPFWTJQGOKEODJ-SNVBAGLBSA-N 263.316 2.158 10 20 CECD CCCOc1ccc(CNC[C@H]2CCCO2)c(O)c1 101588943 LPTUQFWBQCNUJY-CQSZACIVSA-N 265.353 2.450 10 20 CECD C[C@H](N[C@H](C)CO)c1ccc(Br)cc1O 134913965 RTNXFNJTAWYOGD-SFYZADRCSA-N 274.158 2.186 10 20 CECD COc1ccc(O)c(CN(C)[C@H]2CCSC2)c1 179681220 AZWFSFSQNRXMSH-NSHDSACASA-N 253.367 2.338 10 20 CECD CC(C)[C@H](CCO)NCc1ccc(N(C)C)cc1 230689170 GFYBHYHQIJTVKU-HNNXBMFYSA-N 250.386 2.249 10 20 CECD CCN(CC)C(=O)C[C@H](C)NCc1ccc(N(C)C)cc1 122782467 WNANISVVBKVHRC-AWEZNQCLSA-N 291.439 2.489 10 20 CECD CN(CCn1cccn1)Cc1ccc(N(C)C)c(F)c1 125269434 WIZXMORDMKXBRQ-UHFFFAOYSA-N 276.359 2.220 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCCC1 133914034 ZUCYCDXLMGBVJV-UHFFFAOYSA-N 271.364 2.368 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@@H]2CCCNC2)cc1 43591068 HTJMVEMXFKEXIF-AWEZNQCLSA-N 289.423 2.149 10 20 CECD CCOc1cccc(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)c1O 130620939 JIJQCWKKEAFYER-CFVMTHIKSA-N 290.407 2.350 10 20 CECD CC(C)C[C@@H](O)CNCc1ccc(N2CCOCC2)cc1 224269530 SCNAHPCYYTWHKZ-QGZVFWFLSA-N 292.423 2.020 10 20 CECD C=Cn1cc(CNCc2ccc(N(C)C)c(F)c2)cn1 194273821 BLJNICDMCFBLGY-UHFFFAOYSA-N 274.343 2.479 10 20 CECD Cn1cc(-c2n[nH]cc2C(=O)N2CCc3ccccc32)cn1 435819099 PGKYTQBUJNYGJM-UHFFFAOYSA-N 293.330 2.013 10 20 CECD CC[C@@H](O)CN(Cc1ccc(N(C)C)cc1)C1CC1 264471526 RVVDFGGDCDTABY-MRXNPFEDSA-N 262.397 2.488 10 20 CECD CC(C)CNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264802456 YINVHLXWPFARRQ-VMPITWQZSA-N 288.391 2.309 10 20 CECD CCc1nc([C@H](C)N[C@@H](C)c2ccccc2O)n[nH]1 272863001 NGUIDJMYMNKTCU-UWVGGRQHSA-N 260.341 2.485 10 20 CECD Cc1ccc(C(=O)NCC[C@H]2CCO[C@@H](C)C2)c(O)c1O 273222725 UBXWPYNOOZKLEU-RYUDHWBXSA-N 293.363 2.341 10 20 CECD C[C@@H](NC[C@H](O)CN1CCCC1)c1cc(Cl)ccc1O 273383861 IVOFPZIJKWOLMX-YPMHNXCESA-N 298.814 2.153 10 20 CECD C[C@@H](N[C@H](C)c1ccc(F)c(F)c1O)c1ncn(C)n1 277003715 ZRMPFPTYKFMOIF-HTQZYQBOSA-N 282.294 2.211 10 20 CECD CC[C@@H]1NC(=O)N(Cc2ccc(N3CCCC3)cc2)C1=O 272366008 ZHJSLQXAIGHKGY-AWEZNQCLSA-N 287.363 2.117 10 20 CECD CCN(C)c1ccc([C@H](C)NCC(=O)NCC(F)F)cc1 280759212 FICHIBYKWKDWAI-NSHDSACASA-N 299.365 2.175 10 20 CECD CC[C@@H](NC[C@@H](O)C1CCOCC1)c1ccc(F)cc1O 286004631 HTNHXDJCVLWTIH-GDBMZVCRSA-N 297.370 2.360 10 20 CECD CCC[C@]1(NCc2cc([N+](=O)[O-])ccc2O)CCOC1 285406779 CWCPIEIKOOKUMH-AWEZNQCLSA-N 280.324 2.349 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@H]2CCCCO2)cc1 299214822 DYMXQRJKIPHMPH-OAHLLOKOSA-N 291.395 2.121 10 20 CECD CCOc1ccc(CN(C)C[C@@H](O)C(F)(F)F)c(O)c1 809751944 YVXBTWAHVIIEME-GFCCVEGCSA-N 293.285 2.146 10 20 CECD C[C@H](NCC(C)(C)OCCO)c1cc(F)cc(F)c1O 806664394 OXHYBIWWMRJMGV-VIFPVBQESA-N 289.322 2.109 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](CN)CC(C)C)c1 817959802 VGBJZVWMZMMJDC-YPMHNXCESA-N 294.395 2.203 10 20 CECD COc1ccc(CNCc2cnn(CC(F)F)c2)c(O)c1 816597313 MVNPMEKCGSAHJK-UHFFFAOYSA-N 297.305 2.152 10 20 CECD Cc1ccc(O)c(CN2CCC[C@@H](OC(=O)N(C)C)C2)c1 824615217 CACDUTZFKCWTKX-CQSZACIVSA-N 292.379 2.363 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCc1ccc(O)c(O)c1 827316989 LOLSLHMTQNUQLY-SDDRHHMPSA-N 261.321 2.150 10 20 CECD C[C@@H](NC(=O)CCCCc1cnn[nH]1)c1ccccc1O 827941801 YNMOPYXPPULXAQ-LLVKDONJSA-N 288.351 2.101 10 20 CECD Cc1cccc(CN[C@@H]2CCC[C@H]([S@@](C)=O)C2)c1O 826911109 RZYHCWRDEMVMMP-BIENJYKASA-N 281.421 2.480 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cc(C(=O)O)ncn1 906144578 NQSMZQGPYCGVLX-UHFFFAOYSA-N 286.335 2.161 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@H](C)c1cc(C)ccc1O 903342479 FIDMTBLLZQQGCL-CABCVRRESA-N 292.423 2.462 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@]2(C)CCC(=O)N2)c(O)c1 834909630 STKFABQJUNIZJT-BLLLJJGKSA-N 276.380 2.328 10 20 CECD CC[C@H](C)CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832278532 DSEJKEIAMDQAGW-SWLSCSKDSA-N 277.412 2.305 10 20 CECD Cc1cc(C(=O)NCc2ccc(O)cc2O)nn1C(C)C 910943391 BNBWDDYCORIFMU-UHFFFAOYSA-N 289.335 2.114 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H](C)c1ccc(N(C)C)cc1 834904075 MMYRLDPQKVAIDX-DAXOMENPSA-N 278.396 2.207 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1O 833767142 BOPPMYLNQYFIDF-TUAOUCFPSA-N 281.377 2.219 10 20 CECD COC/C(C)=C\C(=O)NCc1c(O)ccc2c1CCCC2 845833170 DDNUXKXNYJGQMA-XFXZXTDPSA-N 289.375 2.480 10 20 CECD COC(=O)c1cnc(SCc2nncs2)s1 917778321 PDNYLKZXYFFADG-UHFFFAOYSA-N 273.364 2.074 10 20 CECD COc1cccc([C@H](C)NCC2(CO)CCC2)c1O 846161708 BFGBRIXULWOFTH-NSHDSACASA-N 265.353 2.214 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CC[C@@H](C)O 840917769 MMMQWYUDCYTKEY-CYBMUJFWSA-N 250.386 2.264 10 20 CECD CCOCC1(C(=O)NCc2cc(Cl)ccc2O)CC1 846476477 MYSQCWASOZEFQL-UHFFFAOYSA-N 283.755 2.479 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)NCc1cc(Cl)ccc1O 846471914 DLQMZGWRZOPQNR-CMPLNLGQSA-N 269.728 2.087 10 20 CECD CCC[C@H](C)S(=O)(=O)NCc1ccc(OC)cc1O 845927998 LGUVNJKKIZASCW-JTQLQIEISA-N 287.381 2.009 10 20 CECD COc1ccc(CNCc2nnn(C(C)(C)C)n2)cc1C 848565740 RZLSAUAPAGINDN-UHFFFAOYSA-N 289.383 2.035 10 20 CECD CC(C)[C@@H](N)CNCc1cccc(Br)c1O 841029949 PMTNUJUIDLZPOW-NSHDSACASA-N 287.201 2.228 10 20 CECD CC[C@H](NCCS(=O)(=O)C1CC1)c1ccc(C)cc1O 840878053 AFKCULKHRTVIEX-AWEZNQCLSA-N 297.420 2.319 10 20 CECD COC(=O)CC1CC(N[C@@H](C)c2cc(OC)ccc2O)C1 845971143 HKFABKJEDGFELQ-UNXYVOJBSA-N 293.363 2.393 10 20 CECD CC(C)Cn1nccc1C(=O)NCc1ccccc1O 843831293 DPGOOYNVECLWMD-UHFFFAOYSA-N 273.336 2.175 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)c2cccnc2)cc1 844852846 UOFFUPSXIYUAGG-UHFFFAOYSA-N 299.374 2.299 10 20 CECD C[C@H](CC(N)=O)N[C@H](C)c1cc2c(cc1O)CCCC2 756660141 JDPJQQDRMMYDFO-GHMZBOCLSA-N 276.380 2.186 10 20 CECD Cc1cc(CCN=c2nc[nH]n2C)c(C)n1-c1ccccc1 858867190 CZRVZKMMTZKIRX-UHFFFAOYSA-N 295.390 2.299 10 20 CECD CCCCc1nc(COC(=O)c2cccc(O)c2O)no1 758564066 ZTLPZFMWQYRXMX-UHFFFAOYSA-N 292.291 2.180 10 20 CECD Cc1ccc(C(=O)Nc2ncc(C3CC3)[nH]2)c(O)c1O 869171845 ZJJPJNPUWIRBHA-UHFFFAOYSA-N 273.292 2.259 10 20 CECD CCOC(=O)[C@H](C)NCc1cc(C)c(C)cc1O 763271044 CZPZJXUKNGHZML-NSHDSACASA-N 251.326 2.050 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H](C3CC3)C1)[C@@H](O)CO2 768465707 QQKVEBNTLRKNDH-ABAIWWIYSA-N 275.348 2.050 10 20 CECD CCN(CCCO)Cc1cccc(Br)c1O 769482961 MEFKBSZATYHKHE-UHFFFAOYSA-N 288.185 2.359 10 20 CECD CCOCCNC(=O)CNc1ccccc1NC(C)C 871845533 DPFRJXSMICKUBJ-UHFFFAOYSA-N 279.384 2.072 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)cc1 130618563 NLZNUUCMCVIGPL-UAGQMJEPSA-N 273.424 2.312 10 20 CECD CC[C@@H]1COCCN1CCNCc1ccc(OC)c(C)c1 873189475 UAZUNONHKPSUQB-MRXNPFEDSA-N 292.423 2.204 10 20 CECD Cc1cccc(O)c1CNCC1(O)CCN(C(C)C)CC1 877085751 RAJURDADZKJJEZ-UHFFFAOYSA-N 292.423 2.026 10 20 CECD COc1ccc(O)c(CNC(=O)NCCC(C)(C)OC)c1 875289830 NUHNSWOWCDMBSO-UHFFFAOYSA-N 296.367 2.015 10 20 CECD C[C@@H](NCC[C@H]1CCOC1=O)c1ccc(N(C)C)cc1 775834281 MUAZSSHDCVXCCT-OCCSQVGLSA-N 276.380 2.356 10 20 CECD CN(C)c1ccc(CNC(=O)COC2(C)CCC2)cc1 772971922 MLOLOYBXSHCTFJ-UHFFFAOYSA-N 276.380 2.328 10 20 CECD CC(=O)NC[C@@H]1CCCCN1Cc1cc(C)c(C)cc1O 877673310 DGKVXBJIXKSXJZ-INIZCTEOSA-N 290.407 2.500 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCC[C@@H]([S@](C)=O)C1 877622724 BLZAJLILMUEGOL-VPZZIHKRSA-N 281.421 2.480 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCc2ccoc2)c1O 774978452 PSVILNLAUIXSHP-UHFFFAOYSA-N 278.264 2.192 10 20 CECD O=C(N[C@@H](CCO)c1cccs1)c1cc(O)cs1 779265870 XEWYIRPDLZTFKK-VIFPVBQESA-N 283.374 2.369 10 20 CECD C[C@@H](NCCOC[C@@H]1CCOC1)c1c(O)cccc1F 886525907 ASIFQOXZKRBDPG-VXGBXAGGSA-N 283.343 2.235 10 20 CECD CN(C)c1ccc([C@@H](N)CNCc2ccc(N)cc2)cc1 1120269143 NHQWYEKXCGCBOI-KRWDZBQOSA-N 284.407 2.124 10 20 CECD CC[C@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H](CC)O1 398759544 DBNBLKSOFSERFI-PHIMTYICSA-N 279.336 2.127 10 20 CECD O=C(NCc1ccccc1O)c1cc2ccccc2c(=O)o1 797743209 FCVWZLCNRDSBBA-UHFFFAOYSA-N 295.294 2.429 10 20 CECD CCOc1ccc(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)c(O)c1 792193553 XZPGBHIKDGFCLQ-HRBWSGTNSA-N 297.420 2.132 10 20 CECD CN(C)C(=O)[C@H]1CCCN1Cc1cccc(Cl)c1O 179637633 BPBOKTMEHGSCOV-GFCCVEGCSA-N 282.771 2.098 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1ccc(Cl)cc1O 1589444439 ZLKSSZDYVNUQHH-JTQLQIEISA-N 257.717 2.341 10 20 CECD CCCC[C@@H](NCc1cc(F)cc(F)c1O)C(=O)O 1334055221 KESPIXDWLMRWDJ-LLVKDONJSA-N 273.279 2.403 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCC[C@H](F)C2)cc1 1335568217 JIZNFDNYAGQDCW-WCQYABFASA-N 265.332 2.349 10 20 CECD CCCN(CC(F)F)C(=O)NCc1ccc(N)cc1 1262603362 GHSSUWFCRKLDBG-UHFFFAOYSA-N 271.311 2.456 10 20 CECD O=C(O)[C@]12CCC[C@H]1CN(Cc1cc(F)c(F)cc1O)C2 1608824557 ATAFAENIJSTCJN-BONVTDFDSA-N 297.301 2.357 10 20 CECD C[C@H](NCCC(=O)O)c1cc2c(cc1O)CCCC2 1603248035 SPMSQAQKQRDTNI-JTQLQIEISA-N 263.337 2.396 10 20 CECD CC(C)[C@@](C)(O)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1593239054 AKDAPIVIEGWYIC-BONVTDFDSA-N 281.352 2.148 10 20 CECD CC[C@@H]1C[C@H](NCc2ccc(OC)cc2O)CCO1 824320394 HAKSOTMPBAUVTE-CHWSQXEVSA-N 265.353 2.448 10 20 CECD CCC(CC)[C@@H](O)CNC(=O)Nc1ccc(N)cc1 841299373 BKGTXBAOUJNCHC-ZDUSSCGKSA-N 265.357 2.187 10 20 CECD CCCN(Cc1c(C)cccc1O)[C@H]1CCS(=O)(=O)C1 876538856 XUPZXSZPYOLWAC-ZDUSSCGKSA-N 297.420 2.100 10 20 CECD CCOc1cccc(CN2CCCC[C@H]2[C@H](C)N)c1O 250521384 SUUMTMRUSUTGDK-JSGCOSHPSA-N 278.396 2.493 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)CN2CCCC2=O)c1 37782916 XPBWAIIYNGMFKI-OLZOCXBDSA-N 276.380 2.362 10 20 CECD C[C@H]1CO[C@H](C)CN1Cc1cc(F)cc(F)c1O 708423566 STFRECNRUKHWBE-DTWKUNHWSA-N 257.280 2.280 10 20 CECD COc1ccnc(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 116167298 CRYYJMKQEZWCSR-UHFFFAOYSA-N 299.374 2.428 10 20 CECD Cc1cc(CC(=O)NCc2ccc(N3CCCC3)cc2)n[nH]1 176429639 KTEHNDQYGGAPRY-UHFFFAOYSA-N 298.390 2.177 10 20 CECD C[C@@H](NC1CCN(C)CC1)c1ccc(F)cc1O 62745787 OTBPMEROWZAUEQ-SNVBAGLBSA-N 252.333 2.276 10 20 CECD C[C@@H]1CC[C@@H](CCC(=O)NCc2ccc(O)c(O)c2)O1 182548014 AFCZRTJNWLPFJZ-PWSUYJOCSA-N 279.336 2.062 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccsc1 180656223 FSJGFHHRIMIUAX-DUXPYHPUSA-N 275.329 2.489 10 20 CECD C[C@H](N[C@H]1C[C@H](O)C1(C)C)c1ccc(F)cc1O 128116429 FZTFEFUXECSAGL-HJIKLVIJSA-N 253.317 2.341 10 20 CECD CCc1nn(C)cc1CN(C)c1ccc2c(c1)OCO2 180759441 YANVSUJVRAEITO-UHFFFAOYSA-N 273.336 2.348 10 20 CECD CSC[C@H](CCO)N[C@H](C)c1ccc(C)cc1O 185530633 SANWJUCVFRHXRJ-NEPJUHHUSA-N 269.410 2.465 10 20 CECD C[C@H]1COCC[C@@H]1NCc1ccc(N(C)C)c(F)c1 191757984 CQFOHCNFTBNOBH-FZMZJTMJSA-N 266.360 2.406 10 20 CECD COc1ccc(N(C)C[C@H]2CCOC2)cc1OC 140336451 NNMUARXFTCJXID-LLVKDONJSA-N 251.326 2.177 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@]2(C)CCCCN2)cc1F 237084364 XUZLYFRRVRPKIH-MRXNPFEDSA-N 293.386 2.040 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@H](O)C2(C)C)cc1F 272322535 IRCLUYIBASXTLJ-KGLIPLIRSA-N 266.360 2.141 10 20 CECD CCNC(=O)C1(CN[C@H](C)c2cc(F)ccc2O)CCC1 277204533 JTRSKTNFPOMGBI-LLVKDONJSA-N 294.370 2.488 10 20 CECD CCOC1CC(O)(CN[C@@H](C)c2ccc(C)cc2O)C1 278589019 YUGWFFDRBDESDV-FUJMWEONSA-N 279.380 2.281 10 20 CECD Oc1ccc(F)cc1CNC[C@@H]1COC2(CCCC2)O1 272513069 XGQDJFSQQDMZLH-CYBMUJFWSA-N 281.327 2.307 10 20 CECD Oc1ccc(F)cc1CN1CCC2(CCO2)CC1 374326288 DNRJVYJKTDYFAU-UHFFFAOYSA-N 251.301 2.286 10 20 CECD Oc1ccc(Cl)cc1CN1CCn2cncc2C1 370666406 HBLOGTXWRXVGCY-UHFFFAOYSA-N 263.728 2.258 10 20 CECD CC[C@H](CN[C@H](C)c1cc(C(=O)OC)ccc1O)OC 289599908 BMJICIYXEDVXFR-ZYHUDNBSSA-N 281.352 2.254 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CC1OCCO1 801546747 XJSSHRYCRXKYAW-UHFFFAOYSA-N 293.363 2.284 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1ccc2c(c1)CCO2 292803993 VVEFWUNOAPUNQK-ZDUSSCGKSA-N 290.407 2.264 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1COc2ccccc2[C@@H]1O 290270830 XVULRCQUPRLMSQ-CJNGLKHVSA-N 289.306 2.116 10 20 CECD CC[C@H](C)CONC(=O)/C=C/c1ccc(O)c(O)c1 293591838 BRHYFBZXHDZWSN-STUBTGCMSA-N 265.309 2.205 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1cccc(OC)c1O 292746924 RBWNUIPRCYFPGJ-GFCCVEGCSA-N 294.395 2.043 10 20 CECD C[C@H](CCO)CCNCc1ccc(N2CCOCC2)cc1 397769723 KQJYXHMNENUURN-HNNXBMFYSA-N 292.423 2.021 10 20 CECD C[C@H](N)CN[C@@H](C)c1cc(Br)cc(F)c1O 817971295 CATFFRHOYNMZMH-BQBZGAKWSA-N 291.164 2.292 10 20 CECD CCN(CCOCCO)Cc1ccc2ccccc2c1O 816600049 IYHKCLXBHOQMIA-UHFFFAOYSA-N 289.375 2.376 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H](CCO)CC1 817771085 UKIZUEOMUQTGBW-SNVBAGLBSA-N 269.366 2.078 10 20 CECD COC[C@]1(CN[C@@H](C)c2ccc(C)c(C)c2O)CCCN1 817974471 MMWJLMHATRSFCC-WMLDXEAASA-N 292.423 2.428 10 20 CECD Cc1ccc(C(=O)OCc2nnc(C3CC3)o2)c(O)c1O 727004619 NRKPGUFYISABLW-UHFFFAOYSA-N 290.275 2.024 10 20 CECD C[C@@H]1C[C@@H](N[C@@H]2CC[C@H]2O)c2c(O)ccc(F)c21 818357988 MKQIJUMPITXDPI-QCNRFFRDSA-N 251.301 2.193 10 20 CECD COc1ccc(O)c(CNC(=S)NCC(C)C)c1 733906351 KWNVJYCDFBARLX-UHFFFAOYSA-N 268.382 2.021 10 20 CECD CC(C)[C@H](OC(=O)c1cc(O)cs1)C(=O)N1CCCC1 732355959 WMNLOPGZPTUGGU-LBPRGKRZSA-N 297.376 2.258 10 20 CECD O=C(CN(Cc1ccccc1O)C1CCCC1)N1CCC1 731848155 VKIGVTVGHJKMCD-UHFFFAOYSA-N 288.391 2.369 10 20 CECD O=C(O)CN(Cc1ccon1)Cc1cc(Cl)ccc1O 739799479 QIGJDKQJGXJOOH-UHFFFAOYSA-N 296.710 2.120 10 20 CECD CC1CCN(CC(=O)NCc2cc(Cl)ccc2O)CC1 846476230 LXOJFJKSGMLXKS-UHFFFAOYSA-N 296.798 2.394 10 20 CECD Nc1ccc(Cc2noc([C@H]3CCSC3)n2)cc1 843158248 AOIUDGUEMDIKBK-JTQLQIEISA-N 261.350 2.463 10 20 CECD COCCOCCN[C@@H](C)c1ccc(Cl)cc1O 841745226 OEZMSHTUHOPLRS-JTQLQIEISA-N 273.760 2.359 10 20 CECD COc1ccc(CN[C@H]2CCN(C(C)=O)C[C@@H]2C)cc1C 742218424 HOZPOLYMTPGJRK-BBRMVZONSA-N 290.407 2.350 10 20 CECD CC(C)(C)n1nnc(CNCc2c(O)cccc2Cl)n1 848564614 PMWKBMVFYRHPGT-UHFFFAOYSA-N 295.774 2.077 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@H](C)c1cc(Cl)ccc1O 840826236 IRLIDWRZDORRDB-YDEJPDAXSA-N 271.744 2.110 10 20 CECD COC[C@@H](C)N[C@@H](C)c1ccc(N2CCOCC2)cc1 743474196 RJTCWQMLXODVLG-KGLIPLIRSA-N 278.396 2.209 10 20 CECD CC(C)(C)n1nnc(CSc2nccs2)n1 848430751 HFGTYBVFERWUGE-UHFFFAOYSA-N 255.372 2.177 10 20 CECD CCOc1cccc(CN[C@@H](CC2CC2)C(=O)OC)c1O 840959168 VKMHYTXNANFBMG-ZDUSSCGKSA-N 293.363 2.222 10 20 CECD CC(C)C1CCN(C(=O)C(=O)Nc2ccc(N)cc2)CC1 841049358 CWXWRUAMMIEFKT-UHFFFAOYSA-N 289.379 2.102 10 20 CECD CC(C)COCCCNC(=O)NCCc1ccc(N)cc1 841668091 SVLRBBJWEHHDTI-UHFFFAOYSA-N 293.411 2.173 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1ccc2c(c1)CCCO2 921996795 IHAUCGGDDIVJBJ-RDJZCZTQSA-N 291.391 2.295 10 20 CECD COc1ccc(O)c([C@@H](C)NC2COC(C)(C)OC2)c1 757698399 QPQPBVAJYXIHJQ-SNVBAGLBSA-N 281.352 2.203 10 20 CECD COC(=O)N(C)CCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 850548538 UVCUXHXHNYTAJS-MWLCHTKSSA-N 296.342 2.367 10 20 CECD Oc1ccc(F)cc1CNc1cnn(CCF)c1 862483922 YCANFFSKLIOLOA-UHFFFAOYSA-N 253.252 2.309 10 20 CECD CC(=O)OCC(C)(C)CC(=O)NCc1cc(C)ccc1O 862757652 AWPBRIDPPGOOKK-UHFFFAOYSA-N 293.363 2.296 10 20 CECD Cc1ccc(CN2CCN(CC(C)C)C(=O)C2)c(O)c1 877433164 KYIXPJABPSDFDE-UHFFFAOYSA-N 276.380 2.001 10 20 CECD Nc1ccc(C(=O)NCCCSc2nccs2)cn1 876661875 ISDNNJHHSTWIMT-UHFFFAOYSA-N 294.405 2.033 10 20 CECD O=C(NCc1ccccc1O)Nc1ccnn1CC1CC1 776031491 VZEXSTPSMCLSRP-UHFFFAOYSA-N 286.335 2.320 10 20 CECD CNC[C@@H](C)CNCc1ccc(N2CCCC2)cc1 1117953813 QQLVZDCEQKPLPS-CQSZACIVSA-N 261.413 2.232 10 20 CECD C[C@H](NCC1=CCN(C)CC1)c1c(O)cccc1F 886561996 OEEREZQIWGTQIY-NSHDSACASA-N 264.344 2.444 10 20 CECD CNC(=O)C1CCC(NCc2cc(F)cc(F)c2O)CC1 882936037 JZAJQLLPYQOOSK-UHFFFAOYSA-N 298.333 2.065 10 20 CECD C[C@H]1C[C@@H](NCCCCO)c2c(O)ccc(F)c21 786939682 DZEFLXKQHLYTJX-GXSJLCMTSA-N 253.317 2.442 10 20 CECD COC(=O)COc1ccc(N(C)CC[C@@H]2CCOC2)cc1 783668075 YLILMHSGFUZOGC-CYBMUJFWSA-N 293.363 2.101 10 20 CECD C[C@H]1CCCN1CCNCc1cc(F)cc(F)c1O 883022610 ZQGOYPWGCYFSLW-JTQLQIEISA-N 270.323 2.244 10 20 CECD CC(C)(C)c1nnc2n1CCN(Cc1ccc(N)cc1)C2 1120268705 HVWKOLCKRLKSJR-UHFFFAOYSA-N 285.395 2.174 10 20 CECD COCCN1CC[C@H](N[C@@H](C)c2ccc(C)cc2O)C1 273604685 SVOUTIAQPNFXPD-KBPBESRZSA-N 278.396 2.072 10 20 CECD COc1ccc(CNC(=O)[C@H](C)C(C)C)c(O)c1 794377004 KFRFJLKVACMQPG-SNVBAGLBSA-N 251.326 2.309 10 20 CECD CCCN1CCC[C@H]1CNCc1cccc(OC)c1O 796521675 NYNOJDXZEISWNS-AWEZNQCLSA-N 278.396 2.365 10 20 CECD COC[C@H](C)NCc1c(O)cccc1Br 706830379 TZEVZJMSQQRTLI-QMMMGPOBSA-N 274.158 2.279 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)C(F)F 792305555 DTBXOCGSHSGLJC-MRVPVSSYSA-N 287.306 2.436 10 20 CECD COc1ccc(CNC(=O)c2ccc3n[nH]cc3c2)c(O)c1 794378339 VDKSKWRKGLUTDR-UHFFFAOYSA-N 297.314 2.207 10 20 CECD COc1ccc(O)c(CN[C@H]2CCN(C(C)(C)C)C2)c1 693905647 IULXFCDWKBCYSG-ZDUSSCGKSA-N 278.396 2.363 10 20 CECD CO[C@@]1(C)C[C@H]1NCc1cc(Br)ccc1O 694388737 SOOOSXGCLMNBBF-NEPJUHHUSA-N 286.169 2.422 10 20 CECD C[C@@H](NC(=O)CNC(C)(C)C)c1ccc(N(C)C)cc1 1325776462 ODPYNVSDYSOFLC-GFCCVEGCSA-N 277.412 2.318 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CC[C@@H](C2CC2)C1 1350471648 ZNPJBWNEWJLJOQ-SNVBAGLBSA-N 290.392 2.486 10 20 CECD OCC(F)(F)CNCc1ccc(N2CCCC2)cc1 231776222 QAWIFQOWUXHSFJ-UHFFFAOYSA-N 270.323 2.004 10 20 CECD CN(C(=O)Cc1ccc(N)cc1)C(C1CC1)C1CC1 154076785 VBACEYNAWAJLOS-UHFFFAOYSA-N 258.365 2.458 10 20 CECD CCn1cc(CN2CCOc3cc(N(C)C)ccc32)cn1 154908099 HVAPLPHGKQCWPE-UHFFFAOYSA-N 286.379 2.368 10 20 CECD Cc1ccsc1C(=O)NCc1ccc(O)c(O)c1 159072401 JCDMUFBOANAZCB-UHFFFAOYSA-N 263.318 2.398 10 20 CECD Cc1ccc(NC(=O)c2cccc(O)c2O)c(O)c1 126574251 PUHGLNKXXJHSGL-UHFFFAOYSA-N 259.261 2.364 10 20 CECD CCN(CC)C(=O)CN(C)Cc1ccc(C)cc1O 876511642 QJDCPOFESJATHL-UHFFFAOYSA-N 264.369 2.001 10 20 CECD C[C@H](N[C@H](C)C(=O)NC(C)(C)C)c1cc(F)ccc1O 181234789 RATOBHMDTIGVPI-VHSXEESVSA-N 282.359 2.485 10 20 CECD Cc1cccc(CN2CC[S@@](=O)C(C)(C)CC2)c1O 322110874 LHBRRDCJNXVMMV-LJQANCHMSA-N 281.421 2.434 10 20 CECD O=C(NCc1ccccc1O)c1cc2c(s1)CCNC2 710844227 MSIDKYIHCAYLAE-UHFFFAOYSA-N 288.372 2.029 10 20 CECD CC(=O)NCCCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 383500456 XSXLJJUTAKPGEE-WCQYABFASA-N 276.380 2.365 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](C(=O)O)C2)c1O 178897949 QUYFZZDENRIZTC-SECBINFHSA-N 297.738 2.155 10 20 CECD COc1cccc(CNC(=O)[C@H](C)CSC)c1O 66928161 PEIJBIRBIUMRBB-SECBINFHSA-N 269.366 2.016 10 20 CECD CCOC[C@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)C1 179498744 LLUSQRVSLBUESV-LBPRGKRZSA-N 293.363 2.295 10 20 CECD CO[C@H]1CCN(Cc2cc3c(cc2O)OCO3)[C@@H](C)C1 282367582 QCINKKGMFFALDE-JQWIXIFHSA-N 279.336 2.120 10 20 CECD CN(C)c1ccc(CNC(=O)NC2CC=CC2)cc1F 127593665 WAQFKDSGNWGCFK-UHFFFAOYSA-N 277.343 2.410 10 20 CECD COc1ccc(O)c(CN2CC[C@@H]([C@H]3CCOC3)C2)c1 374998460 NLLQCFMNIJXDMZ-OLZOCXBDSA-N 277.364 2.259 10 20 CECD Cc1ncccc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183440448 YMFOXNVRRWEBIX-SNVBAGLBSA-N 286.331 2.162 10 20 CECD CON(CC(C)(C)C)C(=O)c1cccc(O)c1O 286594345 UGKYGFNYGNOYKS-UHFFFAOYSA-N 253.298 2.148 10 20 CECD CCOc1cccc(CN2CC[C@H](CN(C)C)C2)c1O 179633737 YJLCOPSJOBYNCA-CYBMUJFWSA-N 278.396 2.174 10 20 CECD COc1cccc(CNC(=O)N[C@@H](C)C(F)(F)F)c1O 288805050 KZJDLXXHKSQWDI-ZETCQYMHSA-N 292.257 2.151 10 20 CECD CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)CCCO1 281561709 KYLLAIAABVILOD-LLVKDONJSA-N 279.336 2.047 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]2c2nc(C)no2)c1 289968729 YYZFBKBWNVRVML-CYBMUJFWSA-N 289.335 2.429 10 20 CECD COc1cc(O)c(CN2CCO[C@H]3CCC[C@H]32)cc1OC 280290646 AEHQPRMYWHVPKE-OCCSQVGLSA-N 293.363 2.163 10 20 CECD CC(C)CN1CC(=O)N[C@H]1c1cccc(Cl)c1O 298769231 DEUDBRMRAUBHPX-CYBMUJFWSA-N 268.744 2.132 10 20 CECD CO[C@H](C)C(=O)NCc1cc(Cl)cc(Cl)c1O 807833775 FEGSTMSOKJHWEB-ZCFIWIBFSA-N 278.135 2.350 10 20 CECD CC(C)CSCCNC(=O)c1c(F)ccc(O)c1O 296507484 LXYHKKNCWRHKGM-UHFFFAOYSA-N 287.356 2.356 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CC23CCNCC3)c(O)c1 817976493 MAVAAACEGPQWON-SWLSCSKDSA-N 260.381 2.493 10 20 CECD COc1cccc(CNc2ncnc3c2CCC3)c1O 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CECD O=C(O)c1ccc(C(=O)NCc2ccccc2O)s1 1602323147 REQGYZKJFDDWPS-UHFFFAOYSA-N 277.301 2.082 10 20 CECD C[C@@H](O)CN[C@H](C)c1ccc(Br)cc1O 134899627 AUKPKTLUXGEFII-HTQZYQBOSA-N 274.158 2.186 10 20 CECD COC[C@H]1CCCN1Cc1cc(C)cc(OC)c1O 164455453 OUBNISKLAPZYOT-CYBMUJFWSA-N 265.353 2.320 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1n[nH]c2c1CCCC2 188979591 BCNYKTAOYHGGTD-UHFFFAOYSA-N 299.374 2.195 10 20 CECD CCC[C@@]1(C)C(=O)NCCN1Cc1cccc(C)c1O 189040215 PPBJFDANGPOQBT-INIZCTEOSA-N 276.380 2.191 10 20 CECD COc1cccc(CNC(=O)NCCCOC(C)C)c1O 73440533 FGEDTLDJFFMHLK-UHFFFAOYSA-N 296.367 2.015 10 20 CECD CSCC[C@H](C)NC(=O)Cc1ccc(N)cc1 157058851 XZBPODOVQWSVAI-JTQLQIEISA-N 252.383 2.069 10 20 CECD COCCCCCNC(=O)NCc1cccc(OC)c1O 73916489 IWCAQSXJJAKNDK-UHFFFAOYSA-N 296.367 2.017 10 20 CECD C[C@H](N[C@H](C)C[S@](C)=O)c1cc(Cl)ccc1O 186539938 AWTZBLQBXKHZEZ-NMIRZEMHSA-N 275.801 2.463 10 20 CECD COC[C@H](C)NCc1cc(Cl)cc(OC)c1O 228669702 WUAMIYRBQPJICL-QMMMGPOBSA-N 259.733 2.179 10 20 CECD Oc1ccccc1CN1CC[C@H](CN2CCCC2)C1 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GOZGMGPPRPFNNH-SNVBAGLBSA-N 275.352 2.144 10 20 CECD CC1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768437836 KFQFIQULKVHQDS-AWEZNQCLSA-N 263.337 2.050 10 20 CECD Cc1ccc(O)c(CNC(=O)COC2CCCC2)c1 862758471 AQRZRPMSEPGMAU-UHFFFAOYSA-N 263.337 2.276 10 20 CECD COc1ccc(O)c(CNC(=O)c2cnc(C3CC3)o2)c1 878852905 YWZHDSMCOLPTPM-UHFFFAOYSA-N 288.303 2.196 10 20 CECD Cc1ccc(CNCCc2nnc3ccccn23)c(O)c1 876897940 OEKLHQLUXNMQTF-UHFFFAOYSA-N 282.347 2.076 10 20 CECD CCCc1cc(NC(=O)c2cc(O)cs2)n(C)n1 772930684 HHFLBIQIHACHDU-UHFFFAOYSA-N 265.338 2.392 10 20 CECD CCN1CCN(Cc2ccc(N3CCCC3)cc2)CC1 1116433846 LDOWWJOASJJCQU-UHFFFAOYSA-N 273.424 2.424 10 20 CECD C[C@H](NC(=O)C1CCN(C)CC1)c1ccc(N(C)C)cc1 775411236 PPRLNJGGBUTUMT-ZDUSSCGKSA-N 289.423 2.272 10 20 CECD Cc1cc(O)c(CN[C@H](CO)C[C@H]2CCCO2)cc1Cl 895750193 XXDXXFZQFZSNLU-QWHCGFSZSA-N 299.798 2.374 10 20 CECD COc1ccc(CNC(=O)C2CCSCC2)c(O)c1 794374505 VJBKPLQDQHDXJY-UHFFFAOYSA-N 281.377 2.160 10 20 CECD CCN1CCC[C@H](N[C@H](C)c2cc(C)ccc2O)C1=O 722360807 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CN(Cc1ccccc1O)C(=O)c1cc(Cl)n(C)n1 857466905 LHXVHGKIEPDAKN-UHFFFAOYSA-N 279.727 2.051 10 20 CECD Cn1cc(CNCc2ccc(N3CCCC3)cc2)cn1 41159285 LFYNUFYYMNQKQF-UHFFFAOYSA-N 270.380 2.310 10 20 CECD CC[C@H](NCc1cc(Cl)cc(OC)c1O)[C@@H](C)O 386742854 YVRSUHPZBSMSIU-KCJUWKMLSA-N 273.760 2.303 10 20 CECD CC[C@@H]1COCCN1C(=O)NCc1ccc(N(C)C)cc1 115641347 MWXYCDAXUBTLAA-CQSZACIVSA-N 291.395 2.073 10 20 CECD COc1cccc(CNC(=O)Nc2ccncc2F)c1O 124866346 WZKVFWUITMSHDP-UHFFFAOYSA-N 291.282 2.257 10 20 CECD Cc1cccc(CN[C@@H](C)C(=O)NCc2ccco2)c1O 181198116 MQNITEOERYUOMR-LBPRGKRZSA-N 288.347 2.088 10 20 CECD NC1CCN(Cc2cc(Br)ccc2O)CC1 32050845 PSVDFKWMDYOLOB-UHFFFAOYSA-N 285.185 2.078 10 20 CECD C[C@@H]1CCCN(C(=O)CSc2nccs2)C1 76404969 RZHTZYIDVHEEIH-SECBINFHSA-N 256.396 2.494 10 20 CECD Cc1c(CNC(=O)N2CCCO2)n(C)c2ccccc12 336508119 SWMNCJRBKNZDGW-UHFFFAOYSA-N 273.336 2.334 10 20 CECD CCOc1ccc(O)c(CN2CCOC[C@@H]2C2CC2)c1 93645781 JYGGTGHEVBJLDQ-OAHLLOKOSA-N 277.364 2.402 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)[C@H]1OC 272683495 TWIOIYQQONZKDW-NUEKZKHPSA-N 296.386 2.174 10 20 CECD Oc1ccccc1CN1CCN(c2ncccc2F)CC1 271474683 ZWXLMBCSARHRMI-UHFFFAOYSA-N 287.338 2.249 10 20 CECD CCOc1cccc(CN[C@H](COC)[C@H]2CCCO2)c1O 278604507 ICLJSEJQRKOOQR-ZIAGYGMSSA-N 295.379 2.075 10 20 CECD COc1cc(O)c(CN2CC[C@@H](O)C(C)(C)C2)cc1OC 276093301 YEDYDTKFJRIWDW-OAHLLOKOSA-N 295.379 2.002 10 20 CECD CC(C)[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(C)(C)O 276614114 JHDZTTUEIKYJGW-ZDUSSCGKSA-N 282.340 2.186 10 20 CECD CC(C)CCOCCNC(=O)c1c(F)ccc(O)c1O 276635842 UHHKQUIXCLHRRV-UHFFFAOYSA-N 285.315 2.029 10 20 CECD CN1CC[C@H]2CCN(Cc3ccc(N(C)C)c(F)c3)[C@H]2C1 272661933 ROGNXQDOMWYEJP-YOEHRIQHSA-N 291.414 2.418 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H]2CCS(=O)(=O)C2)c(O)c1 285264141 QNKXFPNULKXHIP-CHWSQXEVSA-N 297.420 2.094 10 20 CECD CN(C)c1ccc(CN[C@H]2CCO[C@]3(CCOC3)C2)cc1 374271978 PPICKJXBDVJUQQ-DOTOQJQBSA-N 290.407 2.180 10 20 CECD C[C@H](NCC(C)(C)OCCO)c1cc(Cl)ccc1O 287308454 LDKKQUCGYQMQTQ-JTQLQIEISA-N 287.787 2.484 10 20 CECD Cc1nocc1C(=O)N1CCOc2cc(N(C)C)ccc21 631563754 XNDILTAYGZMVFI-UHFFFAOYSA-N 287.319 2.088 10 20 CECD Cc1ccc(N(C)C(=O)/C=C/c2cnn(C)c2C)nc1 288888137 IGQJRKBQAHSHPO-SOFGYWHQSA-N 270.336 2.108 10 20 CECD Cc1cc(CN(C)[C@H](C)C[S@@](C)=O)ccc1N(C)C 294751494 XRDAQTIXPXUOCJ-BFUOFWGJSA-N 282.453 2.260 10 20 CECD CN(C)c1ccc(CN2CCC(F)(F)[C@H](CO)C2)cc1 291227290 KAXOFKFKYQVQID-ZDUSSCGKSA-N 284.350 2.202 10 20 CECD C[C@H](NC1CC1)C(=O)NCc1c(O)ccc2c1CCCC2 295186485 NLPOFOUWRXRDLL-NSHDSACASA-N 288.391 2.028 10 20 CECD OC/C=C\CNCc1ccc(N2CCCCC2)cc1 717575873 GGWFQMKHONLPSO-DJWKRKHSSA-N 260.381 2.315 10 20 CECD Cc1cc(C)c([C@H](C)N[C@H](C)C[S@@](C)=O)c(O)c1 815615270 MNVZUYNCYRQNMK-FTLABTOESA-N 269.410 2.427 10 20 CECD C[C@@H](N[C@@H](CN)C1CC1)c1cc(Cl)ccc1O 817959425 FWPAWXKWAIFRKX-PELKAZGASA-N 254.761 2.434 10 20 CECD Cc1cc(C)c([C@H](C)NCCN2CCO[C@H](C)C2)c(O)c1 815576680 WDZKHWFIIFLUEE-CABCVRRESA-N 292.423 2.380 10 20 CECD Nc1ccc(Cc2nc(C(=O)NC3CC3)cs2)cc1 817906046 XEUBMQFATATAMT-UHFFFAOYSA-N 273.361 2.208 10 20 CECD C[C@@H](NC1CCC(N)CC1)c1cc([N+](=O)[O-])ccc1O 817948286 WQBFLJOUPCPXPJ-KPPDAEKUSA-N 279.340 2.221 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H](C)C(F)(F)F)c1 824330836 CJPKXMXNFQWBLT-ZETCQYMHSA-N 292.257 2.151 10 20 CECD CCOCCCC(=O)N[C@H](C)c1cc(OC)ccc1O 728977970 JGJWAKYPXCDXCX-LLVKDONJSA-N 281.352 2.395 10 20 CECD CS[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 824683961 ZBFATDYDSJGYPC-INIZCTEOSA-N 292.448 2.461 10 20 CECD Oc1cc(Br)ccc1CN1CCC[C@H](O)C1 824491013 LDUPVJSPNUNLGJ-NSHDSACASA-N 286.169 2.111 10 20 CECD Cc1cc(O)c(CN2CC[C@@](F)(CO)C2)cc1Cl 825803663 DXPSALYEMOVHDW-ZDUSSCGKSA-N 273.735 2.260 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCCCN 828148047 QFMXVBVITQNUSI-UHFFFAOYSA-N 264.369 2.260 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@H](C)c1cc(F)cc(F)c1O 903299225 IESWDJSLEGDDKJ-BZHVJNSISA-N 287.306 2.125 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CCCN(CCCO)C2)c1 834850619 OEILSIIZUMKOEF-HUUCEWRRSA-N 292.423 2.198 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@H]1CCOC1 840892578 BIMUBWNUZBFRMX-ZFWWWQNUSA-N 262.397 2.371 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCN(C(C)(C)C)C2=O)c1 842721653 VGPUWLJEGRIIJL-CYBMUJFWSA-N 276.380 2.190 10 20 CECD CCc1cccc(CNCc2ccn(CC)n2)c1O 848917864 ZCPIPVSVOMBMBB-UHFFFAOYSA-N 259.353 2.461 10 20 CECD C[C@@H]1OCC[C@H]1C(=O)NCc1cc(Cl)ccc1O 846473532 MSTSQWKRZKPZLJ-GZMMTYOYSA-N 269.728 2.087 10 20 CECD CC(C)n1[nH]cnc1=NCc1ccc(N(C)C)c(F)c1 840886955 PCKUOOACHWVBSU-UHFFFAOYSA-N 277.347 2.098 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@H]([C@H](C)N)C2)cc1 843056921 CAYZIMTZWAXRTM-YOEHRIQHSA-N 291.439 2.081 10 20 CECD COC[C@@](C)(CC(=O)OC)NCc1cc(C)c(C)cc1O 757921742 ZZOBACSKBTXRJS-MRXNPFEDSA-N 295.379 2.067 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC1CCOCC1 759581237 UTCFECWGFVOXOY-DUXPYHPUSA-N 278.304 2.081 10 20 CECD C[C@H]1CN(C(=O)/C=C\c2cn(C)cn2)c2ccccc2O1 932549028 IECWVDVEIBOAPR-KRZKBDHCSA-N 283.331 2.247 10 20 CECD C[C@H](C1CC1)N(C(=O)CN(C)c1ccc(N)cc1)C1CC1 863557200 JMJPOLMXHUVWFB-GFCCVEGCSA-N 287.407 2.495 10 20 CECD CC[C@@H](N[C@@H]1CCN(C)C1)c1ccc(N(C)C)cc1 765769581 LHVHGFBIGZGCMC-GDBMZVCRSA-N 261.413 2.497 10 20 CECD COC(=O)c1ccccc1CC(=O)NCc1ccccc1O 775780573 QTQVJDLLZIAMBI-UHFFFAOYSA-N 299.326 2.038 10 20 CECD CN(C(=O)CCCNC(=O)C(C)(C)C)c1ccc(N)cc1 877079896 ANTHEDAGVWJYST-UHFFFAOYSA-N 291.395 2.174 10 20 CECD CCCOc1ccc(CNCCCC(=O)NC)cc1C 873027554 PQHAAEIOESMNQG-UHFFFAOYSA-N 278.396 2.400 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773028128 YBQQPPWBKHNATP-KCPJHIHWSA-N 276.380 2.355 10 20 CECD CO[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)C(C)C 771096710 YRCFUHKBRJORBX-OAHLLOKOSA-N 278.396 2.382 10 20 CECD Cc1cc(O)c(CN[C@@H](CCO)C(F)(F)F)cc1C 886371451 MCKKUEYHEUOGON-LBPRGKRZSA-N 277.286 2.412 10 20 CECD C[C@@H](NCCN1CCOCC1(C)C)c1c(O)cccc1F 886523128 XLBSLRHYPHJJMM-GFCCVEGCSA-N 296.386 2.293 10 20 CECD C[C@H](NCCN1C[C@@H]2CC[C@H](C1)O2)c1c(O)cccc1F 886620589 NQQLDDMMGWDPRQ-RWMBFGLXSA-N 294.370 2.045 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cnc(N)s1 1121941603 JVWNLWKJKFTTEC-UHFFFAOYSA-N 291.376 2.483 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H](O)C[C@@H]2C)cc1 788270932 XHBFETXFRURZQS-BBRMVZONSA-N 262.397 2.488 10 20 CECD COc1cccc(CNC(C)(C)C(=O)OC(C)C)c1O 898508494 HFNCQOMSHWIICP-UHFFFAOYSA-N 281.352 2.221 10 20 CECD Cn1ccc(CNCc2c(O)cccc2Br)n1 706818273 MZUVQOHEDUWCOK-UHFFFAOYSA-N 296.168 2.178 10 20 CECD COC[C@H](NCc1cc(F)cc(F)c1O)C1CC1 708481330 QREKUKCXNPLHGB-LBPRGKRZSA-N 257.280 2.185 10 20 CECD Oc1cc(Br)ccc1CN[C@H]1CCC[C@@H]1O 691490677 ZTRYHMGWZDPCCC-QWRGUYRKSA-N 286.169 2.158 10 20 CECD Cc1ccncc1[C@@H](C)NC(=O)c1cccc(O)c1O 790912149 NTYIQDVXMZZKAI-SNVBAGLBSA-N 272.304 2.292 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CC=C(C(=O)O)C2)c1O 1607309405 HHVDNRITSHAXRQ-KOLCDFICSA-N 277.320 2.225 10 20 CECD Cc1cccc(CN2CCSC[C@H]2CC(=O)O)c1O 1600533775 XBZHBUSPEKAOSH-GFCCVEGCSA-N 281.377 2.093 10 20 CECD O=C(/C=C\c1ccc(C(=O)O)o1)NCc1ccccc1O 1601236862 WYIYQDGEEVESQJ-VURMDHGXSA-N 287.271 2.013 10 20 CECD C[C@H](NC(=O)CCNC1CC1)c1ccc(N(C)C)cc1 1576194982 HLVIZAFKQUZIEO-LBPRGKRZSA-N 275.396 2.072 10 20 CECD COc1ccc(CNC/C=C/CNC(=O)C(F)F)cc1C 1754087010 FFRYRIMIRQVRLK-ONEGZZNKSA-N 298.333 2.031 10 20 CECD CC1(C(=O)O)CN(Cc2c(O)ccc(Cl)c2F)C1 1593807499 BDQQRIYHPVHXBE-UHFFFAOYSA-N 273.691 2.091 10 20 CECD COc1cccc(CNCC[C@@H]2C[C@H]3CC[C@H]2O3)c1O 839163743 KQZCDRQOARVCMA-MRVWCRGKSA-N 277.364 2.448 10 20 CECD CCN(Cc1cc(Br)ccc1O)C[C@@H](C)N 843359052 FXJOHEVGFXKAQP-SECBINFHSA-N 287.201 2.324 10 20 CECD Cc1ccc(CN[C@H]2CCn3ccnc3C2)c(O)c1 877429725 MEJRWFPMFNIPKJ-ZDUSSCGKSA-N 257.337 2.002 10 20 CECD Cc1ccc(CN[C@H](C)[C@@H](O)C(F)(F)F)c(O)c1 877693718 ORERKHVRBOMMLE-LDYMZIIASA-N 263.259 2.102 10 20 CECD CCSCCn1cc(COc2ccc(N)cc2)nn1 881196107 UGMYWUZHXDOBMD-UHFFFAOYSA-N 278.381 2.192 10 20 CECD CCN1CC[C@H](CNCc2ccc(OC)c(C)c2)C1 37644587 ODXMMIDLHJNNSD-OAHLLOKOSA-N 262.397 2.435 10 20 CECD C[C@@H](NCc1nccn1C)c1ccc(N(C)C)cc1 71273284 LLSHBUXTGGQDIS-GFCCVEGCSA-N 258.369 2.337 10 20 CECD CCC[C@@H](CNCc1cc2c(cc1O)OCO2)OCC 705343710 NGVRTSUEHFEREL-LBPRGKRZSA-N 281.352 2.416 10 20 CECD Cc1cccc(CNCc2nn(C)cc2Cl)c1O 393527166 YCHJTCGOKUXIPW-UHFFFAOYSA-N 265.744 2.377 10 20 CECD NCC[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 723670774 NZNFADBFBJYCEM-SNVBAGLBSA-N 254.761 2.216 10 20 CECD COc1ccc(O)c(CN2C[C@H](CN)[C@H](C)C[C@@H]2C)c1 397429068 ZGPBRDAQVYQUNI-DYEKYZERSA-N 278.396 2.206 10 20 CECD CCC(CC)(CCO)CNC(=O)NCc1ccc(N)cc1 1353538794 BVQZBFNQKLEKDI-UHFFFAOYSA-N 293.411 2.257 10 20 CECD CCO[C@H]1C[C@@](CO)(NCc2cccc(C)c2O)C1(C)C 188908031 VREXSYRLETYNSF-YOEHRIQHSA-N 293.407 2.356 10 20 CECD Oc1cc2c(cc1CNCC1(O)CCCCCC1)OCO2 79619354 VFDVCOUBSFTDDM-UHFFFAOYSA-N 293.363 2.296 10 20 CECD Oc1ccccc1CN1CCSC2(CCOCC2)C1 186486605 YJAOHTVUJQNAEA-UHFFFAOYSA-N 279.405 2.490 10 20 CECD C[C@H](N[C@@H]1CC[C@H]1O)c1cc(Br)ccc1O 378720497 FVGTWFMTADDOAH-HNBZJPLGSA-N 286.169 2.329 10 20 CECD CC(=O)NCCCN[C@H](C)c1cc(Cl)ccc1O 184921605 XKYQVAHNFQGQME-SECBINFHSA-N 270.760 2.222 10 20 CECD CC(C)[C@@H]1OCCC[C@@H]1CNC(=O)c1cccc(O)c1O 193128203 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ABAHIAQUEUQFKF-UHFFFAOYSA-N 254.293 2.286 10 20 CECD CCCN1C[C@@H](CN[C@@H](C)c2ccccc2O)CC1=O 817590160 UYYSORBSIZSHAG-QWHCGFSZSA-N 276.380 2.301 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@@H]([S@@](C)=O)C2)c1 826910384 GHQAQUJAOXQXJC-WVSMJXTDSA-N 297.420 2.180 10 20 CECD CCCONC(=O)NCc1ccc(N(C)C)cc1C 828272055 FCBGNDHTBZUUQL-UHFFFAOYSA-N 265.357 2.202 10 20 CECD C[S@@](=O)CCN1CCCc2cc(OC(F)F)ccc21 828153916 YIJGVMLZHKJPCE-LJQANCHMSA-N 289.347 2.419 10 20 CECD CN(C)c1ccc(CNC(=O)/C=C\c2ccc[nH]2)cc1 588546884 VXNPUBGADIGCIW-YFHOEESVSA-N 269.348 2.410 10 20 CECD C[C@H]1CCCN1CCN[C@@H]1CCc2cccc(O)c21 834607288 SOAICJUTTUJCBC-GXTWGEPZSA-N 260.381 2.453 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCC[C@@H]3C[C@H]23)c1O 838775336 DSVULCUKXSUJRK-WXHSDQCUSA-N 290.363 2.389 10 20 CECD CC(C)(CO)C(=O)NCc1ccc(N2CCCCC2)cc1 847399630 FJAFTZGRDXVCOF-UHFFFAOYSA-N 290.407 2.312 10 20 CECD CCc1cccc(CNCC(=O)NC2CCCCC2)c1O 848894938 IGWFVXHQOCEPPX-UHFFFAOYSA-N 290.407 2.493 10 20 CECD CCN(CC)[C@H]1CCN(C(=O)c2cc(O)cs2)C1 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CC[C@H](NC1CC(C)C1)c1cccc(-c2nn[nH]n2)c1O 1590467055 QDPCGUGFVUQKAC-ZPPKWKGLSA-N 287.367 2.412 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCCCCN 155762326 MSKGDYUOTUOFCF-UHFFFAOYSA-N 277.412 2.196 10 20 CECD COc1cccc(O)c1CNCCc1ccc(C)cn1 835065915 RNHPSMNNUMTGQF-UHFFFAOYSA-N 272.348 2.437 10 20 CECD CN1CCC(NCc2ccc(N3CCCC3)cc2)CC1 37256081 SSDUPVCPJNKYQU-UHFFFAOYSA-N 273.424 2.471 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@@H](C)c1ccccc1O 37782034 IWVFYIFRMQJMNZ-RYUDHWBXSA-N 262.353 2.054 10 20 CECD CCOC(=O)[C@H](C)N[C@H](C)c1cc(OC)ccc1O 49368153 WDZZJJUFHLWWDS-ZJUUUORDSA-N 267.325 2.003 10 20 CECD CCN(C[C@@H](C)OC)C(=O)Nc1ccc(N)cc1 382756812 PGZFOGDBXXUYPL-SNVBAGLBSA-N 251.330 2.158 10 20 CECD CCC(=O)N1CCCN(c2ccc(OC)cc2)CC1 55877474 MYVLGEWLJNOYCS-UHFFFAOYSA-N 262.353 2.144 10 20 CECD CC(C)OCCC(=O)NCc1ccc(N(C)C)c(F)c1 58733914 JBOIWELXJLGSNH-UHFFFAOYSA-N 282.359 2.323 10 20 CECD COCCCCC(=O)N[C@H](C)c1cc(OC)ccc1O 103529047 RNLSZTANIVKLAI-LLVKDONJSA-N 281.352 2.395 10 20 CECD CC[C@H](C)CS(=O)(=O)NCc1ccc(N(C)C)cc1 113274670 GIGDGLDMVVFKNK-LBPRGKRZSA-N 284.425 2.218 10 20 CECD CN(C)c1ccc(CNc2ncc([N+](=O)[O-])cn2)cc1F 302156578 MZVOVBUQQGTVKD-UHFFFAOYSA-N 291.286 2.202 10 20 CECD O=C(NCC1(CCO)CCCCC1)c1cccc(O)c1O 185848198 QNURFXUBDIWVOU-UHFFFAOYSA-N 293.363 2.161 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCCC(C)=O)c1 184979364 BOZKOJIFJNBJMF-LLVKDONJSA-N 279.336 2.337 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H](C)c1ccc(F)c(F)c1O 187729693 ZMQKZBJDJIYUDF-SOCHQFKDSA-N 291.363 2.433 10 20 CECD CC(C)Oc1ccc(N(C)CC(=O)NCC2CC2)cc1 191581461 COKKLNIOAYFNTL-UHFFFAOYSA-N 276.380 2.436 10 20 CECD COc1ccc(O)c(CNc2ncnc3onc(C)c23)c1 192455641 KUBLPYJTCKQZRL-UHFFFAOYSA-N 286.291 2.253 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CN(C)C[C@@H]3C2)cc1C 194541988 BSAVKDBUOOIEET-GASCZTMLSA-N 260.381 2.002 10 20 CECD C[C@@](O)(CNCc1cccc(Cl)c1O)C1CC1 383759918 DOCGYTSIWLQICN-CYBMUJFWSA-N 255.745 2.296 10 20 CECD COc1cccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2C3)c1O 246211743 ODASUCFVOJKQFC-GVXVVHGQSA-N 275.348 2.453 10 20 CECD CCOC[C@@H]1CN(Cc2cccc(OCC)c2O)CCO1 529666389 KIRMPMDXJXOAIJ-AWEZNQCLSA-N 295.379 2.028 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N3CC(O)C3)c2C)c1 268414135 JRNAKTFWKVOMEF-UHFFFAOYSA-N 284.359 2.219 10 20 CECD C[C@H]1Oc2ccccc2[C@@H]1NC(=O)c1cccc(O)c1O 365677456 OMSCJFPKLBGOAP-YMTOWFKASA-N 285.299 2.350 10 20 CECD CN1Cc2ccccc2[C@@H](NC(=O)c2cccc(O)c2O)C1 369082899 GWRZTLKGQAPWIP-AWEZNQCLSA-N 298.342 2.014 10 20 CECD CN1CC=C(CNCc2ccc(N(C)C)c(F)c2)CC1 271789625 GHDNCVLAFPCOOQ-UHFFFAOYSA-N 277.387 2.243 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC1(N(C)C)CCC1 275558724 AKKXSEYZWLOUBM-UHFFFAOYSA-N 291.395 2.018 10 20 CECD CC(C)SCCNC(=O)/C=C/c1ccc(O)c(O)c1 287069944 NPMVJRFVZQHZCP-GQCTYLIASA-N 281.377 2.369 10 20 CECD COc1cccc(O)c1CN1CCC[C@H]1c1nc(C)no1 809720898 JDPVXXVVGYOKPD-LBPRGKRZSA-N 289.335 2.429 10 20 CECD C[C@H]1SCC[C@H]1NC(=O)NCc1ccccc1O 826036011 SKLCIUYJYNCTMR-MWLCHTKSSA-N 266.366 2.085 10 20 CECD C[C@H]1C[C@H](O)CN1Cc1ccc(Br)cc1O 825666419 IUKKPVABAHZUOT-KWQFWETISA-N 286.169 2.110 10 20 CECD Cc1ncc(/C=C/C(=O)N2CCc3ccncc32)s1 492510042 VZUVFNKHUVOGMC-NSCUHMNNSA-N 271.345 2.449 10 20 CECD O=C(OC[C@@H]1C[C@H]2CC[C@H]1O2)c1cc(O)cs1 837515855 WQMNMNMGIJEAKA-FXBDTBDDSA-N 254.307 2.178 10 20 CECD CC[C@H](N[C@@H](C)CC(=O)NC)c1ccc(N(C)C)cc1 834900229 ODPRNUPBIPPZQB-WFASDCNBSA-N 277.412 2.318 10 20 CECD CC1=NO[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 830559748 UZZRGTFFOKWCRE-HNNXBMFYSA-N 288.347 2.052 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](N)[C@@H](C)C1 843052482 UPLZZGXAVSBEBT-BBRMVZONSA-N 261.413 2.230 10 20 CECD CN(C)c1ccc(/C=C/CNCCCC(=O)O)cc1 843041531 ROVRVUMBXQFWPJ-HWKANZROSA-N 262.353 2.220 10 20 CECD CC[C@@H](C(=O)NCc1cc(Cl)ccc1O)N(C)C 846475812 JYZDJQVDTDKXPH-NSHDSACASA-N 270.760 2.002 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@H](CC(N)=O)C1 840917320 RNGPTIMDUXLOCB-AWEZNQCLSA-N 289.423 2.148 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H]2C[C@@H](O)C2(C)C)c1O 846961706 QZMOVVMPZVUMSD-QWHCGFSZSA-N 297.782 2.497 10 20 CECD Cc1noc(CN(C)Cc2cc(C)c(C)cc2O)n1 848503792 PXDMYDSDPHXFST-UHFFFAOYSA-N 261.325 2.332 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H]1CCCNC1 841032498 FNTXTUJKJJGTFE-CQSZACIVSA-N 261.413 2.150 10 20 CECD C[C@H](NC[C@H]1COCCO1)c1cc(Cl)ccc1O 756434962 RXLKDBZFEPZWGB-ONGXEEELSA-N 271.744 2.112 10 20 CECD C[C@H]1C[C@H](NCCNC(=O)C2CC2)c2c(O)ccc(F)c21 756372201 PJHWJMILHSPFJP-CABZTGNLSA-N 292.354 2.195 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](C2CCOCC2)C1 755326960 VDLXPMUVBZPLHE-LLVKDONJSA-N 281.377 2.342 10 20 CECD Fc1cc(NCc2ccc(N3CCOCC3)cc2)ncn1 853229811 LPTXYJWIROUCAV-UHFFFAOYSA-N 288.326 2.064 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C(=O)C(C)(C)C 935946677 LMZBSRKFFPUITH-UHFFFAOYSA-N 284.352 2.109 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)C[C@H]2C)c1 862757624 AEJSLCZVRITNEU-BXUZGUMPSA-N 275.348 2.322 10 20 CECD O=C(NC[C@@H](CO)Cc1ccccc1)c1cc(O)cs1 761571520 FGIDSEJVASKKRW-LBPRGKRZSA-N 291.372 2.035 10 20 CECD CCOc1ccc(CN(C)C[C@H](C)C(=O)OC)c(O)c1 768882772 WPCGZPZGHLGPCP-NSHDSACASA-N 281.352 2.032 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CC(=O)NC)cc1F 765883704 YGDFNQYJULPTMS-LBPRGKRZSA-N 295.402 2.286 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@@H]1C(=O)NCc1ccccc1O 878559677 NVTVKEGJGNJCJV-MEBBXXQBSA-N 285.347 2.098 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CC12CCC2 874786120 YDKDBWVBTWMISK-HSBHDXMMSA-N 259.305 2.170 10 20 CECD CN(C(=O)[C@@H]1CCO[C@H]1c1ccncc1)c1ccc(N)cc1 877074369 IBJNLNRPJAMRDG-CVEARBPZSA-N 297.358 2.404 10 20 CECD COc1cc(C)cc(CN(C)CC2(O)CCC2)c1O 894462202 XGWVEERZXFINEE-UHFFFAOYSA-N 265.353 2.056 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H](F)C(F)(F)F 278377454 MVMAIJUWSSKTSC-SECBINFHSA-N 265.206 2.251 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@@H](C2OCCO2)C1 896385289 GADCWVSSYHDCTQ-LLVKDONJSA-N 283.755 2.240 10 20 CECD CC1(C)CN(Cc2cc(F)cc(F)c2O)CCO1 708421299 DLRQLDDUCMWLCM-UHFFFAOYSA-N 257.280 2.281 10 20 CECD COc1ccc(CNC(=O)C(=O)c2ccc(C)cc2)c(O)c1 794383240 KEMXDMPBJVKEGU-UHFFFAOYSA-N 299.326 2.208 10 20 CECD COC(=O)c1cccc(CNCc2ccccc2O)c1 795910125 DHQCTDBPVVKILM-UHFFFAOYSA-N 271.316 2.469 10 20 CECD CCOc1cccc(CN[C@H]2CCO[C@@H](C)C2)c1O 219906394 BZXDEKKCUYKNKM-AAEUAGOBSA-N 265.353 2.448 10 20 CECD Oc1ccc(F)cc1CN1CCC(NCC2CC2)CC1 220272435 MJSFMSSPZOCWQP-UHFFFAOYSA-N 278.371 2.495 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)[C@@]23CCC[C@@H]2C3)cc1 1353201545 RDHPWQPMCVZGMN-UKPHBRMFSA-N 287.407 2.059 10 20 CECD O=C(O)[C@H](NCc1ccccc1O)c1ccc2c(c1)CCO2 1610720036 BPTFDCMGGGMPJE-MRXNPFEDSA-N 299.326 2.243 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccc3n2CCN[C@@H]3C)c1 1579723881 UARPHJRUTFXFSX-GFCCVEGCSA-N 299.374 2.096 10 20 CECD O=C(O)c1ncccc1NC(=O)N1Cc2cccc(O)c2C1 1595274041 XNNJJAPDQAHMKI-UHFFFAOYSA-N 299.286 2.033 10 20 CECD Nc1ccc(NC(=O)NCC2(CO)CCCCC2)cc1 841295536 ALHYESQUUZDULC-UHFFFAOYSA-N 277.368 2.333 10 20 CECD C[C@H](NC[C@@]1(O)CCSC1)c1ccc(N(C)C)cc1 158175100 NCFRNPSSJVVGBQ-WFASDCNBSA-N 280.437 2.271 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)c2ncn(C)n2)c(O)c1 275745776 REHAIFVPOQNDRA-MNOVXSKESA-N 260.341 2.241 10 20 CECD C[C@@H](NCCCn1ccnc1)c1ccc(F)cc1O 62745563 UDWPMZAVCWFWPT-LLVKDONJSA-N 263.316 2.469 10 20 CECD CC[C@@](C)(CNCc1ccc(OC)cc1O)OC 322509248 ILXVIDZNZONLDV-AWEZNQCLSA-N 253.342 2.306 10 20 CECD Cc1nc(CC(=O)NCc2ccccc2O)cs1 82284960 IMZQIJMGQZYABF-UHFFFAOYSA-N 262.334 2.016 10 20 CECD CCOc1cccc(CNC[C@@]2(C)CCCO2)c1O 94797046 XYDBXSCTRQQQHX-OAHLLOKOSA-N 265.353 2.450 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H](CF)C1)OCO2 711495498 GDTZKAROOWQGPW-JTQLQIEISA-N 267.300 2.302 10 20 CECD Oc1c(Cl)cccc1CN1CCO[C@H]([C@H]2CCCO2)C1 246009596 YDXCLLBCPRPKIB-KGLIPLIRSA-N 297.782 2.425 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cn[nH]c1 170731870 DOLIPKGHJWULAN-UHFFFAOYSA-N 259.309 2.168 10 20 CECD COc1cccc(CNc2nccn3nc(C)cc23)c1O 302572313 PWTAGUVPTDMORZ-UHFFFAOYSA-N 284.319 2.364 10 20 CECD COc1cccc(CNC(=O)c2ccc(F)cc2O)c1O 123653074 GASSZUQFLPGCHZ-UHFFFAOYSA-N 291.278 2.176 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1cc(F)ccc1O 185512185 RZFVVKSISSIFOP-VYUIOLGVSA-N 273.373 2.294 10 20 CECD Cc1ncccc1C(=O)N1CCOc2cc(N(C)C)ccc21 72540640 JLUHPNVKKZXFCX-UHFFFAOYSA-N 297.358 2.495 10 20 CECD COc1cc(O)c(CN(C)Cc2ccncc2)cc1OC 183739266 VLVMFHLTVDZXTC-UHFFFAOYSA-N 288.347 2.436 10 20 CECD CSC[C@H](C)NC(=O)NCc1ccc(N(C)C)cc1 76778022 NQFGKFCPCYUMTJ-NSHDSACASA-N 281.425 2.303 10 20 CECD CCN(CCO)C(=O)NCc1ccc(N(CC)CC)cc1 193412189 BJYORJLKEBZLDL-UHFFFAOYSA-N 293.411 2.057 10 20 CECD Cc1csc(CCCNC(=O)c2cccc(O)c2O)n1 193007827 QTPJTFSNMASTTR-UHFFFAOYSA-N 292.360 2.225 10 20 CECD CC(C)CN1CCC(NC(=O)Cc2ccc(N)cc2)CC1 236771435 PHUZHLPMGKKCCW-UHFFFAOYSA-N 289.423 2.048 10 20 CECD CC[C@H](NC[C@@H]1CN2CCC[C@H]2CO1)c1ccccc1O 252563686 XLXYGFSLQLLGIG-LZWOXQAQSA-N 290.407 2.296 10 20 CECD CN(C)c1ccc(CN(C)c2ncc(F)cn2)cc1 269519686 VPRDYLPRHZAUBK-UHFFFAOYSA-N 260.316 2.318 10 20 CECD Cc1cc(O)c(CN(C)[C@@H](C)CN2CCOCC2)cc1C 278616964 DTHFSPGDEZQGGJ-HNNXBMFYSA-N 292.423 2.162 10 20 CECD CCOc1ccc(O)c(CN[C@@H](CO)CC2CCC2)c1 279767314 JWPLWPHRRHWBKR-CQSZACIVSA-N 279.380 2.432 10 20 CECD CCCN(C)Cc1ccc([N+](=O)[O-])c(OC)c1O 278159574 DFVOHFOJHQMFGT-UHFFFAOYSA-N 254.286 2.151 10 20 CECD COC1(C)CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 272696606 VHYRBGZNLKZOKB-GQCTYLIASA-N 291.347 2.139 10 20 CECD CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 273414876 QPWVFEVMCXYDGC-NWDGAFQWSA-N 264.369 2.184 10 20 CECD NC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1Cc1cc(Cl)ccc1O 373739229 VOHJHMFYEHLAQR-BHYNMZESSA-N 294.782 2.131 10 20 CECD C[C@H]1COCC[C@H]1CNCc1ccc2c(c1)CCO2 285556854 REKRXFKRERLNLW-WFASDCNBSA-N 261.365 2.384 10 20 CECD CC[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H](C)[S@]1=O 289678374 NVPUNPQTVMJWEV-KEVGGSHVSA-N 285.384 2.263 10 20 CECD CN(CC(C)(C)C)C(=O)c1c(F)ccc(O)c1O 295050062 JZAXAQJQSHRSJX-UHFFFAOYSA-N 255.289 2.355 10 20 CECD CCCN[C@H](C)C(=O)NCc1c(O)ccc2c1CCCC2 295157554 KELBXRMUKKXYNN-GFCCVEGCSA-N 290.407 2.275 10 20 CECD COCCOCCN(C)Cc1c(O)ccc(Cl)c1F 809790089 XMDMWMATBFDLCA-UHFFFAOYSA-N 291.750 2.280 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@H](O)C(F)(F)F 294294104 POKKCTLURDYMIV-VIFPVBQESA-N 287.640 2.198 10 20 CECD C[C@@H](NC(=O)CC(C)(C)C)C(=O)Nc1ccc(N)cc1 818556349 NPBGPQDNJAEZMC-SNVBAGLBSA-N 277.368 2.148 10 20 CECD C[C@H]1CN(Cc2c(O)ccc3ccncc23)C[C@H]1C(=O)O 828457425 UODJTDWLUAUPRG-GXFFZTMASA-N 286.331 2.093 10 20 CECD N[C@H](C(=O)NCc1ccc(N2CCCC2)cc1)C1CCC1 827007732 AIDCXKYITMHEBK-INIZCTEOSA-N 287.407 2.030 10 20 CECD C/C(=C\C(=O)N1C[C@H](C)Oc2ncccc21)c1cnccn1 829227112 GGIBHFLWLLFNLR-OBIHZWKSSA-N 296.330 2.089 10 20 CECD C[C@@H](C(=O)NCc1ccccc1O)N1CCCCCC1 735857103 MVUMUNXJHWREQS-ZDUSSCGKSA-N 276.380 2.273 10 20 CECD CCN(C)C(=O)CN(CC1CC1)c1ccc(OC)cc1 831587519 CPRXKFROTDTTHD-UHFFFAOYSA-N 276.380 2.390 10 20 CECD CN(C)c1ccc(CNCc2nc(C(C)(C)C)n[nH]2)cc1 839169058 GPAWAINCXFRAKW-UHFFFAOYSA-N 287.411 2.458 10 20 CECD CC(C)CCSCC(=O)NCc1ccc(O)cc1O 910951374 HBEAYUZXEYIRMV-UHFFFAOYSA-N 283.393 2.493 10 20 CECD Oc1ccc(Cl)cc1CN1[C@H]2CCNC[C@H]1CC2 843057657 GRKJYBMAHZETRB-CHWSQXEVSA-N 266.772 2.372 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CCCCN2)cc1F 841032603 HMAZPRHVRXPTCW-ZDUSSCGKSA-N 265.376 2.123 10 20 CECD CNCCN(C)Cc1ccc(N2CCCCC2)cc1 843057120 BXUJAEFOXCPHNK-UHFFFAOYSA-N 261.413 2.328 10 20 CECD Cc1ccc(C(=O)NCC(C)(C)OCC2CC2)c(O)c1O 840511752 GOFQGBMSNNGARL-UHFFFAOYSA-N 293.363 2.341 10 20 CECD CC(C)[C@@H]1C[C@H]1CNC(=O)NCCc1ccc(N)cc1 841911559 BGYCKQBOAZWTCP-ZFWWWQNUSA-N 275.396 2.403 10 20 CECD COc1ccc(N(C)C[C@H]2CCNC(=O)CC2)cc1 844354651 FNVXKGCXNUQDAA-GFCCVEGCSA-N 262.353 2.048 10 20 CECD CS[C@H](C)CC(=O)NCCc1ccc(N)cc1 844164706 OJGMETWAJDQSIK-SNVBAGLBSA-N 252.383 2.069 10 20 CECD O=C(Nc1cnn(CC2CC2)c1)c1cc(O)cs1 743807705 SCTSVFGCSRSVSS-UHFFFAOYSA-N 263.322 2.313 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@]2(CCNC2)C1 843120486 NFUPXUPRHYIERC-AWEZNQCLSA-N 284.762 2.370 10 20 CECD c1cc2c(cc1CN[C@H]1CCc3c[nH]nc3C1)CCCO2 921839495 PZFFZWBLYWFYTI-HNNXBMFYSA-N 283.375 2.382 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)C[C@@H]2CCOC2)c1 858299174 QHENSZKHGVUNHY-STQMWFEESA-N 292.379 2.315 10 20 CECD Cc1cnc(CNCCCSc2nccs2)[nH]1 850147001 URHPIWSXTSUNCU-UHFFFAOYSA-N 268.411 2.447 10 20 CECD C[C@H]1C[C@@H](NCC(=O)NCC2CC2)c2c(O)ccc(F)c21 757630973 AZUVSIXVRSFAPJ-JOYOIKCWSA-N 292.354 2.195 10 20 CECD CCc1nncn1CCN[C@H](C)c1cc(F)ccc1O 756620472 KIASPUFCGJIFCH-SNVBAGLBSA-N 278.331 2.036 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1 932639165 MLIGEPPQQNWHJE-HNNXBMFYSA-N 290.407 2.446 10 20 CECD CCOC(=O)CCSc1ncc([N+](=O)[O-])s1 866030784 IXVBJRMFDIJKAR-UHFFFAOYSA-N 262.312 2.097 10 20 CECD CCCOc1ccc(CN[C@@H]2C(=O)NCC[C@@H]2C)cc1C 873122546 SUCMNDSHNREMCT-LRDDRELGSA-N 290.407 2.398 10 20 CECD Cc1nonc1CN[C@H](C)c1cc(F)ccc1O 872138029 YXJWWTJNSUTQEY-SSDOTTSWSA-N 251.261 2.074 10 20 CECD C[C@H](NC(=O)c1ccncn1)c1ccc(N(C)C)cc1 777793063 CFGACCCGWQEYDN-NSHDSACASA-N 270.336 2.034 10 20 CECD CN(Cc1cn(C)nn1)Cc1c(O)ccc2ccccc12 1118595481 WWMNWLMAVMUZIT-UHFFFAOYSA-N 282.347 2.306 10 20 CECD CN(C(=O)c1cnn(C2CCC2)c1)c1ccc(N)cc1 1122173056 HLAUQATZTMSJJH-UHFFFAOYSA-N 270.336 2.467 10 20 CECD CCc1nc(C(=O)N[C@H](C)c2cc(OC)ccc2O)co1 773407444 MIFDMSQARAJSTM-SECBINFHSA-N 290.319 2.442 10 20 CECD COCc1noc(CN2CCCc3cc(OC)ccc32)n1 777554995 QRSAUDPEIKHPRM-UHFFFAOYSA-N 289.335 2.177 10 20 CECD OCC1(NCc2cc(F)cc(F)c2O)CCSCC1 883144587 TUZNXPCOSMCNIA-UHFFFAOYSA-N 289.347 2.018 10 20 CECD COC(=O)[C@@H](CC(F)F)NCc1cccc(Cl)c1O 789583136 VCNVANUCCIPMSS-SECBINFHSA-N 293.697 2.332 10 20 CECD Nc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)ccn1 1332021946 BXHYQPKVIWFFRT-UHFFFAOYSA-N 297.358 2.178 10 20 CECD Cc1ccc(C(=O)N2CCC[C@H](CF)C2)c(O)c1O 1332751096 FMYZGDIHCRYJTK-SNVBAGLBSA-N 267.300 2.228 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CCC[C@H](CF)C1 1355345218 SNQWNKWJOOLPCQ-SECBINFHSA-N 296.371 2.435 10 20 CECD C[C@@H]1[C@@H](C(=O)O)CCN1Cc1c(O)ccc(Cl)c1F 1604636642 OHOTZTZMABRHJC-SFYZADRCSA-N 287.718 2.480 10 20 CECD Cc1cc(C)c(O)c(CN(CC(=O)O)CC(F)(F)F)c1 1600163501 MGNCWOLUZJFSQG-UHFFFAOYSA-N 291.269 2.458 10 20 CECD COCC[C@@H](N)CN(C)c1ccc(OC)c(Cl)c1 1578999769 HUBBLORDWJHUOI-SNVBAGLBSA-N 272.776 2.149 10 20 CECD Nc1ccc(CCN[C@H]2CC[C@@H]3[C@H]4OCC[C@H]4[C@H]23)cc1 1580443607 SNOOJOYKRRRHBH-SMLCLMEVSA-N 272.392 2.214 10 20 CECD Oc1cc(F)c(F)cc1CN1CCC2(CCNC2)CC1 1580888502 NGDZJDLXQHHTRK-UHFFFAOYSA-N 282.334 2.246 10 20 CECD CC[C@H](N[C@H]1C[C@@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1590466773 OIVLIRJGJLPGCH-MIJXAVMKSA-N 299.378 2.412 10 20 CECD C[C@H]1CCNCC[C@H]1NCc1ccc(N(C)C)cc1 817896569 KQCUDEZQTWIPLR-XJKSGUPXSA-N 261.413 2.230 10 20 CECD c1cc2c(cc1CN[C@H]1CCCC13OCCO3)CCCO2 922256883 BJPNNBGFPCMMGF-INIZCTEOSA-N 289.375 2.397 10 20 CECD C[C@@H](NC(=O)CC1CCOCC1)c1ccccc1O 827937408 VOPSGQZCOVFJIO-LLVKDONJSA-N 263.337 2.386 10 20 CECD Nc1ccc(NC(=O)N[C@H](CO)C2CCCCC2)cc1 841300799 UJOWWNZWPJGHCC-CQSZACIVSA-N 277.368 2.332 10 20 CECD CCOc1cccc(CNCc2ccnn2CC)c1O 853093522 MFCQEQAKYRNZMT-UHFFFAOYSA-N 275.352 2.297 10 20 CECD CCCN(CC(=O)N(C)C)Cc1ccc(C)cc1O 876632850 YHWJSORCRDHERP-UHFFFAOYSA-N 264.369 2.001 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H]([C@@H](C)O)C2)c1O 167858003 GBQVITFSKDDJOC-MWLCHTKSSA-N 297.782 2.451 10 20 CECD CC(C)N(CC(F)F)C(=O)c1cccc(O)c1O 193139700 YJPLLAHIRAUOFV-UHFFFAOYSA-N 259.252 2.214 10 20 CECD Cc1cccc(C(=O)N[C@H]2CCCC(=S)C2=O)c1 2332239632 KXLCSYYCVZTQRR-NSHDSACASA-N 261.346 2.216 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@H]2OC)c1O 50369687 ROSLTTUYMXXLFQ-VXGBXAGGSA-N 251.326 2.058 10 20 CECD CC[C@H](OC)C(=O)NCc1ccc2c(c1)CCCN2C 58770372 JYDNXLQHBMEOIN-HNNXBMFYSA-N 276.380 2.110 10 20 CECD CO[C@@H](CNC(=O)c1ccc(C)c(O)c1O)C(C)(C)C 179531490 SRCJWOPBSNLZRF-NSHDSACASA-N 281.352 2.197 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C[C@H](O)C(F)(F)F 183923241 ONLWRPGSPXQYFC-ZDUSSCGKSA-N 290.329 2.498 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](N)CC(F)F 313912818 IYIAHGSPKRBGCH-ZDUSSCGKSA-N 299.365 2.084 10 20 CECD CCOC(=O)[C@@H](NCc1cc(OC)ccc1O)[C@H](C)CC 187865018 KZSYQQLQFCSVTC-ABAIWWIYSA-N 295.379 2.468 10 20 CECD COC1(CNC(=O)c2ccc(C)c(O)c2O)CCCCC1 185450622 HZEYQIUSEXJCDW-UHFFFAOYSA-N 293.363 2.485 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)CCO1 132010045 FXBVITYOYBKHEM-GFCCVEGCSA-N 251.326 2.012 10 20 CECD CCC[C@](C)(O)CNCc1cc(OC)ccc1O 224810412 AJPVDMBHSMMLPQ-AWEZNQCLSA-N 253.342 2.042 10 20 CECD CN1C(=O)/C(=C\c2ccc3c(c2)CCO3)SC1=S 48642745 GALHQJNYQAVEBW-YRNVUSSQSA-N 277.370 2.453 10 20 CECD CCCOC(=O)[C@@H](C)N(C)c1ccc(OC)cc1OC 131800618 ITVUUWYXFQGIJW-LLVKDONJSA-N 281.352 2.482 10 20 CECD CCOCCOCCN(C)Cc1cc(C)ccc1O 191568529 MRIXSZSEPLUODT-UHFFFAOYSA-N 267.369 2.186 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)[C@@H](C)N 192026906 DFRKFSOZBAYXEJ-NWDGAFQWSA-N 264.369 2.114 10 20 CECD COC(=O)[C@H]1CC[C@@H](N[C@H](C)c2cc(OC)ccc2O)C1 193889612 OPLQBBVUSVXUJV-GRYCIOLGSA-N 293.363 2.393 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2cc(C)ccc2O)C1 92456642 TZBSKXVFCHPAQG-ZDUSSCGKSA-N 277.364 2.476 10 20 CECD C[C@H](O)C[C@@H]1CCCN1Cc1ccc(N(C)C)cc1 93481985 GBKHNOHONYHFIY-BBRMVZONSA-N 262.397 2.488 10 20 CECD Cc1cccc(N(C)C(=O)c2c[nH]nc2-c2cnn(C)c2)c1 436357738 DJIYCKBUZRUIRC-UHFFFAOYSA-N 295.346 2.395 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2C[C@H]3CC[C@H]2NC3)c1O 530246606 QGKQYZVRJBAXJA-OASPWFOLSA-N 296.798 2.284 10 20 CECD C[C@@H](CN[C@H](C)c1cc([N+](=O)[O-])ccc1O)N(C)C1CC1 273462248 CYKOTRRTRNETIM-WDEREUQCSA-N 293.367 2.434 10 20 CECD C[C@H](O)CCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 278964374 BPWJSQKGZDDBJX-UWVGGRQHSA-N 268.313 2.112 10 20 CECD Cc1cccc(CN2CCOC[C@@H]2[C@@H]2CCCO2)c1O 377706834 ZHRJAIVLNYIQDY-CABCVRRESA-N 277.364 2.080 10 20 CECD C[C@H]1COCC[C@H]1CNC(=O)N(C)Cc1ccccc1O 287773271 GRUSOGFTXQEENO-STQMWFEESA-N 292.379 2.206 10 20 CECD COCC[C@H](CO)NCc1cc(Cl)cc(Cl)c1O 282257514 OXSWJCOYTKQRPB-SNVBAGLBSA-N 294.178 2.186 10 20 CECD CN(C)CCCC(C)(C)NCc1cc2c(cc1O)OCO2 387175507 CFHWVWIHUODGKG-UHFFFAOYSA-N 294.395 2.331 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1CCOC1 807837775 CMOBMNWYJWEYJX-SSDOTTSWSA-N 290.146 2.352 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1ccc(N(C)C)c(C)c1 293395993 HEEXBYDRXNTHTM-ZDUSSCGKSA-N 278.396 2.302 10 20 CECD CCOC1(C)CCN(C(=O)c2c(F)ccc(O)c2O)CC1 295337400 NERRQZSHIHDUAE-UHFFFAOYSA-N 297.326 2.268 10 20 CECD CC[C@H](NCC1CNC1)c1cc(Cl)ccc1O 817965655 SSSSFBXIAVCFFB-LBPRGKRZSA-N 254.761 2.306 10 20 CECD COc1cccc(CNC(=O)[C@H]2CCC[C@H](OC)C2)c1O 815834760 YFIDBDVRTUJYPO-AAEUAGOBSA-N 293.363 2.222 10 20 CECD CCCOc1ccccc1NC[C@@H](O)CN(C)C1CC1 819399255 SEHSQTSQTUUAAQ-CQSZACIVSA-N 278.396 2.342 10 20 CECD CCOC(=O)[C@H](CC)C(=O)N[C@H](C)c1ccccc1O 827952597 YFXPNOGIRWPOCO-GHMZBOCLSA-N 279.336 2.159 10 20 CECD CCOC(=O)/C=C\CSc1ncc(C(=O)OC)s1 829681603 ZWMYYRVYXQXXGU-PLNGDYQASA-N 287.362 2.141 10 20 CECD CN(C)c1ccc(CN[C@](C)(CCF)C(=O)O)cc1 901916691 WHEAEMPHUWTCEC-CQSZACIVSA-N 268.332 2.045 10 20 CECD C[C@H](Cc1cnccn1)N[C@H]1CCc2cccc(O)c21 834544580 NWKGLKLCVFEBCF-RISCZKNCSA-N 269.348 2.390 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cc(OC)c(C)cc2O)C1 902419000 GZBTYXAEIXQDEB-GFCCVEGCSA-N 293.363 2.094 10 20 CECD COC1CN(Cc2cc(C(C)(C)C)cc(O)c2O)C1 738233653 LUWJBBSMUCVAHO-UHFFFAOYSA-N 265.353 2.226 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1CC2(CC2)C1 831923994 BDLOQANYVJGWFD-SNVBAGLBSA-N 275.348 2.335 10 20 CECD CCOc1cccc(CN[C@@H]2CCO[C@H]2CC)c1O 839192643 SMGMMZUYEHQVAS-OLZOCXBDSA-N 265.353 2.448 10 20 CECD O=C1[C@@H](NCc2cccc(Cl)c2O)C[C@H]2CCCCN12 835075666 ZLUYKQGAFLDRRI-YPMHNXCESA-N 294.782 2.289 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)nn1C 917521665 PMGUEFHOSAGFFM-UHFFFAOYSA-N 286.379 2.067 10 20 CECD CC[C@H](OC)C(=O)N(C)CCN(C)c1ccc(OC)cc1 844852983 BVPOMDGEJAUHLW-HNNXBMFYSA-N 294.395 2.015 10 20 CECD CC[C@@H](N)CNC(=O)NCc1ccc(N(CC)CC)cc1 841717545 KJNZVHZZRJXWSI-CQSZACIVSA-N 292.427 2.069 10 20 CECD CCc1cccc(CN2CCn3cnnc3[C@@H]2C)c1O 848905896 MCUHLIRHCWCWFA-NSHDSACASA-N 272.352 2.123 10 20 CECD CCn1nnc(C)c1CN(C)c1ccc(OC)cc1 844354309 AXSHVXNHPNBFOI-UHFFFAOYSA-N 260.341 2.251 10 20 CECD CCc1cccc(CN2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)c1O 848905802 OKRVOMPNYNQXHA-AEGPPILISA-N 288.391 2.040 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C(=O)OC)cc1 48142212 MLQHPYAGXWWRLC-GFCCVEGCSA-N 264.369 2.184 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C12CCC(CC1)C2 752598988 DIXAYXDMCCPNNI-UHFFFAOYSA-N 261.321 2.294 10 20 CECD CCC(CC)(CNC(=O)c1cc(O)cs1)C(=O)OC 752630879 OEARFBDCGMMTSD-UHFFFAOYSA-N 285.365 2.163 10 20 CECD Oc1cc2c(cc1CN1CC[C@H](C3CC3)C1)[C@@H](O)CO2 768465709 QQKVEBNTLRKNDH-NHYWBVRUSA-N 275.348 2.050 10 20 CECD COc1ccc(O)c(CNC(=O)C2(c3ccccn3)CC2)c1 866767772 XHCPYHBTSLBQGB-UHFFFAOYSA-N 298.342 2.144 10 20 CECD CCCN1CC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 761578565 JVMWLMMWWUSJIS-LBPRGKRZSA-N 289.379 2.488 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2cc(C)ccc2O)C[C@@H]1C 877666598 LVJKULUNUOHQCD-LRDDRELGSA-N 277.364 2.332 10 20 CECD Cc1ccc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)c(O)c1 877132822 OKUNPWRRNWALRT-ZBFHGGJFSA-N 277.364 2.128 10 20 CECD COCC[C@@]1(NCc2ccc(OC)c(C)c2)CCOC1 775032214 GOQXBAHHMWUMFK-MRXNPFEDSA-N 279.380 2.289 10 20 CECD C[C@H](CN1CCCC1=O)N[C@H](C)c1c(O)cccc1F 886509843 GCILWBMPNWQDDD-GHMZBOCLSA-N 280.343 2.193 10 20 CECD COCC[C@@H](C)CNCc1ccc(OC)c(OC)c1O 894897049 WYVRMOCFFCEOHS-LLVKDONJSA-N 283.368 2.172 10 20 CECD COc1cc(O)c(CN(C)[C@@H]2CCCC[C@H]2O)cc1OC 895437407 KYJDNUZXMFJMGL-CHWSQXEVSA-N 295.379 2.145 10 20 CECD COc1cc(C)cc(CNCC[S@](=O)C(C)(C)C)c1O 894282991 BMDQUEAXJVRKDK-FQEVSTJZSA-N 299.436 2.346 10 20 CECD Cc1[nH]nc(NC(=O)c2cccc(O)c2O)c1Cl 790995615 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290.348 2.426 10 20 CECD Cn1cc(/C=C2/C(=O)Nc3ccc(F)cc32)cc1C(=O)O 1600944592 BDHRLPXSRZHRGT-NYYWCZLTSA-N 286.262 2.355 10 20 CECD CCN(C)c1ccc(CN[C@@H]2CCC[C@H]2C(=O)O)cc1 1609991113 JTBDWYDGBPPSGM-HUUCEWRRSA-N 276.380 2.486 10 20 CECD Cc1cccc(CNC(C)(C)c2nocc2C(=O)O)c1O 1610521932 GGGGHSBUCCRUON-UHFFFAOYSA-N 290.319 2.412 10 20 CECD C[C@H](NC(=O)C[C@@H]1CCC[C@H]1N)c1ccc(N(C)C)cc1 1576197737 FXUKSNTTWZMDNN-DUVNUKRYSA-N 289.423 2.447 10 20 CECD COc1cc(C)c(CNCC2(C(=O)O)CCC2)c(O)c1 1574181815 HPBIKSLPDUNWOW-UHFFFAOYSA-N 279.336 2.054 10 20 CECD COc1ccc(CNC[C@H](CC(=O)O)C(F)F)cc1C 1777364236 YOFMTDNNXGXAQL-NSHDSACASA-N 287.306 2.449 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]2C[C@H](C)O)cc1OC 160478378 MPFQWUNKXICTQM-WCQYABFASA-N 295.379 2.145 10 20 CECD C[C@@H]1CCC[C@H](OCC(=O)NCc2ccc(O)c(O)c2)C1 159026331 ZVQCJUBZEQXJKV-YPMHNXCESA-N 293.363 2.309 10 20 CECD C[C@@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H](C)C1(F)F 862437739 IMLBPMCYALDUIL-RKDXNWHRSA-N 285.290 2.461 10 20 CECD CN(Cc1ccc(N)cc1)Cc1ncc(Cl)n1C 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C[C@@H](CCCO)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 296530983 QKVUKDOHZMALHM-WDEREUQCSA-N 282.340 2.360 10 20 CECD C[C@H](NCCCc1cnn(C)n1)c1ccc(F)c(F)c1O 293741347 PFRSFEIKXLXHCP-VIFPVBQESA-N 296.321 2.082 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@@]2(O)CCN(C)C2)c1O 808715815 XNQXPRRAQAQMLA-ABAIWWIYSA-N 298.814 2.071 10 20 CECD CC[C@H](NC[C@H]1CC[C@@H](CO)O1)c1ccc(N(C)C)cc1 294127038 LBKFMNXUYAAMAW-IKGGRYGDSA-N 292.423 2.333 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C2CNC2)cc1F 817903491 PVXQVOQRBPDCAE-LBPRGKRZSA-N 279.403 2.369 10 20 CECD Cc1cc(O)c(CN[C@@H](C)Cc2cnn(C)c2)cc1C 825046050 OZXOXHDQHKLPDD-ZDUSSCGKSA-N 273.380 2.463 10 20 CECD COc1ccncc1NC(=O)/C=C\c1ccc(O)c(O)c1 588406269 ZRIZYKOXWDWDFC-HYXAFXHYSA-N 286.287 2.153 10 20 CECD O=C(NCCOc1ccccc1F)c1cc(O)cs1 732258885 USMBRPOVLASGQU-UHFFFAOYSA-N 281.308 2.402 10 20 CECD Cc1csc(CNC(=O)/C=C\c2ccc(O)c(O)c2)n1 588405394 LSQZNAQUYJVHKO-HYXAFXHYSA-N 290.344 2.192 10 20 CECD CCCC[C@@H](CN)NCc1cc(OC)c(OC)cc1O 841029760 RTSPUPXGBSBOLF-LBPRGKRZSA-N 282.384 2.017 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCC[C@H](N)C2)c1O 841057296 IWXCDHQJACVKNB-NWDGAFQWSA-N 284.787 2.414 10 20 CECD CC[C@@H](C(=O)NCc1ccc(N(C)C)cc1C)[C@H](C)O 842231600 MIIFBJFMWKYEQA-SWLSCSKDSA-N 278.396 2.084 10 20 CECD COc1ccc(N(C)CCN(C)CC[C@@H]2CCNC2)cc1 846225757 UIAFMHOXEFACDB-HNNXBMFYSA-N 291.439 2.063 10 20 CECD CCOc1ccc(CN2C[C@H]3CCC[C@@]3(N)C2)c(O)c1 857226741 YJHPMFGYWLOCHZ-CZUORRHYSA-N 276.380 2.104 10 20 CECD CCCN(CCO)Cc1cc(Cl)cc(C(C)=O)c1O 50145958 DBYLNFAXMHFELF-UHFFFAOYSA-N 285.771 2.453 10 20 CECD C[C@H](N[C@H](C)[C@H]1CN(C)CCO1)c1cc(Cl)ccc1O 756760215 POJOTZQAJKFVPR-FIXISWKDSA-N 298.814 2.415 10 20 CECD COCC[C@]1(NCc2ccc3c(c2)CCCO3)CCOC1 922071428 YPSVADSHJFSAML-KRWDZBQOSA-N 291.391 2.297 10 20 CECD CCn1cnc(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1 854325026 VRLYIZAIRDJFMD-UHFFFAOYSA-N 286.379 2.241 10 20 CECD CN(C)c1ccc(CN[C@@H]2[C@H]3OC[C@H]4C[C@@H]2C[C@@H]43)cc1F 924860665 DSLLCPIQHMCJHY-YEJOONJESA-N 290.382 2.405 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)C[C@H]2C)c1 862757626 AEJSLCZVRITNEU-RISCZKNCSA-N 275.348 2.322 10 20 CECD O=C(NCc1ccccc1O)C1(c2ccccn2)CC1 866756200 SRQDPMDZJYILQE-UHFFFAOYSA-N 268.316 2.135 10 20 CECD CC[C@@H](NC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 764342860 SNMKCQNAWNQKFM-SECBINFHSA-N 285.365 2.304 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@H](CO)C2)cc1F 862210583 PPGUHKFCAWOYCN-NSHDSACASA-N 284.350 2.235 10 20 CECD C[C@@H](NC(=O)NCC1(N(C)C)CCC1)c1ccccc1O 868525760 CMKXRBPAHGBOCT-GFCCVEGCSA-N 291.395 2.237 10 20 CECD COc1nc(C)cc(N(C)Cc2ccc(N(C)C)cc2)n1 760457628 CKCHUCWGFKKXMQ-UHFFFAOYSA-N 286.379 2.496 10 20 CECD CC1(C)CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768447676 AVYWEIHMSMLPJW-AWEZNQCLSA-N 277.364 2.440 10 20 CECD CCn1cc(CN(C)Cc2cc(F)ccc2O)cn1 779021569 UUUZXYGAQOYJEK-UHFFFAOYSA-N 263.316 2.380 10 20 CECD CC[C@@H](NC[C@@](C)(O)COC)c1cc(Cl)ccc1O 775504289 XHFFVYLNBHNNHP-TZMCWYRMSA-N 287.787 2.484 10 20 CECD C[C@H](NCC1(O)CCCC1)c1c(O)cccc1F 886527011 WZZJKJHDIBLCNO-JTQLQIEISA-N 253.317 2.487 10 20 CECD Cc1ccc(C(=O)Nc2ccnc(N(C)C)c2)c(O)c1O 780961507 XHNBRDQNLFFUBX-UHFFFAOYSA-N 287.319 2.120 10 20 CECD COc1ccc(CN2CC[C@H]3C[C@@H]3C2)c(O)c1OC 895432928 GEJCADJJLVEOJE-CMPLNLGQSA-N 263.337 2.251 10 20 CECD COc1ccc(CN(C(C)C)C2COC2)c(O)c1OC 894659159 PLQDOIJGOAONAW-UHFFFAOYSA-N 281.352 2.019 10 20 CECD COc1ccc(CNC[C@H]2CCCCO2)c(O)c1OC 892678391 GOQJGLGXRWYYQW-GFCCVEGCSA-N 281.352 2.068 10 20 CECD CCn1ncnc1CNCc1cc(Cl)cc(F)c1O 793341975 AJRSKSAASUULOK-UHFFFAOYSA-N 284.722 2.086 10 20 CECD CC[C@@H](C)[C@H](OC)C(=O)NCc1ccc(N(C)C)cc1 792849074 OKCIENKULABDEW-DOMZBBRYSA-N 278.396 2.430 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@H]1CCn2ccnc2C1 790987652 FFCCJTFKCPCYJY-VIFPVBQESA-N 295.745 2.486 10 20 CECD CCCN1CCCC[C@H]1C(=O)NCc1ccccc1O 1322708999 IJHKUANGDUYHPP-AWEZNQCLSA-N 276.380 2.273 10 20 CECD CC[C@@H](F)C(=O)N1CCOc2cc(N(C)C)ccc21 1335824890 UGSBRISJWQNBFE-LLVKDONJSA-N 266.316 2.226 10 20 CECD Nc1ccc(CN2CCC(NC3CCOCC3)CC2)cc1 1334753925 IWNLVPIIGNZPQW-UHFFFAOYSA-N 289.423 2.002 10 20 CECD CCc1ccc2c(c1)CCN2C(=O)c1ccoc1CC(N)=O 1334088793 DDQDZIGGJNKWCV-UHFFFAOYSA-N 298.342 2.073 10 20 CECD CN(C(=O)/C=C/c1cnn(C)c1)c1cccc2c1CCCN2 1337210348 MHFFUYOOTAJZSX-CMDGGOBGSA-N 296.374 2.454 10 20 CECD CCN(C)C(=O)CN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 229588062 UAVYJSXNLYXWRT-VXGBXAGGSA-N 276.380 2.317 10 20 CECD CN(C)c1cc(F)c(CN2CC[C@@H]3CC[C@@]32CN)cc1F 1578423084 PGYHIPSEOCTYHU-BLLLJJGKSA-N 295.377 2.344 10 20 CECD COc1cc(C)cc(CN(CC(=O)O)C2CCC2)c1O 1594054367 ARZFHEZMYMDHLM-UHFFFAOYSA-N 279.336 2.148 10 20 CECD CCC[C@@H](CC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1776827154 MUQKZQBYXJSNNS-JTQLQIEISA-N 282.296 2.033 10 20 CECD CCC[C@H](CC(=O)O)NCc1ccc(N(C)C)cc1 1776830404 QWHSBCYNZJDESO-CYBMUJFWSA-N 264.369 2.486 10 20 CECD Cc1ccc(CN[C@H]2c3ccccc3C[C@@H]2O)c(O)c1 877093211 FZYNUAGGOMIEGA-IRXDYDNUSA-N 269.344 2.449 10 20 CECD CCCNC(=O)CCN[C@H](C)c1ccc(N(C)C)cc1 45072722 ULPIFFYKYSIRMG-CYBMUJFWSA-N 277.412 2.320 10 20 CECD Cc1ccc([C@@H](C)NCCS(=O)(=O)C(C)C)c(O)c1 289820344 AEMZYGKRXVXRFL-GFCCVEGCSA-N 285.409 2.174 10 20 CECD COC1(CCNCc2cc3c(cc2O)OCO3)CCC1 383973707 FKOHDJJBWDQTQR-UHFFFAOYSA-N 279.336 2.170 10 20 CECD Cc1ncc(C(=O)NCCc2ccc(N)cc2)c(C(C)C)n1 179043934 FLWWJZRPSDGNJK-UHFFFAOYSA-N 298.390 2.463 10 20 CECD CCN(C)CCN[C@@H](C)c1cc(OC)ccc1O 54109854 OHCHOCFBTHFSLC-NSHDSACASA-N 252.358 2.003 10 20 CECD CO[C@@H](C)CC(=O)NCc1ccc(N(C)C)cc1C 115281393 MGJNAZBIJVKGAO-LBPRGKRZSA-N 264.369 2.102 10 20 CECD Cn1ccc(CNCc2cc(Cl)ccc2O)n1 213179742 BRIOVUNPEXYKTM-UHFFFAOYSA-N 251.717 2.069 10 20 CECD COc1cccc(CNC[C@](C)(O)c2ccsc2)c1O 77460797 WUJNVJPTBKDBBG-HNNXBMFYSA-N 293.388 2.460 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1csnn1 48703905 ASRRPDABATWCLB-UHFFFAOYSA-N 288.376 2.068 10 20 CECD C[C@@H](NCCCCO)c1ccc(N2CCOCC2)c(F)c1 194223408 SYPMOSNFLUTOMB-CYBMUJFWSA-N 296.386 2.085 10 20 CECD COCCCCCNCc1cccc(OC)c1O 227442491 OWHWMDUQYAYABW-UHFFFAOYSA-N 253.342 2.307 10 20 CECD Cc1cccc2c1C(=O)N[C@@H](c1ccc(O)c(O)c1)N2 48619669 DKJLQPKWTBGMJU-AWEZNQCLSA-N 270.288 2.260 10 20 CECD CCOc1ccc(O)c(CN2CCC(OC(C)=O)CC2)c1 93454104 RMMRSMWHKCUNOL-UHFFFAOYSA-N 293.363 2.318 10 20 CECD O=C(O)[C@@H](NCc1cccc(O)c1O)c1ccccc1 50510230 WWZCMUUIEPMTIK-ZDUSSCGKSA-N 273.288 2.013 10 20 CECD Cc1ccc(O)c(CNC[C@H](O)c2ccc(C)o2)c1 265985892 NFWJROHFYCBVLC-AWEZNQCLSA-N 261.321 2.425 10 20 CECD COc1cccc(CN2CC[C@@H](c3nccn3C)C2)c1O 368134289 LOZWOGXCEDREFR-CYBMUJFWSA-N 287.363 2.124 10 20 CECD CC[C@](C)(O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273602642 SGCGEKZLDLIHHH-RNCFNFMXSA-N 268.313 2.112 10 20 CECD C[C@H](N[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc([N+](=O)[O-])ccc1O 273583411 NCWUYLHLMCPEHU-PFEFGLNJSA-N 278.308 2.271 10 20 CECD C/C=C/C[C@@H](CO)N[C@H](C)c1cc(C(=O)OC)ccc1O 274646760 SEACEBDTPDFLFU-FVKZJRLBSA-N 293.363 2.157 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CCCCS2)c1O 272967209 RDSACMMFZPCCIX-LBPRGKRZSA-N 281.377 2.303 10 20 CECD COc1cccc(CN2CCC[C@@H]2c2ncon2)c1O 371376663 ZDGWEICSVKYPHX-LLVKDONJSA-N 275.308 2.121 10 20 CECD CCCNC(=O)CN[C@@H](C)c1c(C)cc(C)cc1O 293651458 IPGAXEJXCBXHTA-LBPRGKRZSA-N 264.369 2.186 10 20 CECD O=C(NCc1ccccc1O)Nc1cccc2c1COC2=O 808904562 CNWOVZANMWQTPS-UHFFFAOYSA-N 298.298 2.384 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](C)n2cccn2)c1 729534990 HGDGDRZLCNNYRH-MNOVXSKESA-N 289.335 2.036 10 20 CECD C[C@H]1C[C@@H](N[C@@H]2CC[C@H]2O)c2c(O)ccc(F)c21 818357985 MKQIJUMPITXDPI-AYHFEMFVSA-N 251.301 2.193 10 20 CECD CN(Cc1cc(Cl)c(F)cc1O)C[C@H]1COCCO1 827139389 ACSWCVWADXOGLO-JTQLQIEISA-N 289.734 2.032 10 20 CECD Cc1noc(C)c1[C@@H](C)NC(=O)c1c(F)ccc(O)c1O 825830311 JKRAKFBVEBRJTM-ZCFIWIBFSA-N 294.282 2.333 10 20 CECD CCn1cccc(NCc2cc(C)ccc2O)c1=O 902123198 UMTPNHZXWUAIBL-UHFFFAOYSA-N 258.321 2.494 10 20 CECD CC[C@@H]1C[C@H]1CNC(=O)/C=C\c1ccc(O)c(O)c1 836829630 KPXLKGKCWNVDTC-GJJFQZOLSA-N 261.321 2.273 10 20 CECD CCN[C@H](C)CNCc1cc(Br)ccc1O 841065374 JIZWXKXXKMTGEJ-SECBINFHSA-N 287.201 2.242 10 20 CECD CCc1cccc(CNCCCN2CCCCC2=O)c1O 848894329 CNHWBIHWLJAPNZ-UHFFFAOYSA-N 290.407 2.447 10 20 CECD CC[C@]1(C)CN(C(=O)NCCc2ccc(N)cc2)CCO1 841959410 NTTQHEPMXFKPTH-MRXNPFEDSA-N 291.395 2.022 10 20 CECD Cc1cc(Br)c(O)c(CN[C@@H]2CCCNC2)c1 841041624 BPBNJHVFCRFSOV-LLVKDONJSA-N 299.212 2.305 10 20 CECD COC(=O)[C@@H](NCc1ccc(N(C)C)cc1C)C1CC1 840941450 ATZNBVKIIFRUMN-HNNXBMFYSA-N 276.380 2.102 10 20 CECD Oc1ccc(Cl)c(F)c1CNCC[C@@H]1CCNC1 841036493 OXSZYXKHBBPLOY-VIFPVBQESA-N 272.751 2.274 10 20 CECD CCc1cccc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1O 848915231 DYRHAZBRWOYKBV-KLHDSHLOSA-N 271.360 2.340 10 20 CECD CCOc1cccc(CN[C@H]2CCCC[C@H]2CN)c1O 841031808 YLNBMJZIJBYSET-JSGCOSHPSA-N 278.396 2.398 10 20 CECD COc1cccc([C@@H](C)NCC(C)(C)N(C)C)c1O 846136119 GYIQZNUZEHFGPM-LLVKDONJSA-N 266.385 2.392 10 20 CECD C[C@@H](NCCN1CCC(O)CC1)c1ccc(Cl)cc1O 841752909 CUWLRGMNJSNQPS-LLVKDONJSA-N 298.814 2.153 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CNCC[C@@H]1C 841059731 WIWRZHAOFBMBNS-BLLLJJGKSA-N 261.413 2.149 10 20 CECD C[C@H](CCCCN)NC(=O)N(C)Cc1ccccc1O 841993559 FUZXGAJOYAGAOQ-GFCCVEGCSA-N 279.384 2.051 10 20 CECD CCn1cnnc1CCN[C@H](C)c1cc(F)ccc1O 756734598 YGFGZOLHQFMKHY-SNVBAGLBSA-N 278.331 2.036 10 20 CECD CSCC1(CCNC(=O)Cc2ccc(N)cc2)CC1 851641371 LMZNJEPCQXORCS-UHFFFAOYSA-N 278.421 2.461 10 20 CECD OC[C@H](CC(F)F)NCc1c(O)ccc(Cl)c1F 758617008 TUCBNDJJBQDZKZ-LURJTMIESA-N 283.677 2.290 10 20 CECD COc1cc2c(c(OC)c1)N(Cc1cnon1)CCC2 852173343 SENQFQUFGZDFHR-UHFFFAOYSA-N 275.308 2.040 10 20 CECD CC(C)c1nc([C@H](C)NC(=O)c2cc(O)cs2)n[nH]1 763224866 WMJIZKWYOQLPRH-ZETCQYMHSA-N 280.353 2.186 10 20 CECD O=C(NCc1ccccc1O)[C@H](O)c1ccccc1Cl 765176764 LMOPKYNGNWGXAI-CQSZACIVSA-N 291.734 2.395 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(F)CCOCC1 865903782 GQEKOIOHYYOGIZ-UHFFFAOYSA-N 294.370 2.196 10 20 CECD CCC[C@H](OCC)C(=O)NCCc1ccc(N)cc1 876527500 HVFRKKGOCOOFRN-AWEZNQCLSA-N 264.369 2.133 10 20 CECD Cc1ccc(CN2CCC[C@H]3CN(C)C[C@H]32)c(O)c1 877599436 ZOBIKLUWPFQFCV-DZGCQCFKSA-N 260.381 2.227 10 20 CECD CCN(C)c1ccc(CN(C)C[C@H](O)C(F)(F)F)cc1 773824891 WJEOTDRQAVVKQC-ZDUSSCGKSA-N 290.329 2.498 10 20 CECD CN(C)CCN(C(=O)c1cc(O)cs1)C1CCCC1 770402862 WLPQZCLKQGGVHV-UHFFFAOYSA-N 282.409 2.400 10 20 CECD 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O=C(c1cccc(O)c1O)N1CCC[C@@H]1C1CCOCC1 790919832 TVZSXUAHHXYGDE-CYBMUJFWSA-N 291.347 2.129 10 20 CECD COC(=O)CC1(CN(C)c2ccc(OC)c(OC)c2)CC1 799296420 CQNMGKZGFJIHNW-UHFFFAOYSA-N 293.363 2.483 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@@H](C)[S@]1=O 792193236 UIHPOVSKAKEJLN-LCKNKQDLSA-N 287.812 2.387 10 20 CECD COc1ccc(O)c(CNC(=O)c2cn(C(C)C)cn2)c1 798981132 JYVIYGPEXHZOGV-UHFFFAOYSA-N 289.335 2.108 10 20 CECD Cc1[nH]nc(C(F)F)c1NC(=O)c1cccc(O)c1O 790912152 YSISNECDHPREEN-UHFFFAOYSA-N 283.234 2.319 10 20 CECD Oc1ccc(Cl)cc1CN1[C@H]2CC[C@H]1COC2 695060044 LEGMLWBSIDZIKL-RYUDHWBXSA-N 253.729 2.409 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCC2CCOCC2)c1 1328700062 NLSXGNJLQXNWMC-UHFFFAOYSA-N 292.379 2.317 10 20 CECD COC(=O)CC1(CNC(=O)c2cc(O)cs2)CCCC1 1339217051 CBAOZJHFUAANJD-UHFFFAOYSA-N 297.376 2.307 10 20 CECD CC(C)C[C@H](N)CC(=O)N[C@H](C)c1ccccc1O 1340915394 FCZXUFOJCJEBTP-NEPJUHHUSA-N 264.369 2.333 10 20 CECD O=C(CCCNCc1cc(Cl)ccc1O)NC1CC1 112017128 ZHGATMAZTDQINW-UHFFFAOYSA-N 282.771 2.194 10 20 CECD 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CECD COc1ccc(O)c([C@H](C)N[C@H](C)C(=O)NCC(C)C)c1 135727311 SPCHUVYPIXIMSN-NWDGAFQWSA-N 294.395 2.212 10 20 CECD CN(C)c1ccc(CNC(=O)C2(O)CCCCC2)cc1F 86537311 MZVKCHRJZGJEPV-UHFFFAOYSA-N 294.370 2.203 10 20 CECD CCN(CC(=O)N(C)Cc1ccc(N(C)C)cc1)C1CC1 46058992 ZEOAORKOWNWWEA-UHFFFAOYSA-N 289.423 2.195 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)Cc1ccc(N)cc1 237132197 KVPWZMAABNVZON-LLVKDONJSA-N 264.369 2.131 10 20 CECD CO[C@]1(C)CCCN(C(=O)c2ccc(C)c(O)c2O)CC1 279990878 LSJGEARBYGQDDX-MRXNPFEDSA-N 293.363 2.437 10 20 CECD CC(=O)C(=O)COC(=O)CCC(=O)c1ccc(Cl)cc1 808488332 DHASZYAOCJLDLP-UHFFFAOYSA-N 296.706 2.004 10 20 CECD C[C@H](NC[C@@H](C)CN(C)C)c1cc([N+](=O)[O-])ccc1O 293604076 IYYJJECKPPCFQC-MNOVXSKESA-N 281.356 2.149 10 20 CECD CCOc1cccc(CN(C)[C@@H]2CC(C)(C)OC2=O)c1O 814179463 CTRNWNTXIASJIT-GFCCVEGCSA-N 293.363 2.317 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1ccccc1O 814300706 LTVIWXUPCGYMJJ-LBPRGKRZSA-N 264.369 2.034 10 20 CECD O=C1CC(C(=O)NCc2ccccc2O)(c2ccccc2)C1 810275186 KRDITWMMHBWYEN-UHFFFAOYSA-N 295.338 2.309 10 20 CECD CNC(=O)[C@H](C)CN(C)Cc1cc(Cl)c(C)cc1O 824913174 KHHAWZZIJLPPHR-SNVBAGLBSA-N 284.787 2.168 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCCN2C)c1 732287670 ZKHPNKYEMJUOML-SMDDNHRTSA-N 292.379 2.062 10 20 CECD CO[C@](C)(C1CC1)[C@H](C)NC(=O)c1cccc(O)c1O 839827730 AZNQBVNPZMVPTL-VFZGTOFNSA-N 279.336 2.031 10 20 CECD O=C(Nc1cc(CC2CC2)[nH]n1)c1cccc(O)c1O 830877329 OEDCIQVOQMFVTO-UHFFFAOYSA-N 273.292 2.026 10 20 CECD C[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)CCS1 841959067 KGBFACUSPLLGFO-LBPRGKRZSA-N 293.436 2.348 10 20 CECD COc1cccc([C@H](C)NCc2cc(C)nn2C)c1O 846168117 QZCGNPVJVSSJHW-NSHDSACASA-N 275.352 2.294 10 20 CECD CCN(CCSC)Cc1cc2c(cc1O)OC[C@@H]2O 842647538 ZOBGZBABPGVJCX-ZDUSSCGKSA-N 283.393 2.003 10 20 CECD CCc1cccc(CN(CC(F)F)C[C@H](C)O)c1O 848915071 SDOBJWQTEPXZSN-JTQLQIEISA-N 273.323 2.403 10 20 CECD C[C@H]1CN(Cc2cccc(Br)c2O)C[C@@H](C)N1 843049187 IQXDHYHFLYFFDD-AOOOYVTPSA-N 299.212 2.337 10 20 CECD N[C@H]1CCC[C@H](NCc2c(O)cccc2Cl)C1 841056920 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CN[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 128855405 SXYDKHGXGPQPKQ-JTQLQIEISA-N 275.179 2.493 10 20 CECD C[C@H](N[C@@H](C)c1nnnn1C1CC1)c1ccccc1O 189132031 OGOPAELGNBJECA-UWVGGRQHSA-N 273.340 2.125 10 20 CECD CO[C@@H](CNC(=O)NCc1ccccc1O)C(C)(C)C 73939604 OHBPSVPYWBKDNI-ZDUSSCGKSA-N 280.368 2.253 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H](O)C2)c1O 184672324 IECNEQCDMDGQGS-NSHDSACASA-N 271.744 2.011 10 20 CECD CN(Cc1cscn1)Cc1cc2c(cc1O)OCO2 49048526 UXRBQAOXVKOEHX-UHFFFAOYSA-N 278.333 2.209 10 20 CECD Cc1cc(C)n(CCN(C)Cc2ccccc2O)n1 264618806 QKARGGXYNPJVRU-UHFFFAOYSA-N 259.353 2.338 10 20 CECD COC[C@@H](O)CCNCc1ccc(N2CCCCC2)cc1 231605707 ITQNHELWEIXMNJ-KRWDZBQOSA-N 292.423 2.164 10 20 CECD COC(=O)CCN(Cc1ccccc1O)C(C)C 271244051 BQRMHJNACYZQTJ-UHFFFAOYSA-N 251.326 2.166 10 20 CECD Cc1ccc(C(=O)N2C[C@H](C)O[C@H](C3CC3)C2)c(O)c1O 279590375 APEJMQNADILVOF-GWCFXTLKSA-N 291.347 2.046 10 20 CECD C[C@@H]1CN(Cc2ccccc2O)C[C@]2(CCCOC2)O1 370712502 VUIRGGHNDLHSPW-CJNGLKHVSA-N 277.364 2.162 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCc1nnc(C)n1C 393200531 YELDAMOQZOLNEQ-PWSUYJOCSA-N 286.379 2.476 10 20 CECD COCCCOc1ccccc1NC[C@H](O)CSC 819421184 GAXKZPRFVQKHQW-LBPRGKRZSA-N 285.409 2.238 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCN1 817901735 XTFCRDHAQHBQBF-SMDDNHRTSA-N 265.376 2.122 10 20 CECD Cc1cc(O)c(CNCc2nnc3n2CCC3)cc1Cl 825096268 DJZYNCJNDXWELT-UHFFFAOYSA-N 292.770 2.182 10 20 CECD CN(Cc1nc(C(F)F)no1)Cc1ccccc1O 822739525 GDUZTEKKKWKXOM-UHFFFAOYSA-N 269.251 2.345 10 20 CECD COc1ccc(N(C)Cc2cn(C)nc2C)c(OC)c1 828475138 YQRGNUMOGDGWPE-UHFFFAOYSA-N 275.352 2.382 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1 824839379 XTQCLXYMZPXNDE-MUIFIZLQSA-N 287.359 2.176 10 20 CECD CCCNC(=O)CN(CC1CC1)c1ccc(OC)cc1 831582956 LTFINNFDVDFBKB-UHFFFAOYSA-N 276.380 2.438 10 20 CECD COc1cccc([C@H](C)NC2CCN(C)CC2)c1O 846138604 WQVWFYWPNOIDFP-NSHDSACASA-N 264.369 2.146 10 20 CECD CCc1cccc(CN[C@@H](C)Cc2cnccn2)c1O 848893792 CMYZLFGQWLZPCL-LBPRGKRZSA-N 271.364 2.465 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1ccc(N(C)C)cc1C 843121326 DGYHMQPKGIPBFT-HOCLYGCPSA-N 279.403 2.193 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCCC[C@@H]2CN)c1 841031470 SITIYDIIPDASJD-DOMZBBRYSA-N 278.396 2.398 10 20 CECD CN(C)C1(CNCc2cc(Cl)cc(F)c2O)CC1 841890100 LBGYPDTVGIUQTD-UHFFFAOYSA-N 272.751 2.369 10 20 CECD C[C@@H](Nc1ncc(C(=O)O)cn1)c1ccc(N(C)C)cc1 844211917 KZCGCWWCTCYNJQ-SNVBAGLBSA-N 286.335 2.414 10 20 CECD C[C@H](NCc1nc([C@H]2CCCO2)n[nH]1)c1ccccc1O 848557409 JSOCVNZBEIDQRM-GXFFZTMASA-N 288.351 2.213 10 20 CECD Cc1ccc(C(=O)OCc2nccs2)c(O)c1O 747054308 QWPHPZGKRYURAF-UHFFFAOYSA-N 265.290 2.220 10 20 CECD COc1ccc(N(C)CCN(C)C[C@H](O)C(C)(C)C)cc1 844402302 SKQURTCMPNINEP-INIZCTEOSA-N 294.439 2.470 10 20 CECD CCOC(=O)C(C)(C)c1nc(Cc2ccc(N)cc2)no1 843159479 QUVZYWGWPVXIAJ-UHFFFAOYSA-N 289.335 2.083 10 20 CECD O=C(NCc1ccccc1O)c1cc(F)cc2nccnc12 748346445 XMTQBJGKJSSJIE-UHFFFAOYSA-N 297.289 2.405 10 20 CECD COc1cccc([C@H](C)NCCCc2nc(C)no2)c1O 846150318 YOWAVYXWUOSGLO-JTQLQIEISA-N 291.351 2.376 10 20 CECD CS[C@@H]1CC[C@H](NC(=O)NCCc2ccc(N)cc2)C1 841841829 DQTBDBSDJAWGGK-UONOGXRCSA-N 293.436 2.395 10 20 CECD Nc1ccc(OCc2cn(C[C@@H]3CCCCO3)nn2)cc1 864645092 TYIBLZDJQXDIDY-HNNXBMFYSA-N 288.351 2.008 10 20 CECD COc1cc(O)c(CN2CCOC(C)(C)[C@H]2C)cc1OC 768462132 JVPWICPDCNQUNO-LLVKDONJSA-N 295.379 2.409 10 20 CECD CC(=O)N1CC[C@H](CN(C)Cc2ccc(C)cc2O)C1 876815240 OPMWTMXSIUCCPD-CQSZACIVSA-N 276.380 2.001 10 20 CECD Cc1cc(C(=O)N2C[C@@H](N)C[C@@H]2C)c(C)n1-c1ccccn1 877175409 JNFDBKXHJUSZEO-FZMZJTMJSA-N 298.390 2.051 10 20 CECD CC(C)[C@@](C)(O)C(=O)NCc1ccc(N2CCCC2)cc1 771167108 CKKFCYBCXXBDLM-QGZVFWFLSA-N 290.407 2.310 10 20 CECD C[C@@H](NCCN(C)CC(F)F)c1c(O)cccc1F 886644723 JLOHASAZNLBVAS-SECBINFHSA-N 276.302 2.379 10 20 CECD Oc1c(F)cc(F)cc1CN1CCc2ncncc2C1 895725018 YDMINJBRXQCYPN-UHFFFAOYSA-N 277.274 2.019 10 20 CECD CC1=NO[C@@H](CNCc2cc(Cl)ccc2O)C1 895311043 NJJHKSZTYDVHDT-LLVKDONJSA-N 254.717 2.300 10 20 CECD C[C@H](N[C@@H](CO)C1CCOCC1)c1ccc(N(C)C)cc1 782776302 AMDDLBCKMUFJPN-GUYCJALGSA-N 292.423 2.191 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@@H](C)O[C@]3(CCOC3)C2)c1 794705801 QYLYMBVQLPHUQJ-RHSMWYFYSA-N 291.391 2.389 10 20 CECD CC[C@H](NCCN1CCO[C@H](C)C1)c1ccc(F)cc1O 796747599 TUHYWMSQFZITAS-DOMZBBRYSA-N 296.386 2.293 10 20 CECD O=S(=O)(Nc1ccc(O)c(Cl)c1)c1ccoc1 795343887 RWATWAKMSOSIKP-UHFFFAOYSA-N 273.697 2.439 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H](C)S1=O 792191972 GYAJGRXKHQECDZ-NXEZZACHSA-N 287.812 2.387 10 20 CECD CN(C)[C@H]1CCCC[C@H]1NC(=O)NCc1ccccc1O 1318428039 VQLAWYPXINLAKW-KGLIPLIRSA-N 291.395 2.064 10 20 CECD Nc1cc(NCc2ccc(N3CCCC3)cc2)ncn1 1318330572 GYWNKNMUYLXCNG-UHFFFAOYSA-N 269.352 2.271 10 20 CECD C[C@H](O)CNCc1cc(Cl)cc(Br)c1O 708159559 ZKGCDSNMELHNDH-LURJTMIESA-N 294.576 2.279 10 20 CECD O=C(N[C@@H]1CCC[C@@H](F)C1)c1c(F)ccc(O)c1O 1329565177 WZZSGXZLNMOFGA-HTQZYQBOSA-N 271.263 2.247 10 20 CECD COc1cc(C)cc(CN[C@@H](CO)C2CCCC2)c1O 1338272922 AQXNROUJLCOIGJ-AWEZNQCLSA-N 279.380 2.350 10 20 CECD O=C(O)[C@@H](F)CNCc1cc(Cl)cc(Cl)c1O 1262163961 OEPWJFBLTVWFAK-QMMMGPOBSA-N 282.098 2.211 10 20 CECD Cc1nn(C)c(C)c1[C@H](C)C(=O)NCc1ccc(N)cc1 1343568022 VQWJSXGTAGLPBP-JTQLQIEISA-N 286.379 2.039 10 20 CECD C[C@@](CC(=O)O)(NCc1ccccc1O)c1ccncc1 1604089275 DYIDENAAXAKOPI-INIZCTEOSA-N 286.331 2.267 10 20 CECD CCN(CC)c1ccc(CN2CCCC[C@@H]2C(N)=O)cc1 162101175 LZOWLEIMIRGQFR-MRXNPFEDSA-N 289.423 2.373 10 20 CECD Cc1c(/C=C/C(=O)N(C)c2ccccc2N(C)C)cnn1C 152540643 ODEWOUHQWLZAJC-ZHACJKMWSA-N 298.390 2.471 10 20 CECD C[C@H](NCC[C@H](O)C1CC1)c1ccc(F)cc1O 903406598 JZMIYCNIWHVLJF-ZANVPECISA-N 253.317 2.343 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CC[C@H](C)O1 835088551 SLMILJBYLGOENU-QWRGUYRKSA-N 251.326 2.058 10 20 CECD C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)NC1CC1 228949557 ODLDMVFUABIEDL-RYUDHWBXSA-N 275.396 2.070 10 20 CECD COC[C@](C)(O)CN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 382546799 GASHOSLJJGDMNU-HWWQOWPSSA-N 279.380 2.236 10 20 CECD CCCNC(=O)NCc1ccc2c(c1)CCCN2C 58483259 LMWNKQBIXWRZOQ-UHFFFAOYSA-N 261.369 2.278 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@H]1CCCO1 173201963 IWLNNJCNHPZSDW-CYBMUJFWSA-N 290.363 2.047 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CN(CC)CC 66096233 UHYXRVGNZPJUCP-UHFFFAOYSA-N 278.396 2.473 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)C3CCC3)C2)cc1 62575108 SONBFFCOMLCVJH-ZDUSSCGKSA-N 288.391 2.438 10 20 CECD CCOC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 121625231 MLSZNRSFELYWKY-UHFFFAOYSA-N 276.380 2.280 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc(OC)no1 184870421 VWAOFGORRARQMB-UHFFFAOYSA-N 290.319 2.441 10 20 CECD C[C@@H](NCCC(=O)N(C)C)c1cc2c(cc1O)CCCC2 185264699 BFKRZGGCRCHLSG-GFCCVEGCSA-N 290.407 2.400 10 20 CECD CCc1ncc(C(=O)NCc2ccc(O)c(O)c2)s1 182539185 VYWBMTOYDGLXJJ-UHFFFAOYSA-N 278.333 2.047 10 20 CECD CO[C@H](C)c1noc(CN(C)Cc2ccccc2O)n1 177676391 GGOXCDBGQOAJTK-SNVBAGLBSA-N 277.324 2.115 10 20 CECD Cn1nccc1/C=C1/SC(NC2CCCCC2)=NC1=O 255894598 FEULGFWIZAMQGM-FMIVXFBMSA-N 290.392 2.313 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](C)[S@](=O)CC2)c1 277395163 GPEBYGUWFZVGNC-KPZWWZAWSA-N 267.394 2.044 10 20 CECD C[C@H](C(=O)NCc1ccc(O)c(O)c1)C(C)(C)C 272339082 OGWZEQZXUKVVND-SECBINFHSA-N 251.326 2.396 10 20 CECD CN(Cc1cc(Cl)ccc1O)C[C@@H](O)C(F)(F)F 809750954 KIOZUVIBLTUCMU-SNVBAGLBSA-N 283.677 2.401 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1C[C@@H]1C 808095656 NIOLGXIDXXXYNB-UWVGGRQHSA-N 254.326 2.150 10 20 CECD CC(C)(C)OC(=O)C1CN(Cc2ccccc2O)C1 297351569 FZSDUAYCMCTTSU-UHFFFAOYSA-N 263.337 2.166 10 20 CECD O=C(OC[C@@H](F)C(F)(F)F)c1cccc(O)c1O 800203080 IJOBZGWRFCFDKI-SSDOTTSWSA-N 268.162 2.155 10 20 CECD C[C@H](O)C[C@@H](C)NCc1cc(Cl)c(F)cc1O 816566941 LYHINPJQSBQVSD-SFYZADRCSA-N 261.724 2.434 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCN[C@H](C)C2)c1 817970773 DWGUFMMGPJRVTO-WOPDTQHZSA-N 264.369 2.192 10 20 CECD O=C(/C=C/c1cccnc1)N1C[C@@H](O)Cc2ccccc21 493257752 GSGHQHUGLHDQIJ-KIUWMYQTSA-N 280.327 2.045 10 20 CECD CC(=O)c1cc(F)cc(CN[C@](C)(C(=O)O)C2CC2)c1O 825946935 XXQYWYOFXNFYSS-HNNXBMFYSA-N 295.310 2.077 10 20 CECD C[C@H](Oc1ccccn1)C(=O)N[C@H](C)c1ccccc1O 827952231 KOETVAVBLBQMHP-NEPJUHHUSA-N 286.331 2.432 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NCc1cc([N+](=O)[O-])ccc1O 825099097 UPJITDFXJMKOAR-OTYXRUKQSA-N 280.324 2.204 10 20 CECD CCCONC(=O)NCc1ccc(N(C)C)c(F)c1 828262936 FWSCZFKEXWVYNI-UHFFFAOYSA-N 269.320 2.033 10 20 CECD CCN(Cc1ccc(Br)cc1O)[C@H](C)CO 825959172 BIMNULNPYLBUOQ-SECBINFHSA-N 288.185 2.357 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H](O)C1CC1 824261756 KVQOCIDKKGIPDM-INIZCTEOSA-N 288.391 2.064 10 20 CECD C[C@H]1CN(Cc2c(O)ccc3ccncc23)C[C@@H]1C(=O)O 828457424 UODJTDWLUAUPRG-GWCFXTLKSA-N 286.331 2.093 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)CCC2CCC2)cc1 832267388 RKVAYJHNWRLGDV-MRXNPFEDSA-N 289.423 2.449 10 20 CECD CCN(C)c1ccc(CN[C@H](CO)[C@H]2CCCOC2)cc1 839651774 RDNNLYYSBAYTLI-DOTOQJQBSA-N 292.423 2.020 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CC[C@H](C(N)=O)C2)c2c(O)ccc(F)c21 834905882 AFRZADDUQWHXMS-KLBPJQLPSA-N 292.354 2.323 10 20 CECD COC[C@H]1CCCCN1C(=O)/C=C/c1ccc(O)c(O)c1 837145186 IKGIKEBMVRDXIV-STMXVASLSA-N 291.347 2.139 10 20 CECD CC[C@@H](NC[C@H]1CNC(=O)C1)c1cccc(Cl)c1O 840837739 LVJWCRFCYQTDBU-JOYOIKCWSA-N 282.771 2.222 10 20 CECD CCOCc1cc(CN[C@H]2CCNC2(C)C)ccc1OC 841085393 AZNXIXKQUNHRFW-INIZCTEOSA-N 292.423 2.462 10 20 CECD COC/C(C)=C\C(=O)NCc1ccc(N(C)C)cc1C 844396096 LLTFKQUQFMCWMA-WQLSENKSSA-N 276.380 2.270 10 20 CECD CC[C@@]1(CO)CCCN1C(=O)Nc1ccc(N)cc1 841296165 PLGMDDBHQMSFJT-AWEZNQCLSA-N 263.341 2.038 10 20 CECD CO[C@@H](COC(=O)c1cccc(O)c1O)CC(C)C 842090635 DPTOBEVFSGCAIC-SNVBAGLBSA-N 268.309 2.316 10 20 CECD CCOCc1cc(CN[C@H](CO)CCF)ccc1OC 846096403 HLEHPWSVTHUDHE-AWEZNQCLSA-N 285.359 2.042 10 20 CECD CCC(C)(C)N1CCN(C(=O)Cc2ccc(N)cc2)CC1 848432511 IKEHWUCSGJFXOT-UHFFFAOYSA-N 289.423 2.144 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=S)NCC2CC2)c1 849256768 RPPHPIQUWXHRJL-SECBINFHSA-N 280.393 2.336 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](N)[C@@H](C)C2)c1O 843353769 PSCNPJKPLVRVNW-LKFCYVNXSA-N 296.798 2.417 10 20 CECD CCOc1cncc(CNCc2ccccc2O)c1 856768631 MMOKJYLSGPKMCR-UHFFFAOYSA-N 258.321 2.476 10 20 CECD COc1cc(C)nc(COC(=O)c2cccc(O)c2O)c1 758572654 LVGJOADNBFERQS-UHFFFAOYSA-N 289.287 2.167 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2cc(F)cc(F)c2O)C1 756656597 YVQSTACGGQTFPW-KOLCDFICSA-N 298.333 2.332 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1cc(Cl)ccc1O 765794499 CQYHVLIZJBJZRQ-VXGBXAGGSA-N 282.771 2.050 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2CC[C@H](C)O2)c1 875657969 VKDPSHPMWXNVQC-AAEUAGOBSA-N 278.352 2.067 10 20 CECD C[C@@H](CC(=O)N(C)c1ccc(N)cc1)[C@@H]1CCCNC1 877079231 VLXODPLIDVOSDL-QWHCGFSZSA-N 275.396 2.257 10 20 CECD OC1CCN(c2ccc(CN3CC[C@@H]4C[C@@H]4C3)cc2)CC1 877636376 VJEXYABFMOHODQ-HZPDHXFCSA-N 286.419 2.490 10 20 CECD CC(C)(C)CN(CCO)Cc1cc(F)ccc1O 779015388 UZJXWLOWRPMAHC-UHFFFAOYSA-N 255.333 2.372 10 20 CECD O=C(O)C1(NCc2cc([N+](=O)[O-])ccc2O)CCCCC1 789897411 IVXQRGDEFYBBMN-UHFFFAOYSA-N 294.307 2.178 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)ccc2O)[C@H]1C 787420921 NEKGHHDINHGEJG-WCQYABFASA-N 263.337 2.084 10 20 CECD C[C@@H](NC[C@@](C)(O)C(F)(F)F)c1c(O)cccc1F 886558377 ITVIVNUPZKKLLR-RDDDGLTNSA-N 281.249 2.495 10 20 CECD CC(C)NC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891402552 ZZCMBZVGHQHLON-OAHLLOKOSA-N 292.427 2.063 10 20 CECD Cc1cc(O)c(CNCC[C@H](C)N(C)C)cc1C 895297764 OGSIHGDJQJNOPV-ZDUSSCGKSA-N 250.386 2.439 10 20 CECD COc1cccc(O)c1CN1C[C@H](O)Cc2ccccc21 789761890 LHNRUUXUNPQXMC-CYBMUJFWSA-N 285.343 2.324 10 20 CECD CC(C)N(Cc1cn(-c2ccc(N)cc2)nn1)C(C)C 899682259 JEMYQQGJJWSODA-UHFFFAOYSA-N 273.384 2.468 10 20 CECD O=C(O)C1(CNCc2c(O)cccc2Cl)CCOCC1 1329427781 LVIJWUOJUUSXFD-UHFFFAOYSA-N 299.754 2.017 10 20 CECD Nc1ccc(CNC(=O)NCCOC2CCCC2)cc1 1336762230 AMTQCZXIHGCJAK-UHFFFAOYSA-N 277.368 2.027 10 20 CECD CCOc1cccc(CN2CCO[C@H](C)[C@@H]2C)c1O 93418097 ZXYYXRRXVCHLMX-NWDGAFQWSA-N 265.353 2.400 10 20 CECD C/C=C\C[C@@H](CO)NCc1cc(F)c(N(C)C)cc1F 1261787926 FZIJIQUSLNMKRL-RXNFCKPNSA-N 284.350 2.448 10 20 CECD Cc1cc(CN[C@@H]2CCC[C@@H]2C(=O)O)ccc1N(C)C 1607647691 GXEZTYJKFXEAGQ-UONOGXRCSA-N 276.380 2.404 10 20 CECD CC(C)(C)C[C@H](OC(=O)c1cc(O)cs1)C(=O)O 1589762142 YWDKRGAPGXLCNJ-QMMMGPOBSA-N 272.322 2.500 10 20 CECD N[C@@H]1CC[C@H](CNCc2cc(Cl)cc(F)c2O)C1 1580389892 WAKISKQHEIVRFR-GZMMTYOYSA-N 272.751 2.402 10 20 CECD C[C@@H]1CN(Cc2cc(F)c(F)cc2O)C[C@H]1CC(=O)O 1599866459 FNXDEILWLSDMME-RKDXNWHRSA-N 285.290 2.213 10 20 CECD C[C@H](NCC[C@@H](O)C1CC1)c1cc(F)ccc1O 903406158 GZZFINDKWOMNGD-TVQRCGJNSA-N 253.317 2.343 10 20 CECD CN(C)c1ccc(CN[C@H]2CCN3CCCC[C@@H]23)cc1 217641289 CNODLFNIZNNMRS-IRXDYDNUSA-N 273.424 2.469 10 20 CECD CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccccc2O)C1 113343729 ZFRQKAUAGIWYJI-CYBMUJFWSA-N 292.379 2.491 10 20 CECD c1cc(N2CCCC2)ccc1CNCCN1CCCC1 37228660 IXKBOUUROHEGBR-UHFFFAOYSA-N 273.424 2.472 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCSC1 383575073 AIDXJDPMBRVZQQ-LLVKDONJSA-N 251.351 2.104 10 20 CECD Cc1ccc(O)c([C@H](C)NCCc2cnccn2)c1 390142734 UNXRHBTYCDMTCC-LBPRGKRZSA-N 257.337 2.384 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](O)[C@H](C)C2)c1O 388201523 SETBJLIDWUZGBW-AMIZOPFISA-N 283.755 2.061 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](C(=O)O)C2)cc1 3749774 DNHUHXWLFCLYDZ-CYBMUJFWSA-N 262.353 2.049 10 20 CECD CN(C)c1ccc(CNC(=O)C2=CCCCO2)cc1 174440154 AMTGOCKLLKRYEQ-UHFFFAOYSA-N 260.337 2.063 10 20 CECD CC(C)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 65560639 DXELXUQQSCPILX-CYBMUJFWSA-N 276.380 2.356 10 20 CECD COc1cc(O)c(CN(CCCCO)C2CC2)cc1OC 180233432 QCTFNZGLBJYRNY-UHFFFAOYSA-N 295.379 2.146 10 20 CECD Cc1ccc(C(=O)N(C)CCC2CCOCC2)c(O)c1O 182597455 SPQXRZKXDZESGN-UHFFFAOYSA-N 293.363 2.295 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2cc(C)c(C)cc2O)C1 185771379 IFHGJSABFSIRSJ-CQSZACIVSA-N 292.379 2.329 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(=O)NC2CCCC2)c1 182459983 IAYVVRQAIYLRRP-LLVKDONJSA-N 292.379 2.110 10 20 CECD Oc1ccccc1CN1CC[C@@H](CN2CCCC2)C1 179578554 RJSOYCUJRLRVGB-AWEZNQCLSA-N 260.381 2.310 10 20 CECD Cc1c(CNC(=O)N[C@H]2CCOC2)n(C)c2ccccc12 349733631 JOPIFLLNRDUPFX-LBPRGKRZSA-N 287.363 2.075 10 20 CECD CC(=O)N1CCC[C@@H](CNCc2cccc(C)c2O)C1 279915812 WZVNKNIILPWZPG-AWEZNQCLSA-N 276.380 2.049 10 20 CECD C[C@@H](N[C@@H]1C[C@H]2CC[C@@H]1O2)c1cc([N+](=O)[O-])ccc1O 273583402 NCWUYLHLMCPEHU-FUPATZSFSA-N 278.308 2.271 10 20 CECD Cc1cc(CN2CCOC[C@@H]2C[C@H](C)O)ccc1N(C)C 294487805 HQCHUTTXMXNWPG-HOCLYGCPSA-N 292.423 2.033 10 20 CECD OC[C@H]1CN(Cc2cccc(Cl)c2O)CCC1(F)F 291236841 KXHLFEINKKIOKE-SNVBAGLBSA-N 291.725 2.495 10 20 CECD Cc1cc(C)c([C@@H](C)N[C@@H]2CC(=O)N(C3CC3)C2)c(O)c1 294804138 PEKPETZJTQNDLP-CHWSQXEVSA-N 288.391 2.423 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@H](C)C(=O)N(C)C)c1O 808706393 JBIHUBGZZQGNTN-VHSXEESVSA-N 284.787 2.481 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2nc(C)oc2C)c1 815835324 PKNBPGXSUSMJBC-QMMMGPOBSA-N 290.319 2.497 10 20 CECD Cc1ccoc1CNC(=O)c1ccc(C)c(O)c1O 816983440 XOPCHXHZZRGBTD-UHFFFAOYSA-N 261.277 2.238 10 20 CECD Cc1cc([C@H](C)NCCc2ccc(N)cc2)nn1C 817957322 KVNSCLUGASWDJN-LBPRGKRZSA-N 258.369 2.204 10 20 CECD CC[C@@H](NC[C@@]1(COC)CCCN1)c1ccc(F)cc1O 817973983 HXUAYHGURKGTMC-GDBMZVCRSA-N 296.386 2.341 10 20 CECD Cn1cc([C@H](O)CNCc2ccc3ccccc3c2O)cn1 816555117 UNLOOFSVEKKYFE-MRXNPFEDSA-N 297.358 2.102 10 20 CECD CCS(=O)(=O)CCNCc1ccc2ccccc2c1O 816546197 AYHKZVJBPQZEKN-UHFFFAOYSA-N 293.388 2.070 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCC[C@H]2OC)c1 824903727 LOMKEVYCBIJVEL-UKRRQHHQSA-N 265.353 2.448 10 20 CECD O=C(NC[C@H]1CC1(Cl)Cl)c1c(F)ccc(O)c1O 825425180 GBOSVYYPVBIWBG-RXMQYKEDSA-N 294.109 2.161 10 20 CECD CCOCCOCCCC(=O)N[C@H](C)c1ccccc1O 827956853 PQIQGUMELFVARI-CYBMUJFWSA-N 295.379 2.403 10 20 CECD C[C@H](CC(=O)NCc1ccccc1O)C1CCNCC1 828016057 SMQUHALBHFPXQS-GFCCVEGCSA-N 276.380 2.034 10 20 CECD Cc1ccc(CCNC(=O)c2ccc(C)c(O)c2O)nc1 837227325 TVZXKSFASKSEQZ-UHFFFAOYSA-N 286.331 2.082 10 20 CECD CCCc1nc(COC(=O)c2cc(O)cs2)no1 732353111 CVFUREMIVXQYRN-UHFFFAOYSA-N 268.294 2.146 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(C)c(C)c1O 834904011 MCNUZJRWXJYDOV-NWANDNLSSA-N 279.380 2.464 10 20 CECD C[C@@H](NCCN1CCCC1=O)c1cc(Cl)ccc1O 846206230 ODNVQCXCJSPCEQ-SNVBAGLBSA-N 282.771 2.319 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCCC[C@H]1F 840276609 MKORIZQRALFTNE-VXGBXAGGSA-N 266.316 2.472 10 20 CECD CCN1C[C@@H](CN[C@@H](C)c2cc(C)ccc2O)CC1=O 846210273 WVSPHYLSLOHCCI-QWHCGFSZSA-N 276.380 2.220 10 20 CECD CCCN(CC(=O)OC)Cc1c(O)ccc2ccncc12 918176174 QOMRRMSSWSUADY-UHFFFAOYSA-N 288.347 2.325 10 20 CECD CCNC(=O)[C@@H](NCc1cccc(CC)c1O)C(C)C 848915113 XVUCNCBTMQNKOR-AWEZNQCLSA-N 278.396 2.205 10 20 CECD COc1cccc([C@H](C)N[C@H](C)[C@H](CO)SC)c1O 846144729 LWOROYHUDVINPI-CWSCBRNRSA-N 285.409 2.164 10 20 CECD CN(Cc1cccc(Br)c1O)C1CCNCC1 843046714 ZPDCVTXTWMSKLU-UHFFFAOYSA-N 299.212 2.339 10 20 CECD COc1ccc(N(C)CC2(CC(=O)O)CC2)cc1OC 846241405 HNUNBNMYQMKIDW-UHFFFAOYSA-N 279.336 2.395 10 20 CECD O=C(O)/C=C/c1ccc(N2CC[C@@H](F)C2)c([N+](=O)[O-])c1 689864880 RXSFJHFAXGVEBC-XCRNYIDWSA-N 280.255 2.241 10 20 CECD CCOCc1cc(CN[C@@H](C)C2(CO)CC2)ccc1OC 850361627 UGOOSKLVOWRXFO-ZDUSSCGKSA-N 293.407 2.482 10 20 CECD Cc1cc(CNC(=O)C(C)(C)O)c(C)n1-c1ccccc1 863164603 PLGHSXFIBALVJD-UHFFFAOYSA-N 286.375 2.481 10 20 CECD COC[C@@H](NC(=O)N[C@H](C)c1ccccc1O)C1CC1 868430031 CHMGSIGEEBBDKZ-ZWNOBZJWSA-N 278.352 2.177 10 20 CECD CN(C(=O)[C@H]1CCCC[C@]1(C)N)c1ccc(N)cc1 877077718 RYYSTDNWEAJENN-HIFRSBDPSA-N 261.369 2.139 10 20 CECD CN(C(=O)[C@@H]1CC1(Cl)Cl)c1ccc(N)cc1 877080099 GRJJWBXBHGUFEA-VIFPVBQESA-N 259.136 2.425 10 20 CECD C[C@@H](CC(=O)N(C)c1ccc(N)cc1)C1CCNCC1 877078864 IDBZCEDCRTYNEX-LBPRGKRZSA-N 275.396 2.257 10 20 CECD CN(C)c1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)ccn1 779531974 PNWUOZAHMBWUFF-GQCTYLIASA-N 299.330 2.211 10 20 CECD CCCOc1ccc(CNC[C@H]2CCCNC2=O)cc1C 873131529 URTXYNBIWJVOLQ-OAHLLOKOSA-N 290.407 2.400 10 20 CECD CCN(C)c1ccc(CN2C[C@H](C)O[C@@H](COC)C2)cc1 773888795 OJMUBHAPMJHAIH-WMLDXEAASA-N 292.423 2.378 10 20 CECD C[C@H](C(=O)NCc1ccccc1O)c1ccccn1 774067360 YWQJLNRKIFSWMI-NSHDSACASA-N 256.305 2.207 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCN(CC2CC2)C1 882989679 CSJXZZNCQZYBCD-CYBMUJFWSA-N 282.334 2.244 10 20 CECD COC[C@H]1CN(CCN=[N+]=[N-])C[C@H]1C(F)(F)F 409436245 YVYPBCLQDNOEBE-HTQZYQBOSA-N 252.240 2.053 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCCC(=O)O)cc1 1329578310 AIGMKAMBSFPBFM-UHFFFAOYSA-N 292.379 2.404 10 20 CECD COC(=O)[C@@H]1CC12CCN(Cc1ccc(N)cc1)CC2 1337838989 YKQOLVQCIJIUSU-AWEZNQCLSA-N 274.364 2.044 10 20 CECD CCOc1cccc(CN(CC(=O)O)[C@H](C)CC)c1O 86752937 PCHMZFNXSLYRSO-LLVKDONJSA-N 281.352 2.476 10 20 CECD CO[C@H](CN[C@H](C)c1ccccc1O)C1CCOCC1 877755880 QFRCSNIFYXWNIC-MLGOLLRUSA-N 279.380 2.484 10 20 CECD Nc1ccc(CNC(=O)N2CCCC(F)(F)C2)cc1 1337069826 CRWRMZOPQMMLNL-UHFFFAOYSA-N 269.295 2.210 10 20 CECD CC[C@H](CCO)CN[C@H](C)c1cc(OC)ccc1O 94948706 MPQOIBJNDFCXKU-VXGBXAGGSA-N 267.369 2.460 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1261482826 ZVBQIYCEELBPEB-HOCLYGCPSA-N 273.424 2.456 10 20 CECD CC(C)CNC(=O)CN[C@H](C)c1ccc(Cl)cc1O 1348550149 CROABBLRJTXIAS-SNVBAGLBSA-N 284.787 2.468 10 20 CECD O=C(c1cc(O)cs1)N1CCC(c2ncccn2)CC1 1347854273 AEEQKZAFGOCGBB-UHFFFAOYSA-N 289.360 2.264 10 20 CECD CN[C@@H](C)CCNCc1cc(Br)ccc1O 1345099674 JGNNFIJIKRVQGM-VIFPVBQESA-N 287.201 2.242 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)c1ncc(C(=O)O)s1 1604307416 HPHMFDKWFUILQO-YFKPBYRVSA-N 298.345 2.099 10 20 CECD Cc1ccc(CN[C@@H]2Cc3ccccc3[C@H]2N)c(O)c1 1579696837 IHCPIGGNDKNSEY-NVXWUHKLSA-N 268.360 2.415 10 20 CECD NC[C@]12CC[C@@H]1CCN2Cc1cc(Cl)c(F)cc1O 1580253722 QZMJHHVLEXUTIH-QMTHXVAHSA-N 284.762 2.498 10 20 CECD CCN1CCc2cc(CNc3cc(C(=O)O)ncn3)ccc21 1776878030 PQJAGJWYNFFGCZ-UHFFFAOYSA-N 298.346 2.169 10 20 CECD Cc1cc(C)c(O)c(CN2CCO[C@@H]([C@@H]3CCCO3)C2)c1 164480053 OXFPJQNXYNBYBL-JKSUJKDBSA-N 291.391 2.389 10 20 CECD COc1ccc(O)c(CN2CC[C@H](OC)[C@@H](C)C2)c1 824815328 LYHUPKZVHGFKQI-NHYWBVRUSA-N 265.353 2.258 10 20 CECD COc1ccc(O)c(CN(C)[C@H]2CCN(C(C)C)C2)c1 825338960 XDBGBZBQMPSQIP-AWEZNQCLSA-N 278.396 2.315 10 20 CECD COc1cccc(O)c1CN[C@H]1C[C@@H](OC)C12CCC2 839182221 LRSHEGQAFDJBQL-LSDHHAIUSA-N 277.364 2.448 10 20 CECD CN1CCC(C)(CNCc2ccc3c(c2)CCO3)CC1 227328014 LSAXPSFFACRTLS-UHFFFAOYSA-N 274.408 2.443 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](N)C[C@@H]2C)c1O 229104718 LZNIGIMYPJFGHQ-JOYOIKCWSA-N 284.787 2.366 10 20 CECD C[C@H]1C[C@H](NCc2ccc(N(C)C)cc2)CN1C1CC1 122328581 DVCJRSVYSXVPTC-ZFWWWQNUSA-N 273.424 2.467 10 20 CECD CC[C@H](C)NC(=O)CCNCc1cc(Cl)ccc1O 38013770 NWONZGKXQOGWQL-JTQLQIEISA-N 284.787 2.440 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1CCN2CCC[C@H]2C1 300416029 DNUTZQRRQBOVKY-KGLIPLIRSA-N 264.344 2.248 10 20 CECD C[C@@H]1C[C@@H](C)N(Cc2cc(F)ccc2O)C[C@H]1CN 397304689 GHDXMDMMJZUQEV-NQBHXWOUSA-N 266.360 2.337 10 20 CECD C[C@@H]1CC[C@H](C(=O)O)CN1Cc1cc(F)ccc1O 397483167 GSRHOCGIEZKQPM-ZJUUUORDSA-N 267.300 2.216 10 20 CECD C[C@@H](CO)CCCNCc1ccc(N(C)C)cc1 230161405 QRQYNTSWRMOXIV-CYBMUJFWSA-N 250.386 2.251 10 20 CECD CC1(C)[C@H](O)C[C@H]1NCc1cc(Cl)ccc1O 128188093 GTVBHBAFISVKRL-VXGBXAGGSA-N 255.745 2.295 10 20 CECD COc1ccc(O)c(CNC(=O)c2ncc(F)cc2F)c1 192178659 GIZNMBRBIRSJLA-UHFFFAOYSA-N 294.257 2.004 10 20 CECD CC[C@H](CCO)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273591874 PJIRFFAKRGITOL-GHMZBOCLSA-N 282.340 2.360 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)[C@@H]1CCCCO1 272006231 PDNKSRQXGYXRTB-RISCZKNCSA-N 278.352 2.149 10 20 CECD Cc1noc([C@H]2CCCN2Cc2ccccc2O)n1 289910483 UYLLBROHECOVOU-GFCCVEGCSA-N 259.309 2.421 10 20 CECD CC[C@H](NC1CN(C(=O)OC)C1)c1ccc(F)cc1O 286078812 LLAQXFYSPUEOTR-LBPRGKRZSA-N 282.315 2.023 10 20 CECD O=C(NCc1nccc(C(F)F)n1)c1cc(O)cs1 807891306 NGJHZFRBMGSDFB-UHFFFAOYSA-N 285.275 2.111 10 20 CECD COc1cccc(CN2CC[C@@H](O)CC(C)(C)C2)c1O 295206320 KUXLIZFWXNFXBQ-CYBMUJFWSA-N 279.380 2.384 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H](O)CN2CCCC2)c(O)c1 293248553 BMPJZVWGLFAQPU-HUUCEWRRSA-N 292.423 2.116 10 20 CECD CCOC1(CNC(=O)c2ccc(C)c(O)c2O)CCCC1 294321874 XAEGPYBXUKPPSC-UHFFFAOYSA-N 293.363 2.485 10 20 CECD C[C@H](NC(=O)CCc1ncc[nH]1)c1ccc(N(C)C)cc1 807274222 LPGNEFTWEGOZKO-LBPRGKRZSA-N 286.379 2.286 10 20 CECD CC(C)(O)C(=O)NCc1cc(Cl)cc(Cl)c1O 813683269 ZRDCSQCGFUYKSO-UHFFFAOYSA-N 278.135 2.086 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CC13CCNCC3)CC2 817977002 YXYNFEIIYAKSID-OCCSQVGLSA-N 258.365 2.111 10 20 CECD O[C@H](CNc1ccccc1OCC1CC1)Cn1cccn1 819450923 JASOUJVAOAUPSY-CQSZACIVSA-N 287.363 2.145 10 20 CECD COC[C@@H](CNCc1cc(Cl)c(C)cc1O)OC 825479752 RNARHZDLIILBRY-LLVKDONJSA-N 273.760 2.105 10 20 CECD Cc1nnc([C@@H](C)OC(=O)c2ccc(C)c(O)c2O)o1 727004863 XIKMALHBXSKFTP-SSDOTTSWSA-N 278.264 2.016 10 20 CECD NC(=O)Nc1cccc(NC(=O)c2cc(O)cs2)c1 732266904 PGJRERPTEBKAIC-UHFFFAOYSA-N 277.305 2.197 10 20 CECD COc1cc2c(c(OC)c1)N(C[C@@H]1CCOC1)CCC2 839653863 IGNYWGMOSWEJPC-LBPRGKRZSA-N 277.364 2.493 10 20 CECD CCOc1ccc(O)c(/C=C2/SC(=S)NC2=O)c1 915840840 KCFGKXBZAJCOQE-UXBLZVDNSA-N 281.358 2.280 10 20 CECD COCCOC[C@@H](C)NCc1ccc(N(C)C)c(F)c1 742377400 UFBFXZMCGALWNV-GFCCVEGCSA-N 284.375 2.033 10 20 CECD C[C@@H](CNC(=O)NCCc1ccc(N)cc1)c1ccncc1 841853198 XTOKRUAXPJIACA-ZDUSSCGKSA-N 298.390 2.309 10 20 CECD C[C@@H](NC[C@@H](O)CN1CCCC1)c1ccc(Cl)cc1O 841744517 IHVAKDHUHVLCOP-DGCLKSJQSA-N 298.814 2.153 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N[C@@H]1CCCOCC1 845094611 UUDUFESUXUXLKR-GFCCVEGCSA-N 298.770 2.414 10 20 CECD O=C(COC(=O)C1CC2(CC2)C1)c1ccc(O)c(O)c1 850214764 OPNIIQPTKYDMFN-UHFFFAOYSA-N 276.288 2.014 10 20 CECD CC(C)N(C)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756526953 UYPJUQBVCMTYSQ-NSHDSACASA-N 281.356 2.291 10 20 CECD C[C@H](NCc1cc(F)c(N(C)C)cc1F)c1ncn(C)n1 858158846 SHMCUBMCXIAVQY-VIFPVBQESA-N 295.337 2.010 10 20 CECD Cc1nccn1CCCCOC(=O)c1cccc(O)c1O 758555957 ACBRVLPMQBJFJQ-UHFFFAOYSA-N 290.319 2.240 10 20 CECD CN(C)c1cc(F)c(CN2CC(C(C)(C)O)C2)cc1F 862389867 QPPQYFBABKDJHH-UHFFFAOYSA-N 284.350 2.234 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H](C3CC3)C1)[C@H](O)CO2 768465708 QQKVEBNTLRKNDH-IAQYHMDHSA-N 275.348 2.050 10 20 CECD CN(C(=O)CCCOC1CCOCC1)c1ccc(N)cc1 877075984 HTKLIUGOZNEMPG-UHFFFAOYSA-N 292.379 2.207 10 20 CECD C[C@H](NCC(=O)NCC1CCC1)c1ccc(N(C)C)cc1 775832017 WHZLIWICJBHNMI-ZDUSSCGKSA-N 289.423 2.320 10 20 CECD Cc1[nH]c(C=O)cc1C(=O)N(C)Cc1ccccc1O 774042966 GPVDWKJLGFSKPN-UHFFFAOYSA-N 272.304 2.113 10 20 CECD COC(=O)[C@@H]1CCN(Cc2c(C)cccc2O)[C@H]1C 877467003 VDZYZJHKKPOWBW-NWDGAFQWSA-N 263.337 2.084 10 20 CECD Cc1ccc(CN[C@@H](C)C(=O)OCC(C)C)c(O)c1 877469721 SNEAALPGHNDVGW-LBPRGKRZSA-N 265.353 2.378 10 20 CECD C[C@H](c1ccccc1)[C@H](CO)NC(=O)c1cc(O)cs1 778511506 CCEHNQANRSRQER-MFKMUULPSA-N 291.372 2.348 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@@H](n2cncn2)C1 777221735 LIODYEVEEYWRMR-SNVBAGLBSA-N 278.743 2.084 10 20 CECD C[C@H]1[C@H](C)N(Cc2cc(F)cc(F)c2O)CCN1C 894488380 XBYUOHUIUPMNBG-UWVGGRQHSA-N 270.323 2.195 10 20 CECD C[C@](O)(CC(=O)NCc1ccccc1O)c1ccccc1 780982998 ALPRKULXLDWBRY-KRWDZBQOSA-N 285.343 2.306 10 20 CECD COc1ccc(CNC(=O)Cc2ccccc2F)c(O)c1 794389563 QVAOBDNSKXHWKT-UHFFFAOYSA-N 289.306 2.399 10 20 CECD Oc1ccc(Cl)c(F)c1CNCC1(O)CCC1 790960262 AIOQLFGPCQSESM-UHFFFAOYSA-N 259.708 2.189 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cncc(F)c1 799012170 LWTAZPRWSUSZNR-RQOWECAXSA-N 274.251 2.284 10 20 CECD COc1ccc(CNC(=O)NCC(C)(C)C)c(O)c1 792841776 OIDJFIIVWCPSIB-UHFFFAOYSA-N 266.341 2.246 10 20 CECD Oc1ccc(Cl)cc1CNCCC1(O)CCOCC1 796465657 IFVDSWQXLQKYRG-UHFFFAOYSA-N 285.771 2.067 10 20 CECD COc1ccc(O)c(CNc2cncc(Cl)n2)c1 302827071 BAOUJQBZJDHNPV-UHFFFAOYSA-N 265.700 2.456 10 20 CECD Cc1ccc([C@@H](C)NCC2(CO)CCOCC2)c(O)c1 186149836 BJOZEORGNYGURP-CYBMUJFWSA-N 279.380 2.140 10 20 CECD CSC1(CNC(=O)c2cccc(O)c2O)CCC1 280077667 KFXAIQCYLUMAGI-UHFFFAOYSA-N 267.350 2.113 10 20 CECD OC[C@]12C[C@@H]1CN(Cc1ccc(N3CCCC3)cc1)C2 1320882611 YNWYWXQVTVOZFW-NVXWUHKLSA-N 272.392 2.101 10 20 CECD COc1cccc(CN[C@H]2CCC[C@@H](OC)C2)c1O 746755677 REMPLMHPTKGMGU-QWHCGFSZSA-N 265.353 2.448 10 20 CECD CC(C)CNC(=O)CNCc1c(O)ccc(Cl)c1F 1343558650 FKBWWKDERPHZCN-UHFFFAOYSA-N 288.750 2.047 10 20 CECD O=C(O)c1ccc(Sc2ncc(Cl)s2)nn1 1602404753 FDCJRDNQKVETDE-UHFFFAOYSA-N 273.726 2.436 10 20 CECD Cc1ccc(O)c(CN(C)[C@@H](COC(C)C)C(=O)O)c1 1610509254 CMESFBSSPZWNAX-ZDUSSCGKSA-N 281.352 2.011 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1cc(C(=O)O)no1 1610121617 BWLCGBUDUFXNCR-UHFFFAOYSA-N 289.335 2.071 10 20 CECD O=C(O)[C@@H]1CCC[C@H]1NCc1cccc(Cl)c1O 1610742179 OHQOCUKZIVNAGL-MWLCHTKSSA-N 269.728 2.389 10 20 CECD C[C@@H]1OC[C@]2(CC[C@@H](CNCc3ccc(N)cc3)O2)[C@@H]1C 1576902584 BEYVPMIQEIMCOR-OSRSDYAFSA-N 290.407 2.331 10 20 CECD CC(C)C[C@H](O)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1591183721 LZCZXJIZZQJARR-JQWIXIFHSA-N 281.352 2.148 10 20 CECD C[C@@H](NC[C@@H]1CCCOC1)c1cc(C(=O)O)ccc1O 1593257235 MQHQVJRBFLDEAG-MNOVXSKESA-N 279.336 2.168 10 20 CECD NC1CCC(NCc2cccc(Cl)c2O)CC1 158753078 HVFGJOUYOOIURH-UHFFFAOYSA-N 254.761 2.405 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](C)[C@@H]2C(=O)O)c1 818631631 LQKRPPRBQAKOMF-QMTHXVAHSA-N 279.336 2.086 10 20 CECD CCN(CC)C[C@@H](C)NCc1cccc(OC)c1O 45690681 XPRURWQPPCPXRT-GFCCVEGCSA-N 266.385 2.221 10 20 CECD CC[C@@H](C)[C@@H](CNCc1cc2c(cc1O)OCO2)OC 294115510 DFXDIFZVMOOCEC-MEBBXXQBSA-N 281.352 2.272 10 20 CECD COc1cccc(CNC[C@@H](C)CN2CCCC2)c1O 60942120 XJDZKRIYKDCNHI-CYBMUJFWSA-N 278.396 2.222 10 20 CECD Oc1cccc2c1[C@@H](N[C@@H]1CCN(C3CC3)C1)CC2 389088051 FYPYJFSWNCJGBK-OCCSQVGLSA-N 258.365 2.206 10 20 CECD COc1ccc(O)c([C@H](C)NCc2nccnc2C)c1 699907627 CGDYZUYJOSZEGH-JTQLQIEISA-N 273.336 2.350 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@H]2c2ccco2)c1O 105651124 MBKLIXGDRVOTIM-VXGBXAGGSA-N 287.315 2.414 10 20 CECD Cc1ccc(C(=O)NCCN(C)C2CCCC2)c(O)c1O 179482941 JBNXLKVMWTYARL-UHFFFAOYSA-N 292.379 2.010 10 20 CECD CCCNC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 65698284 KOFLUURIFFXLHP-CYBMUJFWSA-N 291.395 2.293 10 20 CECD CC(C)[C@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 131276490 WWQDPRRVXYHHOF-IUODEOHRSA-N 250.386 2.420 10 20 CECD CS[C@H](CO)[C@H](C)NCc1c(O)cccc1Cl 152451042 CIAMCBCNGCWLQU-QPUJVOFHSA-N 275.801 2.248 10 20 CECD C[C@@H]1C[C@@H](CN)CN1Cc1cc(Cl)ccc1O 216020767 MLSJHRBHVAZBOQ-ZJUUUORDSA-N 254.761 2.215 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCCC(=O)OC 182756590 ORLFCTXRMDOJGD-UHFFFAOYSA-N 293.363 2.474 10 20 CECD COc1ccc(O)c(CN2CCC(NCC3CC3)CC2)c1 133594014 MOFUVZBRNBESEK-UHFFFAOYSA-N 290.407 2.365 10 20 CECD COc1cccc(/C=C2\SC(=S)NC2=O)c1F 195501864 NOKBRDDRRYHJNR-YVMONPNESA-N 269.322 2.323 10 20 CECD Nc1ccc(CC(=O)Nc2ccnn2CC2CC2)cc1 237919032 RBNDUFICUFWIRM-UHFFFAOYSA-N 270.336 2.057 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2c2nncn2C)cc1 93809512 DIOKUKOEPATWSV-HNNXBMFYSA-N 285.395 2.218 10 20 CECD C[C@@H](C(=O)NCCc1ccc(N)cc1)[C@H](N)c1ccccc1 262583170 RJMFASYWBCUFBX-DYVFJYSZSA-N 297.402 2.264 10 20 CECD CC[C@@H](NCc1cc(OC)ccc1O)[C@@H](O)C(F)(F)F 271876159 ZLKYJIRESIGLRT-ZYHUDNBSSA-N 293.285 2.192 10 20 CECD CC(C)(CO)CCNCc1ccc(N2CCOCC2)cc1 385923822 TYEDGVSXDVTQNI-UHFFFAOYSA-N 292.423 2.021 10 20 CECD Cc1cc(CN2C[C@@H](C)[C@H](CO)C2)ccc1N(C)C 294761857 YNCWDTHVLNUQEI-HIFRSBDPSA-N 262.397 2.121 10 20 CECD O=C1NCc2c(NCc3ccccc3O)cccc21 808419877 OCJIBVRJPFHYOB-UHFFFAOYSA-N 254.289 2.248 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1C[C@@H]1C 808095657 NIOLGXIDXXXYNB-VHSXEESVSA-N 254.326 2.150 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@H](C)CC(N)=O)c1O 808703598 PCDWQEKDINWNNQ-RKDXNWHRSA-N 270.760 2.269 10 20 CECD COc1ccc(O)c(CNC(=O)c2ncoc2C2CC2)c1 815835529 WWTCIKKHFYQHKC-UHFFFAOYSA-N 288.303 2.196 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H]2C[C@H](F)CN2)c1 817976271 JHTMFHPUOUJOAG-SRVKXCTJSA-N 252.333 2.051 10 20 CECD CCOc1cccc(CN2CCN(C)C[C@@H]2CC)c1O 816660342 ACGIDDYOKBOPTQ-AWEZNQCLSA-N 278.396 2.317 10 20 CECD CCOc1ccc(CN2CCCc3n[nH]cc32)c(O)c1 811497476 OOPWORZEJLQQQB-UHFFFAOYSA-N 273.336 2.467 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)N2CCCC2)c1 728937655 FRODBHSDCDMEKU-SNVBAGLBSA-N 264.325 2.267 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2ccccc2O)n1 828656459 YKNHLGHJHARGAZ-JTQLQIEISA-N 260.341 2.163 10 20 CECD CC(C)[C@H](NC(=O)c1cccc(O)c1O)[C@H](CO)C(C)C 834053064 LQDAPRWLXUMKSF-OCCSQVGLSA-N 295.379 2.117 10 20 CECD COC(=O)c1cccc(NC(=O)c2cc(O)cs2)c1O 732287472 VKMGQONETBGNBA-UHFFFAOYSA-N 293.300 2.198 10 20 CECD CC(C)c1ccc(C(=O)NCCc2ccc(N)cc2)c(O)n1 904925874 NFYPKMIONMAZGX-UHFFFAOYSA-N 299.374 2.465 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@@H](N)C1 841058497 SANLXSAWVBVTAH-HUUCEWRRSA-N 261.413 2.421 10 20 CECD Cc1cc(CN[C@H](C)[C@@H](C)C(=O)O)ccc1N(C)C 846229663 XEMMVPVYHCZRNS-VXGBXAGGSA-N 264.369 2.260 10 20 CECD CCOC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1ccc(N)cc1 841297122 AKNFFAAJTKMZAJ-OLZOCXBDSA-N 291.351 2.122 10 20 CECD CCOc1ccc(CN2CC[C@H](N)C[C@@H]2C)c(O)c1 846699696 VVZUCDTVXGHNJA-AAEUAGOBSA-N 264.369 2.103 10 20 CECD CC[C@@H]1COC(C)(C)CN1C(=O)c1cc(O)cs1 846657927 IGSGMMMKXSSIHP-SECBINFHSA-N 269.366 2.483 10 20 CECD CN(CCC[C@@H]1CCOC1)c1ccc(OCC(=O)O)cc1 846279826 MUZARWITIWZYTP-CYBMUJFWSA-N 293.363 2.403 10 20 CECD C[C@@H]1C[C@@H](NCc2c(O)ccc(Cl)c2F)CCN1 841062126 GIHQKSQVCCJPBI-BDAKNGLRSA-N 272.751 2.415 10 20 CECD CCCN1CCC[C@H]1CNC(=O)Nc1ccc(N)cc1 841300652 YPSGIUQNOIMPDK-AWEZNQCLSA-N 276.384 2.265 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCN[C@@H](C)C2)c1 841061990 PPIUKNVBCSJFCQ-AAEUAGOBSA-N 264.369 2.021 10 20 CECD COc1ccc(O)c(CNC(=O)c2c[nH]c3ncccc23)c1 741284153 HSWVSMZVEKVKIT-UHFFFAOYSA-N 297.314 2.207 10 20 CECD CCn1cc(CC(=O)NCc2cc(Cl)ccc2O)cn1 846474000 PVSUJGARCARSHM-UHFFFAOYSA-N 293.754 2.121 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H](C)[C@H]2CCCOC2)c1 858355704 VZYWWSXAPMMJOG-OLZOCXBDSA-N 292.379 2.315 10 20 CECD Cc1nc(COC(=O)/C=C/c2ccc(O)c(O)c2)oc1C 759788675 JEAKTGITQBWTIG-GQCTYLIASA-N 289.287 2.459 10 20 CECD C[C@@H]1CCN(Cc2cccc(Cl)c2O)C[C@@H]1CO 857061312 OGTNMWXQUPEDFZ-ZYHUDNBSSA-N 269.772 2.496 10 20 CECD COc1cccc([C@H](C)N[C@H]2C[C@H](OC)C2)c1O 858584493 RTANYTXBKZCTHP-DCAQKATOSA-N 251.326 2.229 10 20 CECD C[C@@H]1C[C@@H](NCCCOCCO)c2c(O)ccc(F)c21 757637686 MHYVOTFSJPCASI-ZYHUDNBSSA-N 283.343 2.068 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ncccc1F 935945056 IWGGSQFLROVLGV-UHFFFAOYSA-N 295.310 2.342 10 20 CECD C[C@H]1COCCN1Cc1cc(F)c(N(C)C)cc1F 862227278 YNOREXBEALJIQG-JTQLQIEISA-N 270.323 2.252 10 20 CECD C[C@@H](NCCN1CCOC[C@H]1C)c1ccc(N(C)C)cc1 765728639 NOFQTORRCMGKMH-HUUCEWRRSA-N 291.439 2.124 10 20 CECD CN(Cc1ccccc1O)C(=O)Cn1cnc2ccccc21 769283308 SSURKYFEOHGWNX-UHFFFAOYSA-N 295.342 2.401 10 20 CECD CCn1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cn1 773015551 PUDLOYIWDVOQPP-LBPRGKRZSA-N 286.379 2.460 10 20 CECD CCc1nc(CN(C)c2ccc(OC)c(OC)c2)n[nH]1 771756574 OLJHLWPVZITWFC-UHFFFAOYSA-N 276.340 2.021 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@@H]1C 787421824 XFPYCGRKSXQSCV-DGCLKSJQSA-N 294.370 2.275 10 20 CECD COc1cccc(CNC(=O)C2CCC(OC)CC2)c1O 780937331 VJSYWDXWJCJRHJ-UHFFFAOYSA-N 293.363 2.222 10 20 CECD COc1ccc(CN2CCC[C@@H]([C@@H](C)O)C2)c(O)c1OC 893417121 BXUKMIXLOXYDRK-VXGBXAGGSA-N 295.379 2.002 10 20 CECD CNC(=O)C1CCN(Cc2c(O)cccc2Cl)CC1 133341284 ZYRLHRQJBHOYMS-UHFFFAOYSA-N 282.771 2.004 10 20 CECD CC[C@H](NCc1cn(CC)nn1)c1ccccc1O 404457475 NTXIVITWMHICQA-ZDUSSCGKSA-N 260.341 2.245 10 20 CECD CC[C@@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H](CC)O1 398759541 DBNBLKSOFSERFI-GHMZBOCLSA-N 279.336 2.127 10 20 CECD COC(=O)N1CC(N[C@@H]2C[C@@H](C)c3c(C)ccc(O)c32)C1 1343304514 CRIQHYYJBQMIGM-ZYHUDNBSSA-N 290.363 2.289 10 20 CECD Nc1cc(CSc2ncc(C(=O)O)s2)ccn1 1601212811 WYSBIYDREAUDFQ-UHFFFAOYSA-N 267.335 2.111 10 20 CECD Cc1cc(N(C)C(=O)/C=C\[C@@H]2CCCNC2)ccc1O 1579617054 KKQAYECCFVASOF-UJZCVKTISA-N 274.364 2.219 10 20 CECD CC[C@@H]1CN(Cc2cc(F)c(F)cc2O)CC[C@@H]1N 1577279212 ALMWYTBGQOCWCD-RNCFNFMXSA-N 270.323 2.230 10 20 CECD C[C@H](NC(=O)C(C)(C)F)c1ccc(N2CCOCC2)cc1 154648132 ZXKNITCMDZSKGO-LBPRGKRZSA-N 294.370 2.449 10 20 CECD Nc1ccc(NC(=O)CCNC(=O)c2cccs2)cc1 238136589 VYNXFFGUDBCRCV-UHFFFAOYSA-N 289.360 2.089 10 20 CECD CCN(CC)C(=O)[C@@H](C)N[C@H](C)c1ccccc1O 37126691 IIXJBYKTXVYSRF-VXGBXAGGSA-N 264.369 2.300 10 20 CECD COc1ccc(C(=O)N(C)Cc2ccccc2O)cn1 48606756 VCLLGIDGEVVRPF-UHFFFAOYSA-N 272.304 2.068 10 20 CECD COc1cc(Cl)cc(CNC[C@@H](CO)C(C)C)c1O 394028360 DHAMBUIBEWJZKC-NSHDSACASA-N 287.787 2.408 10 20 CECD Cn1cnc(CNCc2c(O)cccc2Br)c1 898041781 ASEQORHUPCCEEQ-UHFFFAOYSA-N 296.168 2.178 10 20 CECD Cc1ccccc1CNC(=O)CN(C)Cc1ccccc1O 109770138 FPWBGVFJEVLOFP-UHFFFAOYSA-N 298.386 2.449 10 20 CECD C[C@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)[C@@H]1C 177900603 FRBRFIUXISJAAR-UONOGXRCSA-N 289.423 2.099 10 20 CECD CC(=O)N1CCC(CN[C@@H](C)c2ccc(F)cc2O)CC1 185377078 XOYIEAZKTFZDJF-NSHDSACASA-N 294.370 2.440 10 20 CECD CCCCOCCCNC(=O)/C=C/c1ccc(O)c(O)c1 180590599 UIVZOLAKLWWGCP-SOFGYWHQSA-N 293.363 2.434 10 20 CECD COc1cccc(CN[C@@H]2CCCc3c2cnn3C)c1O 37087340 IIBPTDIZNUFOGV-CYBMUJFWSA-N 287.363 2.302 10 20 CECD CCOc1cccc(CNC[C@H](CC)OC)c1O 289885356 SETJISXAFHOWGL-LBPRGKRZSA-N 253.342 2.306 10 20 CECD CCOc1cccc(CN(CCCOC)CCOC)c1O 133098542 AZHHGYTZJRCZFY-UHFFFAOYSA-N 297.395 2.276 10 20 CECD CCC[C@@](C)(O)CNCc1ccc(N(C)C)cc1 226251058 PVGWGPALDPJKRX-OAHLLOKOSA-N 250.386 2.393 10 20 CECD CCOC(=O)[C@@H](CC)Sc1ncc([N+](=O)[O-])s1 192474718 IQCFRXUKWLVWMB-ZCFIWIBFSA-N 276.339 2.485 10 20 CECD CCOC(=O)[C@H](C)N(Cc1cc(F)ccc1O)C1CC1 191711451 PXSKIMXEGDRYFE-JTQLQIEISA-N 281.327 2.447 10 20 CECD CCN1CCCN(Cc2cc(Cl)ccc2O)CC1=O 191538033 XWPXEGQQXDOVDL-UHFFFAOYSA-N 282.771 2.100 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)CCCF 611651376 SXBGDIPAEUEIGK-UHFFFAOYSA-N 266.316 2.228 10 20 CECD CC[C@@H](O)CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273605139 TVZJGPJOKHCYJX-GXSJLCMTSA-N 268.313 2.112 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@H]1CCC[C@@H]1O 271252673 ITKJYTFDRWAHDH-CJNGLKHVSA-N 280.387 2.485 10 20 CECD CC[C@H](NCCC(=O)N(C)C)c1ccc(C)cc1O 280089965 MIKTZQKBDTVYRH-ZDUSSCGKSA-N 264.369 2.220 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC2=CCCOC2)c1 286918826 FMHFHBLEAZZVMT-NSHDSACASA-N 291.347 2.176 10 20 CECD Cc1ccc([C@H](C)NCCCc2cnn(C)n2)c(O)c1C 293793328 UMEUSHLCLFAIKA-ZDUSSCGKSA-N 288.395 2.421 10 20 CECD CC(=O)C(=O)COC(=O)COc1ccc(C(C)C)c(C)c1 808486770 YDGOXZUXIBHSMZ-UHFFFAOYSA-N 292.331 2.199 10 20 CECD CS[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 296752233 BPLZBKULTQAACT-TZNOJPMFSA-N 279.361 2.075 10 20 CECD C[C@H](N[C@H]1CCN[C@H](C)C1)c1ccc(F)cc1O 817971902 QZHGFDAELJUULV-SCVCMEIPSA-N 252.333 2.322 10 20 CECD CCOc1ccc(CN2CC3(CCOC3)C2)c(O)c1 816669063 FZFOZDLIQWKAEB-UHFFFAOYSA-N 263.337 2.013 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2ccc(F)cc2O)n1 818347426 ZQKKYORZLQYPEX-SECBINFHSA-N 278.331 2.302 10 20 CECD COc1ccc2c(c1)C[C@@H](C(C)C)CN2CC(=O)N(C)C 817295811 XYNHNZWWGHUQCR-CQSZACIVSA-N 290.407 2.418 10 20 CECD Cc1nc[nH]c1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 822082705 OGCKLZRFVPTCTO-JTQLQIEISA-N 272.352 2.275 10 20 CECD COCCC(=O)NCc1ccc(N2CCCCC2)cc1 727103783 UUROBJZYJXVEJZ-UHFFFAOYSA-N 276.380 2.330 10 20 CECD Cc1nc(C)c(CC(=O)NCc2ccc(O)c(O)c2)s1 901131029 GQUDIBYHCNQRNU-UHFFFAOYSA-N 292.360 2.030 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@]1(C)CO 827699279 GGMGMJJCNLNUQR-BLLLJJGKSA-N 280.387 2.342 10 20 CECD O=C(N[C@@H]1CCC[C@@H]2C[C@@H]21)c1c(F)ccc(O)c1O 839797911 RKQOHBRPKVWEEO-KHQFGBGNSA-N 265.284 2.155 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@]2(C)CCC(=O)N2)cc1 834910084 VLVVSDOIMQDZSG-SUMWQHHRSA-N 289.423 2.462 10 20 CECD Cc1cn(C)nc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 839727866 DUHJLQYDWSQCAX-LBPRGKRZSA-N 286.379 2.286 10 20 CECD CC[C@@](C)(CNC(=O)/C=C/c1ccc(O)c(O)c1)OC 836824413 YGZKAKOTOMJVFH-VFADXPBXSA-N 279.336 2.042 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@@H]1CCc2cccc(O)c21 834880483 FWTIHGWCBOWIKO-GZBFAFLISA-N 277.364 2.021 10 20 CECD Cc1ccc(C(=O)OCC(F)(F)C(F)F)c(O)c1O 744910538 RJVPPAVXTAXODC-UHFFFAOYSA-N 282.189 2.463 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1(C(=O)C2CC2)CC1 846477591 SUKGGRQQJMLQKC-UHFFFAOYSA-N 293.750 2.421 10 20 CECD CCCNC(=O)CSc1ncc(Cl)s1 849998767 STQHVHJZDSQMGL-UHFFFAOYSA-N 250.776 2.415 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1c(O)cccc1OC 842753371 FEYLCAFIFROCMR-NEPJUHHUSA-N 267.369 2.288 10 20 CECD CCOc1ccc(CN[C@@H]2CCN[C@@H](C)C2)c(O)c1 841061425 IVJGSIFVHFZJSH-WCQYABFASA-N 264.369 2.021 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@H](C)CN)cc1F 843052472 UNFPYWXYXXDPED-LBPRGKRZSA-N 267.392 2.451 10 20 CECD CCO[C@H]1C[C@H]1C(=O)NCc1cc(Cl)ccc1O 846471916 DLQMZGWRZOPQNR-PWSUYJOCSA-N 269.728 2.087 10 20 CECD C[C@@H](NCCCn1cncn1)c1ccc(Cl)cc1O 841749331 CNLMRKJLAFCCOQ-SNVBAGLBSA-N 280.759 2.378 10 20 CECD C[C@@H](NCC(C)(C)C(N)=O)c1ccc(Cl)cc1O 841750835 JLRIDGGOUYIYIO-MRVPVSSYSA-N 270.760 2.208 10 20 CECD C[C@H](CCCCN)NC(=O)NCc1ccc(N(C)C)cc1 841654886 QGAGAVDROPESMZ-CYBMUJFWSA-N 292.427 2.069 10 20 CECD NC[C@H]1CC[C@@H](NCc2cc(Br)ccc2O)C1 841084523 KFPXFGAKUOIWCZ-JOYOIKCWSA-N 299.212 2.372 10 20 CECD C[C@H]1CN[C@H](C)CN1Cc1cc(Cl)cc(F)c1O 843119946 QBYKJINNIZLXOJ-BDAKNGLRSA-N 272.751 2.367 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)CCCN)c1 841081324 UPEYLFQBUFCJJE-NSHDSACASA-N 252.358 2.008 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)[C@@H]2CCCNC2)c1 841033734 VEPZQUCIUWJKCM-QWHCGFSZSA-N 278.396 2.269 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc2c(c1)CCCO2 921951043 HKNAGFIZBNXAQJ-HUUCEWRRSA-N 288.391 2.016 10 20 CECD COc1cccc([C@H](C)NCCC2(CO)CC2)c1O 846168862 MWLYFZOZZBUZBU-NSHDSACASA-N 265.353 2.214 10 20 CECD Cc1ccc([C@H](C)NC[C@H](O)COCC2CC2)c(O)c1 756509357 AWSMBKFZKCYSCE-JSGCOSHPSA-N 279.380 2.139 10 20 CECD CO[C@H]1COCC[C@H]1CNCc1ccc2c(c1)CCCO2 922157056 VNHZXWYIUVNEQI-RDJZCZTQSA-N 291.391 2.153 10 20 CECD Cc1nc(C)c(C(=O)N(C)Cc2ccc(N(C)C)cc2)[nH]1 856739775 ZVDCXBOSDCFMQT-UHFFFAOYSA-N 286.379 2.365 10 20 CECD CN(CCOC1CC1)Cc1ccc(N2CCOCC2)cc1 929185990 WACWEPDVZDKQFM-UHFFFAOYSA-N 290.407 2.134 10 20 CECD COCc1csc(CNC(=O)Cc2ccc(N)cc2)c1 851644190 LNQXWCMBKISONI-UHFFFAOYSA-N 290.388 2.336 10 20 CECD CO[C@@H](C)[C@@H](C)NCc1ccc(N2CCOCC2)cc1 268868444 UMJTUVBNOWDGMA-KGLIPLIRSA-N 278.396 2.036 10 20 CECD COCCCCNC(=O)N[C@H](C)c1ccccc1O 868058236 MPXUVTAPJXYGBY-LLVKDONJSA-N 266.341 2.179 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)C(OC)OC)cc1 873862629 VIHRBNZJNIRDCN-UHFFFAOYSA-N 294.395 2.110 10 20 CECD Cc1ccc(CN[C@H]2CC(=O)N(C(C)(C)C)C2)c(O)c1 877082393 RIQMNYBDRSKSGK-ZDUSSCGKSA-N 276.380 2.190 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCC[C@H]2CCO)c1 875515512 PYDIRVSXMNMUAH-GXTWGEPZSA-N 292.379 2.051 10 20 CECD C[C@@H](CCO)NCc1ccc(N2CCSCC2)cc1 779342837 TUWMGVUZCRRLBS-ZDUSSCGKSA-N 280.437 2.100 10 20 CECD C[C@H](NC(=O)c1n[nH]c2c1CCC2)c1ccc(N(C)C)cc1 773019468 XRKOXMOBTAAGEH-NSHDSACASA-N 298.390 2.455 10 20 CECD Cc1nccnc1NCc1ccc(N2CCN(C)CC2)cc1 882879725 JLQIZBHQYAOAHN-UHFFFAOYSA-N 297.406 2.149 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cccc(OCC)c2O)C1 896962346 MIJKYCQZZSEREL-CYBMUJFWSA-N 293.363 2.176 10 20 CECD CC[C@]1(NCc2cc(F)cc(C(C)=O)c2O)CCOC1 792419784 SXSOFXITGPATLE-HNNXBMFYSA-N 281.327 2.393 10 20 CECD CC1(C)C[C@@H]1NCc1ccc(N2CCOCC2)cc1 44371814 GLLPKKSPFZPDSD-HNNXBMFYSA-N 260.381 2.411 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)[S@]1=O 792192676 OQXRWTFDIAZCOV-OYHTYJOISA-N 298.427 2.233 10 20 CECD CC1(CNCc2cccc(Br)c2O)COC1 82694092 KWSXXTPGUUTVIG-UHFFFAOYSA-N 286.169 2.281 10 20 CECD COc1ccc(CNCc2ccoc2)c(O)c1OC 1335431087 AHRQPVQLKNCICI-UHFFFAOYSA-N 263.293 2.292 10 20 CECD O=C(O)c1cnc(SC[C@H]2CCCC[C@@H]2O)s1 1602537263 PEQLVCZNWNWPET-SFYZADRCSA-N 273.379 2.485 10 20 CECD Cc1ccc(CNC(C)(C)c2nocc2C(=O)O)c(O)c1 1607783290 XBRSSRWDLWKCQL-UHFFFAOYSA-N 290.319 2.412 10 20 CECD C[C@@H]1C[C@@H]1[C@@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 1776602320 FGQFOSLCPBNXTP-KEHGIVTQSA-N 287.718 2.384 10 20 CECD CCOc1cccc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)c1O 152985396 LTSHERLCTDRVPB-UPJWGTAASA-N 263.337 2.200 10 20 CECD CCOC(=O)CCN[C@H](C)c1cc(OC)ccc1O 45685935 UDEPKBNDUVQEQQ-SNVBAGLBSA-N 267.325 2.005 10 20 CECD C[C@H](CNC(=O)N(C)Cc1ccccc1O)N(C)C1CC1 105267343 SVMCYJLEQWHMIN-GFCCVEGCSA-N 291.395 2.016 10 20 CECD COc1ccc(O)c(CNc2ccc3nccnc3n2)c1 301307481 ZLOXOOWROUONIW-UHFFFAOYSA-N 282.303 2.351 10 20 CECD CCCCOCC(=O)N(C)Cc1ccccc1O 118494120 DEMNYTLWVXOFTN-UHFFFAOYSA-N 251.326 2.167 10 20 CECD CC1(C)[C@@H](NCc2cccc(Cl)c2O)C[C@H]1O 128179844 LAPNKKFRBOQTLP-WDEREUQCSA-N 255.745 2.295 10 20 CECD Cc1ncsc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183466052 CWGHBHFOGAIGEP-MRVPVSSYSA-N 292.360 2.224 10 20 CECD C[C@@H](N[C@@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 86758486 TWAGIAZHJOAPJJ-QMTHXVAHSA-N 262.353 2.266 10 20 CECD O=C(O)C[C@H]1CCCN(Cc2cc(F)ccc2O)C1 236426359 GQEFUXDQJGAKBX-SNVBAGLBSA-N 267.300 2.218 10 20 CECD Cc1ccc(O)c(CNC[C@@H]2COC3(CCCC3)O2)c1 271450593 RTBMTRUNWYIOEI-CQSZACIVSA-N 277.364 2.476 10 20 CECD Cc1cccc(CN(CCO)Cc2cccnc2)c1O 271748917 UOVQGKVZRQSLML-UHFFFAOYSA-N 272.348 2.090 10 20 CECD CC[C@H](NCC(=O)NCC(F)F)c1ccc(N(C)C)cc1 280836603 LMQZRDKUNONSFF-ZDUSSCGKSA-N 299.365 2.175 10 20 CECD C[C@H]1CSCCN(C(=O)c2c(F)ccc(O)c2O)C1 295617123 DQUZUXKOOUGTAR-MRVPVSSYSA-N 285.340 2.062 10 20 CECD CC(C)(O)C1CN(Cc2c(O)cccc2Cl)C1 297501680 WETTUXRIVJEMBO-UHFFFAOYSA-N 255.745 2.248 10 20 CECD CCN(CC)C(=O)CN(CC)c1ccc(OC)c(OC)c1 299285568 QGXXBRRVCXSQEK-UHFFFAOYSA-N 294.395 2.399 10 20 CECD C[C@]1(CCCO)CCCN1Cc1cc2c(cc1O)OCO2 290447301 MDLVDIYCGNXUMM-MRXNPFEDSA-N 293.363 2.248 10 20 CECD Cc1ccc(C(=O)NCCc2ccc(O)c(O)c2)nc1C 298053201 HCBYUSUWFXMRQE-UHFFFAOYSA-N 286.331 2.082 10 20 CECD Cn1nc(NC(=O)NCc2ccccc2O)cc1C1CC1 290675214 SYSUODDPIOCJLI-UHFFFAOYSA-N 286.335 2.325 10 20 CECD CC(=O)C(=O)COC(=O)CSc1ccccc1Cl 808485239 LHYGDXHBIOBKIG-UHFFFAOYSA-N 286.736 2.133 10 20 CECD Cc1cc([C@@H](C)NCCc2ccc(N)cc2)n(C)n1 817957928 RASMKCVNTHVVNN-GFCCVEGCSA-N 258.369 2.204 10 20 CECD CN(c1ccc(CNCCC(N)=O)cc1)C1CCCCC1 818979801 AUYXJGPTIROEBU-UHFFFAOYSA-N 289.423 2.421 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](O)CC(F)(F)F 819077887 QFKANSAIBXIUHT-CYBMUJFWSA-N 290.329 2.464 10 20 CECD C[C@H]1C[C@H](NCCNC2CC2)c2c(O)ccc(F)c21 817951946 BRSSXYRFPFPCGX-CABZTGNLSA-N 264.344 2.421 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H](C)C(C)(F)F)c1 815835306 PBPZNIXRZYDWPS-QMMMGPOBSA-N 273.279 2.308 10 20 CECD O=C(Nc1nnc(C2CC2)s1)c1c(F)ccc(O)c1O 824125651 OCJDPGKDOOUPBC-UHFFFAOYSA-N 295.295 2.218 10 20 CECD COCC[C@H](C)Sc1ncc(C(=O)OC)s1 829680890 HRLYTVZSCUCCLA-ZETCQYMHSA-N 261.368 2.447 10 20 CECD CC[C@]1(C)CCN(C(=O)c2c(F)ccc(O)c2O)C1 826882390 JTPXIYIMWTXMRK-CQSZACIVSA-N 267.300 2.499 10 20 CECD CCN(Cc1cc(Cl)c(C)cc1O)[C@H]1CCNC1=O 825773529 JFMRIGUSNLQEHY-LBPRGKRZSA-N 282.771 2.064 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)CC(=O)OC)cc1 905457838 ZASQCDAWHFQEFH-UHFFFAOYSA-N 292.379 2.054 10 20 CECD CCC[C@@](C)(N)C(=O)N[C@H](C)c1cc(OC)ccc1O 828668212 ZKYHZOXIQTVMEW-MEBBXXQBSA-N 280.368 2.096 10 20 CECD CN(CCC(=O)O)Cc1cccc(Br)c1O 820586321 TVQFRERFIHZRFQ-UHFFFAOYSA-N 288.141 2.061 10 20 CECD CCOc1ccc(O)c(CNCCc2cnc(C)cn2)c1 835062360 SWOSYGIQVLMLFF-UHFFFAOYSA-N 287.363 2.222 10 20 CECD CCN(CCCC(=O)O)c1ccc(OC)c(OC)c1 737100822 LZWFNFFVFZGPCI-UHFFFAOYSA-N 267.325 2.395 10 20 CECD CN(Cc1c(O)ccc2ccncc12)[C@@H]1CCOC1 730260250 MUXNPCSMLMRHPG-GFCCVEGCSA-N 258.321 2.161 10 20 CECD CCN(CC)CCOCCN[C@H]1CCc2cccc(O)c21 834764522 FHYVEYWAXDFDNH-HNNXBMFYSA-N 292.423 2.328 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2CCCC[C@H]2O)c1O 846164366 PGZMMEUHSNGPTL-RAIGVLPGSA-N 265.353 2.355 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2cnc(C)o2)c1 840794097 CRTIEIFWDXZLMG-SECBINFHSA-N 290.319 2.326 10 20 CECD CC[C@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)[C@@H](C)O 842250735 KKFAGRVANMSCMD-JMSVASOKSA-N 278.396 2.337 10 20 CECD Oc1cccc(Cl)c1CNCC[C@H]1CCNC1 841036340 LNTHPJQLUUZPAP-SNVBAGLBSA-N 254.761 2.135 10 20 CECD CC1(C)NCC[C@H]1NCc1cc(Cl)cc(F)c1O 841085581 HNUAQTUOUOOWKH-LLVKDONJSA-N 272.751 2.415 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1cccc(F)n1 749236040 HLHWJKHLKPDJHK-UHFFFAOYSA-N 289.310 2.268 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@@H]1CCCN1 841037049 YDTNLXMWKLAIKK-QMMMGPOBSA-N 258.724 2.026 10 20 CECD COc1cccc([C@H](C)N[C@H](CO)CC2CC2)c1O 846157377 MARSSZCLNNVSBG-JQWIXIFHSA-N 265.353 2.212 10 20 CECD c1cc(N2CCCCC2)ccc1CN1CCCNCC1 843047734 YOFQWBFFRKMECV-UHFFFAOYSA-N 273.424 2.472 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@](C)(O)C(C)C)c1 756578029 VLHVNGMOKWALDJ-BDJLRTHQSA-N 295.379 2.236 10 20 CECD CO[C@H](CNC(=O)c1cccc(O)c1O)C1CCCCC1 856224635 HPHJZVVPSLAVNY-CQSZACIVSA-N 293.363 2.423 10 20 CECD Cc1cc(CCNC(=N)N)c(C)n1-c1ccccc1 750542484 JCIHXQPJQJMYRK-UHFFFAOYSA-N 256.353 2.120 10 20 CECD CN(C)c1ccc(CNc2ncnc3nccnc23)cc1F 752635458 LTWGHZBERQLBSE-UHFFFAOYSA-N 298.325 2.237 10 20 CECD C[C@@H](N[C@@H]1CCN(C2CC2)C1=O)c1ccc(N(C)C)cc1 1116673901 QICMWGHIJBCKBL-MLGOLLRUSA-N 287.407 2.167 10 20 CECD Cc1ccc(/C=C2/SC(=S)N(C)C2=O)cn1 764892317 VUUPUDFEOMGXSX-WEVVVXLNSA-N 250.348 2.221 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2cscn2)c1 875394704 HTPCBBLNFPVEDN-UHFFFAOYSA-N 291.376 2.199 10 20 CECD CCC[C@@H](CCO)NCc1cc(OC)c(OC)cc1O 877667063 LESHTJWQQCUZEU-LBPRGKRZSA-N 283.368 2.050 10 20 CECD COc1ccc(N(C)Cc2nccnc2C)c(OC)c1 878294192 CMNDBFKVGOBIDZ-UHFFFAOYSA-N 273.336 2.439 10 20 CECD CN(C(=O)[C@H]1CSCCS1)c1ccc(N)cc1 877080487 JTIXZGVISMCYDP-LLVKDONJSA-N 268.407 2.080 10 20 CECD CC(C)c1nn(C)cc1C(=O)N(C)c1ccc(N)cc1 877078345 MVTGHOYOCCHJOE-UHFFFAOYSA-N 272.352 2.402 10 20 CECD COC(=O)CC1(NCc2cccc(C)c2O)CCC1 777440681 IZNZQTKDAFJMEL-UHFFFAOYSA-N 263.337 2.276 10 20 CECD CC[C@H](N[C@@H](C)CC(N)=O)c1cc(Cl)ccc1O 775514005 QMVCMVOXGVYEOJ-KWQFWETISA-N 270.760 2.350 10 20 CECD COc1cc(O)c(CN[C@@H](C)[C@@H]2CCCOC2)cc1OC 780780325 QAZALPJYVWRUPD-NWDGAFQWSA-N 295.379 2.314 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](F)C(C)C)c1 784443267 QPJFOWASBQFOSI-LBPRGKRZSA-N 255.289 2.011 10 20 CECD COc1cc(C)cc(CNCc2cc(C)nn2C)c1O 894687700 RHVIKGZECWNKMS-UHFFFAOYSA-N 275.352 2.041 10 20 CECD COC(=O)C[C@@H](NCc1ccc(N(C)C)cc1)C1CC1 785791675 HWEMWVWSLVOBLG-OAHLLOKOSA-N 276.380 2.184 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)cc(OC)c2O)[C@H]1C 787243386 WJXUJEUAIYUQSH-WCQYABFASA-N 293.363 2.093 10 20 CECD CCC[C@@H](NCc1c(C)cccc1O)C(=O)OC 897834248 KSNKHGBCFBBSPI-GFCCVEGCSA-N 251.326 2.132 10 20 CECD COc1ccc(CNC2C[C@H](C)O[C@@H](C)C2)c(O)c1OC 893260179 LKXBGCHJLKRYRD-QWRGUYRKSA-N 295.379 2.455 10 20 CECD COc1ccc(CNC(=O)c2scnc2Cl)c(O)c1 794377965 BGVUGSVUWQHXSP-UHFFFAOYSA-N 298.751 2.441 10 20 CECD COC1CCC(NC(=O)Nc2ccc(N)cc2)CC1 703820524 KYZWBRMUJVVSDJ-UHFFFAOYSA-N 263.341 2.348 10 20 CECD CNC[C@@H](C)CN[C@@H](C)c1cc(F)cc(F)c1O 1329022572 FTBTWLSYHKCHMO-BDAKNGLRSA-N 258.312 2.177 10 20 CECD CCc1cccc(CNCC2=CCN(C)CC2)c1O 709481873 HPHLGSGUNODPSC-UHFFFAOYSA-N 260.381 2.306 10 20 CECD COc1cc(C)cc(CN2CCN(C)C(C)(C)C2)c1O 1333812797 LMWYNSGDULZRPY-UHFFFAOYSA-N 278.396 2.235 10 20 CECD CC(C)c1cc(CNC(=O)c2cccc(O)c2O)on1 790718263 QJFIIKIOISZPQG-UHFFFAOYSA-N 276.292 2.139 10 20 CECD CCC(CC)(CO)NCc1ccc(OC)c(OC)c1O 1262361385 LVKOXGFAKLIONG-UHFFFAOYSA-N 283.368 2.050 10 20 CECD CC[C@H](N[C@H](C)c1ccc(N2CCOCC2)cc1)C(=O)O 1605090060 QOTYOZIZKOUNSN-DOMZBBRYSA-N 292.379 2.037 10 20 CECD Cc1cc(CN2Cc3cccc(O)c3C2)[nH]c1C(=O)O 1600195749 BLSNKPFXCMHNOH-UHFFFAOYSA-N 272.304 2.243 10 20 CECD C[C@H](NCc1cccc(C(=O)O)n1)c1ccccc1O 1607460871 QVWYBYILQZYAGX-JTQLQIEISA-N 272.304 2.336 10 20 CECD COC(C)(C)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1610223263 SWSVGYFJCOOTCR-VIFPVBQESA-N 267.325 2.166 10 20 CECD COc1cc(CN2CCCNCC2)c(O)c(C(C)(C)C)c1 1579149038 KVACQUXDUJECSX-UHFFFAOYSA-N 292.423 2.494 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2CC(=O)Nc3ccccc32)cc1 1580443586 RHERQERIOKZYFC-CQSZACIVSA-N 295.342 2.011 10 20 CECD C[C@@H](CN[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 1589067282 GXCRBNCGCYKYPS-WDEREUQCSA-N 250.342 2.124 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2nccc(C(=O)O)n2)c1 1599598029 DYFVESAVBOMVRV-MRVPVSSYSA-N 289.291 2.062 10 20 CECD CCN1CCc2cc(CNCCC(F)(F)C(=O)O)ccc21 1776877244 CBXDZAIKWOHVCE-UHFFFAOYSA-N 298.333 2.269 10 20 CECD CCN(Cc1cc(C)c(C)cc1O)[C@@H]1CCS(=O)(=O)C1 16839691 VBRDRJRLRNPYFY-CQSZACIVSA-N 297.420 2.018 10 20 CECD CCc1ncsc1C(=O)NCc1cccc(OC)c1O 162851501 UDWQGYKHSGVARV-UHFFFAOYSA-N 292.360 2.350 10 20 CECD O=C(O)C1CCC(NCc2c(O)cccc2F)CC1 903710888 URCJYLWBHSRVRY-UHFFFAOYSA-N 267.300 2.264 10 20 CECD CN(Cc1cc(F)ccc1O)C1CCC(N)CC1 220324144 LFLAEPDAWTVIOZ-UHFFFAOYSA-N 252.333 2.233 10 20 CECD C[C@@H](CNCc1cc(F)ccc1O)N(C)C1CC1 226607792 XYWKXBZZPMCWSE-JTQLQIEISA-N 252.333 2.104 10 20 CECD CO[C@]1(C)CCCN(C(=O)Nc2ccc(N)cc2)C1 230272648 DXURNENDYUASJH-CQSZACIVSA-N 263.341 2.302 10 20 CECD Cc1ccc(O)c(CN2CC[C@H]3CC[C@@H](C2)N3C)c1 156058197 XKPFOSABJXKNCL-CABCVRRESA-N 260.381 2.369 10 20 CECD CCOc1cccc(CN2CC[C@H](C)[C@H](CN)C2)c1O 163425562 ITNQKEFDCZLQGI-GXTWGEPZSA-N 278.396 2.208 10 20 CECD CN(Cc1cn2cccnc2n1)Cc1ccccc1O 111235896 AWZGCGVGDNUBCX-UHFFFAOYSA-N 268.320 2.067 10 20 CECD CCOc1cccc(CN[C@H](C)CCOC)c1O 112018226 IDAVTXABASAIRT-LLVKDONJSA-N 253.342 2.306 10 20 CECD CN(C)c1ccc(CN2CCC(CC(=O)O)CC2)cc1 20215725 RSHNKEDUHOUMPM-UHFFFAOYSA-N 276.380 2.439 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(C)CCNC1 62895131 ODUVQZXNWBACSZ-QGZVFWFLSA-N 289.423 2.101 10 20 CECD C[C@@H](NCC(C)(C)CO)c1ccc(N(C)C)cc1 122043346 IJSFVNJAXMVMST-GFCCVEGCSA-N 250.386 2.422 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(OC)ccc2O)C[C@@H]1C 188112047 BYWHPQACUYIVIU-FZMZJTMJSA-N 293.363 2.032 10 20 CECD CC(C)CONC(=O)NCc1ccc2c(c1)CCCN2C 127812165 SUEZSKKHWOIGQE-UHFFFAOYSA-N 291.395 2.456 10 20 CECD CC(C)OC(=O)[C@@H](C)N(C)Cc1cc(F)ccc1O 180226780 YFSOWALBJXJPGW-SNVBAGLBSA-N 269.316 2.303 10 20 CECD CCNC(=O)NCc1ccc(N2CCSCC2)cc1 46906078 YWFUNMVJIUWRRH-UHFFFAOYSA-N 279.409 2.059 10 20 CECD C[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CCS1 191931647 LBQNGPWFFHGODP-TZNOJPMFSA-N 293.388 2.465 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@H](C)c1ccc(F)cc1O 228946163 YCBJWIVHPPPCPR-ZJUUUORDSA-N 268.332 2.095 10 20 CECD CN(C)c1ccc(CN(CCO)Cc2cccnc2)cc1 93085558 XQBFZQNZFQXLTH-UHFFFAOYSA-N 285.391 2.142 10 20 CECD Cc1ncc(CNC(=O)N(C)Cc2ccccc2O)s1 98119312 RPGRANQWLYIMPP-UHFFFAOYSA-N 291.376 2.499 10 20 CECD Cc1ccc(C(=O)N2CCCC[C@@H]2C[C@@H](C)O)c(O)c1O 279860426 SHXMHXYEAIPWJF-VXGBXAGGSA-N 293.363 2.172 10 20 CECD CCOC(=O)c1cc(CNCc2ccccc2O)[nH]c1C 294707492 BFWIRZYTQVSQBJ-UHFFFAOYSA-N 288.347 2.495 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)O[C@H]2CNOC2)cc1 808088337 LINFONUDRWBKMG-HNNXBMFYSA-N 286.331 2.154 10 20 CECD Cc1cc(C(=O)NC2CC2)c(C)n1-c1ccccn1 298312080 JKUPJNDRNUJZQM-UHFFFAOYSA-N 255.321 2.381 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCc2ncn(C)n2)c1O 808709100 BUPMDPKCYGONHE-SECBINFHSA-N 280.759 2.333 10 20 CECD Cn1cc([C@@H](O)CNCc2ccc3ccccc3c2O)cn1 816555116 UNLOOFSVEKKYFE-INIZCTEOSA-N 297.358 2.102 10 20 CECD Cn1cncc1CNCc1c(O)ccc(Cl)c1F 810160241 ZDGVSFCQYWPYGE-UHFFFAOYSA-N 269.707 2.208 10 20 CECD CCOc1ccc(CN2CCC[C@@H](CO)CC2)c(O)c1 816665486 JHXMQCZXVTZSTC-CYBMUJFWSA-N 279.380 2.385 10 20 CECD O=C(NCCNCc1ccccc1O)c1ccc(F)cc1 725846638 NXWGCIGEPKVVLU-UHFFFAOYSA-N 288.322 2.051 10 20 CECD Cc1cc(O)c(CN[C@H]2CCN(C(C)C)C2=O)cc1Cl 825291067 DCPGBHXIJPMWJL-ZDUSSCGKSA-N 296.798 2.453 10 20 CECD C[C@@H](NC(=O)CN1CCCC1)c1ccc(N(C)C)cc1 822081783 GXGFJDZLENSKKO-CYBMUJFWSA-N 275.396 2.026 10 20 CECD O=C(/C=C/c1cncc(F)c1)N1C[C@@H](CO)c2ccccc21 493491162 JCFIZIXDAZIHOU-GFUIURDCSA-N 298.317 2.357 10 20 CECD C[C@@H]1CN(C(=O)/C=C\c2cnn(C)c2)c2ccccc2O1 732033062 GBEZRUICNOVRJR-QDZRJHCZSA-N 283.331 2.247 10 20 CECD O=C(N[C@H]1CCCc2nc(O)ccc21)c1cc(O)cs1 732267367 ZIZQGVLLIAURDE-NSHDSACASA-N 290.344 2.362 10 20 CECD CN(C[C@@H]1CCCCO1)c1ccc(OCC(=O)O)cc1 833692921 BVTSCQRYNSRZPR-AWEZNQCLSA-N 279.336 2.155 10 20 CECD OC[C@H](CN[C@H]1CCc2cccc(O)c21)Cc1ccco1 834624028 DWWBYTNRJDTDNB-WFASDCNBSA-N 287.359 2.413 10 20 CECD Cc1ncc(CNC(=O)NCc2ccc(N(C)C)cc2)o1 837378679 CWBNFGFGZAZEQR-UHFFFAOYSA-N 288.351 2.048 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)cc1 841860088 AEHARNBJYMJSJE-RHMLRGBNSA-N 285.391 2.155 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NOCC(F)F 846714739 JLJJCVICOHRLIH-UHFFFAOYSA-N 280.658 2.042 10 20 CECD C[C@H]1CCC[C@@H](C)CN1C(=O)C(=O)Nc1ccc(N)cc1 841049486 SJUCQLAVXSQSBB-NEPJUHHUSA-N 289.379 2.244 10 20 CECD C[C@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@H](C)S1 841955245 XCTVBAZMOABQIU-RYUDHWBXSA-N 293.436 2.347 10 20 CECD CCCNC(=O)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756355043 GDHSMFFWUYPHNJ-GXSJLCMTSA-N 280.343 2.195 10 20 CECD c1cc(N2CCCC2)ccc1CN[C@@H]1[C@H]2C[C@@H]3CN[C@H]1[C@H]3C2 925542004 FOJXWRICAVDVLP-BVRUVYRISA-N 297.446 2.373 10 20 CECD COC[C@H]1CCCN1Cc1cc2c(cc1O)CCC2 751950144 PMLWEMGCAXHVPR-OAHLLOKOSA-N 261.365 2.492 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)C2(CO)CC2)c1 696063719 PDHNDDBKTYQRIL-GHMZBOCLSA-N 265.353 2.212 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@]2(C)CCOC2)c1 755528591 FNROIIXXKCMOQB-BONVTDFDSA-N 279.336 2.005 10 20 CECD Cc1cc(Br)cc(CN(C)C[C@H](C)N)c1O 863652799 XBFLYKJDZATWBS-VIFPVBQESA-N 287.201 2.242 10 20 CECD CN(Cc1cnn(C)c1)Cc1cc(F)c(N(C)C)cc1F 862212694 JYIVPAKBAULKAD-UHFFFAOYSA-N 294.349 2.396 10 20 CECD Cc1cccc(CN2CC[C@H](C)[S@](=O)CC2)c1O 763491059 MKLUAOLWNWGYEE-KPZWWZAWSA-N 267.394 2.044 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2O[C@@H](C)C[C@@H]2C)c1 862755444 HIQAGUADERYARY-COPLHBTASA-N 263.337 2.130 10 20 CECD CCC[C@@H](CNC(=O)c1ccc(C)c(O)c1O)OCC 862419097 QQFBOQCXSHJODT-NSHDSACASA-N 281.352 2.341 10 20 CECD Cc1cccc(O)c1CN1CCN(C2CCC2)CC1 876733917 KQINYYPCPFCFRT-UHFFFAOYSA-N 260.381 2.371 10 20 CECD C[C@@H]1NC(=O)N(c2cc(Cl)c(N)c(Cl)c2)C1=O 772127788 VKVPVKHXASVGIE-BYPYZUCNSA-N 274.107 2.020 10 20 CECD CO[C@@H]1CCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 776245735 IGZUYHIWWQTCHX-IUODEOHRSA-N 291.395 2.244 10 20 CECD CCO[C@H](C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773013052 ZHQJHUWBPZPRIK-VXGBXAGGSA-N 264.369 2.355 10 20 CECD CC[C@@]1(C(=O)N[C@H](C)c2ccccc2O)CCCN1 877255263 BGSKGXGYVQSBDI-ABAIWWIYSA-N 262.353 2.102 10 20 CECD Cc1ccc(CN(C)[C@H]2CCN(C)C[C@@H]2C)c(O)c1 877530985 HFDWRDIIQHJVIZ-ZFWWWQNUSA-N 262.397 2.473 10 20 CECD COc1cccc(O)c1CN[C@@H](CO)CC1CCC1 883126535 RUKFJVDXPYEKNR-GFCCVEGCSA-N 265.353 2.042 10 20 CECD CNC(=O)C1CCN(Cc2cc(Cl)ccc2O)CC1 133334890 BYYQYNZDQXDPPN-UHFFFAOYSA-N 282.771 2.004 10 20 CECD C[C@@H](NS(=O)(=O)CCC1CC1)c1ccccc1O 867833868 DLRLWFHUVGOXBE-SNVBAGLBSA-N 269.366 2.173 10 20 CECD C[C@@H](NCCO)c1cc(Cl)c(Cl)cc1O 192613738 UKSFSQQYNAJOPM-ZCFIWIBFSA-N 250.125 2.342 10 20 CECD C[C@H]1CNCCN1Cc1ccc(N2CCCC2)cc1 1326199439 JQVHKOQGLUIJMX-AWEZNQCLSA-N 259.397 2.081 10 20 CECD COC(=O)[C@H]1CC(F)(F)CN1Cc1ccc(N(C)C)cc1 1334839166 DLYOVAQFHUEJBX-CYBMUJFWSA-N 298.333 2.135 10 20 CECD COc1cc(C)c(CN2CC[C@@](C)(C(=O)O)C2)c(O)c1 1604695422 WAGJUMJMHWJJQQ-OAHLLOKOSA-N 279.336 2.006 10 20 CECD CN(C)c1ccc(OCc2nccs2)cc1C(=O)O 1598330371 WTPOOQKMWFLWTJ-UHFFFAOYSA-N 278.333 2.486 10 20 CECD CCCOc1ccc(CNC[C@@](C)(O)CC(=O)O)cc1C 1776820772 QVLYYGROBKVUBY-INIZCTEOSA-N 295.379 2.099 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)cc1 228537493 NLZNUUCMCVIGPL-USXIJHARSA-N 273.424 2.312 10 20 CECD CCOc1cccc(CN2CC[C@@H](N)[C@H](CC)C2)c1O 251860829 SUISXPROUVYUGS-TZMCWYRMSA-N 278.396 2.350 10 20 CECD CN1CCC[C@@H]1CNCc1c(O)cccc1Cl 113328578 OLFBEKRTHOMSFO-SNVBAGLBSA-N 254.761 2.229 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(O)cc1 26268048 QEFITTUAKPOZPK-KRXBUXKQSA-N 271.272 2.455 10 20 CECD C[C@@]1(NCc2cc(Cl)cc([N+](=O)[O-])c2O)CCOC1 120117355 GJIMRHATTPJMGZ-GFCCVEGCSA-N 286.715 2.222 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@H](Nc2ccccc2)C1 187066599 CPNGPRRFNVJEPA-ZDUSSCGKSA-N 298.342 2.424 10 20 CECD CCC[C@@H](NCc1cc(Cl)ccc1O)C(=O)O 86732756 NTPFFSNDEXMYPI-SNVBAGLBSA-N 257.717 2.389 10 20 CECD Cc1cccc(CN(C)[C@@H]2CCN(C)C[C@H]2C)c1O 290414349 KFYQRUKATXVDGR-UKRRQHHQSA-N 262.397 2.473 10 20 CECD C[C@H]1COCCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 91810251 YMOXGSHHQCMKOX-QMMMGPOBSA-N 286.715 2.175 10 20 CECD C[C@@H](NCc1cc(F)ccc1O)C(=O)OC(C)(C)C 180938108 BYWXVLPLBIDRJW-SECBINFHSA-N 269.316 2.351 10 20 CECD CC[C@H](CCO)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273609131 VFCYUCXGCACWPT-VXGBXAGGSA-N 295.379 2.238 10 20 CECD CC(=O)N1CCC[C@H](CNCc2ccc(N(C)C)cc2)C1 279938392 YPLDTANWGNVRMC-MRXNPFEDSA-N 289.423 2.101 10 20 CECD Cc1ccc(C(=O)N[C@H](C)[C@H]2CCCCO2)c(O)c1O 272890640 ARECRYSGVTWLHF-ZYHUDNBSSA-N 279.336 2.094 10 20 CECD Nc1ccc(CC(=O)NCc2ccc3c(c2)CCCN3)cc1 295247979 PZDAYOYIDUQKGX-UHFFFAOYSA-N 295.386 2.486 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(C(C)=O)CC1 293212851 JMBHSXCTNQZFOX-UHFFFAOYSA-N 288.391 2.470 10 20 CECD CC(=O)NCC[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 809778410 OZRIVNPSWUTLHX-ZDUSSCGKSA-N 294.370 2.270 10 20 CECD Cc1cc(O)c(CNCc2snnc2C)cc1C 291771007 SUQNUENXIMCTLI-UHFFFAOYSA-N 263.366 2.459 10 20 CECD C[C@@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc(O)cs1 807776954 JILBXJLCAOGLTH-PWSUYJOCSA-N 280.393 2.153 10 20 CECD COCCNCCN[C@@H](C)c1ccc2ccccc2c1O 817965505 WEFILLARHKKTLX-ZDUSSCGKSA-N 288.391 2.432 10 20 CECD COc1ccc(N(CCn2cncn2)CC(C)C)cc1 727128651 FRBXXBAFFHBIMG-UHFFFAOYSA-N 274.368 2.449 10 20 CECD CCn1nc(C)c(CNCc2cc(Cl)cc(F)c2O)n1 822494173 IFFIKPCTGDSQRA-UHFFFAOYSA-N 298.749 2.394 10 20 CECD CN(C)c1ccc(CNC(C)(C)CC(=O)O)cc1F 737376814 XLYBTRVNVYMDQN-UHFFFAOYSA-N 268.332 2.235 10 20 CECD CC(C)CN(CCC(=O)O)Cc1cccc(F)c1O 833486811 RRLRXYNUBDICLL-UHFFFAOYSA-N 269.316 2.464 10 20 CECD Cc1ccc(O)c(CN2CC(OCC(F)F)C2)c1 839138356 PPVUJEYSKQGQRY-UHFFFAOYSA-N 257.280 2.167 10 20 CECD CCc1cccc(CN[C@@H]2C[C@H]3CCCCN3C2=O)c1O 848914353 IBEBOBUKRCEBOM-HUUCEWRRSA-N 288.391 2.198 10 20 CECD C[C@H](NCCCCCCN)c1cc([N+](=O)[O-])ccc1O 843342440 QQZACRYQRSILGT-NSHDSACASA-N 281.356 2.470 10 20 CECD Cc1cccc(CN[C@@H]2CCN(CC(F)F)C2)c1O 841893473 FXNIUNZFAFISBI-GFCCVEGCSA-N 270.323 2.130 10 20 CECD Cc1nc(CNC(=O)NCc2ccccc2O)sc1C 743711809 VNXFFWGIRWYHDZ-UHFFFAOYSA-N 291.376 2.465 10 20 CECD CCN(C(=O)/C=C\c1scnc1C)c1cnn(C)c1 848343978 VSPVRRURGYEPBG-WAYWQWQTSA-N 276.365 2.251 10 20 CECD COc1cccc([C@@H](C)NCC2=CCN(C)CC2)c1O 846158504 HRQQJCXBHYGPJP-GFCCVEGCSA-N 276.380 2.313 10 20 CECD CC(C)(N)CCC(=O)NCCCSc1nccs1 843439612 MNUAUIIPIKJZPB-UHFFFAOYSA-N 287.454 2.259 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](CN)C(C)(C)C)c1O 842475940 YLILSJNXVUIAFE-CYBMUJFWSA-N 282.359 2.197 10 20 CECD Nc1ccc(CCNC(=O)NCC[C@@H]2CCCCO2)cc1 841871242 AGPJDKBXDWLQIV-HNNXBMFYSA-N 291.395 2.070 10 20 CECD Cc1noc(C)c1CNC[C@@H](N)c1ccc(N(C)C)cc1 841044844 YZRIPNWWLVGWPJ-MRXNPFEDSA-N 288.395 2.147 10 20 CECD Oc1c(F)cc(Cl)cc1CNCCCNC1CC1 841094357 XDTDDMNVZUMCHA-UHFFFAOYSA-N 272.751 2.416 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)C1(CO)CC1 850361178 OEOLGOLMUXLNNK-NSHDSACASA-N 266.360 2.142 10 20 CECD CCN1CCC[C@@H](NCc2cc(C)c(C)cc2O)C1=O 922639464 MHQAAQOTWWARJL-CQSZACIVSA-N 276.380 2.110 10 20 CECD CCOCc1cc(CN[C@H](CO)CC2CC2)ccc1OC 754832097 FDNXGQKIKNVCFP-INIZCTEOSA-N 293.407 2.482 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ncc3n2CCCC3)c1 869411707 ZFFYLZWEOMCDKK-UHFFFAOYSA-N 285.347 2.163 10 20 CECD Cc1ccc(O)c(CNC(=O)c2oc(C)nc2C)c1 862760544 UVVCZNIOKGOEMP-UHFFFAOYSA-N 260.293 2.235 10 20 CECD CC(C)N(Cc1cc2c(cc1O)OC[C@H]2O)C1CC1 768441815 NTFGZJTXLSWKEA-CQSZACIVSA-N 263.337 2.191 10 20 CECD CC(=O)N[C@@H](CCC(C)C)C(=O)N(C)c1ccc(N)cc1 877074188 BLNXYCNWQHYCCI-HNNXBMFYSA-N 291.395 2.173 10 20 CECD COC(=O)[C@H]1C[C@H]2CC[C@H]1N(Cc1ccc(C)cc1O)C2 877584263 YHPNHAFNXQMWDK-VHDGCEQUSA-N 289.375 2.474 10 20 CECD C[C@H]1SCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 783612315 YRKPGXFXURLODD-LDYMZIIASA-N 268.338 2.284 10 20 CECD CC(C)[C@@H](NC(=O)c1cc(O)cs1)c1cnn(C)c1 885420740 XRBNMWSBCZMJEH-GFCCVEGCSA-N 279.365 2.314 10 20 CECD COc1cc(C)cc(CNCCCn2ccnc2C)c1O 894192698 AVRXVRBTIMYPCC-UHFFFAOYSA-N 289.379 2.394 10 20 CECD C[C@H](NC(=O)NCCC(C)(C)N)c1ccc(N(C)C)cc1 891812911 GTHWKXMSWJHORU-LBPRGKRZSA-N 292.427 2.240 10 20 CECD CC[C@@H](NCC1(O)CCC1)c1ccc(F)cc1O 796757908 BVOCHPAMKWVIOR-GFCCVEGCSA-N 253.317 2.487 10 20 CECD CN(Cc1nccn1C(F)F)c1ccc(N)cc1 702069898 SZKHYGNTSOBDRA-UHFFFAOYSA-N 252.268 2.497 10 20 CECD CCc1cccc(CNC[C@@H](O)CC(C)C)c1O 691494793 OUCZOQILGNVBMM-AWEZNQCLSA-N 251.370 2.451 10 20 CECD CO[C@H](C)CNCc1cc(Br)cc(F)c1O 715723153 WFXOXWXGMDWPSA-SSDOTTSWSA-N 292.148 2.418 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCCC[C@H]1CN)c1ccccc1O 1332544898 VXBTXDRHSVYFHT-MBNYWOFBSA-N 291.395 2.270 10 20 CECD COc1cncc(CNCc2ccc(OC)cc2O)c1 699777350 BCXSXKDIUFCCRP-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CC[C@H]1CN(C(C)=O)[C@@H](CC)CN1Cc1ccc(N)cc1 1336116964 JJOANUVVXQRVEU-IRXDYDNUSA-N 289.423 2.490 10 20 CECD C[C@@H]1CN(C(=O)NCc2ccc(N)cc2)C[C@@H](C)S1 1262603563 MZFLWEWDBHRXKO-GHMZBOCLSA-N 279.409 2.304 10 20 CECD COCn1ncc(C)c1CN(C)c1ccc2c(c1)OCO2 1262364656 DZNFVZSCPGOACF-UHFFFAOYSA-N 289.335 2.161 10 20 CECD CSCCCN[C@H](C)c1cc(C(=O)O)ccc1O 1607397919 AZQBBEZGONYFGS-SECBINFHSA-N 269.366 2.494 10 20 CECD C[C@H]1CCN(Cc2ccc(F)c(F)c2O)C[C@@H]1C(=O)O 1589355158 NAQQDAAAJVLRNR-WPRPVWTQSA-N 285.290 2.213 10 20 CECD NC[C@@H]1Cc2ccccc2N(C(=O)/C=C/c2cccnc2)C1 1580273253 HOTAFAATFKIFRI-KIUWMYQTSA-N 293.370 2.259 10 20 CECD CN(Cc1cc(F)c(F)cc1O)C(C)(C)CC(=O)O 1598507003 HKDUYTNRLBLBCO-UHFFFAOYSA-N 273.279 2.356 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1ccc(OC)c(OC)c1O 1594825867 WDSBXLSTVJRONV-HNNXBMFYSA-N 297.351 2.142 10 20 CECD CN(Cc1occc1C(=O)O)c1ccc2c(c1)OCO2 1598542285 WGXUYOADCXDNDX-UHFFFAOYSA-N 275.260 2.343 10 20 CECD C[C@@H](C(=O)NCCc1ccc(N)cc1)C(F)(F)F 818545212 PHNVULVHMRRYAB-QMMMGPOBSA-N 260.259 2.126 10 20 CECD CC[C@@]1(C(=O)O)CCCN(Cc2ccc(N)cc2)C1 1120268482 FYEDFTAHSLRDBH-OAHLLOKOSA-N 262.353 2.346 10 20 CECD CSC[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1 294701214 QZCJEXMFFMIWDZ-JTQLQIEISA-N 281.377 2.313 10 20 CECD C[C@@H](N[C@@H]1CCc2cccc(O)c21)C(=O)NC(C)(C)C 295787451 ABDOCUYZBCMXCF-ZYHUDNBSSA-N 276.380 2.272 10 20 CECD Nc1ccc(CN2CCC(O)(C(F)(F)F)CC2)cc1 311347354 KPSKVAZSBUUMCD-UHFFFAOYSA-N 274.286 2.158 10 20 CECD C[C@H]1C[C@H](CNC(=O)Nc2ccc(N)cc2)CCO1 388927403 BJOOXROQNWDXMT-WDEREUQCSA-N 263.341 2.205 10 20 CECD CC(C)CNC(=O)COc1ccc(N2CCCC2)cc1 178195718 WOCURGILPBPKKD-UHFFFAOYSA-N 276.380 2.438 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CC[C@@H](N)C2)cc1 178711713 LWBUNWZDHPBQRW-LSDHHAIUSA-N 289.423 2.276 10 20 CECD CCN(CCC(=O)OC)Cc1cccc(C)c1O 179825651 QPVNYWOPUVIABU-UHFFFAOYSA-N 251.326 2.086 10 20 CECD Cc1ccc(O)c(CNc2cccnc2-n2cncn2)c1 71408235 BIKXLJLENLHLAL-UHFFFAOYSA-N 281.319 2.288 10 20 CECD Cc1coc(SCC(=O)c2ccc(O)c(O)c2)n1 188379042 IVCKFSMKTLFEKE-UHFFFAOYSA-N 265.290 2.369 10 20 CECD CN(C)c1ccc(CNC(=O)c2cn3ccccc3n2)cc1 198263964 HCTIVXBXGWIZNV-UHFFFAOYSA-N 294.358 2.330 10 20 CECD Cn1cc(-c2nc(C(=O)Nc3ccc(N)cc3)cs2)cn1 237718686 NLQFYYGXSBIQEC-UHFFFAOYSA-N 299.359 2.378 10 20 CECD CC(C)C[C@@H](CO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273300363 BFMPBNBTIPLCHI-MNOVXSKESA-N 282.340 2.358 10 20 CECD CC[C@H](NC[C@@]1(O)CCO[C@@H]1C)c1ccc(F)cc1O 287713645 XTSRNIGMXUCITI-DGFSRKRXSA-N 283.343 2.112 10 20 CECD C[C@H](NC[C@@H](CO)[C@@H]1CCOC1)c1cc(Cl)ccc1O 280921512 RCYZBFNLHJYTIC-TUAOUCFPSA-N 299.798 2.341 10 20 CECD CC/C(C)=C/C(=O)NCc1ccc(N2CCOCC2)cc1 294486634 JQGYTOGKJYHDBT-WYMLVPIESA-N 288.391 2.496 10 20 CECD COC1([C@H](C)NCc2cccc(C)c2O)CCOCC1 817419398 GMXHMTPLSDGXJD-ZDUSSCGKSA-N 279.380 2.374 10 20 CECD CC[C@H]1CN(C)CCN1Cc1ccc(N(C)C)c(F)c1 816660606 JZDYUPXEFFNYJU-AWEZNQCLSA-N 279.403 2.418 10 20 CECD COC[C@H](CCO)NCc1ccc2ccccc2c1O 816552751 VDNJBQLIPFJKDH-AWEZNQCLSA-N 275.348 2.032 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(CC(N)=O)CC2)c1 817586432 OHURZPNDUHJIPN-NSHDSACASA-N 262.353 2.007 10 20 CECD CCCN(CCNC(=O)NC(C)C)Cc1ccccc1O 827959245 OPJGJMGVOGLDIY-UHFFFAOYSA-N 293.411 2.312 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CO[C@@H](C)C1 828426673 BLLYCOOFWCKFHM-JSGCOSHPSA-N 292.379 2.491 10 20 CECD C[C@@H]1CCCCN1CCCNC(=O)c1cc(O)cs1 732258615 WPTLFHYMERLBPH-LLVKDONJSA-N 282.409 2.448 10 20 CECD O=C(Nn1cnc2ccccc21)c1cc(O)cs1 731865444 KAYVBWVCVGWAOK-UHFFFAOYSA-N 259.290 2.187 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1C=CCCC1 588404673 AYMYFSCYLVNGQS-UPZNUWHASA-N 259.305 2.336 10 20 CECD O=C(NCCSC(F)(F)F)c1cc(O)cs1 732272512 VOTDUNDZAYIUGO-UHFFFAOYSA-N 271.285 2.437 10 20 CECD CNC(=O)CCN(Cc1ccccc1O)C1CCCC1 732204507 LQGNHXBVYQXUKO-UHFFFAOYSA-N 276.380 2.273 10 20 CECD CN(C(=O)c1cc(O)cs1)[C@@H](CO)CC(C)(C)C 839787374 YEDMLNDLPXTUCF-SECBINFHSA-N 271.382 2.323 10 20 CECD C[C@@H](NC[C@@H]1COCCO1)c1ccc(Cl)cc1O 841746164 VVEOTQJJGBNYKU-MWLCHTKSSA-N 271.744 2.112 10 20 CECD CC[C@H]1COC(C)(C)CN1C(=O)c1ccc(C)c(O)c1O 846369596 IWRGAHHRKBMJNY-NSHDSACASA-N 293.363 2.436 10 20 CECD Cc1ccc(O)c(CN[C@H]2CCN(C(C)(C)C)C2=O)c1 842721655 VGPUWLJEGRIIJL-ZDUSSCGKSA-N 276.380 2.190 10 20 CECD CSCCNC(=O)NCc1c(O)ccc2c1CCCC2 743521136 PNAKDIIVQLIULQ-UHFFFAOYSA-N 294.420 2.433 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](NC)C2)cc1 843045769 VXMRHBAAIFZRIS-OAHLLOKOSA-N 261.413 2.327 10 20 CECD COCC1(CNCc2cc(Cl)ccc2O)CCNCC1 841068985 ZETYOGJIUFCZGR-UHFFFAOYSA-N 298.814 2.151 10 20 CECD CCOc1ccc(CN[C@@H]2CCO[C@H]2C2CC2)c(O)c1 922516582 PFNHICVISGTCNA-ZBFHGGJFSA-N 277.364 2.448 10 20 CECD C[C@]1(CNC(=O)Nc2ccc(N)cc2)CCCC[C@@H]1O 841298437 AANZZFVESZDMQQ-DZGCQCFKSA-N 277.368 2.332 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(C=O)[nH]1 750000846 UJAFYQKYUDHWBG-UHFFFAOYSA-N 285.347 2.132 10 20 CECD COC(=O)c1cc(CNCc2cc(C)ccc2O)c[nH]1 858236914 AMOWQZGANXPKEK-UHFFFAOYSA-N 274.320 2.105 10 20 CECD COc1ccc(O)c(CNC(=O)c2csc(C=O)c2)c1 769539528 QKZVKPVINXURER-UHFFFAOYSA-N 291.328 2.205 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H]3CC[C@H](C2)N3)cc1 873217356 JYURRQZHCRUNOZ-IYBDPMFKSA-N 273.424 2.469 10 20 CECD C[C@@H](NCc1cnc(N(C)C)nc1)c1ccc(N(C)C)cc1 775365128 UIQRWARZZMNBDR-CYBMUJFWSA-N 299.422 2.459 10 20 CECD COc1cc(O)c(CNCCOC2CCC2)cc1OC 776223254 TUHHVQNULPVGEY-UHFFFAOYSA-N 281.352 2.068 10 20 CECD CC[C@H](N[C@@H]1CCC[C@H]1C(=O)NC)c1ccccc1O 775523915 BAWQNVOWYZOJAP-HZSPNIEDSA-N 276.380 2.348 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCO[C@]2(CCOC2)C1 877132959 SBUOCHRJQMMWKE-CZUORRHYSA-N 277.364 2.128 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CCO[C@@]2(CCOC2)C1 770752354 NMLUBMIOKFMOPD-ABAIWWIYSA-N 297.782 2.473 10 20 CECD CN(C)c1ccc(CNCC[C@@H]2CCOC2)cc1F 784656198 JCOCWAUICHMQBX-GFCCVEGCSA-N 266.360 2.408 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@H](C)S1=O 792191973 GYAJGRXKHQECDZ-UWVGGRQHSA-N 287.812 2.387 10 20 CECD COc1ccc(CNC(=O)c2ccc(C)o2)c(O)c1 794370930 SPWOMEAGAKJDET-UHFFFAOYSA-N 261.277 2.232 10 20 CECD CN(CCO[C@@H]1CCCCO1)Cc1ccccc1O 193071365 CZNNTZZRGNMYHN-OAHLLOKOSA-N 265.353 2.367 10 20 CECD CC[C@H](C)CS(=O)(=O)NCc1cc(C)ccc1O 1328849432 BKGALGJWCNMZEJ-JTQLQIEISA-N 271.382 2.166 10 20 CECD Cc1cccc(CN2C[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c1O 1607851082 XUVNWYRCNBFKGP-UBHSHLNASA-N 275.348 2.386 10 20 CECD Cc1cccc(CN(C[C@H](C)C(=O)O)C2CC2)c1O 1600531286 KSLHBYADHQRWDI-NSHDSACASA-N 263.337 2.386 10 20 CECD O=C(O)[C@H]1C[C@H]2CC[C@H]1N(Cc1ccc(F)c(F)c1O)C2 1608615677 BLJJYFSGANSPCH-UBHAPETDSA-N 297.301 2.356 10 20 CECD CN(C)c1ccc(CN[C@H]2C[C@@H]3C[C@]3(C(=O)O)C2)cc1F 1598320740 PRTNPYZSWLUDQY-WQGACYEGSA-N 292.354 2.235 10 20 CECD CN(C)[C@@H](C(=O)NCCc1ccc(N)cc1)c1ccccc1 152529199 DEOWMCNNCCHRJE-QGZVFWFLSA-N 297.402 2.230 10 20 CECD CC(C)(C)C[C@@H](CO)NC(=O)Nc1ccc(N)cc1 841297844 IVRNJDIECFLGNN-LBPRGKRZSA-N 265.357 2.187 10 20 CECD Cc1ccc(CN2CCC(C)(C(=O)O)CC2)c(O)c1 1594359941 BOLDGYBRCFCJGE-UHFFFAOYSA-N 263.337 2.387 10 20 CECD CC[C@H](NCCCC(=O)N(C)C)c1ccccc1O 155386739 YZDBWMOTJZWMNQ-ZDUSSCGKSA-N 264.369 2.301 10 20 CECD COc1ncccc1NCc1cc2c(cc1O)OCO2 42879975 KCICUXULRVPWTM-UHFFFAOYSA-N 274.276 2.137 10 20 CECD CN(Cc1ccccc1O)C1C[C@@H]2CC[C@H](C1)N2C 289857876 VHXQWNPDKMTENG-YIONKMFJSA-N 260.381 2.449 10 20 CECD CC[C@@H](C)N1CCN(C(=O)Nc2ccc(N)cc2)CC1 55083787 AYJNACJDICAECB-GFCCVEGCSA-N 276.384 2.217 10 20 CECD CC(=O)NCCCN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 383500447 XSXLJJUTAKPGEE-AAEUAGOBSA-N 276.380 2.365 10 20 CECD O=C(NCc1ccccc1)c1c(F)ccc(O)c1O 789941352 GINOBKKASULBAS-UHFFFAOYSA-N 261.252 2.167 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@@H]1CCOC1 179164003 HJJAERKWOGKGKW-CQSZACIVSA-N 291.395 2.073 10 20 CECD CC(C)=CC(=O)N1CCOc2cc(N(C)C)ccc21 173188312 CTLDTLAZHBGSIA-UHFFFAOYSA-N 260.337 2.444 10 20 CECD COC[C@@H](NC(=O)c1cccc(O)c1O)c1ccc(C)o1 185787358 KHCBQMMHRSLEEH-LLVKDONJSA-N 291.303 2.117 10 20 CECD CCN(C)C(=O)CN[C@H](C)c1ccc(N(C)CC)cc1 186817114 RKZTUJLKPLMATQ-CYBMUJFWSA-N 277.412 2.272 10 20 CECD CNCCCNCc1cc(Cl)cc(Cl)c1O 83457848 XZHFSYMTBVPHSV-UHFFFAOYSA-N 263.168 2.398 10 20 CECD CC1(C)[C@H](NC(=O)NCc2ccccc2O)[C@H]2CCO[C@H]21 266027126 VMWKHNOTWBCKSK-MRVWCRGKSA-N 290.363 2.005 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNC[C@@H]2CCSC2)c1 278520299 QAISQTKRNNMAML-VIFPVBQESA-N 268.338 2.143 10 20 CECD C[C@H]1C[C@@H](C)O[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 282194745 PJTYXSODFFCZFR-RWSFTLGLSA-N 294.370 2.321 10 20 CECD CCN(Cc1nc(C)n[nH]1)c1ccc(OC)c(OC)c1 292398825 JDYDBKUEWAFOIF-UHFFFAOYSA-N 276.340 2.157 10 20 CECD CC[C@H](C)CONC(=O)NCc1ccccc1O 291956644 UXAUIOWSKBJFFE-JTQLQIEISA-N 252.314 2.169 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)no1 299342983 QSVDKNAHVKPQSE-UHFFFAOYSA-N 277.299 2.118 10 20 CECD CCOc1ccc(CN2CC[C@H](n3cccn3)C2)c(O)c1 812780321 ACRCPZNIYQPBDY-AWEZNQCLSA-N 287.363 2.434 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCC12OCCO2)c1ccccc1O 827946427 HOROEDMTRLINLB-YPMHNXCESA-N 291.347 2.113 10 20 CECD COc1ncccc1NC(=O)c1cc(O)cs1 732272206 NNFPVESGWWPERA-UHFFFAOYSA-N 250.279 2.110 10 20 CECD O=Cc1nc(/C=C/c2ccc(N3CCOCC3)cc2)c[nH]1 901554665 AWNMPVLBMQYNMZ-DAFODLJHSA-N 283.331 2.229 10 20 CECD Cc1cc(CNC(=O)Cc2ccc(N)cc2)cc(C)n1 831739799 CHZMWEOJYXJQFU-UHFFFAOYSA-N 269.348 2.140 10 20 CECD CC[C@H](C)NC(=O)CCNCc1ccc(N(C)C)cc1C 840930142 JDZKOZPRVHOEPP-AWEZNQCLSA-N 291.439 2.455 10 20 CECD C[C@@H]1CN(Cc2cccc(Br)c2O)C[C@@H](C)N1 843049188 IQXDHYHFLYFFDD-NXEZZACHSA-N 299.212 2.337 10 20 CECD C[C@H]1CCC[C@H](CNC(=O)C(=O)Nc2ccc(N)cc2)C1 841022410 SVWQRZIRICGOJV-RYUDHWBXSA-N 289.379 2.150 10 20 CECD C[C@@H](C(=O)NCc1ccccc1O)N1CCc2ccccc21 748347153 WNGRDQKWMOYQFI-ZDUSSCGKSA-N 296.370 2.460 10 20 CECD N[C@@H]1CCO[C@H]([C@H]2CCCN(Cc3ccccc3O)C2)C1 844901452 FMAFIBLZPQYUFG-UXLLHSPISA-N 290.407 2.111 10 20 CECD CCCN1C[C@H](CNCc2cccc(CC)c2O)CC1=O 848918313 VTMCWFFVNSLHRS-ZDUSSCGKSA-N 290.407 2.303 10 20 CECD CC[C@H](C)CN(C)C(=O)NCCc1ccc(N)cc1 841955542 GFVJSFDAWCIVSP-LBPRGKRZSA-N 263.385 2.499 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)N(C)[C@H](C)C2)c1O 840089971 LUTBDSCFWRVJMZ-BETUJISGSA-N 278.396 2.234 10 20 CECD CSCCCN(C)C(=O)NCCc1ccc(N)cc1 841957423 BFIADEAVNXCDSC-UHFFFAOYSA-N 281.425 2.206 10 20 CECD CC(=O)NCCCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756371781 MHDORTMMNUIRTA-BXKDBHETSA-N 280.343 2.195 10 20 CECD CCC(=O)NCCCNCc1ccc(OC)c(C)c1 1153999138 QVMWCOKBZVTHOY-UHFFFAOYSA-N 264.369 2.010 10 20 CECD CCn1cnnc1CCN[C@H](C)c1cc(C)ccc1O 756734732 ZWWDDNDUCQSSKR-GFCCVEGCSA-N 274.368 2.205 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CCCF 935944934 DVPGVPWZUXDETB-UHFFFAOYSA-N 260.305 2.244 10 20 CECD Cc1nccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 773009178 PHADRLNCRPJBEN-LLVKDONJSA-N 284.363 2.342 10 20 CECD CCOC(=O)C1(CNCc2ccc(C)cc2O)CC1 877402089 XFELCECGVCMTDS-UHFFFAOYSA-N 263.337 2.134 10 20 CECD Cc1cccc(O)c1CNCC1(C(=O)N(C)C)CCCC1 877029638 JKTLNAJXRHTJGV-UHFFFAOYSA-N 290.407 2.439 10 20 CECD Cc1ccc(CN2CCN(CC(F)(F)F)CC2)c(O)c1 876556505 NQWYTCZAAHNPCH-UHFFFAOYSA-N 288.313 2.381 10 20 CECD Cc1ccc(CN[C@H]2CCN3CCC[C@H]3C2)c(O)c1 876940375 SFBCEJXPTXVOBU-GJZGRUSLSA-N 260.381 2.417 10 20 CECD Cc1ccc(CNC[C@@H]2CCN(C3CC3)C2)c(O)c1 876929636 LFZFQCDPMUOCNS-ZDUSSCGKSA-N 260.381 2.275 10 20 CECD CC(C)n1cnc(S(=O)(=O)Nc2ccc(O)cc2F)c1 780838444 WVTPWCHLVXDEKY-UHFFFAOYSA-N 299.327 2.110 10 20 CECD CC(C)[C@@H](C)C(=O)OCC(=O)c1ccc(O)c(O)c1 783668333 MOZXPWWMDPEUPS-SECBINFHSA-N 266.293 2.116 10 20 CECD COCCCCN(C)Cc1ccc(OC)c(OC)c1O 894964602 SJRJQZYELBMUGF-UHFFFAOYSA-N 283.368 2.268 10 20 CECD COc1ccc(CNCc2cnn(C)c2C2CC2)c(O)c1 894184722 DWWYKKFWDIDHCB-UHFFFAOYSA-N 287.363 2.302 10 20 CECD Oc1ccccc1CNCCOC1CCSCC1 898442839 SWGHJMUUNJKJCH-UHFFFAOYSA-N 267.394 2.394 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)CC[C@@H]1N 94339177 HHVLUBIWWPDUAK-SKDRFNHKSA-N 254.761 2.215 10 20 CECD CN[C@H](C)CCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 1327485853 IWMLINZLKBVSSL-CHWSQXEVSA-N 292.427 2.111 10 20 CECD CN(Cc1c(O)cccc1Cl)Cc1nnc2n1CCC2 768223612 JGLXBVUBWSXTQK-UHFFFAOYSA-N 292.770 2.215 10 20 CECD COc1cncc(CNCc2cc(OC)ccc2O)c1 699791188 YVEUUNOAKHQQFC-UHFFFAOYSA-N 274.320 2.094 10 20 CECD Oc1ccc(Cl)cc1CN[C@H]1CCn2ccnc2C1 778187131 ILVIYKZSKXWTDL-LBPRGKRZSA-N 277.755 2.347 10 20 CECD C[C@H]1C[C@H](NCCCCN)c2c(O)ccc(F)c21 1348851883 HBIDVXLWTJCNAH-ONGXEEELSA-N 252.333 2.408 10 20 CECD C[C@H](NC[C@@]1(C)CCOC1)c1cc(C(=O)O)ccc1O 1609776542 HFWHEMJOBGFCHM-ZUZCIYMTSA-N 279.336 2.168 10 20 CECD C[C@H](N[C@@H]1CC[C@@H]1C)c1cccc(-c2nn[nH]n2)c1O 1589954864 KBHPKQGPHYJBKS-HOTUBEGUSA-N 273.340 2.021 10 20 CECD COc1cccc([C@H](C)NCC2(C(=O)O)CCC2)c1O 1594123622 SKPMCVRGDNYNOT-JTQLQIEISA-N 279.336 2.306 10 20 CECD O=C(O)[C@]1(NCc2cc(F)cc(F)c2O)CCC[C@@H]2C[C@H]21 1777600644 PYESXKPCEVNOOJ-UQHVFFSPSA-N 297.301 2.403 10 20 CECD COc1ccc(O)c([C@H](C)NS(=O)(=O)CC(C)C)c1 161158064 LBRVVSWDKIFFGQ-JTQLQIEISA-N 287.381 2.037 10 20 CECD COc1cccc(O)c1CNCc1nn(C)cc1Cl 824758642 YNDAANXNFSNNOA-UHFFFAOYSA-N 281.743 2.078 10 20 CECD COc1cc(CNCc2cc(F)ccc2O)ccn1 226606495 CUVOJZIDEIICRD-UHFFFAOYSA-N 262.284 2.225 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@@H]3[C@@H]2C(=O)O)c1 229247051 QMBSZTUGPQVNNS-CORIIIEPSA-N 275.348 2.386 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H](O)c1ccccc1 121567746 OAGFXNWTXZZLJQ-HNNXBMFYSA-N 271.316 2.084 10 20 CECD COc1ccc(CN[C@H](C)CN2CCCC2=O)cc1C 37782650 PFPGUEZYMXSILR-CYBMUJFWSA-N 276.380 2.104 10 20 CECD CC[C@H](C)N1CCN(C(=O)Nc2ccc(N)cc2)CC1 55083789 AYJNACJDICAECB-LBPRGKRZSA-N 276.384 2.217 10 20 CECD Cc1ccc([C@@H](C)N[C@H]2CCN(C(C)C)C2=O)c(O)c1 186048509 OURVUZKTSGGDDQ-OCCSQVGLSA-N 276.380 2.361 10 20 CECD Cc1ncc(CN(C)C(=O)c2cccc(O)c2O)s1 192987197 XPNUEIATEKUIFA-UHFFFAOYSA-N 278.333 2.135 10 20 CECD COC(=O)C(C)(C)NCc1cc(Cl)ccc1O 37085576 YMLVICYWHCUIGS-UHFFFAOYSA-N 257.717 2.087 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2ccccc2O)C1 183565322 NAKMHBUUNRDXIB-VXGBXAGGSA-N 262.353 2.054 10 20 CECD C[C@H]1CCN[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 126567609 QJQUTXNVHFJQCX-BBRMVZONSA-N 289.423 2.099 10 20 CECD CCC[C@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423471 KOGAAWMDQDRGAT-ZDUSSCGKSA-N 250.342 2.096 10 20 CECD Cc1c(CNCc2c(O)cccc2Cl)cnn1C 156578641 PLKIGYAUBMFNOU-UHFFFAOYSA-N 265.744 2.377 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(=O)N2CCCCC2)c1 135728307 PBVPUOLPSQXXHM-GFCCVEGCSA-N 292.379 2.064 10 20 CECD C[C@@H]1C[C@@H](CN)CN1Cc1cc(Br)ccc1O 220335520 DBAQHJKAGAFGRK-ZJUUUORDSA-N 299.212 2.324 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCC(F)(F)F 49027317 OYLVYNOSSSZOHG-UHFFFAOYSA-N 289.301 2.456 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1ccno1 266882718 YIRLIAYTJYKFON-UHFFFAOYSA-N 259.309 2.140 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](O)CN2CCCC2)c(O)c1C 273418180 RLJHUVCDEZGGNN-CABCVRRESA-N 292.423 2.116 10 20 CECD CC[C@@H](N[C@H](C)CN1CCOCC1)c1ccc(F)cc1O 285683213 OAVBIOCDYLPFAX-IUODEOHRSA-N 296.386 2.293 10 20 CECD CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@@H](C)S1(=O)=O 289970766 ZCFVQSUQLXCDHS-TZMCWYRMSA-N 297.420 2.098 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCc2nncn2C)c1O 808675879 WHADBKGDRDBTAE-VIFPVBQESA-N 280.759 2.333 10 20 CECD COc1cccc(O)c1CN1C[C@@H](N2CCCC2)C[C@@H]1C 809703901 RRYCHNBJOLYPPD-KBPBESRZSA-N 290.407 2.459 10 20 CECD C[C@@H](NC(=O)Cn1cc(C2CC2)cn1)c1ccccc1O 827955949 HSTRZGHEEAJYTL-LLVKDONJSA-N 285.347 2.344 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2cc(Cl)cc(F)c2O)C1 827812580 QOXJQFTULMZBLY-GVJMRKKJSA-N 287.718 2.226 10 20 CECD O=C(NC[C@H]1Cc2ccccc2O1)c1cc(O)cs1 731869137 MRRUFONENKFFEK-LLVKDONJSA-N 275.329 2.187 10 20 CECD Cc1ccc(O)c(CNCC(=O)N2CCc3ccccc32)c1 733328679 ZVGXVUXNTHEZTR-UHFFFAOYSA-N 296.370 2.380 10 20 CECD CN(C)c1ccc(CN(C(=O)c2cc[nH]n2)C2CC2)cc1 915847740 MYJGTSWCVCSUGM-UHFFFAOYSA-N 284.363 2.281 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCC[C@@H]3C[C@H]23)c(O)c1O 838253962 JBPQLVGRHAORQM-USWWRNFRSA-N 261.321 2.325 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](N)C[C@@H]1C 846703820 QLINSTAQXHMYMC-ZFWWWQNUSA-N 261.413 2.373 10 20 CECD Cc1cc(Br)c(O)c(CN(C)[C@@H](C)CN)c1 843051999 NXVAPESVAZXWPH-VIFPVBQESA-N 287.201 2.242 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CO)CCF)cc1 846095530 AYMUFICFTPSWRF-CQSZACIVSA-N 268.376 2.343 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(N(C)C)cc1C 840936560 LGKIURFSIRLYQI-CVEARBPZSA-N 289.423 2.065 10 20 CECD CCn1ccc(Cc2nc(Cc3ccc(N)cc3)no2)n1 844906924 WBNJAUAMNCWTIP-UHFFFAOYSA-N 283.335 2.050 10 20 CECD COc1ccc(CNC(=O)[C@@H](CC(C)C)OC)c(O)c1 841431916 KADSEISRJKITBZ-CQSZACIVSA-N 281.352 2.078 10 20 CECD C[C@@H](CNCc1ccc2c(c1)CCO2)Cn1cccn1 917397704 ZVXMMCLGRLLVHK-ZDUSSCGKSA-N 271.364 2.244 10 20 CECD CN1CC[C@@H]2CN(Cc3c(O)ccc4ccncc34)C[C@@H]21 840132337 LAIYNKZXDXANRB-CJNGLKHVSA-N 283.375 2.076 10 20 CECD N[C@@H]1CCCO[C@H]1C1CCN(Cc2ccccc2O)CC1 841100094 UKZHDDCFTGYOLX-WBVHZDCISA-N 290.407 2.111 10 20 CECD C[S@](=O)[C@@H]1CCC[C@H](NCc2ccccc2O)C1 850355439 IRNGHHUXORTRME-JCGVRSQUSA-N 267.394 2.172 10 20 CECD CN(C)c1cc(F)c(CN[C@](C)(CO)C2CC2)cc1F 858149832 XCTHOIYYHUWCSU-OAHLLOKOSA-N 284.350 2.281 10 20 CECD COc1cccc(O)c1CNCCNc1ccc(C)cn1 922926749 WYXLITQXZRLBBB-UHFFFAOYSA-N 287.363 2.306 10 20 CECD CC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CC1 855856960 FTMNPSMNPAJMRH-GXWOQWCDSA-N 261.321 2.416 10 20 CECD CCOc1cccc(CNC[C@@H](CO)CC2CC2)c1O 850386858 QLTJZKQTWLGSRO-ZDUSSCGKSA-N 279.380 2.289 10 20 CECD CCOc1ccc(N(C)CC2CCS(=O)(=O)CC2)cc1 757655747 PIGWIURBGUQJGJ-UHFFFAOYSA-N 297.420 2.346 10 20 CECD Cc1ccc(C(=O)N=[S@@](C)(=O)C(C)C)c(O)c1O 926056201 JDILYZCMRKTJQE-SFHVURJKSA-N 271.338 2.053 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnn(CC3CC3)c2)cc1 864572867 AWOGJHXMXMAGKH-UHFFFAOYSA-N 298.390 2.289 10 20 CECD Cc1ccc(O)c(CNC(=O)CN2[C@H](C)CC[C@H]2C)c1 862761003 ZQYZNTVLBXZWGC-CHWSQXEVSA-N 276.380 2.190 10 20 CECD COc1cc(Cl)cc(CNCCCCC(=O)O)c1O 874042148 WBVDLRMYRPXFSV-UHFFFAOYSA-N 287.743 2.399 10 20 CECD COc1cccnc1CNCc1ccc(C)cc1O 877574446 JVTNSPSRKSDMPT-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Cc1ccc(CN[C@H]2CCc3c[nH]nc3C2)c(O)c1 877084859 ONJSRBJDMMNNQM-ZDUSSCGKSA-N 257.337 2.071 10 20 CECD Cc1cccc(O)c1CN[C@@H]1c2ccccc2C[C@@H]1O 876969179 XPLMKROWMKUVPK-DLBZAZTESA-N 269.344 2.449 10 20 CECD CC[C@]1(O)CCCN(Cc2cccc(OC)c2O)C1 877691697 SRBSERKBYNHHTO-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CCO[C@@H]1C[C@H](NCc2cc(C)c(C)cc2O)[C@H]1OC 775979235 SUZRPPOKZBISCK-NUEKZKHPSA-N 279.380 2.291 10 20 CECD CCN(CC)CCO[C@@H]1CCN(Cc2ccccc2O)C1 779025979 RTTNGQCBZIXMPC-MRXNPFEDSA-N 292.423 2.325 10 20 CECD CCN(CC)C[C@@H](C)NCc1ccc(OC)c(OC)c1O 892939679 UQVYONOYUAJKCC-GFCCVEGCSA-N 296.411 2.229 10 20 CECD COc1ccc(CNC2(C)CCOCC2)c(O)c1OC 893188885 IYVWBLKKILCFSE-UHFFFAOYSA-N 281.352 2.068 10 20 CECD CO[C@@]1(C)CCCN(C(=O)c2cc(O)cs2)C1 792669924 MCAJROUOCLPRTM-LBPRGKRZSA-N 255.339 2.095 10 20 CECD CC[C@@H](NCCN1CCOC[C@H]1C)c1ccc(C)cc1O 794809079 QGEFLXLYNCWPQD-GDBMZVCRSA-N 292.423 2.462 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CCC[C@H]2C)c(O)c1 792916961 BZBJYQFJYMISMK-MFKMUULPSA-N 278.352 2.389 10 20 CECD COC[C@H](NCc1cc(F)cc(F)c1O)C(C)C 708442586 NITOHCMCTCZAPW-LBPRGKRZSA-N 259.296 2.431 10 20 CECD C[C@H](N)[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 70171807 KMYLCFWXEKEZOZ-ZFWWWQNUSA-N 261.413 2.312 10 20 CECD Cc1ccccc1[C@@H](CO)NCc1ccc(N)cc1 1579790421 URNFPTUVTQXLAL-MRXNPFEDSA-N 256.349 2.400 10 20 CECD COc1cc(C)cc(CN(C)C(C)(C)CC(=O)O)c1O 1599391844 JDVDJVWPBKABFW-UHFFFAOYSA-N 281.352 2.394 10 20 CECD CCCC(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1752857188 YZUKXFPIJAQITR-CYBMUJFWSA-N 278.396 2.398 10 20 CECD C[C@@H](NCc1oncc1C(=O)O)c1ccc(N(C)C)cc1 1593318148 AZRSCZOAONDHGC-SNVBAGLBSA-N 289.335 2.290 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cccc(F)c1F 159078467 MDJZSOYETOTLCG-UHFFFAOYSA-N 279.242 2.306 10 20 CECD C[C@H](NCCOCCO)c1ccc(N2CCCCC2)cc1 159172298 TVYGNZQSZPYGEO-HNNXBMFYSA-N 292.423 2.336 10 20 CECD O[C@@H](CNCc1ccc2c(c1)CCO2)CC(F)(F)F 818996266 CYJIXTSZBBJWHC-LLVKDONJSA-N 275.270 2.024 10 20 CECD CCCN(Cc1cc(F)ccc1O)[C@@H]1CCNC1 219894091 AVRVBEKSYWONPX-CYBMUJFWSA-N 252.333 2.105 10 20 CECD CCC(CC)(CO)CNCc1cc(OC)ccc1O 224922048 FQYVHLAQLWOTQJ-UHFFFAOYSA-N 267.369 2.289 10 20 CECD CO[C@@]1(C)CCCN(C(=O)Nc2ccc(N)cc2)C1 230272644 DXURNENDYUASJH-AWEZNQCLSA-N 263.341 2.302 10 20 CECD COc1cccc(CN[C@@H]2CCO[C@H]2C2CC2)c1O 230315842 MCWWLFMFOZJNAV-DOMZBBRYSA-N 263.337 2.058 10 20 CECD CC(C)C[C@@H](NCc1cc(F)ccc1O)C(=O)O 232601273 AQKMBJJFMMAHAQ-LLVKDONJSA-N 255.289 2.120 10 20 CECD CN(C)C[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 271165238 HEZIVFRBENUBJJ-NSHDSACASA-N 268.788 2.429 10 20 CECD C[C@H](NCCc1ccnn1C)c1ccc(F)cc1O 184009310 RPWYBVPFHIQPGS-JTQLQIEISA-N 263.316 2.158 10 20 CECD NCc1ccc2c(c1)CCCN2C[C@H]1CCCOC1 690528953 MISWGODGCWKKSZ-CQSZACIVSA-N 260.381 2.325 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cnn(CC2CC2)c1 181142278 VWZMXFQNXDIMHZ-GQCTYLIASA-N 299.330 2.356 10 20 CECD C[C@@H](NCCCO[C@@H]1CCOC1)c1ccc(F)cc1O 185702315 RGVPBKHCZUROBU-DGCLKSJQSA-N 283.343 2.378 10 20 CECD CN1CCCc2cc(CNC(=O)[C@H]3CCCCO3)ccc21 121357854 NZMSMLNEYYDUAN-MRXNPFEDSA-N 288.391 2.254 10 20 CECD CCC1(O)CCN(Cc2cc(F)cc(C(C)=O)c2O)CC1 79464997 NLVPFKMXOHHOJV-UHFFFAOYSA-N 295.354 2.471 10 20 CECD COCCN(C)CCCN[C@H](C)c1cc(C)ccc1O 185008470 MXMHEESFVCROCF-CQSZACIVSA-N 280.412 2.320 10 20 CECD O=C(NCCc1c(F)cccc1F)c1cccc(O)c1O 186968746 AJDXOPRJXFEKOA-UHFFFAOYSA-N 293.269 2.349 10 20 CECD CC[C@](C)(CCO)NCc1cccc(OC)c1O 134472330 KEWAWMANRDEGQS-CQSZACIVSA-N 253.342 2.042 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H](C)SC)c1 133761501 NDJWSHFTUFUBAE-SECBINFHSA-N 269.366 2.159 10 20 CECD CCC[C@@](C)(NCc1ccc(N(C)C)cc1)C(=O)O 86731604 FEVTVSCATVXQEZ-OAHLLOKOSA-N 264.369 2.486 10 20 CECD CCN(CCCN(C)C)Cc1cc(F)ccc1O 233472746 OAMWQHOCSQVWTI-UHFFFAOYSA-N 254.349 2.305 10 20 CECD Cc1ccc(O)c(CN2C[C@@H](C)O[C@@]3(CCCOC3)C2)c1 366449955 FZAVJLWYZCDTCS-PBHICJAKSA-N 291.391 2.471 10 20 CECD CO[C@@H](C(=O)NCc1ccc2c(c1)CCCN2C)C1CC1 279337340 PIMSABRJJBIUKX-MRXNPFEDSA-N 288.391 2.110 10 20 CECD CN(Cc1c(O)cccc1Cl)CC1(O)CCOCC1 275867323 JPESSKDORQSVTA-UHFFFAOYSA-N 285.771 2.019 10 20 CECD C[C@]1(NCc2cc3c(cc2O)OCO3)CCO[C@@H]1C1CC1 273133949 NCZGNVASYIBBNV-CVEARBPZSA-N 291.347 2.168 10 20 CECD CO[C@H](C)CN(C)Cc1cc(F)cc(C(C)=O)c1O 285626991 KQBWNNXHICDQHB-SECBINFHSA-N 269.316 2.201 10 20 CECD CCCN[C@@H](C)C(=O)NCc1ccc(N2CCCC2)cc1 296371181 JYGQPJGTUMPPDL-AWEZNQCLSA-N 289.423 2.291 10 20 CECD CCCCNC(=O)CN(CC)c1ccc(OC)cc1 299396796 UIDWBCARBFFSRM-UHFFFAOYSA-N 264.369 2.438 10 20 CECD C[C@@H](NCC1CCNCC1)c1cc(F)cc(F)c1O 817941793 RSRAJJDRWQNCDL-SECBINFHSA-N 270.323 2.321 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCC(C)(C)C(=O)O 818624810 RUHNENFPUCXWQG-UHFFFAOYSA-N 294.351 2.035 10 20 CECD COCC[C@](C)(O)CNCc1cc(Cl)c(C)cc1O 825278591 MKZIHVFHQHUAPQ-AWEZNQCLSA-N 287.787 2.231 10 20 CECD CC[C@@H](NC1CCN(c2ccc(OC)cc2)CC1)[C@@H](C)O 824922252 YPRDBVRBXJORLU-CXAGYDPISA-N 292.423 2.413 10 20 CECD C[C@@H](NC(=O)c1cnc2n1CCCC2)c1ccccc1O 827940575 GCXQOWUJKJQBBM-LLVKDONJSA-N 285.347 2.416 10 20 CECD CCC(=O)C1(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 822863926 UZCRCUCKKHKBMS-UHFFFAOYSA-N 292.354 2.267 10 20 CECD C[C@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(N)cc1 837303343 IBENZGQMXSSKBA-WFASDCNBSA-N 276.380 2.480 10 20 CECD CNC(=O)C[C@@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 834898636 AJZLRXRKYLBSGW-PWSUYJOCSA-N 264.369 2.184 10 20 CECD CCOC[C@@H]1CCCCN1C(=O)c1cc(O)cs1 839797856 KFMIUDSQFSPLSW-JTQLQIEISA-N 269.366 2.485 10 20 CECD CCOCc1cc(CN[C@H]2C[C@@H](C(=O)O)C2)ccc1OC 901614449 GHJSQBWZFZWHLT-XBXGTLAGSA-N 293.363 2.185 10 20 CECD COC1CCC(NC(=O)c2ccc(C)c(O)c2O)CC1 837955018 DAEWZOFADANNJM-UHFFFAOYSA-N 279.336 2.094 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Cc1cccnc1 734404017 BTNVLALUGBHURC-UHFFFAOYSA-N 283.375 2.315 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@](C)(CN)C2CC2)c1O 843355960 OJSMMLYKAOGSQE-OAHLLOKOSA-N 296.798 2.465 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2C[C@H]3CC[C@@H]2O3)c1O 846188682 IJBRXKUBDVZMAD-WFFHOREQSA-N 263.337 2.371 10 20 CECD CCN(CC)c1ccc(CNCC(C)(C)N)cc1F 841029824 BDUAULGDJHPFFF-UHFFFAOYSA-N 267.392 2.499 10 20 CECD COc1cccc(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1O 846111299 LEIYLQMNHAAACJ-NXEZZACHSA-N 255.264 2.098 10 20 CECD C[C@@H](CNC(=O)C(=O)Nc1ccc(N)cc1)C(C)(C)C 841038837 RILHMFNVTQVFMB-JTQLQIEISA-N 277.368 2.006 10 20 CECD COCCCN(C)CCNCc1ccc2c(c1)CCCO2 921779481 IQJIXHAUJLPXNQ-UHFFFAOYSA-N 292.423 2.070 10 20 CECD Cc1cc(O)c(CN2CC[C@H]3NCC[C@H]3C2)cc1C 843126036 FEZDFWKHXGCKMT-DZGCQCFKSA-N 260.381 2.193 10 20 CECD C[C@H]1COC[C@@H]1NCc1ccc(N(C)C)c(F)c1 922641311 KIFDXQZPJYHHBO-GWCFXTLKSA-N 252.333 2.016 10 20 CECD CN(C)c1cc(F)c(CNCCn2ccnc2)cc1F 858087816 UDTLITKVJKMBOL-UHFFFAOYSA-N 280.322 2.017 10 20 CECD CCOC(C)(C)C(=O)NCc1ccc(N(C)C)cc1C 865904929 UUJXXVCMTFNMMR-UHFFFAOYSA-N 278.396 2.492 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1 932639166 MLIGEPPQQNWHJE-OAHLLOKOSA-N 290.407 2.446 10 20 CECD Cc1ccc(O)c(CNC(=O)C(F)(F)C2(O)CCCC2)c1 862757540 XTDAZWAISRPMTQ-UHFFFAOYSA-N 299.317 2.257 10 20 CECD COc1cccc(CNC[C@H]2CCC[C@@H]2OC)c1O 774831727 YAGORTNXCFWRGP-YPMHNXCESA-N 265.353 2.306 10 20 CECD CCCn1cc(CN(C)c2ccc(OC)cc2)nn1 877609280 JKKWONCCGDYOSZ-UHFFFAOYSA-N 260.341 2.333 10 20 CECD CC[C@]1(O)CCN(Cc2cc(Cl)ccc2O)C1 779218408 DNRJKFBZYDRRJU-ZDUSSCGKSA-N 255.745 2.392 10 20 CECD Cn1cc(/C=C\C(=O)N2CCCc3cccc(O)c32)cn1 778951440 LZHRAUKXSAOPBS-FPLPWBNLSA-N 283.331 2.118 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCC[C@@H]1OC 774828514 CQLDPMDJIWFPLN-RISCZKNCSA-N 265.353 2.306 10 20 CECD Cc1noc(NC(=O)NCCCSc2nccs2)n1 779350837 FSMWRLHYDHHEMQ-UHFFFAOYSA-N 299.381 2.138 10 20 CECD C[C@H](NCc1ccc(Br)cc1O)C(C)(C)O 691394313 CIILCUXIPZBPJE-QMMMGPOBSA-N 288.185 2.404 10 20 CECD C[C@@H](N[C@@H]1CCN(C2CC2)C1)c1c(O)cccc1F 886522280 GKFHVNNRLHUGCV-GHMZBOCLSA-N 264.344 2.419 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CC[C@@H]2C[C@@H]2C1 1121366946 VPMPNEYOTVPACE-RKDXNWHRSA-N 276.365 2.095 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@H](OC)C2)cc1F 895968078 GNIXWFVCMMFVTB-INIZCTEOSA-N 296.386 2.477 10 20 CECD CN(C)c1ccc(CNc2cn[nH]c(=O)c2Cl)cc1 15116842 NFANCQQDGUIFDP-UHFFFAOYSA-N 278.743 2.101 10 20 CECD Cc1nc([C@@H](C)NCc2ccc(N(C)C)c(F)c2)n[nH]1 894772496 LWKRKWHWUFMHFP-SECBINFHSA-N 277.347 2.169 10 20 CECD COc1ccc(CNC(=O)c2cc(Cl)cn2C)c(O)c1 794382252 SKBVRZBIFYKVQG-UHFFFAOYSA-N 294.738 2.323 10 20 CECD Cc1cc(C)c([C@@H](C)NCc2nnc(C)n2C)c(O)c1 1324239087 BKDYEUDPBKRMTK-LLVKDONJSA-N 274.368 2.297 10 20 CECD CCOc1cccc(CNC[C@@H](OC)C(F)(F)F)c1O 733330020 OIBCEGHKNGPTPF-LLVKDONJSA-N 293.285 2.458 10 20 CECD Nc1ccc(CNC(=O)N[C@H]2CCC[C@@H](F)C2)cc1 1335568218 JIZNFDNYAGQDCW-YPMHNXCESA-N 265.332 2.349 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@H](N)C(C)(C)C 1263101383 QOUIWMKNLYFTBN-HNNXBMFYSA-N 291.439 2.441 10 20 CECD C[C@@H](NC(=O)OC[C@@H]1CCCO1)c1ccccc1O 1348699019 UZRVOLYQVPTNJO-MNOVXSKESA-N 265.309 2.358 10 20 CECD COc1cc(CN(C)Cc2ccccc2O)sn1 851840540 GZUKLWFQPAOHLD-UHFFFAOYSA-N 264.350 2.489 10 20 CECD C[C@@H]1C[C@H](NCCC(=O)O)c2c(O)ccc(F)c21 1589291814 UVZMALAIRCLGFC-APPZFPTMSA-N 253.273 2.144 10 20 CECD C[C@H](N[C@H]1CCCC[C@@H]1O)c1cc(C(=O)O)ccc1O 1593354406 PFINMPZWAKKAAV-WFBYXXMGSA-N 279.336 2.045 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@H]2C(=O)O)cc1 1598320787 SONKRHOSLINDBE-KGLIPLIRSA-N 262.353 2.096 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C)[C@@H]2C(=O)O)cc1 1776855658 VVSGCSQNRHBDTO-IUODEOHRSA-N 276.380 2.438 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2CCC[C@H]2C(=O)O)cc1F 1777038259 FVHIHAGKJMTTAZ-ZWNOBZJWSA-N 298.333 2.374 10 20 CECD CC(C)C(=O)NCCCN[C@@H]1CCc2cccc(O)c21 834694178 VAUNJFHRVDKTJD-CYBMUJFWSA-N 276.380 2.131 10 20 CECD CCOc1cccc(CNCCOCC(F)(F)F)c1O 111607860 RGLPSXMSSFROPO-UHFFFAOYSA-N 293.285 2.459 10 20 CECD CCCCOCCNCc1cc2c(cc1O)OCO2 42880349 LZMZKSBACGBPNG-UHFFFAOYSA-N 267.325 2.027 10 20 CECD CS[C@@H]1CC[C@H](N(C)C(=O)c2cccc(O)c2O)C1 707342153 FABJERZYVNZMAV-VHSXEESVSA-N 281.377 2.454 10 20 CECD CCc1cccc(CNCCn2ccnc2C)c1O 709420165 XCQLCCCTNIZQBT-UHFFFAOYSA-N 259.353 2.249 10 20 CECD C[C@H](Cn1cccn1)NCc1ccc(N(C)C)c(F)c1 113320683 SIQJNXLRTGMIQC-GFCCVEGCSA-N 276.359 2.267 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccccc2F)c1 114541239 YJGSLCHRIIHDPA-UHFFFAOYSA-N 275.279 2.470 10 20 CECD C[C@H](N[C@H]1CCO[C@@H]1C)c1ccc(N2CCOCC2)cc1 120534096 RGOGXEUQFWRWQE-VBQJREDUSA-N 290.407 2.351 10 20 CECD CC(=O)N1CCC(CN[C@H](C)c2cc(F)ccc2O)CC1 185377571 MHSSGGWKKNWKNK-LLVKDONJSA-N 294.370 2.440 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCO[C@H]2C)c1 134244066 BPCQPYGYXPKMLB-KWBADKCTSA-N 251.326 2.229 10 20 CECD COc1ncccc1CN(C)c1ccc2c(c1)OCO2 193451197 ANXHSNGSAAJHGX-UHFFFAOYSA-N 272.304 2.455 10 20 CECD Cc1ccc(OCCNC(=O)Cc2ccc(N)cc2)cc1 237719723 IYLSNKYQKMBVCN-UHFFFAOYSA-N 284.359 2.315 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2[C@H](C)[C@H]2C2CC2)c1 528864859 TZHCVZTZQWBYJY-TURNYIBQSA-N 275.348 2.309 10 20 CECD C[C@@H]1C(=O)N(c2cc(Cl)c(N)c(Cl)c2)C(=O)N1C 278252288 XATMJIHLAMZYHX-RXMQYKEDSA-N 288.134 2.363 10 20 CECD CC[C@H](NCC(=O)NCC1CC1)c1ccc(F)cc1O 285959159 FKFLIXLFNJKGDW-ZDUSSCGKSA-N 280.343 2.098 10 20 CECD CC(=O)C1(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 293387367 GRQLWOFCBNMUBZ-UHFFFAOYSA-N 286.375 2.272 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2CC2(C)C)cc1 299033532 KCTQHWSQWGPFRW-ZDUSSCGKSA-N 261.369 2.350 10 20 CECD C[C@@H](NC[C@H]1CC[C@@H](CO)O1)c1cc(Cl)ccc1O 294061490 HECYWSHUASRZHS-JLLWLGSASA-N 285.771 2.236 10 20 CECD CC[C@@H](C)CONC(=O)/C=C/c1ccc(O)c(O)c1 293591835 BRHYFBZXHDZWSN-BREXMAIKSA-N 265.309 2.205 10 20 CECD CCC(N)(CC)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 817960912 UDZCZTDFWXVPAT-JTQLQIEISA-N 281.356 2.469 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCC2(C1)OCCO2 816502725 NEYDMWGDISHNAO-UHFFFAOYSA-N 287.718 2.134 10 20 CECD Oc1cccc2c1[C@H](NCCC1=CCNCC1)CC2 817984920 CCMDRRRGCICXAS-CQSZACIVSA-N 258.365 2.279 10 20 CECD COc1cccnc1CNCc1ccc2c(c1)CCO2 825249480 IWUTZONYDKDDDA-UHFFFAOYSA-N 270.332 2.315 10 20 CECD O=C1OCCN1[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 827001410 VUFFEXUJTFCRMZ-SNVBAGLBSA-N 296.754 2.072 10 20 CECD C[C@H](NC[C@@H]1CCN1C)c1cc(F)cc(F)c1O 903319431 ZFEUBZNZJCAFFE-WPRPVWTQSA-N 256.296 2.025 10 20 CECD Cc1noc(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 836494069 PPPDCZYSFXWAEQ-VIFPVBQESA-N 289.339 2.327 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]1(C)CCCCO1 837521081 UMQPBGUJUVOMQN-BDJLRTHQSA-N 293.363 2.104 10 20 CECD C[C@H]1C[C@@H](CN2CCOc3cc(N(C)C)ccc32)CCN1 841011244 FVJOXHDAFRONSJ-KBPBESRZSA-N 289.423 2.340 10 20 CECD CC[C@H]1CN(CC)CCN1C(=O)Nc1ccc(N)cc1 841297617 HQZZOODQAFKEBN-AWEZNQCLSA-N 276.384 2.217 10 20 CECD Cc1cc(CNCCCSc2nccs2)n(C)n1 841865121 LFSMQIRNMROVNS-UHFFFAOYSA-N 282.438 2.457 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C2CC(N)C2)c1O 843387532 LLLQUUGZQQBJKE-UHFFFAOYSA-N 282.771 2.170 10 20 CECD CCn1cncc1CNCc1ccc(N(C)C)c(F)c1 841860442 VHPBNIJBMVPQGY-UHFFFAOYSA-N 276.359 2.398 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CC(=O)N1CCCC1 840910645 VLJTYBFQKVSZIP-UHFFFAOYSA-N 289.423 2.115 10 20 CECD NCC[C@@H](NCc1c(O)cccc1Cl)C(F)(F)F 841089897 BPSFNHBKEWAROA-SNVBAGLBSA-N 282.693 2.415 10 20 CECD CCc1cccc(CN[C@H](C)c2nnc3n2CCC3)c1O 848900803 KCEHKIIHUZPFJH-LLVKDONJSA-N 286.379 2.343 10 20 CECD CCN(C)c1ccc(Cn2cnc([N+](=O)[O-])c2)cc1 747808319 FFBAJFYELOSILF-UHFFFAOYSA-N 260.297 2.296 10 20 CECD CCc1c(-c2nc(Cc3ccc(N)cc3)no2)cnn1C 843159943 SURNCPHRAKYEOT-UHFFFAOYSA-N 283.335 2.206 10 20 CECD Nc1ccc(NC(=O)N2C[C@]3(CCCO3)[C@H]2C2CC2)cc1 841298743 FEURUQWLEIDYGJ-GDBMZVCRSA-N 287.363 2.444 10 20 CECD C[C@H](CNCc1cc(F)c(N(C)C)cc1F)N(C)C 858127431 FEIKCOXRDUZTPX-SNVBAGLBSA-N 271.355 2.071 10 20 CECD C[C@H](NC1COC(C)(C)OC1)c1cc(F)cc(F)c1O 757702965 DYYMDRSRPZIMMV-QMMMGPOBSA-N 287.306 2.473 10 20 CECD CN(C)c1ccc(N(C)C(=O)/C=C\c2cn(C)cn2)cc1 935217000 ZFQPMMBCSARGRC-YHYXMXQVSA-N 284.363 2.162 10 20 CECD COc1ccc(N(C)CCN(C)c2ccc(F)nn2)cc1 865909636 XCPSURSWQNQFKQ-UHFFFAOYSA-N 290.342 2.197 10 20 CECD CCN1C(=O)/C(=C/c2cc(OC)ns2)SC1=S 864087353 SXCJOFBLBGOENC-DAXSKMNVSA-N 286.403 2.373 10 20 CECD CC(C)[C@H]1NC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 761582050 ZCYYAUULYMBQNK-SMDDNHRTSA-N 289.379 2.390 10 20 CECD COC(=O)c1cc(C)nc(N[C@H](C)c2ccccc2O)n1 1118990719 CVXNLMUIRLZYMP-SNVBAGLBSA-N 287.319 2.450 10 20 CECD CC[C@H](NC[C@@]1(O)CCOC1)c1cc(Cl)ccc1O 775522914 BQDGEZGNEGPESF-JSGCOSHPSA-N 285.771 2.238 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1ccc(C)cc1O 877588093 VTTCCQRRCQGJGD-ZDUSSCGKSA-N 263.337 2.132 10 20 CECD CC[C@@H]1CO[C@H](C)CN1Cc1cc(OC)c(OC)cc1O 775642835 PCYLUEANKFRXMR-DGCLKSJQSA-N 295.379 2.409 10 20 CECD C[C@@H]1CCN2[C@H](C1)C(=O)N[C@H]2c1ccc(N(C)C)c(F)c1 777899839 OXEQVLRKIFXTEN-VCTAVGKDSA-N 291.370 2.121 10 20 CECD Cc1cccc(C[C@H](CO)NC(=O)c2cc(O)cs2)c1 788006072 RIUYWSGTICZMNB-GFCCVEGCSA-N 291.372 2.096 10 20 CECD Oc1c(F)cc(Cl)cc1CNCC[C@@H](O)C1CC1 898202811 NQSGBDUWLATMBH-GFCCVEGCSA-N 273.735 2.435 10 20 CECD Cc1ccc(CN2CC[C@H](c3n[nH]c(C)n3)C2)c(O)c1 895012665 TYIUITFQUGJPHO-ZDUSSCGKSA-N 272.352 2.117 10 20 CECD OC[C@H]1CCCCCN1Cc1cc(F)cc(F)c1O 895151610 VBSUSSXRAVILKX-GFCCVEGCSA-N 271.307 2.407 10 20 CECD Oc1cccc(Br)c1CNC1CCOCC1 706863857 SUPZUDGJMXZTRY-UHFFFAOYSA-N 286.169 2.423 10 20 CECD C[C@H](NC(=O)CNC(C)(C)C)c1ccc(N(C)C)cc1 1325776465 ODPYNVSDYSOFLC-LBPRGKRZSA-N 277.412 2.318 10 20 CECD C[C@@H]1CC2(CCNCC2)CN1Cc1ccc(N)cc1 1334755153 XVSYBIDNVDBALT-CYBMUJFWSA-N 259.397 2.233 10 20 CECD COc1cccc(O)c1CN1CC[C@@]2(CCOC2)C1 769532504 KFHUVPPNHUGXPS-OAHLLOKOSA-N 263.337 2.013 10 20 CECD C[C@H](N)[C@H](C)C(=O)NCc1c(O)ccc2ccccc12 1576088909 UVPXHDRWAMBNCG-QWRGUYRKSA-N 272.348 2.145 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@@H]3C[C@@H](C(=O)O)C[C@@H]32)cc1 1777039932 DVJABGDKIFAMMA-LQKXBSAESA-N 288.391 2.342 10 20 CECD CN(C)c1ccc(CN2C[C@@H](F)C[C@H]2CC(=O)O)cc1 1777039670 JKLOOHIAQLVFKY-JSGCOSHPSA-N 280.343 2.140 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)cc1 250246824 KZTYXCCNVWSDIQ-KCQAQPDRSA-N 258.365 2.364 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](N3CC=CC3)C2)c1 164406418 FEKMEFAOKJPIIJ-MRXNPFEDSA-N 272.392 2.455 10 20 CECD COc1ccc(N2CCN(Cc3cnc(C)cn3)CC2)cc1 749436503 KZZUXZBBLYDZAZ-UHFFFAOYSA-N 298.390 2.116 10 20 CECD CO[C@H]1CCC[C@@H](C(=O)NCc2ccccc2O)C1 815833404 LRGYXCXVOLKKAQ-YPMHNXCESA-N 263.337 2.214 10 20 CECD C[C@@H](Cc1cnn(C)c1)N[C@H]1CCc2cccc(O)c21 834897823 WALZAWALRLJZGL-FZMZJTMJSA-N 271.364 2.334 10 20 CECD Cc1cccc(CN[C@H]2CCN3CCC[C@H]3C2)c1O 252738800 GAZMQSQMXSPUKB-GJZGRUSLSA-N 260.381 2.417 10 20 CECD CCCNC(=O)CCN[C@H](C)c1ccc(F)cc1O 62748374 VPEKPIKBNJOAGI-SNVBAGLBSA-N 268.332 2.098 10 20 CECD CCCN(Cc1cncn1C)c1ccc(CN)cc1 194979615 ACKNVCWMPYYDTJ-UHFFFAOYSA-N 258.369 2.295 10 20 CECD C[C@@H]1NC[C@H](C)N(Cc2cc(F)ccc2O)[C@@H]1C 401202617 ANXPKMXJPOQPJD-GARJFASQSA-N 252.333 2.102 10 20 CECD CCn1cc(CN[C@@H](C)c2ccc(N(C)C)cc2)nn1 404466143 MIDDDHKDBQYIGJ-LBPRGKRZSA-N 273.384 2.215 10 20 CECD CC(C)OC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 308758956 SVIJEDSKXCGIBL-GFCCVEGCSA-N 264.369 2.355 10 20 CECD C[C@H]1C[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 68535650 WSXIYTFXKGMCEZ-XJKSGUPXSA-N 288.391 2.138 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2cccc(C)c2O)C1 180567364 HIWAFVUKBFARNF-OAHLLOKOSA-N 263.337 2.086 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H](C)CN2CCOCC2)c1 185504743 GQSGABZFUCWGEE-CABCVRRESA-N 292.423 2.320 10 20 CECD C/C=C/C[C@@H](CO)N[C@@H](C)c1cc(OC)ccc1O 186520252 YTLTYINZTHCIDD-XMXMHJJKSA-N 265.353 2.379 10 20 CECD Cc1ccc(O)c(CN(C)[C@@H]2CCN(C)C[C@@H]2C)c1 290364722 HBPSFSKQBPYTCX-DZGCQCFKSA-N 262.397 2.473 10 20 CECD CCn1c(C)nnc1Sc1ncc([N+](=O)[O-])s1 195512682 CGFHBFHXZBYHLH-UHFFFAOYSA-N 271.327 2.122 10 20 CECD CCOc1cccc(CN2CCC[C@]23CCOC3=O)c1O 190036044 HERLXAGSFWHWAC-MRXNPFEDSA-N 291.347 2.072 10 20 CECD C[C@H](O)CCN(C)Cc1cccc(Br)c1O 93481575 BVVWRWXSOUZAHV-VIFPVBQESA-N 288.185 2.357 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccn(C)c2)cc1F 268567672 AYNLKWKTLSMQHB-UHFFFAOYSA-N 275.327 2.160 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)[C@H]2CCCCO2)c(O)c1O 272890637 ARECRYSGVTWLHF-CMPLNLGQSA-N 279.336 2.094 10 20 CECD COc1ccc(O)c(CN2C[C@H](O)Cc3ccccc32)c1 279426385 NSIBSSXZFJSOQX-CQSZACIVSA-N 285.343 2.324 10 20 CECD CC[C@]1(CO)CCCN(C(=O)c2ccc(C)c(O)c2O)C1 275159430 BBASPOHDLARBOW-INIZCTEOSA-N 293.363 2.031 10 20 CECD O=C(c1cccc(O)c1O)N1CCOC2(CCCCC2)C1 279259643 JDXFXNLKBZBZQI-UHFFFAOYSA-N 291.347 2.273 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@]2(O)CCO[C@H]2C)cc1 278932315 XPWCQUZCXOAYEZ-ZQIUZPCESA-N 292.423 2.333 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 273445331 DYDTXPZDFPWZFA-YPMHNXCESA-N 299.436 2.483 10 20 CECD CCCCCS(=O)(=O)NCc1ccccc1O 273740272 VFIJVGUOEGXTKW-UHFFFAOYSA-N 257.355 2.002 10 20 CECD C[C@@H](NCCc1cn[nH]c1)c1ccc(F)c(F)c1O 289759062 LOCIIANTRDXCJI-MRVPVSSYSA-N 267.279 2.287 10 20 CECD CC1(C)[C@H](NC(=O)c2cccc(O)c2O)[C@@H]2CCCO[C@H]21 370498575 HQOCBVIREAQORZ-ZLKJLUDKSA-N 291.347 2.031 10 20 CECD CC[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H](C)[S@@]1=O 289678369 NVPUNPQTVMJWEV-VARDARPISA-N 285.384 2.263 10 20 CECD Cc1cc(C)c([C@@H](C)NCC2(S(C)(=O)=O)CC2)c(O)c1 284859294 AMYBFSDQSZVBGO-GFCCVEGCSA-N 297.420 2.237 10 20 CECD CC(=O)C(=O)COC(=O)c1csc2c1CC[C@@H](C)C2 808483248 IEDLBBVKYIHUEH-MRVPVSSYSA-N 280.345 2.188 10 20 CECD CC1(C)CC[C@@H]1NC(=O)c1c(F)ccc(O)c1O 295683481 IKWBZKQHFOOHRY-VIFPVBQESA-N 253.273 2.155 10 20 CECD COCC1(CN[C@H](C)c2ccccc2O)CCNCC1 817974698 NTMLVSULYTUFRX-CYBMUJFWSA-N 278.396 2.059 10 20 CECD Cc1cc(CN[C@@H](C)c2nncn2C)ccc1N(C)C 815090247 UJJNXORYUQGRFY-LBPRGKRZSA-N 273.384 2.040 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H](CCO)CC1 817771084 UKIZUEOMUQTGBW-JTQLQIEISA-N 269.366 2.078 10 20 CECD C[C@@H](NCCCNC1CC1)c1cc(F)cc(F)c1O 817984780 ZWXZCMQDOKQYTQ-SECBINFHSA-N 270.323 2.463 10 20 CECD CN(C)c1ccc(CNC(=O)OC2CCOCC2)cc1 810036139 SIGGQFRYBCDEEI-UHFFFAOYSA-N 278.352 2.158 10 20 CECD CCO[C@H](C)C(=O)N[C@@H](C)c1cc(OC)ccc1O 728977559 AFAANLYQNKESMH-VHSXEESVSA-N 267.325 2.003 10 20 CECD CO[C@H]1C[C@H](N(C)C(=O)c2cccc(O)c2O)C12CCC2 837017845 RXDVZMVIXVRNNX-STQMWFEESA-N 291.347 2.127 10 20 CECD CCN1C[C@@H](N[C@H](C)c2ccc(N(C)CC)cc2)CC1=O 834892464 VLDAIOJPGWQWFU-HIFRSBDPSA-N 289.423 2.414 10 20 CECD Cc1cccc(CN2CCC(C)(C(=O)O)CC2)c1O 843041094 NUDYRRAIGZVXQI-UHFFFAOYSA-N 263.337 2.387 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)CN(C)C)c1O 846174513 WZGSCYFETJMVFJ-WDEREUQCSA-N 252.358 2.002 10 20 CECD CC[C@@H](N[C@H](CO)CCF)c1ccc(C)cc1O 846209381 QSKNJFYUWJSZHP-WCQYABFASA-N 255.333 2.462 10 20 CECD COc1cccc([C@@H](C)NCC[C@H](C)OC)c1O 846143648 FKXQNPBCDNNDFM-WDEREUQCSA-N 253.342 2.476 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CC(=O)N(C(C)C)C2)c1O 846155308 POAVJCKMXBKUEY-NEPJUHHUSA-N 292.379 2.061 10 20 CECD CCN(C)c1ccc(CN(C[C@H](C)O)C2CC2)cc1 847104679 JEOOQZOPZIGLEZ-ZDUSSCGKSA-N 262.397 2.488 10 20 CECD N[C@@H]1CCC[C@H]1CC(=O)NCCCSc1nccs1 846671270 QEFOIKWDYAGUSH-WDEREUQCSA-N 299.465 2.259 10 20 CECD C[C@@H](N[C@H](CO)c1cnn(C)c1)c1ccc(Cl)cc1O 841752459 TVKMKQGUWOHRDW-NOZJJQNGSA-N 295.770 2.163 10 20 CECD S=C(NCc1ccc(N2CC=CC2)cc1)NCC1CC1 849257282 JQYUWWUVTBBTRZ-UHFFFAOYSA-N 287.432 2.437 10 20 CECD CCC[C@@H](O)CN[C@@H](C)c1cccc(OC)c1O 846142554 ARFPAZMPILBKDD-WDEREUQCSA-N 253.342 2.212 10 20 CECD CCCNCCNC/C=C\c1ccc(N(C)C)cc1 841046641 KEUSRVDXPYCRQW-WAYWQWQTSA-N 261.413 2.355 10 20 CECD COCC[C@H](C)NC(=O)NCc1cc(Cl)ccc1O 844941778 RWHUBNSISSBOES-VIFPVBQESA-N 286.759 2.270 10 20 CECD CCO[C@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)C1 751533933 FACIIYRHSYFKCN-NSHDSACASA-N 279.336 2.047 10 20 CECD CN(C(=O)/C=C\c1cnn(C)c1)c1cc(F)ccc1F 750554407 ZJWYBCGHEUXMMT-UTCJRWHESA-N 277.274 2.375 10 20 CECD CC(C)N1C[C@@H](NCc2ccc3c(c2)CCCO3)CC1=O 921762787 JRAZBFMSCQJXTK-HNNXBMFYSA-N 288.391 2.111 10 20 CECD OCC1(NCc2ccc3c(c2)CCCO3)CCSCC1 922176243 BBGWMCDTCKEKTN-UHFFFAOYSA-N 293.432 2.359 10 20 CECD COCCCCCNC(=O)NCc1cc(C)ccc1O 858163744 JCABQLILYAGTJC-UHFFFAOYSA-N 280.368 2.317 10 20 CECD Cc1cc(C(=O)CN2CC[C@H]2CO)c(C)n1-c1ccccc1 934030133 XOMBPOGIAFTRLI-INIZCTEOSA-N 298.386 2.343 10 20 CECD Cc1ccn(C[C@H](C)C(=O)N(C)Cc2ccccc2O)n1 866596788 JYGUZWRODJBKGU-LBPRGKRZSA-N 287.363 2.192 10 20 CECD CN(C)c1cc(F)c(CN2CCc3c[nH]nc3C2)cc1F 862247714 LIQISMWNMUPLGQ-UHFFFAOYSA-N 292.333 2.312 10 20 CECD CO[C@@H](C(=O)NCc1ccc(N(C)C)cc1)C(C)C 769792411 VVAUDTKWWMDAGR-CQSZACIVSA-N 264.369 2.040 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(C)cc2O)C[C@@H]1C 877635691 BRDFTQSGYKIXEU-GXTWGEPZSA-N 277.364 2.332 10 20 CECD C[C@H](OC[C@@H]1CCCCO1)C(=O)N(C)c1ccc(N)cc1 877078519 SFRZHYYKUQIAJV-WFASDCNBSA-N 292.379 2.206 10 20 CECD COCCOC[C@H]1CCN(Cc2ccc(C)cc2O)C1 876774830 IGCYBVRUMAFGBH-AWEZNQCLSA-N 279.380 2.186 10 20 CECD CCN(C)c1ccc(Cn2cc(C(C)(C)O)nn2)cc1 881315197 NGTBQKFKZSLBPX-UHFFFAOYSA-N 274.368 2.010 10 20 CECD CCOc1ccc(O)c(CN2CC[C@](O)(CC)C2)c1 779219367 OLLLJIFVHSSGGL-OAHLLOKOSA-N 265.353 2.138 10 20 CECD CC(C)S(=O)(=O)CCN[C@@H](C)c1c(O)cccc1F 886610491 CHACCYRVUVNHSC-JTQLQIEISA-N 289.372 2.005 10 20 CECD CC[C@@H](C)N(CCO)Cc1cc(C)cc(OC)c1O 894920628 YPUAMEXJUYXYOR-GFCCVEGCSA-N 267.369 2.302 10 20 CECD Cc1ccc(O)c(CN2CCC3(CC2)C[C@@H](O)CCO3)c1 897260629 IVWPPGZTNMIOHT-HNNXBMFYSA-N 291.391 2.207 10 20 CECD Cc1ncc(NC(=O)c2cccc(O)c2O)s1 790903660 KPIQDSVDEMJYJY-UHFFFAOYSA-N 250.279 2.115 10 20 CECD C[C@@H](NC(=O)NCCC1CCNCC1)c1ccccc1O 892232301 BOSRZGFXQNCDOG-GFCCVEGCSA-N 291.395 2.142 10 20 CECD COCCCN(CCO)Cc1c(O)ccc(Cl)c1F 792179146 IWYOUORJYRFUJD-UHFFFAOYSA-N 291.750 2.016 10 20 CECD CCCN(Cc1csnn1)c1ccc(CN)cc1 194977241 BFSVBAJABISBMM-UHFFFAOYSA-N 262.382 2.413 10 20 CECD O=C(NCc1ccccc1O)c1ncc(Cl)s1 1339565010 PQKIEERDGWKXIL-UHFFFAOYSA-N 268.725 2.432 10 20 CECD Cc1cc(CN[C@@H](C)c2cc(F)ccc2O)ncn1 756775946 NLOXXABNABZDAV-JTQLQIEISA-N 261.300 2.481 10 20 CECD COc1ccc(N(C)Cc2ccc(C(=O)O)cn2)cc1 94762632 DLAPEUVHDFIRQY-UHFFFAOYSA-N 272.304 2.425 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1C[C@@H]2CC[C@H]1N2 1343394054 YDHJYCOIGNVADY-USXIJHARSA-N 299.418 2.044 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C(=O)O)[C@@H]2C)c1 1605696751 QSJGZRWBZPLGPO-GXFFZTMASA-N 279.336 2.086 10 20 CECD CN(Cc1occc1C(=O)O)c1ccc2c(c1)OCCO2 1777082480 DSOMIORYVCGGDL-UHFFFAOYSA-N 289.287 2.385 10 20 CECD CN(C)c1ccc(CN[C@H]2CCN3CCC[C@@H]3C2)cc1 106868661 SMFTVGVRZVSDKK-DOTOQJQBSA-N 273.424 2.469 10 20 CECD C[C@H]1CC[C@@H](CN2CCCc3cc(CN)ccc32)O1 232007580 ZTHJXHXSWHMBOA-WFASDCNBSA-N 260.381 2.465 10 20 CECD Cc1ccc(O)c(CNC[C@H]2CCN(C3CC3)C2)c1 71408007 JZFQEROGUYNVEQ-CYBMUJFWSA-N 260.381 2.275 10 20 CECD Cc1ccc(S(=O)(=O)NCc2ccccc2O)c(F)c1 404921077 RNNBCSCOIPAALH-UHFFFAOYSA-N 295.335 2.318 10 20 CECD OC[C@H]1C[C@H](NCc2cc(Br)ccc2O)C1 923008203 QNNULMWMTINRCW-JLIMDTESSA-N 286.169 2.015 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1ccc(Cl)nc1 6919718 HOBAUBSYTCGBKD-UHFFFAOYSA-N 284.724 2.241 10 20 CECD CC[C@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1 54786333 ANQIVZZYGSTSKW-ZDUSSCGKSA-N 291.395 2.121 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC[C@H]2CCOC2)c1 176138224 VAVBKRFMFGTWCP-NEPJUHHUSA-N 293.363 2.395 10 20 CECD C[C@H](N[C@@H]1C[C@H](O)C1(C)C)c1cc(F)ccc1O 128323849 IXGFHPQNMLKXCR-CKLFPEKLSA-N 253.317 2.341 10 20 CECD CCN1CCN(CCCN[C@@H](C)c2ccccc2O)CC1 183416245 UEWZQBPZJUVEJE-HNNXBMFYSA-N 291.439 2.070 10 20 CECD COc1ccc([C@@H]2NC(=O)c3ccccc3N2)c(O)c1 46836218 CREDPSQQSSSWEZ-AWEZNQCLSA-N 270.288 2.255 10 20 CECD CC(=O)c1cc(F)cc(CN2CCNC[C@H]2C(C)C)c1O 530229815 MNHMRSBBNFOHGS-HNNXBMFYSA-N 294.370 2.164 10 20 CECD CCOCC[C@@H](O)COc1ccc(N2CCCC2)cc1 277618189 YQRCUYSRBUAQKN-OAHLLOKOSA-N 279.380 2.453 10 20 CECD O=C1CCCN1[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 276856049 VYZYEHOQUHTYGC-GFCCVEGCSA-N 294.782 2.242 10 20 CECD CCCOc1ccc(CN2C[C@H](CC)[C@@H](O)C2)c(O)c1 271279558 LTBPWZQOCBBGRX-LRDDRELGSA-N 279.380 2.384 10 20 CECD CC[C@@H](NCc1nnc2n1CCC2)c1ccc(C)cc1O 280274377 YBQXWSZLMSXMTD-CYBMUJFWSA-N 286.379 2.479 10 20 CECD CC[C@@H](NC[C@@]1(O)CCOC1)c1cccc(Cl)c1O 287277823 BHZBZNGUVSUQDP-OCCSQVGLSA-N 285.771 2.238 10 20 CECD CCCCN(Cc1ccccc1O)Cc1nncn1C 801595452 CMGCQIHZTCAZII-UHFFFAOYSA-N 274.368 2.323 10 20 CECD C[C@@H](CN(C)C)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 807141089 QDZLLFHODXZFKY-QWHCGFSZSA-N 292.427 2.063 10 20 CECD CN(C)c1ccc(CN(C(=O)[C@H]2CCOC2)C2CC2)cc1 299311883 NBNGQMXTITVVLP-AWEZNQCLSA-N 288.391 2.280 10 20 CECD C[C@H](N[C@H](C)CCCN)c1cc([N+](=O)[O-])ccc1O 817977289 GSBQWPLCSUFZEM-ZJUUUORDSA-N 267.329 2.078 10 20 CECD C[C@H](NCCC1=CCNCC1)c1cc([N+](=O)[O-])ccc1O 817984973 DDYGTZUASMTIRI-NSHDSACASA-N 291.351 2.261 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)CC3CC3)C2)cc1 819583928 XAEJOOGNCPEXCP-CQSZACIVSA-N 288.391 2.438 10 20 CECD CC[C@H](O)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 813885316 SRANUMIRXQFOQA-ATZCPNFKSA-N 253.317 2.440 10 20 CECD O=C1NN(c2ccccc2)C(=O)/C1=C/c1cccnc1Cl 728697285 MQLWGNZZIFRCAF-FMIVXFBMSA-N 299.717 2.196 10 20 CECD CCc1noc(CCCC(=O)Nc2ccc(N)cc2)n1 832244404 PSOIHLGQZJDNLR-UHFFFAOYSA-N 274.324 2.176 10 20 CECD CC(C)n1ccc(CNC(=O)c2cc(O)cs2)n1 738547906 GIRQVTIFIOVDNS-UHFFFAOYSA-N 265.338 2.161 10 20 CECD CC(=O)C1=NN(c2ccc(Cl)c(C)c2)C(=O)C1 905023589 LLAZHJKLQLEEEL-UHFFFAOYSA-N 250.685 2.330 10 20 CECD C/C(=C(/F)C(=O)NCc1ccc(O)c(O)c1)C1CC1 901131393 KIVACHRDYHGBBX-JYRVWZFOSA-N 265.284 2.368 10 20 CECD CC1(C)NCC[C@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 841086082 LXUCNVPMAXSDPQ-LLVKDONJSA-N 299.758 2.184 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)C(=O)NC(C)(C)C)c1O 846141266 HEQXJJMHCBHBDA-QWRGUYRKSA-N 294.395 2.355 10 20 CECD CCOc1ccc(CNCC(N)(CC)CC)c(O)c1 841031688 ZBGHTSKMGWZELM-UHFFFAOYSA-N 266.385 2.398 10 20 CECD C[C@H](N[C@@H]1CCN(C)C1)c1ccc(Cl)cc1O 841748062 VVWNKYXBQHQWIP-GXSJLCMTSA-N 254.761 2.400 10 20 CECD C[C@H](N[C@H](C)c1ccc(Cl)cc1O)C(=O)NCCF 841752250 NWCHLJFMBKOEHT-BDAKNGLRSA-N 288.750 2.170 10 20 CECD CCc1cccc(CN2CCO[C@H]([C@@H]3CCCO3)C2)c1O 848891223 XMBITURHDSYJQO-HOTGVXAUSA-N 291.391 2.334 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1([S@](C)=O)CCC1 840942594 JFTOGJQFFCPUIE-FQEVSTJZSA-N 294.464 2.452 10 20 CECD COc1ccc(N(C)CC2(CC(=O)O)CC2)c(OC)c1 846251632 MAAQYHULCKFQIU-UHFFFAOYSA-N 279.336 2.395 10 20 CECD C[C@@H]1C[C@@H](NCCO[C@H]2CCOC2)c2c(O)ccc(F)c21 927079042 CLGZFMREFYUABA-NTZNESFSSA-N 295.354 2.475 10 20 CECD Cn1cc(CCCNCc2ccc3c(c2)CCCO3)cn1 921657225 YKLXPHOAXJTSPK-UHFFFAOYSA-N 285.391 2.468 10 20 CECD CC[C@H](NCc1cn(CC)nn1)c1ccc(F)cc1O 850522179 GQWSQVVJTHHIOI-ZDUSSCGKSA-N 278.331 2.384 10 20 CECD Cc1ccc(O)c(CNC[C@H]2CC(=O)N(C(C)(C)C)C2)c1 850396259 IKFQIUKNDRNZCT-CYBMUJFWSA-N 290.407 2.437 10 20 CECD CCN(CC(=O)NC)Cc1ccc(N(CC)CC)cc1 768308719 SWQMNKFUWKPSEN-UHFFFAOYSA-N 277.412 2.101 10 20 CECD OC[C@@H]1CCCN1Cc1c(O)cccc1Br 862232633 FKPAOQVUNKBRIP-VIFPVBQESA-N 286.169 2.111 10 20 CECD COC(=O)c1cnc(SCc2cc(OC)no2)s1 863340811 NHRCDWKSURGENG-UHFFFAOYSA-N 286.334 2.219 10 20 CECD Cc1ccc(CN2CCOC[C@@H]2[C@H]2CCCC2=O)c(O)c1 877465848 YXJQBXWBQUOSMN-HUUCEWRRSA-N 289.375 2.271 10 20 CECD Cc1nonc1CN[C@H](C)c1cc(F)cc(F)c1O 872135288 DPVABCHPSMXRPR-ZCFIWIBFSA-N 269.251 2.213 10 20 CECD Cc1ccccc1OCC(=O)NCc1ccc(O)c(O)c1 778927237 MSXJWANXBKIJJF-UHFFFAOYSA-N 287.315 2.101 10 20 CECD CN1C[C@H]2CN(Cc3cc(Cl)cc(F)c3O)C[C@H]2C1 787301978 BDNPAEKFGYXXAL-PHIMTYICSA-N 284.762 2.178 10 20 CECD CCc1cccc(CNC[C@@](C)(O)CSC)c1O 691499942 KTWGZRPDURBLPO-CQSZACIVSA-N 269.410 2.158 10 20 CECD CC1(C)C[C@H](CNC(=O)NCc2ccc(N)cc2)CCO1 1353414593 WWOIRRXFBZBZDC-CYBMUJFWSA-N 291.395 2.273 10 20 CECD O=C(Nc1ccc(Cl)nc1)c1cccc(O)c1O 188124108 AMIXCXGHWKOLPK-UHFFFAOYSA-N 264.668 2.399 10 20 CECD CO[C@H](C)CNCc1c(O)cccc1Br 706846428 ICIPTIRILCNQQB-MRVPVSSYSA-N 274.158 2.279 10 20 CECD C[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccccc1O 777725559 URGYJYUCXKWVKR-XQQFMLRXSA-N 297.420 2.399 10 20 CECD COc1ccc(CN[C@@H]2CCn3ccnc3C2)cc1C 778187900 NDWNSUSYDIXPOT-CQSZACIVSA-N 271.364 2.305 10 20 CECD C[C@H]1CCN(CCNCc2cc(F)c(N(C)C)cc2F)C1 1348086787 TWIUGAZYWIAUOO-LBPRGKRZSA-N 297.393 2.462 10 20 CECD CCOCCCN[C@H](C)c1cc(C(=O)O)ccc1O 1610032616 FQSXRMJSZAKJOE-SNVBAGLBSA-N 267.325 2.168 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]2C[C@@H](C)O)cc1OC 160478506 MPFQWUNKXICTQM-DGCLKSJQSA-N 295.379 2.145 10 20 CECD COc1ccc(O)c(CNC(=O)C(C2CC2)C2CC2)c1 151722142 NOUZSPCJSDZYDG-UHFFFAOYSA-N 275.348 2.453 10 20 CECD COC(=O)C1CCN(Cc2cc(C)ccc2O)CC1 159227007 GYUSGRGCGZBJAX-UHFFFAOYSA-N 263.337 2.086 10 20 CECD CCCN(CC(C)(C)O)C(=O)Nc1ccc(N)cc1 689995528 XDQUAPGGOBROJR-UHFFFAOYSA-N 265.357 2.284 10 20 CECD OC[C@H](C[C@H]1CCCO1)NCc1cccc(Cl)c1O 895747914 JIYRVDLMPJOPAD-NWDGAFQWSA-N 285.771 2.065 10 20 CECD COc1cc(Cl)cc(CNC[C@H](CO)C(C)C)c1O 394028356 DHAMBUIBEWJZKC-LLVKDONJSA-N 287.787 2.408 10 20 CECD CC[C@H](N[C@H](C)C[S@](C)=O)c1ccccc1O 119178596 AKEGKOYMPMGIPQ-YOIRWDDOSA-N 255.383 2.200 10 20 CECD COc1cccc(CN[C@H](C)[C@H]2CCCO2)c1O 20206684 BNZNDJYMDCJRCN-ZYHUDNBSSA-N 251.326 2.058 10 20 CECD CN(C)CC(=O)N(Cc1ccco1)Cc1ccccc1O 173668673 YVRSVEHQRBDUEX-UHFFFAOYSA-N 288.347 2.076 10 20 CECD COc1ccc(N(C)C[C@H](O)COCC(C)C)cc1 33637685 NUCNNCKUHNVHJM-AWEZNQCLSA-N 267.369 2.165 10 20 CECD CC[C@H](NCCCOCCO)c1ccc(N(C)C)cc1 180241375 QLCBZUYXXSAMJQ-INIZCTEOSA-N 280.412 2.192 10 20 CECD CC[C@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183475142 QHKJBYSKLSFAPZ-VHSXEESVSA-N 251.326 2.191 10 20 CECD CCO[C@@H](C)C(=O)NCc1c(O)ccc2c1CCCC2 75159557 QKSORJMLBXXITE-NSHDSACASA-N 277.364 2.312 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 135201725 RUEGBRCWRXPLAD-HOCLYGCPSA-N 290.407 2.038 10 20 CECD CCC[C@@H](N)C(=O)N(CCC)Cc1ccccc1O 236900012 QVZYPJQGSKAXKI-CYBMUJFWSA-N 264.369 2.258 10 20 CECD CO[C@@H](C)CCNC(=O)NCc1ccc(N(C)C)c(F)c1 263736204 CTSIRNNVBHCXIU-NSHDSACASA-N 297.374 2.116 10 20 CECD CN(C)[C@@H]1CC[C@H]2[C@@H](C1)OCCN2Cc1ccccc1O 374890899 FEXGDYVJEXMTIW-HLLBOEOZSA-N 290.407 2.076 10 20 CECD Cc1ccc(O)c(CN(C)Cc2ncnn2CC(F)F)c1 278846262 CZQNYMKASFUXII-UHFFFAOYSA-N 296.321 2.189 10 20 CECD O=C(NCc1ccccc1O)c1ocnc1C1CC1 289853378 VNERLYHWUDWCOX-UHFFFAOYSA-N 258.277 2.188 10 20 CECD COCCN(C)C(=O)c1cc(C)n(-c2ccccn2)c1C 298902584 BSPQXSGGEFMDTD-UHFFFAOYSA-N 287.363 2.208 10 20 CECD CN(Cc1ccccc1O)c1nnc(-c2ccccn2)n1C 809867170 FQMYIBBPLURIQL-UHFFFAOYSA-N 295.346 2.219 10 20 CECD Cc1cccc(CN2CCCN(CC(F)F)CC2)c1O 290331474 DSTONMBCEXDSKC-UHFFFAOYSA-N 284.350 2.473 10 20 CECD Cc1cc(CN2CCC[C@H]2C(=O)N(C)C)ccc1N(C)C 293427660 JBQDPHANISVDRC-INIZCTEOSA-N 289.423 2.114 10 20 CECD CCCN(CC)C[C@@H](C)NC(=O)c1c(F)ccc(O)c1O 296292350 ZHCIQDASRBHPLL-SNVBAGLBSA-N 298.358 2.087 10 20 CECD COc1ccc(O)c([C@H](C)NC(=S)NC2CCC2)c1 814197334 XGMYBXXJRJJBRX-VIFPVBQESA-N 280.393 2.478 10 20 CECD C[C@H]1CN(Cc2cc(Cl)c(F)cc2O)CC[C@H]1O 816574988 YQQODRUZYAVXDW-QPUJVOFHSA-N 273.735 2.387 10 20 CECD CCn1ccnc1C(=O)NCCCSc1nccs1 813452821 ZHJCOZBUHAXVGM-UHFFFAOYSA-N 296.421 2.272 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc2n(n1)CCCC2 825481322 KOBXQERPQRCZCT-UHFFFAOYSA-N 285.347 2.197 10 20 CECD CC[C@@H](O)[C@@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 822576084 GVNYERCJOFANGA-MLGOLLRUSA-N 290.407 2.092 10 20 CECD CC[C@H]1CN(CC)CCN1Cc1cc2c(cc1O)OCO2 825005354 IGISKNJOOYMOIP-ZDUSSCGKSA-N 292.379 2.037 10 20 CECD CCOc1ccc(CN2CCC[C@@H](CC(=O)O)C2)c(O)c1 820387359 LUUNUTMPWJFUBI-LBPRGKRZSA-N 293.363 2.478 10 20 CECD OC[C@@H](C1CC1)[C@H](NCc1cc(F)ccc1O)C1CC1 824846436 SCGIWWTUMNMUOO-GOEBONIOSA-N 279.355 2.418 10 20 CECD Cn1cnc(/C=C\C(=O)N2CCCOc3ccccc32)c1 904248809 GSLBYDLNKIRGJX-FPLPWBNLSA-N 283.331 2.249 10 20 CECD Cc1occc1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832293429 WROAPSKFVPXXLE-HNNXBMFYSA-N 287.363 2.084 10 20 CECD C/C(Cl)=C/C(=O)NCc1ccc(N2CCOCC2)cc1 900337950 PXCDCBIUSHTAGC-BENRWUELSA-N 294.782 2.282 10 20 CECD Cc1cnc(NCc2ccc(N3CCN(C)CC3)cc2)nc1 834478788 WLFSBGZLOBECQG-UHFFFAOYSA-N 297.406 2.149 10 20 CECD CSCCONC(=O)NCc1cc(Cl)ccc1O 845164261 VSUMDSGDZHEJNE-UHFFFAOYSA-N 290.772 2.139 10 20 CECD Cc1cc([C@@](C)(O)CNC(=O)c2cc(O)cs2)c(C)o1 743517107 QBUUDUANHBCMGO-AWEZNQCLSA-N 295.360 2.301 10 20 CECD C[C@H]1CC[C@@H](CN(C)c2ccc(OCC(=O)O)cc2)O1 846280188 UNSLJZPOIPCHSX-FZMZJTMJSA-N 279.336 2.154 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(N)nc1 746295940 DMULAMJPJAKGPW-UHFFFAOYSA-N 284.363 2.002 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H](O)CC1 840948990 LPHMZHUFZAJMIK-INIZCTEOSA-N 262.397 2.408 10 20 CECD C[C@H](NC(=O)[C@H]1CCC(=O)C1)c1ccc(N(C)C)cc1 843859088 UVBRXGDFGLBUOM-AAEUAGOBSA-N 274.364 2.299 10 20 CECD CCN(C)c1ccc(CN(C)C[C@H](C)C(=O)O)cc1 846225523 NVPDDVFCBFQSJP-LBPRGKRZSA-N 264.369 2.295 10 20 CECD COc1ccc(O)c(CN2C[C@@H](N)Cc3ccccc32)c1 841106311 JQIZLWZFHOBYPK-AWEZNQCLSA-N 284.359 2.291 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1cc(F)ccc1O 756731403 ABWIPSRITWDOPL-WDEREUQCSA-N 271.332 2.233 10 20 CECD O=C(c1cc(O)cs1)N1CCC([C@@H]2CCOC2)CC1 753488977 VNAKMZWBJDKHBI-LLVKDONJSA-N 281.377 2.342 10 20 CECD Cc1cccc(CN2CC[C@@H](C)[S@@](=O)CC2)c1O 763491064 MKLUAOLWNWGYEE-XIKOKIGWSA-N 267.394 2.044 10 20 CECD CC(=O)OC1CCN(Cc2c(C)cccc2O)CC1 876738760 ACNDLFWNZWLKIT-UHFFFAOYSA-N 263.337 2.228 10 20 CECD COCC1(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 776248553 JHCDFQRBCCIPCL-LBPRGKRZSA-N 291.395 2.292 10 20 CECD C[C@H](NCCCn1cccn1)c1c(O)cccc1F 886498625 JHNCZSVQCJKITK-NSHDSACASA-N 263.316 2.469 10 20 CECD COc1cc(C)cc(CNCCn2ccnc2C)c1O 894211207 OQWINNGJLOQKTK-UHFFFAOYSA-N 275.352 2.004 10 20 CECD Oc1c(Cl)cccc1CN1CCc2ncncc2C1 895722835 LGKLXBYXNZJSPX-UHFFFAOYSA-N 275.739 2.394 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@H](O)C1CC1 790965254 AHRBRNXJKGJUMY-NSHDSACASA-N 259.708 2.045 10 20 CECD CCCC(=O)NCCC1=CCN(c2ccnc(C)n2)CC1 1089804898 YAEVROBVJDTWGN-UHFFFAOYSA-N 288.395 2.228 10 20 CECD CN(Cc1ccccc1O)c1ccc(S(C)(=O)=O)cc1 302628591 IQDBTBRTZVTXSF-UHFFFAOYSA-N 291.372 2.432 10 20 CECD Oc1c(F)cc(F)cc1CN1CC[C@@H](N2CCCC2)C1 708424085 WGBXWLSXOILSTB-CYBMUJFWSA-N 282.334 2.341 10 20 CECD CC(C)[C@@H]1CN(Cc2cc(F)ccc2O)CCO1 709019966 LIZZCMRNZXXHSZ-AWEZNQCLSA-N 253.317 2.388 10 20 CECD CCOc1cccc(CN[C@@H](CO)CC(C)C)c1O 40773806 XFXJYDLMDLZJOQ-CYBMUJFWSA-N 267.369 2.288 10 20 CECD Nc1ccc(CCNC(=O)CC[C@@H]2CCCCO2)cc1 69384410 HQSCKRQNMIKQHS-HNNXBMFYSA-N 276.380 2.277 10 20 CECD CCc1ncoc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 1336432785 KAEFFJFBIWOBEZ-VIFPVBQESA-N 290.319 2.009 10 20 CECD CNc1ncccc1C(=O)NCc1ccc(N(C)C)cc1 1336853513 GONRPXCUFYEGME-UHFFFAOYSA-N 284.363 2.119 10 20 CECD Cc1cc(CNCc2cc(F)c(N(C)C)cc2F)ncn1 1331272602 QIDWIYJNYFMVET-UHFFFAOYSA-N 292.333 2.419 10 20 CECD CC(C)CN1CCC[C@H]1C(=O)N(C)c1ccc(N)cc1 1357944425 ISEMQLLXQYUNQP-HNNXBMFYSA-N 275.396 2.352 10 20 CECD Cc1cc(O)c(CN2CC(C)(C(=O)O)C2)c(Cl)c1 1610475696 JXCOSTHHFWZACK-UHFFFAOYSA-N 269.728 2.261 10 20 CECD CN(C)c1ccc(CN[C@@](C)(CN)C2CC2)cc1F 1578426155 WHRZKUUCVANNDI-HNNXBMFYSA-N 265.376 2.109 10 20 CECD N[C@H]1CCC[C@@H](NC(=O)NCc2cccc(Cl)c2O)C1 1580176688 QBJFVDJJFZYHBE-WDEREUQCSA-N 297.786 2.115 10 20 CECD CCCC[C@H](OC(=O)c1ccc(C)c(O)c1O)C(=O)O 1595645855 VPIAZBMCLXUBEJ-JTQLQIEISA-N 282.292 2.206 10 20 CECD CN(C)c1ccc(OC[C@H]2C[C@H]3CC[C@H]2O3)cc1C(=O)O 1598328071 DEVYNBSFHFGITL-IXPVHAAZSA-N 291.347 2.397 10 20 CECD CCN(CC)CCN[C@H](C)c1cc(OC)ccc1O 19919480 TZECVXSRSGFAKP-GFCCVEGCSA-N 266.385 2.393 10 20 CECD C[C@@H]1C[C@@H]1[C@@H](NCc1cc(F)c(N(C)C)cc1F)C(=O)O 1776602425 JBMDNBJJNJMPTD-IPURGOFSSA-N 298.333 2.230 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(F)ccc1F 158968778 WBBCUVNKCCPDHE-UHFFFAOYSA-N 279.242 2.306 10 20 CECD CCOC(=O)C[C@H]1CCCN1Cc1cc(F)ccc1O 156270372 KBEOROIPHAIAMM-CYBMUJFWSA-N 281.327 2.449 10 20 CECD COc1cc(CN2CCOC(C)(C)C2)c(O)cc1C 159807517 DLMAIZDQKCYMAV-UHFFFAOYSA-N 265.353 2.320 10 20 CECD CO[C@H]1CCN(Cc2cc(F)ccc2O)C[C@@H]1C 824815475 QJLCUNZDLJELPH-HZMBPMFUSA-N 253.317 2.388 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCCc1ccc(O)c(O)c1 827085520 UQSGXPIISGAOMA-AVGNSLFASA-N 275.348 2.193 10 20 CECD CN(C)c1ccc(CNCc2cc(C(=O)O)co2)cc1 228157265 QKNIDUKZAJPMPZ-UHFFFAOYSA-N 274.320 2.334 10 20 CECD COc1cccc(CNC[C@@H]2CCC[C@H](O)C2)c1O 230670218 HFHPMVXHSOALPS-YPMHNXCESA-N 265.353 2.042 10 20 CECD COc1cccc(CNCc2c(C)n[nH]c2C)c1O 263793033 NXNVBPUMDGDOAF-UHFFFAOYSA-N 261.325 2.031 10 20 CECD C[C@@H]1C[C@@H](CNCc2cc(F)ccc2O)CCO1 272653085 QDKXUGQSFOVANK-MNOVXSKESA-N 253.317 2.436 10 20 CECD Cc1noc(C)c1CC(=O)N(C)Cc1ccccc1O 48606749 DDKNMVYCSCUEON-UHFFFAOYSA-N 274.320 2.198 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CCO1 708436157 KFPLKVPLIOQETL-KCJUWKMLSA-N 257.280 2.328 10 20 CECD CSCCNC(=O)N[C@H](C)c1ccccc1O 867997242 UPILYPQJUVOEGU-SECBINFHSA-N 254.355 2.115 10 20 CECD NCc1cc(C(=O)NCc2ccc(N3CCCC3)cc2)co1 188093843 DFEXEEORSSVUFM-UHFFFAOYSA-N 299.374 2.269 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2cc(F)ccc2O)C1 185788966 PQJVQZARQCIGCA-ZYHUDNBSSA-N 280.343 2.193 10 20 CECD C/C=C/C=C/C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186374509 XGNZDDBORRHENE-KXGOJYIESA-N 261.321 2.277 10 20 CECD CN(Cc1ccccc1)C(=O)c1cccc(O)c1O 126212039 OBGSQQOXCKHYOR-UHFFFAOYSA-N 257.289 2.370 10 20 CECD COc1cccc(OC)c1C(=O)NCc1ccccc1O 133750017 RICWSEDQOWZVIX-UHFFFAOYSA-N 287.315 2.339 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCCC[C@@H]2CO)c1O 133823682 FOGWDSRFKUGJMM-CQSZACIVSA-N 295.354 2.471 10 20 CECD Cc1cc(O)c(CN(CCO)CC(F)F)cc1C 193028034 NAANANXBXGXYKD-UHFFFAOYSA-N 259.296 2.068 10 20 CECD COc1cc(Cl)cc(CN2CCCOCC2)c1O 228630516 FBTCDCNSPHZLOH-UHFFFAOYSA-N 271.744 2.277 10 20 CECD C[C@@H]1CC[C@@H](CCC(=O)NCc2ccccc2O)O1 266641178 YIIOQHRUXGCTLH-YPMHNXCESA-N 263.337 2.356 10 20 CECD CC1(C)[C@H]2OCCC[C@H]2[C@H]1NC(=O)Cc1ccc(N)cc1 369761841 WCQDGKPFYFDYPK-IMJJTQAJSA-N 288.391 2.131 10 20 CECD C[C@@H]1C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CCO1 271206692 KKMDBDRXSILWOZ-OCCSQVGLSA-N 291.395 2.119 10 20 CECD CNc1ccc(C(=O)NCc2ccc(N(C)C)cc2)cn1 278498573 ACCZJQAUKZNSNT-UHFFFAOYSA-N 284.363 2.119 10 20 CECD C[C@H](CO)CCCNCc1ccc(N(C)C)c(F)c1 270311546 VBQMWUXWHOQILL-LBPRGKRZSA-N 268.376 2.390 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccncn1 275257723 IARSIIVVNHUIHJ-UHFFFAOYSA-N 284.363 2.205 10 20 CECD COC[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@@H](C)O1 275876568 ATGVBTCDJBRBAD-MNOVXSKESA-N 285.771 2.281 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c1O 280370261 DJSZNYLNNUBOJE-GRDNDAEWSA-N 291.391 2.469 10 20 CECD CN(C)c1ccc(CN2CCCc3n[nH]cc32)cc1 283726131 BTFPPULYXACESA-UHFFFAOYSA-N 256.353 2.429 10 20 CECD CC1(C)OCC(NCc2cc(Cl)c(F)cc2O)CO1 816569497 NONGNKIQPWDUPP-UHFFFAOYSA-N 289.734 2.426 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1ccccc1O 814300705 LTVIWXUPCGYMJJ-GFCCVEGCSA-N 264.369 2.034 10 20 CECD CN(C)c1ccc([C@H](N)CN[C@@H]2CCCCC[C@H]2N)cc1 817942120 MLTFTXUKFXQRFW-BRWVUGGUSA-N 290.455 2.002 10 20 CECD Cc1cc(Br)cc(CN[C@@H]2CC[C@H]2O)c1O 822504037 OTPBIILLXANORT-GHMZBOCLSA-N 286.169 2.076 10 20 CECD CN(C)c1ccc(CNC(=O)[C@]2(C)CCCCO2)cc1F 837377128 IAFOLGZSJPHLKD-INIZCTEOSA-N 294.370 2.467 10 20 CECD O=Cc1c[nH]nc1/C=C/c1ccc(N2CCC(O)CC2)cc1 905071614 HAOOTUBLRVFJKQ-ZZXKWVIFSA-N 297.358 2.354 10 20 CECD CC[C@@](C)(CNC(=O)NCc1ccc(OC)cc1O)OC 836579475 OEWAGVGHJIGTGJ-HNNXBMFYSA-N 296.367 2.015 10 20 CECD COc1cc(CNC(=O)c2cc(O)cs2)ccc1O 731869610 SVMNWMWYEDJVMW-UHFFFAOYSA-N 279.317 2.098 10 20 CECD O=C(NCc1cc(Cl)ccc1O)O[C@@H]1CCOC1 916705169 VNUKRVCMKCMNGF-SNVBAGLBSA-N 271.700 2.061 10 20 CECD O=C(NCCc1ccccc1[N+](=O)[O-])c1cc(O)cs1 743718305 OIEQFEHRZVGEGF-UHFFFAOYSA-N 292.316 2.334 10 20 CECD CC(C)[C@@H](N[C@H](C)c1ccc(F)cc1O)C(=O)O 62748316 MYFNFACYXWIMPA-PRHODGIISA-N 255.289 2.291 10 20 CECD CC[S@](=O)CCN[C@@H](C)c1ccc(Cl)cc1O 841762983 LFNJDBAZXOAWDZ-XYZCENFISA-N 275.801 2.465 10 20 CECD C[C@@H]1CCNC[C@@H]1NCc1ccc(N2CCCC2)cc1 841059002 IYMWOIFCGALOKD-PBHICJAKSA-N 273.424 2.374 10 20 CECD CN(C)c1ccc(CN(c2ncnn2C)C2CC2)cc1 846755801 RLQXRDOLGVRAGI-UHFFFAOYSA-N 271.368 2.050 10 20 CECD NC[C@@H](NCc1cccc(F)c1O)C1CCCC1 841085745 CGJMLPZXOJZSCH-CYBMUJFWSA-N 252.333 2.138 10 20 CECD CC(C)NC(=O)CSc1ncc(Cl)s1 849998765 STHRYGYGKWETCI-UHFFFAOYSA-N 250.776 2.413 10 20 CECD CCSC1(CNC(=O)NCc2ccccc2O)CC1 852628478 NLPNMUUSAFDYGX-UHFFFAOYSA-N 280.393 2.477 10 20 CECD Cc1nc2n(n1)C[C@H](NCc1ccc3c(c1)CCCO3)CC2 921662370 NRKMRUXMUGJDMI-OAHLLOKOSA-N 298.390 2.016 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC/C=C\Cl 759589816 UEOROGRYTDGZCO-RRPUJVGUSA-N 254.669 2.407 10 20 CECD COc1cccc([C@@H](C)NCc2cccnc2O)c1O 858562717 HNGVRIHQOADROF-SNVBAGLBSA-N 274.320 2.352 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCNC(C)(C)C)c1 934940644 SLKRZHXNVZMTIF-NSHDSACASA-N 294.395 2.356 10 20 CECD COC1(C)CN(Cc2cc(F)c(N(C)C)cc2F)C1 862369010 RKNFUGDGVPRIJM-UHFFFAOYSA-N 270.323 2.252 10 20 CECD C[C@@H]1C[C@@H](C)N(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768449533 ZYNGKLINLGQFKY-RULNRJAQSA-N 263.337 2.048 10 20 CECD COc1cc(CN2CC[C@@H](N3CCCC3)C2)c(O)cc1C 768452034 NJFWCHDQTKQZJG-OAHLLOKOSA-N 290.407 2.379 10 20 CECD C[C@H]1C[C@H](C(=O)NCc2ccc(N(C)C)cc2)CCC1=O 763263301 TTZPUZNFPYAQBC-GXTWGEPZSA-N 288.391 2.374 10 20 CECD COC(=O)c1cc(CN[C@H](C)c2ccccc2O)cn1C 877755835 OIHNQQSAUJVGSN-LLVKDONJSA-N 288.347 2.368 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2c(C)cccc2O)C1 876509530 IIIBZNGZHCYIER-ZDUSSCGKSA-N 277.364 2.476 10 20 CECD COc1cccc(CNC(=O)c2ccncc2C)c1O 771417248 NFQWVNCEXUGHPS-UHFFFAOYSA-N 272.304 2.034 10 20 CECD Cc1ccc(CNCC2(CS(C)(=O)=O)CCC2)c(O)c1 877592647 RGFVUMITCZJMNX-UHFFFAOYSA-N 297.420 2.005 10 20 CECD CC[C@@H]1C[C@@H](C(=O)N(C)c2ccc(N)cc2)CCO1 877076165 MUATVLVLYPCHQU-SMDDNHRTSA-N 262.353 2.437 10 20 CECD CCN(C)c1ccc(CN2CCN(C(C)C)C(=O)C2)cc1 773830206 FDJCUSTVOHIKNH-UHFFFAOYSA-N 289.423 2.195 10 20 CECD COc1ccc(CNC(=O)N[C@H]2C=CCCC2)c(O)c1 1116862856 HCBUWXSXEBNCLB-LBPRGKRZSA-N 276.336 2.309 10 20 CECD Cc1cccc(O)c1CNCC[S@@](=O)C(C)(C)C 877056948 XXANVYOABIYWSM-GOSISDBHSA-N 269.410 2.337 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1(C)C 779530478 SBVXFDGZWZUUJH-VTGPQGOBSA-N 291.347 2.041 10 20 CECD C[C@@H](N[C@H](C)C1(CO)CC1)c1c(O)cccc1F 886636346 LXRLIGCSZQAJBP-NXEZZACHSA-N 253.317 2.343 10 20 CECD COc1cc(C)cc(CN(C)Cc2cnc[nH]2)c1O 895224647 KYJCYNPJJCHYIH-UHFFFAOYSA-N 261.325 2.064 10 20 CECD COc1ccc2c(c1)CCCN2Cc1csnn1 780766484 HYCRSKDAOPWRSZ-UHFFFAOYSA-N 261.350 2.500 10 20 CECD Cc1ccc(O)c(CN2[C@@H](C)[C@H](C)N(C)C(=O)[C@H]2C)c1 895923623 XOCLTXMALAQZRI-RWMBFGLXSA-N 276.380 2.140 10 20 CECD COCCN(C(=O)c1cccc(O)c1O)[C@@H]1CC[C@H](C)C1 791772881 FDSPFGCCHJIJBF-NWDGAFQWSA-N 293.363 2.375 10 20 CECD CC[C@H](Nc1cnn(CCO)c1)c1ccc(C)cc1O 794811541 FUGLBSJGACYCLV-AWEZNQCLSA-N 275.352 2.453 10 20 CECD C[C@H](NCc1ccnn1C)c1ccc(N(C)C)cc1 71333442 VAXCAKJUCKYTQD-LBPRGKRZSA-N 258.369 2.337 10 20 CECD C[C@]1(CNCc2cc(F)cc(F)c2O)CCOC1 708481348 QTHKDJGXESWJFI-CYBMUJFWSA-N 257.280 2.187 10 20 CECD COc1ccc(CN=c2c(C)c[nH]cc2[N+](=O)[O-])c(O)c1 1323175865 WLGPASNHFQGTBB-UHFFFAOYSA-N 289.291 2.046 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](O)[C@H](C)C2)c1O 249149268 VTBQXRCTSKGYLT-YMTOWFKASA-N 297.782 2.451 10 20 CECD CSC[C@@H]1CCCN1C(=O)NCc1ccc(N)cc1 1262603914 ZBQOJKCCRFKLBN-ZDUSSCGKSA-N 279.409 2.306 10 20 CECD CCCCN(Cc1ccccc1O)C[C@@H]1CN(C)C(=O)O1 1347647764 PGJYDNZRKNIHDY-AWEZNQCLSA-N 292.379 2.445 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@H](CCC(=O)O)C2)cc1 1601216459 BXIMYPVRFHKXIE-LLVKDONJSA-N 291.351 2.378 10 20 CECD CC1(C(=O)O)CN(Cc2cc(Cl)cc(F)c2O)C1 1593808638 VAVSUKMWLXHITI-UHFFFAOYSA-N 273.691 2.091 10 20 CECD C[C@H](N[C@@H](C)[C@H]1CCCNC1)c1cc(C(=O)O)ccc1O 1593196368 HMFRZCSYTSPGQV-GVXVVHGQSA-N 292.379 2.129 10 20 CECD COc1ccc(CNCc2cccc(OC)c2O)cn1 20186195 JGWVPTVMPOOGCF-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CC[C@H](C)OCC(=O)N[C@@H](C)c1cc(OC)ccc1O 162187598 LNXQCRKFKBGGHF-QWRGUYRKSA-N 281.352 2.393 10 20 CECD Cc1cccc(CNc2cccc(-c3nnn[nH]3)c2)c1O 158018494 AMASPNIJQOAIEV-UHFFFAOYSA-N 281.319 2.493 10 20 CECD O=C(NCc1cccc(F)c1)c1cccc(O)c1O 126240828 KZFHIFCMTCUVHL-UHFFFAOYSA-N 261.252 2.167 10 20 CECD C[C@@H](NC[C@]1(O)CCSC1)c1ccc(N(C)C)cc1 158174959 NCFRNPSSJVVGBQ-IUODEOHRSA-N 280.437 2.271 10 20 CECD O=S(=O)(NCc1ccccc1O)c1ccc(F)c(F)c1 158578983 PYSQUNYHIRQQRW-UHFFFAOYSA-N 299.298 2.149 10 20 CECD Oc1ccccc1CNCc1cccc2c1OCO2 40666974 RNQVNBLQZHPUIK-UHFFFAOYSA-N 257.289 2.411 10 20 CECD COc1cc(Cl)cc(CNC(C)(C)CN(C)C)c1O 308612751 HKFXDFYATLBSSR-UHFFFAOYSA-N 286.803 2.484 10 20 CECD C[S@@](=O)C1(CNCc2cc(Cl)ccc2O)CCC1 393695156 BAEYSIBTJQXXIX-GOSISDBHSA-N 287.812 2.436 10 20 CECD C[C@H](CC(=O)NCc1ccc(N(C)C)cc1)n1cccn1 20991103 LCABGBAYWCLLCK-CYBMUJFWSA-N 286.379 2.217 10 20 CECD C[C@@H](NCCSCCCO)c1ccc(F)cc1O 185378695 PQZHFNQFIWNRHC-SNVBAGLBSA-N 273.373 2.298 10 20 CECD CC[C@@H](C)[C@@](C)(O)CNCc1cc([N+](=O)[O-])ccc1O 304067301 UJMLVCGSWBHBAF-YGRLFVJLSA-N 282.340 2.187 10 20 CECD COc1ccsc1S(=O)(=O)Nc1ccc(O)cc1 182403930 ICKHZUGYGOBLLL-UHFFFAOYSA-N 285.346 2.263 10 20 CECD COc1ccc(O)c(CNC(=O)c2cnn(C(C)C)c2)c1 188450196 CTMMKDSCRZWGJQ-UHFFFAOYSA-N 289.335 2.108 10 20 CECD CC(C)[C@@H](O)CN[C@H](C)c1ccc(F)c(F)c1O 187722844 NFCOUHCNHADLGC-KCJUWKMLSA-N 259.296 2.338 10 20 CECD COC(=O)[C@@H](CC(C)C)NCc1ccccc1O 36980435 FHNMRIPJJUJRBT-GFCCVEGCSA-N 251.326 2.070 10 20 CECD COc1ccc(O)c([C@H](C)NCC(=O)N[C@@H](C)C(C)C)c1 182406097 MTXOGXRCCGHPTO-RYUDHWBXSA-N 294.395 2.212 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(F)c(F)c1O 187792196 HWIKALZSQHLJEG-IUCAKERBSA-N 296.317 2.084 10 20 CECD C[C@H]1C[C@H](NCc2cc(F)ccc2O)CCN1C 226612787 WRGSLHMGTXPBLZ-GXFFZTMASA-N 252.333 2.104 10 20 CECD COc1ccc(CN[C@@H]2C[C@H]3CC[C@H]2NC3)cc1C 530242890 DXDJUQRMHLJEJV-RBSFLKMASA-N 260.381 2.234 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H](CCO)COC)cc1 268995712 IHPWXTVHGRSLDK-ZFWWWQNUSA-N 280.412 2.191 10 20 CECD CC(C)(C)c1cc(C(=O)NCc2ccc(O)c(O)c2)no1 272396388 YHZFRYBHHAJCGN-UHFFFAOYSA-N 290.319 2.313 10 20 CECD CC1(C)NC(=O)N(c2cc(Cl)c(N)c(Cl)c2)C1=O 277906224 DDHPDMNXHFPOGS-UHFFFAOYSA-N 288.134 2.410 10 20 CECD CCN(C[C@H](O)CSC)c1ccc(OC)c(OC)c1 275478070 WVJQIHGGPHJWEX-LBPRGKRZSA-N 285.409 2.254 10 20 CECD COc1ccc(N(C)Cc2cnc(N(C)C)nc2)cc1F 272484919 CRUVBTJEBMBIGD-UHFFFAOYSA-N 290.342 2.327 10 20 CECD CCc1nn(C)c(Sc2nccs2)c1[N+](=O)[O-] 288114590 LANFXMWFSWGSEX-UHFFFAOYSA-N 270.339 2.498 10 20 CECD Cc1ccc(C(=O)NCCc2scnc2C)c(O)c1O 297010932 SFYMADDMMWZLDL-UHFFFAOYSA-N 292.360 2.144 10 20 CECD CCOCc1cc(CN[C@H]2CC[C@@H](CO)C2)ccc1OC 295132810 YJEUNRHDTYXNGY-ZBFHGGJFSA-N 293.407 2.482 10 20 CECD C[C@@H](CCO)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 297390319 RUBHULKMKKXUFX-GHMZBOCLSA-N 282.340 2.360 10 20 CECD CCOc1ccc(CN(C)C[C@H](O)C(F)(F)F)c(O)c1 809751945 YVXBTWAHVIIEME-LBPRGKRZSA-N 293.285 2.146 10 20 CECD CCN(C)C(=O)CN[C@@H](C)c1cc(Cl)cc(C)c1O 808714019 LMJDUDYRHSLLJD-JTQLQIEISA-N 284.787 2.483 10 20 CECD C[C@H](NCCC[C@@H]1CCCN1)c1cc([N+](=O)[O-])ccc1O 817981853 VVYIAMJOJYMVKB-NWDGAFQWSA-N 293.367 2.483 10 20 CECD CN(C)CCc1ccc(C(=O)NCc2ccccc2O)cc1 816912300 RPZNVDASXADTCJ-UHFFFAOYSA-N 298.386 2.426 10 20 CECD C[C@H](N[C@@H]1CC[C@@H](CN)C1)c1cc(F)ccc1O 817982235 PRJCKKCOFDHBSZ-HOSYDEDBSA-N 252.333 2.309 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](n3ccnn3)C2)cc1 822498155 VHOTZPUKIGESJI-MRXNPFEDSA-N 285.395 2.181 10 20 CECD C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cnn(C)c1)c1ccccc1O 827952295 MUMCGUZCWPEFAN-DDTOSNHZSA-N 285.347 2.107 10 20 CECD CC[C@H](NC[C@@H]1CCCN1CCCO)c1ccccc1O 824564303 IKGCEUZATPBFRM-HOCLYGCPSA-N 292.423 2.280 10 20 CECD O=C(c1cc(O)cs1)N1CCOC[C@@H]1c1ccco1 735125982 QEVBNPKMIGFMMO-SNVBAGLBSA-N 279.317 2.260 10 20 CECD Cc1ccc(C(=O)N2CCC(C(C)(C)O)CC2)c(O)c1O 827781797 IFKVTAMIXQWUKD-UHFFFAOYSA-N 293.363 2.029 10 20 CECD CCOC(=O)C1CCC(NC(=O)c2cc(O)cs2)CC1 732275275 HUVYSYFLSWYXCI-UHFFFAOYSA-N 297.376 2.305 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H](C(=O)O)C1 901708813 BGDZKQPAUUINGW-JOCQHMNTSA-N 262.353 2.014 10 20 CECD Cc1ccc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)o1 832284616 KWFPGZPYEBKHFV-CQSZACIVSA-N 287.363 2.084 10 20 CECD O=C(NCCCCNc1ccccn1)c1cc(O)cs1 732287313 APBUPUCRGLQICN-UHFFFAOYSA-N 291.376 2.471 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnc(C2CC2)nc1O 901055570 PCPWUOBSZFLEKW-UHFFFAOYSA-N 299.330 2.037 10 20 CECD CC(C)[C@]1(C)C[C@H]1NC(=O)c1c(F)ccc(O)c1O 839800221 VGFNRMBRPPSKRL-YGRLFVJLSA-N 267.300 2.401 10 20 CECD O=C(C[C@@H]1C=CCCC1)NCc1ccc(O)cc1O 910947456 FJFKNFDAXSCLPF-LLVKDONJSA-N 261.321 2.460 10 20 CECD CN1CCCc2cc(CNC(=O)O[C@H]3CCOC3)ccc21 914014806 MRCQLRCEBXILPS-AWEZNQCLSA-N 290.363 2.084 10 20 CECD CCCS(=O)(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 841569009 IOGHAMDNYBZGSK-CYBMUJFWSA-N 298.452 2.321 10 20 CECD CC1(NCc2cc(Cl)cc([N+](=O)[O-])c2O)CCNCC1 841065073 MIIRHUHGQGOAFE-UHFFFAOYSA-N 299.758 2.186 10 20 CECD Cc1cncc(CN(C)c2ccc(OCC(=O)O)cc2)c1 846279912 PSUBOOABTHBMMD-UHFFFAOYSA-N 286.331 2.490 10 20 CECD Nc1ccc(Cc2noc(C[C@H]3CCCCO3)n2)cc1 843158987 JXFROCAHSYJLLE-CYBMUJFWSA-N 273.336 2.354 10 20 CECD Cc1ccc(O)c(CN(C)C(C)(C)CN2CCOCC2)c1 840976420 FEZLKKJCXPJKNL-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CCN[C@H](C)CNCc1cccc(Br)c1O 841066828 WUFZBYKOMXOLLI-SECBINFHSA-N 287.201 2.242 10 20 CECD C[C@@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)CO1 842674397 ZYNOVGDNSLDXIS-PWSUYJOCSA-N 252.333 2.159 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCS[C@@H]2C)c1O 843434779 NWBNYLYYDWKEFW-PSASIEDQSA-N 298.364 2.293 10 20 CECD COc1cccc(O)c1CNCCC[C@H]1CCCN1 841071811 BWXYCQQSAUUWGZ-LBPRGKRZSA-N 264.369 2.023 10 20 CECD C[C@@H](NCCCSc1nccs1)c1cnn(C)n1 925104190 WHIJQSQMVYGLPB-SECBINFHSA-N 283.426 2.105 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC2(OC)CCC2)c1 757635916 BSBOCOUHICPPPI-LLVKDONJSA-N 293.363 2.399 10 20 CECD CN(C)c1ccc(CN[C@H]2Cc3ccccc3NC2=O)cc1 858281578 UXQVNIFIIYBBAN-KRWDZBQOSA-N 295.386 2.406 10 20 CECD Oc1c(CNC[C@H]2C[C@@H](O)C2)ccc2ccccc12 862528027 LJKAEFAPFVAXQG-VDISTLRHSA-N 257.333 2.406 10 20 CECD COc1ccc(N(C)CC23CC(CN2)C3)cc1F 873209061 IBCZTWGSVTWMRP-UHFFFAOYSA-N 250.317 2.023 10 20 CECD CCn1nccc1C(=O)NCc1ccc2c(c1)CCCN2C 772948953 VUHBCKCUHIPOCR-UHFFFAOYSA-N 298.390 2.215 10 20 CECD CC[C@](C)(N)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881377169 HHPXJZQVZFRMIT-INIZCTEOSA-N 287.411 2.285 10 20 CECD COc1ccc(O)c(CN2CC[C@H](C)C[C@H]2[C@H](C)O)c1 785987207 GJJRDIGHVQWXPO-HUBLWGQQSA-N 279.380 2.382 10 20 CECD COc1ccc(CN[C@@H]2CS[C@@H](C)C2)c(O)c1OC 894903147 KGTIZNKTMYGYIF-ONGXEEELSA-N 283.393 2.393 10 20 CECD CCOC(=O)CN(CC)Cc1cc(F)cc(F)c1O 893969975 VVRSNFIOCYCUIZ-UHFFFAOYSA-N 273.279 2.055 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)C1CC1 35136420 PAZKINUCWWKWSG-ZDUSSCGKSA-N 260.381 2.411 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)S1=O 792192678 OQXRWTFDIAZCOV-VXGBXAGGSA-N 298.427 2.233 10 20 CECD CCOc1cccc(CN(C)CCN2CCCC2)c1O 133914838 ZOATXPMTQDUHMF-UHFFFAOYSA-N 278.396 2.319 10 20 CECD Oc1ccc(CCNc2ncncc2Cl)cc1O 302527456 DJNZGJJELOBIIV-UHFFFAOYSA-N 265.700 2.196 10 20 CECD CCOc1ccc(N2CCN(CCC(C)(C)O)CC2)cc1 1327208761 OTCGHEJCOHCOLU-UHFFFAOYSA-N 292.423 2.368 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2cnc(C)s2)c1 1328702911 LCIWKQVTSLPKNK-UHFFFAOYSA-N 291.376 2.465 10 20 CECD C[C@H]1c2nncn2CCN1Cc1ccc(N2CCCC2)cc1 1326278811 CAYQYOMARFZGTD-AWEZNQCLSA-N 297.406 2.455 10 20 CECD NC1CCN(Cc2ccc(N3CCCC3)cc2)CC1 1349313400 FMQKDHBFCUQFMN-UHFFFAOYSA-N 259.397 2.210 10 20 CECD CN(C)c1cc(F)c(CN2CC[C@@H]3CC[C@]32CN)cc1F 1578423085 PGYHIPSEOCTYHU-LRDDRELGSA-N 295.377 2.344 10 20 CECD CN(C)c1ccc(CNC[C@H]2CCCNCC2)cc1F 1578425666 LRSKCGMMBLLUFQ-ZDUSSCGKSA-N 279.403 2.371 10 20 CECD COc1cc(Cl)cc(CNC(C)(C)C(=O)O)c1O 1599420532 KKKZBBABVQAIMF-UHFFFAOYSA-N 273.716 2.007 10 20 CECD C[C@H](NC[C@@H]1CCC[C@H](O)C1)c1cc(C(=O)O)ccc1O 1593252116 NZPLQNGLOVSVJT-LOWVWBTDSA-N 293.363 2.292 10 20 CECD COc1ccc(N(C)C[C@@H]2CCCNC2)cc1F 259124589 WCJLIGVRHJJPLS-LLVKDONJSA-N 252.333 2.270 10 20 CECD Cc1nnc(CCN[C@H]2CCc3cccc(O)c32)s1 297470143 YMYZLFXNSRLVMI-NSHDSACASA-N 275.377 2.372 10 20 CECD C[C@H]1COCCN(Cc2cc(F)cc(F)c2O)C1 708421370 FIFLBSAYUWJAHF-SECBINFHSA-N 257.280 2.139 10 20 CECD Oc1cc2c(cc1CN[C@@H]1CCC(F)(F)C1)OCO2 389425002 OMOMHLWFXNBQPK-SECBINFHSA-N 271.263 2.398 10 20 CECD CC(C)NC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 25992603 UQPHNZIHAJAZII-UHFFFAOYSA-N 291.395 2.073 10 20 CECD CCN(CC)c1ccc(CN(CC(N)=O)C(C)C)cc1F 179657981 BYTZIXDQLLBNEV-UHFFFAOYSA-N 295.402 2.368 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(N(C)C)CCC1 119941332 MOPFMWSFRZMFRL-UHFFFAOYSA-N 289.423 2.162 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2O)C[C@H]1N 300049901 VFWXGNAVIWRUAS-RDDDGLTNSA-N 275.179 2.478 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1 183419068 DWNVCJFMRLQUFD-LLVKDONJSA-N 271.316 2.459 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)C[S@](C)=O)c(O)c1 186540846 ZTOHUEWDQBRXIX-RLFDGXBXSA-N 255.383 2.118 10 20 CECD COC(=O)C(C)(C)C(=O)CSc1nccs1 285059032 GXIJLJYNVXOXRZ-UHFFFAOYSA-N 259.352 2.004 10 20 CECD CCOc1ccc(O)c(CNC(CC)(CC)CO)c1 265267601 SKYINHCXPXITOF-UHFFFAOYSA-N 267.369 2.432 10 20 CECD Oc1ccccc1CN1CC[C@@H](Oc2ccncc2)C1 369393369 WZOZKHBEYGLIJM-OAHLLOKOSA-N 270.332 2.441 10 20 CECD Cc1ccc([C@H](C)NC[C@H](O)CN2CCCC2)c(O)c1C 273418186 RLJHUVCDEZGGNN-GJZGRUSLSA-N 292.423 2.116 10 20 CECD C[C@H](N[C@@H]1CCO[C@@]2(CCOC2)C1)c1ccccc1O 368602878 LIRYWQHBBSHGFY-ZENOOKHLSA-N 277.364 2.381 10 20 CECD CC(C)N1C[C@@H](N[C@@H](C)c2ccccc2O)CC1=O 272910657 WNMXMAYFZNAJBN-RYUDHWBXSA-N 262.353 2.052 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCC2(CO)COC2)c1O 808708027 FMLPNCVIAODTHN-SNVBAGLBSA-N 285.771 2.014 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)C(F)(F)F)c(O)c1O 291870520 WPQYBSGXCINGHZ-LURJTMIESA-N 263.215 2.087 10 20 CECD Cc1ccc(O)c(CNc2cccc(C(=O)NC(N)=O)c2)c1 801736053 STAUPORBYDVMQD-UHFFFAOYSA-N 299.330 2.121 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cccc[n+]1[O-] 299680975 SQFMVHNHUDJNGQ-UHFFFAOYSA-N 286.331 2.078 10 20 CECD COC[C@@H](C)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 818116073 GGDODXCIWWKDJX-KGLIPLIRSA-N 278.396 2.146 10 20 CECD Cn1cc2c(n1)CCC[C@@H]2NCCc1ccc(N)cc1 817957095 IWRGFUBBWRKTPB-HNNXBMFYSA-N 270.380 2.212 10 20 CECD CON1CCC(NCc2ccc(N(C)C)c(F)c2)CC1 817419814 YKOUMIMDWXAELY-UHFFFAOYSA-N 281.375 2.007 10 20 CECD Cc1cc(C)c([C@H](C)N[C@H](C)C[S@](C)=O)c(O)c1 815615273 MNVZUYNCYRQNMK-SOZUMNATSA-N 269.410 2.427 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2c(O)cccc2Cl)C1 827501104 QOJMJVVESJHVGW-DTORHVGOSA-N 269.728 2.087 10 20 CECD COc1ccc(N(C)C(=O)c2cccc3c2CCNC3)cn1 662897863 PVVPQDIWVLBHKD-UHFFFAOYSA-N 297.358 2.013 10 20 CECD Cc1cc(CN2CCC[C@]23CCNC3)ccc1N(C)C 903872293 YPKIESHXSJMPGX-QGZVFWFLSA-N 273.424 2.389 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C\c2ccc(O)cc2)c1 588468889 SAWBURXDTPNXSP-WTKPLQERSA-N 299.326 2.436 10 20 CECD CCNC(=O)C(C)(C)NCc1c(O)ccc(Cl)c1F 835076373 OVUAPZZJHUGGHE-UHFFFAOYSA-N 288.750 2.189 10 20 CECD COc1ncc(C)cc1NC(=O)c1cc(O)cs1 746693007 ATYBXVBYIGCIJR-UHFFFAOYSA-N 264.306 2.418 10 20 CECD C[C@@H]1CC[C@@H](CNC(=O)NCc2cc(Cl)ccc2O)O1 845253657 YALJDODCKLHCFI-SKDRFNHKSA-N 298.770 2.412 10 20 CECD COc1cccc([C@H](C)N[C@@H]2C[C@@H](O)C2(C)C)c1O 846165578 VVKAFHAGAADCTI-ZWKOPEQDSA-N 265.353 2.211 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)NCc1ccc(N(C)C)cc1C 840936270 HYNJZFZFWNNGGL-KGLIPLIRSA-N 291.439 2.454 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@@H]2[C@H]2CCCOC2)cc1 843502225 BFKMAIDORBNZGN-GOEBONIOSA-N 288.391 2.229 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1ccc(N(C)C)c(F)c1 840832674 DKSIEUUNLVJGCP-ZDUSSCGKSA-N 279.359 2.121 10 20 CECD C[C@H](NCC1(N(C)C)CC1)c1cc(F)cc(F)c1O 841763624 OEWWSPCVIXMXTN-VIFPVBQESA-N 270.323 2.415 10 20 CECD C[C@@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(Cl)cc1O 841755579 JIVVNNRNHFUSLF-YMTOWFKASA-N 282.771 2.365 10 20 CECD C[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)[C@@H]1CN 843051085 DZLMRASTASBHQQ-BLLLJJGKSA-N 279.403 2.451 10 20 CECD Cc1cc(O)c(CNC(C)(C)CN2CCOCC2)cc1C 840961337 ALYFXLMBROSFRS-UHFFFAOYSA-N 292.423 2.209 10 20 CECD CN(C)c1ccnc(CNCc2ccccc2O)c1 922478350 MEQDVSZPCJJXGL-UHFFFAOYSA-N 257.337 2.143 10 20 CECD CCn1cnnc1NCc1cccc(Br)c1O 922660658 RWJVTYNRKSZLTD-UHFFFAOYSA-N 297.156 2.378 10 20 CECD CNC[C@H](C)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 854231982 MOPWINSRVOOAAO-ATZCPNFKSA-N 252.333 2.277 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1cc(F)cc(F)c1O 756595144 UFDDTDFUNUJNAQ-RGNHYFCHSA-N 291.363 2.433 10 20 CECD CC(=O)[C@@H]1CCCCN1C(=O)/C=C\c1ccc(O)c(O)c1 854731508 BGPQFECNNSATON-WOLRVDTOSA-N 289.331 2.081 10 20 CECD CCc1cnc(COC(=O)/C=C\c2ccc(O)c(O)c2)o1 759580824 RETPHQBAYKFIRD-XQRVVYSFSA-N 289.287 2.405 10 20 CECD Cc1ccc(O)c(CNC(=O)NCC2CC=CC2)c1 858721867 QRYLAZIGVFNNFI-UHFFFAOYSA-N 260.337 2.466 10 20 CECD CON(C)CCN[C@@H](C)c1cc2c(cc1O)CCCC2 850478977 ISJQUKIDLBHOBA-LBPRGKRZSA-N 278.396 2.415 10 20 CECD Cn1nc(C2CC2)cc1CNC(=O)Nc1ccc(N)cc1 926142670 KZXAKSQXSCHIQC-UHFFFAOYSA-N 285.351 2.201 10 20 CECD C[C@@H](NC[C@]1(C)CCOC1)c1cc([N+](=O)[O-])ccc1O 756576001 SJVIFNCGDIPUCI-YGRLFVJLSA-N 280.324 2.378 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@@]2(C)CO)cc1F 862336956 OJANVTORQJAOEC-HNNXBMFYSA-N 284.350 2.378 10 20 CECD COc1cccc(O)c1CN(C)CCOCC1CC1 769523307 FTISYANDEBFTDZ-UHFFFAOYSA-N 265.353 2.259 10 20 CECD CSC(C)(C)C(=O)NCc1cc(C)ccc1O 862753037 AQQJMDJUTGHWMT-UHFFFAOYSA-N 253.367 2.458 10 20 CECD CCCOc1ccc(CNCC[C@H](O)COC)cc1C 873099500 KZRRNHKPGFYOLI-HNNXBMFYSA-N 281.396 2.271 10 20 CECD O=C(NCc1ccccc1O)c1ccc(OC(F)F)cn1 773396904 JSCHNKMLPZRVCY-UHFFFAOYSA-N 294.257 2.319 10 20 CECD Cc1cccc(O)c1CN(C)CC(=O)OC(C)(C)C 876659087 MZCVGEYYJNRRDN-UHFFFAOYSA-N 265.353 2.474 10 20 CECD C[C@@H](CNCc1ccc(N2CCCC2)cc1)C(=O)O 1118393209 BSJYQPDYHKFVAE-LBPRGKRZSA-N 262.353 2.097 10 20 CECD C[C@H](NC(=O)N[C@@]1(C)CCOC1)c1ccc(N(C)C)cc1 776237911 KCCZFGMMZLWGDF-LRDDRELGSA-N 291.395 2.292 10 20 CECD Oc1ccccc1CN1CCCC[C@@H]1C1OCCO1 770509517 BYTOOMNYNNCWNA-CYBMUJFWSA-N 263.337 2.120 10 20 CECD CCN(CC)Cc1ccc(N2CCN(C)CC2)cc1 775637315 PLWJFMGIYINPKM-UHFFFAOYSA-N 261.413 2.280 10 20 CECD CC1(C)CCC[C@@]1(O)CNC(=O)NCc1ccc(N)cc1 1120676727 ARPILJYTTVSEDM-MRXNPFEDSA-N 291.395 2.009 10 20 CECD Cc1cc(C[C@H](C)NCc2cc(F)cc(F)c2O)n[nH]1 883049581 QDTFIRHLWNRMLV-QMMMGPOBSA-N 281.306 2.423 10 20 CECD Cc1ccc(CNCC2([S@](C)=O)CCC2)c(O)c1 877496844 ZWZMOJOOTRZJSR-SFHVURJKSA-N 267.394 2.091 10 20 CECD CCN1CCN(Cc2cc(Cl)cc(F)c2O)CC1 775638246 FFGUSTIWGLOXNJ-UHFFFAOYSA-N 272.751 2.322 10 20 CECD CC[C@@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N(C)C 775409311 DTXJWVIOCZPCNS-DOMZBBRYSA-N 277.412 2.270 10 20 CECD C[C@H](CC(N)=O)N[C@H](C)c1cccc(C(F)(F)F)c1O 788633874 WOJPMVKAWIVTCW-HTQZYQBOSA-N 290.285 2.326 10 20 CECD CC(C)[C@@H](F)C(=O)NCc1ccc(N(C)C)cc1 784030319 OHQFNFNZZSWTOD-CYBMUJFWSA-N 252.333 2.363 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CO[C@@H](C)C2)c1 784441401 FUXJKQBZSWNRJR-GARJFASQSA-N 279.336 2.003 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C(=O)O)C(C)C)c(O)c1 43430216 VTLLKWQECHJWGC-ZWNOBZJWSA-N 251.326 2.460 10 20 CECD CON(C)CCNCc1cc(Cl)cc(Cl)c1O 883172561 LMCVRZKQWSUKOU-UHFFFAOYSA-N 279.167 2.282 10 20 CECD COc1ccc(N2CCN(Cc3ccon3)CC2)cc1 77247135 XQXGAWCVMNXPSC-UHFFFAOYSA-N 273.336 2.005 10 20 CECD Cc1cccc2c1C(=O)N[C@H](c1cc(O)ccc1O)N2 1317889691 OGVVLSUMQYUJNU-CQSZACIVSA-N 270.288 2.260 10 20 CECD CN(Cc1ccccc1O)c1nnc(Cc2ccoc2)n1C 1339208111 JINXORNXAKVAQX-UHFFFAOYSA-N 298.346 2.341 10 20 CECD CCC[C@]1(NC(=O)NCc2ccc(N)cc2)CCOC1 1335737710 SMKVWTYNEREDCU-HNNXBMFYSA-N 277.368 2.027 10 20 CECD C[C@@H](NCC1=CCN(C)CC1)c1cc(C(=O)O)ccc1O 1609781516 XYZCZIDZWSTXCH-LLVKDONJSA-N 290.363 2.003 10 20 CECD COc1cc(C)nc(Sc2ncc(C(=O)O)s2)n1 1607150496 GBLICQMKNMSNQD-UHFFFAOYSA-N 283.334 2.100 10 20 CECD C[C@H](N[C@H]1CC=C(C(=O)O)C1)c1cc(F)ccc1O 1604330563 RBJBWWTWLZXBIH-KWQFWETISA-N 265.284 2.355 10 20 CECD CCC[C@@](C)(NCc1cccc(F)c1O)C(=O)O 1595560263 VEMOOYRTZREYRV-CYBMUJFWSA-N 255.289 2.264 10 20 CECD CS[C@@H]1C[C@@H](C(=O)O)N(Cc2ccc(N(C)C)cc2)C1 1777402271 CSCUGBFHODAVSJ-KGLIPLIRSA-N 294.420 2.143 10 20 CECD CSc1cc(C(=O)NCc2ccc(O)c(O)c2)ccn1 158948246 PKVBUQQBYLZGKH-UHFFFAOYSA-N 290.344 2.145 10 20 CECD NCc1ccc(CNCc2ccc3c(c2)CCO3)cc1 258899039 DFOJFFNKSYQKQD-UHFFFAOYSA-N 268.360 2.370 10 20 CECD C[C@H](NC[C@@](C)(O)C(F)(F)F)c1ccccc1O 272861329 MXZVZROCIBONSB-GZMMTYOYSA-N 263.259 2.356 10 20 CECD CC(C)NC(=O)N1CCOc2cc(N(C)C)ccc21 176657861 PVLOQQFLYKTXDF-UHFFFAOYSA-N 263.341 2.069 10 20 CECD CCN(C)c1ccc([C@H](C)NCCCNC(C)=O)cc1 121339598 NUAPAUUNHYSZIB-ZDUSSCGKSA-N 277.412 2.320 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2ccc(N(C)C)cc2)CC1 37317963 AQECYWBDUUVLBC-CYBMUJFWSA-N 289.423 2.414 10 20 CECD C[C@H]1C[C@H](NCc2ccc(N3CCOCC3)cc2)CCO1 219887720 QVRPSKLSRLVJNF-GOEBONIOSA-N 290.407 2.180 10 20 CECD CSC[C@H]1CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 181222576 ZOZWWTVFOZZOKQ-HOSRBBHYSA-N 293.388 2.465 10 20 CECD COCc1nc(C)cc(NCc2cc(OC)ccc2O)n1 75052227 FECXBYHWUSZWTP-UHFFFAOYSA-N 289.335 2.258 10 20 CECD COc1ccc(N(C)C[C@H](O)COCC(C)C)c(OC)c1 131711240 TWLNVPVAJWSMBM-ZDUSSCGKSA-N 297.395 2.174 10 20 CECD CC[C@H](NCc1ncn(C)n1)c1ccc(N(C)C)cc1 90969744 UQSCOTPBLRGUFD-AWEZNQCLSA-N 273.384 2.122 10 20 CECD CC[C@H](NC[C@@H]1COCCN1)c1cc(Cl)ccc1O 530223918 IXPUBWKDZYKBMV-YPMHNXCESA-N 284.787 2.075 10 20 CECD C[C@H]1C[C@@H](CCNC(=O)NCc2ccccc2O)CCO1 273104697 PGIYJSQOJDJWQB-STQMWFEESA-N 292.379 2.397 10 20 CECD Oc1cc2c(cc1CN1CC[C@H](C3CC3)C1)OCO2 371259746 VBFYPFFOGBAOSH-NSHDSACASA-N 261.321 2.353 10 20 CECD Cc1[nH]c(C=O)cc1C(=O)N(C)Cc1ccc(N(C)C)cc1 283099917 WZCMEEAVTYJZKW-UHFFFAOYSA-N 299.374 2.474 10 20 CECD CC[C@H](NCc1nncn1CC)c1ccc(F)cc1O 285687696 OFXAXUHBDQFBEB-LBPRGKRZSA-N 278.331 2.384 10 20 CECD CC[C@@H](NC[C@@H]1C[C@H](F)CN1)c1ccc(C)cc1O 817975761 BAPUWFBSENIEGH-SGMGOOAPSA-N 266.360 2.441 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCOC[C@@H]2OC)c1 824709460 QIWKLTSJDAZDOW-OZVIIMIRSA-N 295.379 2.103 10 20 CECD Cc1cc(O)c(CN(C)[C@H]2CCN(C)C2=O)cc1Cl 824835987 FTOVCCSBXBALDO-LBPRGKRZSA-N 282.771 2.017 10 20 CECD Cc1ccc(C(=O)NCc2ccc3c(c2)CCCN3C)nn1 839604868 GWCCGBSBGJNFJR-UHFFFAOYSA-N 296.374 2.097 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@]2(C)CCC(=O)N2)cc1 834910078 VLVVSDOIMQDZSG-GUYCJALGSA-N 289.423 2.462 10 20 CECD COc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H]2C(C)C)c1 838473878 CQKJFBLMVQOKGH-FZMZJTMJSA-N 292.379 2.492 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1CCC[C@@H]2C[C@H]12 838060776 KBLOGKDDIAYAFE-WXHSDQCUSA-N 260.337 2.380 10 20 CECD COc1ccc(O)c(CNC(=O)CSC(C)C)c1 734016906 NCVHDUMOLWXYIB-UHFFFAOYSA-N 269.366 2.159 10 20 CECD Cc1noc(C)c1CCNC(=O)c1cc(O)cs1 732290171 RKRSYRVIEKEZKS-UHFFFAOYSA-N 266.322 2.031 10 20 CECD COc1ccc(N(C)C(=O)c2cc(O)cs2)cn1 732277020 AYKPLODOKCYEGC-UHFFFAOYSA-N 264.306 2.134 10 20 CECD CN(Cc1c[nH]c(C(=O)O)c1)c1ccc2c(c1)OCO2 833694796 PWIHAQIBZPAJAC-UHFFFAOYSA-N 274.276 2.078 10 20 CECD COc1cc(C)cc(CN2[C@H]3CC[C@H]2COC3)c1O 840165368 UIUUIXCGDCAJIW-STQMWFEESA-N 263.337 2.072 10 20 CECD Cc1ccnc(CN(C)c2ccc(OCC(=O)O)cc2)c1 846279869 OTTSVEKWGVCURQ-UHFFFAOYSA-N 286.331 2.490 10 20 CECD COC/C(C)=C/C(=O)NCc1ccc(N(C)C)cc1C 844396098 LLTFKQUQFMCWMA-XYOKQWHBSA-N 276.380 2.270 10 20 CECD CN(CCN1CCCCC1)C(=O)c1cc(O)cs1 846661939 HHBIBEHPRNJDJW-UHFFFAOYSA-N 268.382 2.012 10 20 CECD Oc1cccc(Cl)c1CNCC[C@]1(O)CCCOC1 846110816 NZCPDRIXSPPWCA-CQSZACIVSA-N 285.771 2.067 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C1)[C@H](O)CO2 840101539 JZZMOKKXDBTRTO-KWEIWBAHSA-N 299.370 2.072 10 20 CECD F[C@@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 846122189 KFWVQJKQYMOQBV-OAHLLOKOSA-N 278.371 2.457 10 20 CECD COc1ccc(N(C)CCc2nnn(C(C)(C)C)n2)cc1 852209590 PVAWYLHDYXDYIS-UHFFFAOYSA-N 289.383 2.116 10 20 CECD C[S@](=O)[C@H]1CCC[C@@H](NCc2ccccc2O)C1 850355441 IRNGHHUXORTRME-VBHSOAQHSA-N 267.394 2.172 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCN(C)C(=O)OC)cc1 850550938 RWMVCLZQESSIMS-CYBMUJFWSA-N 293.411 2.492 10 20 CECD C[C@H]1NCCC[C@@H]1NCc1ccc2c(c1)CCCN2C 925530903 HPJJBTVRUIKOJV-CJNGLKHVSA-N 273.424 2.299 10 20 CECD CCCCN(C)C[C@@H](C)NC(=O)c1ccc(C)c(O)c1O 753024292 RURKMPSKTNVDIO-GFCCVEGCSA-N 294.395 2.256 10 20 CECD Cc1cc(O)c(CN2CC[C@H](CC(N)=O)C2)cc1Cl 857046013 DYZUNVVJDVSHBE-SNVBAGLBSA-N 282.771 2.051 10 20 CECD CCO[C@@H](CC)C(=O)NCc1cc(C)ccc1O 862759122 WQCSPOMCZVCAOD-ZDUSSCGKSA-N 251.326 2.132 10 20 CECD COC(=O)[C@](C)(NCc1ccc(OC)c(C)c1)C1CC1 930155934 PZUNBJUVEPPWIY-MRXNPFEDSA-N 277.364 2.435 10 20 CECD COc1nc(C)cc(N[C@H](C)Cc2ccc(O)c(O)c2)n1 762800041 IVCWCXFIWUVCCN-SECBINFHSA-N 289.335 2.248 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H]2CCN(C)C2)cc1 765767794 HMUVLMCPKXGCTG-UKRRQHHQSA-N 261.413 2.497 10 20 CECD CC[C@H]1CN(Cc2c(C)cccc2O)C[C@@H](C)S1(=O)=O 877522087 MMCWFQRIZFFTRU-OLZOCXBDSA-N 297.420 2.098 10 20 CECD Cc1cccc(CNC(C)(C)c2cnn(C)c2)c1O 776177669 SIKRFZMRFCQMJQ-UHFFFAOYSA-N 259.353 2.459 10 20 CECD C[C@@H]1CCN(Cc2c(O)cccc2Cl)[C@H](C(N)=O)C1 779200499 HDEMKOMTPINKBZ-SKDRFNHKSA-N 282.771 2.131 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C)[S@@](=O)CC2)cc1 773888646 LEHUWWJCMCMIRO-VLIAUNLRSA-N 294.464 2.486 10 20 CECD COCCCCNCc1ccc(N2CCC(O)CC2)cc1 876935134 QLKWWGOKFYCZIJ-UHFFFAOYSA-N 292.423 2.164 10 20 CECD CCN(C)c1ccc(CN2CC[C@](O)(CC)C2)cc1 773864743 XRTDRLGLVKIJCX-MRXNPFEDSA-N 262.397 2.490 10 20 CECD CN(C(=O)c1conc1C1CC1)c1ccc(N)cc1 877076879 WCMDYKXQAFGXKU-UHFFFAOYSA-N 257.293 2.411 10 20 CECD C[C@@H](NC(=O)[C@H](O)c1cccnc1)c1ccc(N(C)C)cc1 775406924 QIKNJDBYWZVFMC-MLGOLLRUSA-N 299.374 2.058 10 20 CECD Cc1cccc(O)c1CN1C[C@@H](C)S(=O)[C@H](C)C1 877473662 PFZGKWBAMKRDJS-VXGBXAGGSA-N 267.394 2.042 10 20 CECD CC(C)Nc1ccccc1NCC(=O)N1CCO[C@@H](C)C1 871847145 LXAVSWLPKFLINY-ZDUSSCGKSA-N 291.395 2.166 10 20 CECD Cc1cc(N(C)C)ccc1CN=c1nc[nH]n1CC1CC1 1120816896 ROQYIVPFTVTZDW-UHFFFAOYSA-N 285.395 2.097 10 20 CECD CCOC[C@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898450371 QMRPDDLFGSVJRP-YOEHRIQHSA-N 293.455 2.370 10 20 CECD Cc1cccc(O)c1CN[C@@H]1Cc2ccccc2[C@H]1O 898387891 UJZMUNHXIXTNJC-NVXWUHKLSA-N 269.344 2.449 10 20 CECD CCc1cccc(CN2CC[C@H](c3n[nH]c(C)n3)C2)c1O 895012014 JGMZUXBOIQHIRF-AWEZNQCLSA-N 286.379 2.371 10 20 CECD COc1ccc(CNCC[C@@H]2CCCCO2)c(O)c1OC 893479548 SULMMIWAPVYVFT-ZDUSSCGKSA-N 295.379 2.458 10 20 CECD C[C@H]1COC[C@@H]1NCc1cc(Cl)c(F)cc1O 896735309 ZJNQTGPPAOYSEZ-CPCISQLKSA-N 259.708 2.309 10 20 CECD CN(C)c1ccc([C@@H](CNCc2cc[nH]c2)N(C)C)cc1 898450072 MQLCIMKZCJQLMQ-QGZVFWFLSA-N 286.423 2.473 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2COCO2)cc1F 894872516 JYVNGUJJTZRTDO-ZDUSSCGKSA-N 282.359 2.134 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](O)C(C)(C)C2)c1O 790936444 CVKAHIXSIDAKQB-GFCCVEGCSA-N 285.771 2.257 10 20 CECD COc1ccc(CNC(=O)N[C@@H](C)c2ccc[nH]2)c(O)c1 793029187 QASJABRCTSMEDC-JTQLQIEISA-N 289.335 2.289 10 20 CECD COc1ccc(CNC(=O)/C=C\c2ccc[nH]2)c(O)c1 794380791 CURXNNHNRPUGMI-ALCCZGGFSA-N 272.304 2.059 10 20 CECD C[C@@H]1COC[C@@H]1NCc1ccc(N2CCCC2)cc1 710990979 VIYGBVYPZFPTBW-CJNGLKHVSA-N 260.381 2.411 10 20 CECD CCOc1cc(C(=O)N[C@H](C)c2ccccc2O)[nH]n1 1336023343 OLULMNVZSOWWBW-SECBINFHSA-N 275.308 2.005 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2c(O)cccc2OC)C1 769516326 SHVTWIQYFVHMOM-ZDUSSCGKSA-N 278.396 2.174 10 20 CECD Nc1ccc(CNC(=O)c2cccnc2C2CC2)cc1 1515333954 ZZRWRYAKZPFJHH-UHFFFAOYSA-N 267.332 2.471 10 20 CECD C[C@H](CC(=O)O)NCc1cccc(Br)c1O 1609888086 CUCKLFLJMPHXID-SSDOTTSWSA-N 288.141 2.108 10 20 CECD CC1(C)CCC[C@]1(O)CNC(=O)Nc1ccc(N)cc1 841299642 LUDGQAXUYAGGOE-HNNXBMFYSA-N 277.368 2.332 10 20 CECD C[C@@H](CCCC(=O)O)NCc1ccc(N(C)C)cc1 1255787238 XOAIGJWQOYPWOU-LBPRGKRZSA-N 264.369 2.486 10 20 CECD CN1CCCc2cc(CNCc3ccn(C)n3)ccc21 112344674 ZVQFDQQPVZZSTM-UHFFFAOYSA-N 270.380 2.092 10 20 CECD C[C@@H]1CCN(C(=O)c2cccc(O)c2O)CCS1 277697824 DZSIRHYNGCLXEI-SECBINFHSA-N 267.350 2.065 10 20 CECD COc1ccc(O)c(CN2CC[C@H](OC)C[C@@H]2C)c1 282127235 BDVRIPFMPWNPSO-FZMZJTMJSA-N 265.353 2.400 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@@H](C(F)(F)F)C1 311665256 YEKFGXRPVAKUAN-SSDOTTSWSA-N 275.226 2.122 10 20 CECD COc1cc(Cl)cc(CN(C)C2(CN)CCC2)c1O 385500626 QFTZELACIZFSTQ-UHFFFAOYSA-N 284.787 2.367 10 20 CECD COc1ccc(O)c(CNC(=O)NCCC2CC2)c1 174927942 CYQLIVXGASMIKV-UHFFFAOYSA-N 264.325 2.000 10 20 CECD COc1ccc(O)c(CNC(=O)C(C)(Cl)Cl)c1 180736592 FAZFZCLGBOKLIM-UHFFFAOYSA-N 278.135 2.211 10 20 CECD CCCCN(CC(N)=O)Cc1cccc(Cl)c1O 124551794 MACNUKPEDANBOK-UHFFFAOYSA-N 270.760 2.133 10 20 CECD COC[C@H](NC(=O)c1cccc(O)c1O)c1ccc(C)o1 185787371 KHCBQMMHRSLEEH-NSHDSACASA-N 291.303 2.117 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)N[C@@H](C)c1cc(OC)ccc1O 182343904 AUGLUFIVAZOBOG-WOPDTQHZSA-N 294.395 2.355 10 20 CECD CN(CCNC(=O)Cc1ccc(N)cc1)c1ccccc1 40316924 HAQOYWWOSBHGLZ-UHFFFAOYSA-N 283.375 2.064 10 20 CECD CC[C@H](NCc1ccc2c(c1)CCO2)[C@@H](O)C(F)(F)F 270966528 ILMXHBLJAMGBIY-WCQYABFASA-N 289.297 2.413 10 20 CECD CN(C)c1ccc(CN2CC([C@@H]3CCOC3)C2)cc1F 376137276 XCSXOSLEOOPRRH-CYBMUJFWSA-N 278.371 2.360 10 20 CECD CN(C)c1ccc(OCC(=O)NC2CCCC2)cc1 277989932 ZHHPRHNVIXDEDK-UHFFFAOYSA-N 262.353 2.190 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(C)COC2)cc1F 273067164 MNKOFPRIRPRJJW-UHFFFAOYSA-N 294.370 2.325 10 20 CECD Cc1c(/C=C/C(=O)N2CCOCc3ccccc32)cnn1C 279354626 GLGNUBHBJJUMPG-BQYQJAHWSA-N 297.358 2.305 10 20 CECD CC[C@H](N[C@H]1CCCN(CCCO)C1)c1ccccc1O 295193034 XNUKLRZVPXFQSU-HOCLYGCPSA-N 292.423 2.280 10 20 CECD CN(C[C@@H](O)COc1ccc(N2CCCC2)cc1)C1CC1 290851478 XLFGJYHMCCELID-MRXNPFEDSA-N 290.407 2.121 10 20 CECD Cc1cc(O)c(CN[C@H]2CCCN(C)C2=O)cc1Cl 825331726 RHNIBEPUXRZRMJ-LBPRGKRZSA-N 282.771 2.064 10 20 CECD Cc1ccncc1CC(=O)N(C)Cc1ccccc1O 830141371 RPFCNOAPJOFSBO-UHFFFAOYSA-N 270.332 2.297 10 20 CECD CCc1cc(CNC(=O)N(C)Cc2ccccc2O)on1 741423884 ICSPXPGWRPECAU-UHFFFAOYSA-N 289.335 2.284 10 20 CECD C[C@H](CO)N(CC1CCC1)C(=O)Nc1ccc(N)cc1 841294396 BDRRBFQZHYUIDX-LLVKDONJSA-N 277.368 2.284 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 846699934 YHHCDUQXSWTDQQ-KWQFWETISA-N 299.758 2.265 10 20 CECD CC[C@H](SC)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 844163221 VVDSKXPACXIPDT-KBPBESRZSA-N 295.452 2.010 10 20 CECD COc1cccc(CNC(=O)[C@@H](C)c2ccco2)c1O 743333353 OMOAEWFQPUUWTM-JTQLQIEISA-N 275.304 2.414 10 20 CECD CCC[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841067272 MFARNVVSCXFQAU-LBPRGKRZSA-N 289.379 2.246 10 20 CECD CCC(CC)(CCO)NC(=O)Nc1ccc(N)cc1 841300666 ZBRUGEILHYXVBY-UHFFFAOYSA-N 265.357 2.332 10 20 CECD CCOc1ccc(CN[C@H]2CC[C@H](CO)CC2)c(O)c1 759294552 QDPCYPUBABPVKS-MQMHXKEQSA-N 279.380 2.432 10 20 CECD CC(C)(C)OC(=O)[C@@H]1CCCN1C(=O)c1cc(O)cs1 760166206 GQNFMCVILXMCTI-JTQLQIEISA-N 297.376 2.400 10 20 CECD C[C@@H]1C[C@@H](C)N(Cc2cc3c(cc2O)OC[C@H]3O)C1 768449527 ZYNGKLINLGQFKY-GPCCPHFNSA-N 263.337 2.048 10 20 CECD OC[C@@H](CC(F)F)NCc1cc(Cl)cc(F)c1O 763539053 PXDQCZBLJQBHOQ-MRVPVSSYSA-N 283.677 2.290 10 20 CECD CSC[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O 768464003 YTWMQEVAEFLGPZ-BXUZGUMPSA-N 295.404 2.145 10 20 CECD Cc1cccc(O)c1CNCCCN1CCCO[C@@H](C)C1 877477673 HHYWXFZOFWDFGU-HNNXBMFYSA-N 292.423 2.291 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2ccc(C)cc2O)C1 876782185 NBYMTYQQEFERIC-OAHLLOKOSA-N 263.337 2.086 10 20 CECD Cc1ccc(CNC[C@@H](C(C)C)N2CCOCC2)c(O)c1 876908487 MQOSJAYSYNKOFF-INIZCTEOSA-N 292.423 2.147 10 20 CECD C[C@@H](NCC(=O)NCC1CCC1)c1ccc(N(C)C)cc1 775832016 WHZLIWICJBHNMI-CYBMUJFWSA-N 289.423 2.320 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)CO1 784075889 GZHCDSJOWSMMKN-IUODEOHRSA-N 288.391 2.110 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)NCc1cc(C)cc(OC)c1O 894386650 KPXMEFDLQJBLHA-NWDGAFQWSA-N 294.395 2.102 10 20 CECD OC[C@@H](CC(F)(F)F)NCc1ccc2c(c1)CCO2 717742469 CDXZPAGKSRCVLQ-LLVKDONJSA-N 275.270 2.024 10 20 CECD C[C@@H]1CCC[C@@]1(NCc1cc(F)cc(F)c1O)C(=O)O 1776636277 DPXXFUCCQFGTKN-CLAHSXSESA-N 285.290 2.403 10 20 CECD CCN(CC)c1ccc(CNCC[C@H](F)C(=O)O)cc1 1776860977 SVTUDHWXIOIXOC-AWEZNQCLSA-N 282.359 2.435 10 20 CECD CC1(C(=O)O)CC(NCc2cc(F)cc(F)c2O)C1 1776496787 LUOJYDYWPLQRQB-UHFFFAOYSA-N 271.263 2.013 10 20 CECD CCN(CCC(=O)OC)Cc1cc(C)cc(C)c1O 164360449 SJYZKWNQMYAMIB-UHFFFAOYSA-N 265.353 2.394 10 20 CECD CSC(C)(C)CNC(=O)Cc1ccc(N)cc1 157022049 XEKRPNWNBIJWDH-UHFFFAOYSA-N 252.383 2.069 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]2C(C)(C)O)c1 154431200 GWBRCBQEBQLKAU-CQSZACIVSA-N 265.353 2.136 10 20 CECD Cc1ccccc1CNC(=O)Cc1ccc(N)cc1 20185651 NZOAJJBRWXKHQI-UHFFFAOYSA-N 254.333 2.436 10 20 CECD Oc1ccccc1CNC[C@H]1Cc2ccccc2O1 38009306 HQOZIQSMQRMCML-CQSZACIVSA-N 255.317 2.486 10 20 CECD Cc1ccc([C@@H](C)NCC(C)(C)OCCO)c(O)c1 287367624 ONBXVWKGXCJKGE-GFCCVEGCSA-N 267.369 2.139 10 20 CECD COCC[C@](C)(O)CN[C@@H](C)c1ccc(N(C)C)cc1 178371518 JTYFOKPCNGQMAY-BBRMVZONSA-N 280.412 2.191 10 20 CECD CCOc1cccc(CNCC2(CO)CCC2)c1O 184369275 YMBCPNKHUXZXHS-UHFFFAOYSA-N 265.353 2.043 10 20 CECD CC(=O)NCCN(C)Cc1c(O)ccc2ccccc12 308194741 QCBADFOUYREDPH-UHFFFAOYSA-N 272.348 2.113 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCCn1ccnc1 179629616 INVRTCSTDDNSSW-UHFFFAOYSA-N 286.379 2.238 10 20 CECD O=C(NCCCSc1nccs1)c1cc[nH]c1 114375078 ZAGRNZGHSPNWFT-UHFFFAOYSA-N 267.379 2.383 10 20 CECD CS[C@H](C)CNC(=O)NCc1ccc(N(C)C)cc1 119381762 TVWKRUUIULJOPL-LLVKDONJSA-N 281.425 2.303 10 20 CECD COc1ccc(CNCc2cccc(OC)c2O)cc1O 171134431 QVEKYCUTDZIYHV-UHFFFAOYSA-N 289.331 2.405 10 20 CECD C[C@H](CCN1CCN(C)CC1)N[C@H](C)c1ccccc1O 186566999 ANKDEIFTQFDTMM-HUUCEWRRSA-N 291.439 2.069 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CCNCC1 37807393 ZHWQQKXYPDRVAA-UHFFFAOYSA-N 289.423 2.101 10 20 CECD C[C@H](N[C@H](C)c1cc(F)ccc1O)c1nnnn1C1CC1 189122054 IKJIZPZXDPTBFA-BDAKNGLRSA-N 291.330 2.265 10 20 CECD CC[C@@H](SC)C(=O)NCc1cccc(OC)c1O 125111192 CRSMDQSQBIMBHH-LLVKDONJSA-N 269.366 2.159 10 20 CECD O=C(COCC1CC1)NCc1c(O)ccc2c1CCCC2 75159756 LTCYWWUOMXAXPP-UHFFFAOYSA-N 289.375 2.314 10 20 CECD COC[C@@H](C)NC(=O)c1cc(C)n(-c2ccccn2)c1C 78585518 VZBUJWVSNUJFEY-LLVKDONJSA-N 287.363 2.254 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)NC(C)(C)C)c1 135727749 YUPUEWMBZUFQRZ-QWRGUYRKSA-N 294.395 2.355 10 20 CECD Nc1ccc(CC(=O)Nc2cc(C3CC3)[nH]n2)cc1 137039071 GLNSZEIWXZJIDW-UHFFFAOYSA-N 256.309 2.051 10 20 CECD CCOC(=O)c1nc(-c2ccc(O)c(O)c2)cs1 49394227 UCIMPPJCPMZXEP-UHFFFAOYSA-N 265.290 2.398 10 20 CECD CC[C@@H](NCC(=O)NCC(F)(F)F)c1ccccc1O 183325981 ZVAYQLGGTJESNY-SNVBAGLBSA-N 290.285 2.111 10 20 CECD C[C@H](NC[C@H]1CN2CCC[C@H]2CO1)c1ccc(F)cc1O 252548372 MMTTXRKKFWXDJA-UBHSHLNASA-N 294.370 2.045 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2[C@@H](C)O)c1O 267473887 ZTKPVPCNOKJBIP-ABAIWWIYSA-N 295.354 2.469 10 20 CECD CC[C@H](C(=O)NCc1ccc(N(C)C)cc1)N(CC)CC 265460178 XGINRYORPVLXQH-MRXNPFEDSA-N 291.439 2.489 10 20 CECD CCn1nc(C)c(C(=O)N(C)Cc2ccccc2O)c1C 269164863 VGHLUDWPENWAOX-UHFFFAOYSA-N 287.363 2.498 10 20 CECD Cc1cc(O)c(CN2CC[S@](=O)[C@@H](C)[C@H]2C)cc1C 265663718 XVXDMVZVTMLKFQ-NQCMUKECSA-N 281.421 2.350 10 20 CECD CC[C@H](NCC1(C(N)=O)CCCC1)c1ccccc1O 274953376 VNHPMWKTBYBQPC-ZDUSSCGKSA-N 276.380 2.479 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC[C@H](C)OC)c1 273575705 LTHSBAYEHIHWBO-QWRGUYRKSA-N 281.352 2.254 10 20 CECD COc1cccc(CN2C[C@@H](N3CCCC3)C[C@H]2C)c1O 289698708 OLWJJLGCBULLNZ-HIFRSBDPSA-N 290.407 2.459 10 20 CECD CCCCN(Cc1ccccc1O)C[C@H](O)COCC 282519606 SZBKLJVGBGJNOY-HNNXBMFYSA-N 281.396 2.392 10 20 CECD O=C1CCC(COC(=O)/C=C/c2ccc(O)c(O)c2)CC1 803400146 RWWPXXKJBVOZOZ-XBXARRHUSA-N 290.315 2.414 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](C)CN(C)C)c1 293651312 LHVCMJMHDKWDNB-RYUDHWBXSA-N 294.395 2.027 10 20 CECD COc1cccc(CN(C)Cc2nncn2C(C)C)c1O 292891719 ZAYANAPFEDIXAX-UHFFFAOYSA-N 290.367 2.205 10 20 CECD CCCN1C[C@@H](CN[C@@H](C)c2ccc(F)cc2O)CC1=O 817589839 QDWPVPMONBCJJX-NWDGAFQWSA-N 294.370 2.440 10 20 CECD C[C@H](NCC1CCNCC1)c1cc(F)ccc1O 817941128 MSFXMFCROWYLGG-JTQLQIEISA-N 252.333 2.182 10 20 CECD Cc1c(NC(=O)c2c(F)ccc(O)c2O)n[nH]c1C1CC1 825637199 PTICZIWIKIBLFV-UHFFFAOYSA-N 291.282 2.398 10 20 CECD CC(C)[C@H](C(=O)N[C@H](C)c1ccccc1O)N(C)C 827937294 QVVGPYDZIXDCEA-BXUZGUMPSA-N 264.369 2.156 10 20 CECD CCNC(=O)C(C)(C)NCc1cc(Cl)cc(F)c1O 835075840 DFCQLEGVIHORCA-UHFFFAOYSA-N 288.750 2.189 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC[C@H]1CCCOC1 844905507 MCZUDRFMDBKULT-SNVBAGLBSA-N 298.770 2.271 10 20 CECD CN(C(=N)NCc1cc(Cl)ccc1O)C1CC1 849050004 WQKLKWIRXNPTLI-UHFFFAOYSA-N 253.733 2.164 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H]1CCCN1C 840934321 ZZNRJGJKEARNTI-MRXNPFEDSA-N 261.413 2.245 10 20 CECD COc1cccc([C@H](C)NC[C@H](C)CCO)c1O 846149127 VZZVNLFLUAZHNG-MNOVXSKESA-N 253.342 2.070 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)c1cc(O)cs1 743697616 HBNYONMCWYVGEC-MRVPVSSYSA-N 257.355 2.387 10 20 CECD CC(C)CC[C@H](C)NC(=O)C(=O)Nc1ccc(N)cc1 841001130 YBWDTZYQOZKYNE-NSHDSACASA-N 277.368 2.148 10 20 CECD COC(=O)[C@@H]1CN(Cc2cc(C)cc(C)c2O)C[C@H]1C 754740364 QTRUCHNIZIZNJT-TZMCWYRMSA-N 277.364 2.250 10 20 CECD CCn1ccc(NCc2ccc(N3CCN(C)CC3)cc2)n1 850363712 JPJBXVCAEMUHKB-UHFFFAOYSA-N 299.422 2.267 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2C[C@H](CO)C2)c2c(O)ccc(F)c21 927147014 IKSAVTGBIUBVEL-DNRKLUKYSA-N 265.328 2.440 10 20 CECD C[C@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1cc(F)cc(F)c1O 756735938 JHKXQDRYNJWPEL-WCBMZHEXSA-N 296.317 2.084 10 20 CECD C[C@@H](N[C@H](C)c1nncn1C)c1cc(F)cc(F)c1O 756531716 BKZSRBIOODAJTN-HTQZYQBOSA-N 282.294 2.211 10 20 CECD COc1cc(Cl)cc(CN2CCc3n[nH]cc3C2)c1O 857878867 UMALVTPCWKPUNP-UHFFFAOYSA-N 293.754 2.336 10 20 CECD C[C@@H](NC(=O)NO[C@H]1CCCCO1)c1ccccc1O 868562286 YQBOKCNXHUQUBJ-MFKMUULPSA-N 280.324 2.211 10 20 CECD CCN(C)c1ccc(CN2CCC(CC(N)=O)CC2)cc1 773729238 GSELJZKHISLRSV-UHFFFAOYSA-N 289.423 2.230 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2cc(F)ccc2O)C[C@@H]1C 877666942 QEHSBIXPSPITAZ-BONVTDFDSA-N 281.327 2.162 10 20 CECD Cc1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n[nH]1 773992914 GSTIFCWQRIUWCY-NSHDSACASA-N 272.352 2.275 10 20 CECD C[C@@H](N[C@H](C)c1c(O)cccc1F)C(=O)NC(C)(C)C 886516537 MSYSIUAMONUZNN-NXEZZACHSA-N 282.359 2.485 10 20 CECD CCN(C)c1ccc(CN[C@@]2(CCOC)CCOC2)cc1 773943149 LSHQTQDNCSLJOF-KRWDZBQOSA-N 292.423 2.428 10 20 CECD C[C@H](Nc1ccc(N(C)CCO)cn1)c1ccccc1O 783524553 OTVNCONICZMHTG-LBPRGKRZSA-N 287.363 2.389 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC(C)(C)OC)c1 787447448 ZTBALEBDQYIWAD-SNVBAGLBSA-N 281.352 2.393 10 20 CECD CC[C@H]1CO[C@H](C)CN1Cc1ccc(OC)c(OC)c1O 891475490 GLXYSRKSSRENTE-YPMHNXCESA-N 295.379 2.409 10 20 CECD CC[C@@H](NCC(=O)N(CC)CC)c1ccccc1O 135734480 BADVZWVISFHGCR-CYBMUJFWSA-N 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CECD Cc1cc(N(C)C)ccc1CNCc1cncn1C 115629144 TXWYWCALHIJNTO-UHFFFAOYSA-N 258.369 2.084 10 20 CECD C[C@H](NC[C@@H](C)O)c1ccc(N2CCOCC2)cc1Cl 131144815 MCAAHHGIKMRZHN-NEPJUHHUSA-N 298.814 2.208 10 20 CECD CCc1nsc(NCc2cccc(OC)c2O)n1 92649018 DETLNKBZGAKQCT-UHFFFAOYSA-N 265.338 2.427 10 20 CECD COCCC1(CNC(=O)Cc2ccc(N)cc2)CCC1 237164575 AIXJQKRQEVFXEE-UHFFFAOYSA-N 276.380 2.134 10 20 CECD COc1cc(O)c(CNCc2cccnc2C)cc1OC 529660874 GQZAFAKOUGXZHX-UHFFFAOYSA-N 288.347 2.403 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C)Cn2cccn2)c1O 267471790 YPFOLKREBCZDEI-JTQLQIEISA-N 291.326 2.109 10 20 CECD CN(C)c1ccc(CN2CCc3[nH]ncc3C2)cc1 278888276 QAFRHUQZHWRGAQ-UHFFFAOYSA-N 256.353 2.034 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2CCCO2)c1 273426099 UEBSIJBKOUSANV-CMPLNLGQSA-N 279.336 2.008 10 20 CECD CCC(CC)(CCO)NCc1cc([N+](=O)[O-])ccc1O 283054518 SOMXHEZEFICNJD-UHFFFAOYSA-N 282.340 2.331 10 20 CECD C[C@@H]1CN(Cc2ccccc2O)CC2(CCOCC2)O1 280402253 HEUMYJSPFSKCBD-CYBMUJFWSA-N 277.364 2.162 10 20 CECD 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COC1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CCC1 272857619 FANGYSIIFFMZJM-UHFFFAOYSA-N 276.380 2.280 10 20 CECD CCOC1CC(COC(=O)c2cc(O)cs2)C1 803346790 ZOZWIJTYBDACHS-UHFFFAOYSA-N 256.323 2.426 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)Cc1cnn(C)n1 290113271 XXTYCYGUADCYCX-UHFFFAOYSA-N 287.411 2.292 10 20 CECD C[C@H](NCC1(CC(N)=O)CC1)c1ccc(Cl)cc1O 817590189 VZMXROSOCNVGTN-VIFPVBQESA-N 282.771 2.352 10 20 CECD CCNC(=O)[C@@H](NCc1ccc(N(C)C)cc1)C(C)C 815131818 MYGJHXMWYVICRI-HNNXBMFYSA-N 277.412 2.003 10 20 CECD NC(=O)[C@@H]1CCCN(Cc2ccc3ccccc3c2O)C1 816478109 URKDTDRQTKJVAX-CQSZACIVSA-N 284.359 2.243 10 20 CECD COc1ccc(O)c(CN[C@H](C)c2ccnc(O)c2)c1 816639077 HDSZODYFDSIFDW-SNVBAGLBSA-N 274.320 2.352 10 20 CECD CN(C)CCCCC(=O)NCc1ccc(N(C)C)c(F)c1 729286325 MBKAZXLJPGVQOT-UHFFFAOYSA-N 295.402 2.240 10 20 CECD COc1ccc(O)c(CN2CC[C@@H]3OCC[C@@H]3C2)c1 724815037 ZWURIQLTZDGMQO-ABAIWWIYSA-N 263.337 2.012 10 20 CECD Cc1cccc(CNC2CCN([C@@H]3CCOC3)CC2)c1O 827549080 AFJDKKTTYCRVKV-MRXNPFEDSA-N 290.407 2.044 10 20 CECD CN(C(=O)/C=C/c1cccnc1)c1ccc([N+](=O)[O-])nc1 493274025 RLVXEHZUFSYVKO-QPJJXVBHSA-N 284.275 2.061 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](O)C1CC1 822898914 VDGBQYDHRQLJKZ-MRXNPFEDSA-N 290.407 2.261 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)NCc1ccccc1O 836667162 XBRQSRSRVYTIGY-TZMCWYRMSA-N 278.352 2.149 10 20 CECD CNC(=O)C[C@@H](C)N[C@H](C)c1cc2c(cc1O)CCCC2 834898693 BLSXIJLGJQVTKA-VXGBXAGGSA-N 290.407 2.446 10 20 CECD CC[C@H]1CN(C(=O)c2cc(O)cs2)C[C@H](C)O1 732301707 GTDGNVRAKDBQDW-WPRPVWTQSA-N 255.339 2.093 10 20 CECD Cc1cnc(CCNCc2cc(Cl)ccc2O)cn1 835061773 NWJAQDAOOZXAHP-UHFFFAOYSA-N 277.755 2.476 10 20 CECD Oc1c(F)cccc1CN1CCC([C@H]2CCCN2)CC1 843046148 OLYLJRVQTUJAFW-OAHLLOKOSA-N 278.371 2.495 10 20 CECD Nc1ccc(NC(=O)NC[C@H]2COC3(CCCC3)O2)cc1 841295988 MEFYXSVQCZNYEV-ZDUSSCGKSA-N 291.351 2.076 10 20 CECD COC[C@H](C)CN[C@H](C)c1cccc(OC)c1O 846147062 VIDNGIXKICSSIG-GHMZBOCLSA-N 253.342 2.334 10 20 CECD Cc1noc(CN(C)Cc2cccc(Cl)c2O)n1 848928095 VXDMPXYQIPTIGN-UHFFFAOYSA-N 267.716 2.369 10 20 CECD C[C@@H](CCCCN)NCc1ccc(N2CCOCC2)cc1 841078282 DYIQSJZDGCNMND-HNNXBMFYSA-N 291.439 2.130 10 20 CECD Nc1ccc(Cc2noc(CC3CCOCC3)n2)cc1 843159262 NXFYRLUGHYGDSF-UHFFFAOYSA-N 273.336 2.212 10 20 CECD Cc1cc(CN2CC[C@@H](C(=O)O)[C@H]2C)ccc1N(C)C 846285076 NLCZCKOHWZSQSM-TZMCWYRMSA-N 276.380 2.356 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC[C@@H]1CCCOC1 844905506 MCZUDRFMDBKULT-JTQLQIEISA-N 298.770 2.271 10 20 CECD CCN1CC[C@@H](NCCc2ccc(N)cc2)[C@H](C)C1 841035388 NJKNHNHOAULTKW-CZUORRHYSA-N 261.413 2.131 10 20 CECD CNC[C@@H](C)N[C@@H](C)c1cc(Br)ccc1O 854232785 UENFLBOZJZJWPR-BDAKNGLRSA-N 287.201 2.413 10 20 CECD CO[C@@H](CN(C)c1ccc(OCC(=O)O)cc1)C1CCC1 851705509 OHNIDQNUAOHFBK-HNNXBMFYSA-N 293.363 2.401 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)[C@@H](O)C(F)(F)F)c1O 866463644 OPSFALXZODBGGS-YVZVNANGSA-N 293.285 2.363 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCSC1 761840485 BZVOKMQOVJMVMZ-ZDUSSCGKSA-N 278.421 2.464 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC[C@@H](C)NC1 863649314 CEOMLPHMYXJFOD-HIFRSBDPSA-N 261.413 2.291 10 20 CECD C[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C[C@H]1CO 862425498 YEBQUKAOYPJWKF-YPMHNXCESA-N 298.377 2.481 10 20 CECD CO[C@@H]1CCC[C@@H]1CNCc1cc2c(cc1O)OCO2 774830422 CNUWGFNUZHOHKH-ZWNOBZJWSA-N 279.336 2.026 10 20 CECD CCN(C)C(=O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 775586844 PRTAFHCSDOPOCE-KOLCDFICSA-N 280.343 2.148 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1c(O)cccc1F 886530739 PMYFJVFZNYDXRQ-YGOYTEALSA-N 273.373 2.294 10 20 CECD C[C@@H](N[C@H](CCO)C1CCOCC1)c1c(O)cccc1F 886590044 MJGJDQPIZFMSOF-BXUZGUMPSA-N 297.370 2.360 10 20 CECD OC[C@@H](CNCc1cc(F)cc(F)c1O)CC1CC1 883175523 JDBZPPREKLCQCZ-SNVBAGLBSA-N 271.307 2.169 10 20 CECD CN(C)CCn1cc(NCc2cc(F)cc(F)c2O)cn1 882967062 VBFRNARPZUXTEB-UHFFFAOYSA-N 296.321 2.041 10 20 CECD COc1cc(C)cc(CNCC[C@H](C)CCO)c1O 894870540 MMSVQQSCLCQFSQ-NSHDSACASA-N 267.369 2.207 10 20 CECD COc1ccc(O)c(CN2CCCCC[C@H]2CO)c1 895150220 ICYCFIZLZFWMRL-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD COc1cc(C)cc(CNCc2nccs2)c1O 894200877 XPEKLJAXEVGPIH-UHFFFAOYSA-N 264.350 2.456 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C2OCCO2)C1 896380395 HHJASCOFHGPRMU-OAHLLOKOSA-N 290.407 2.256 10 20 CECD COc1ccc(CNC(=O)c2cc(Cl)c[nH]2)c(O)c1 794376918 CVWSZMVVNUMSJQ-UHFFFAOYSA-N 280.711 2.312 10 20 CECD CC1(C)[C@@H](NCc2c(O)ccc(Cl)c2F)C[C@H]1O 790989147 YJADRLPQSZFCEC-WDEREUQCSA-N 273.735 2.434 10 20 CECD COc1ccc(O)c(CNCc2ccc(C)nc2)c1 62050698 DCMYZRWLUSCQAV-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CC[C@@H]1CN(C(=O)Nc2ccc(N)cc2)C[C@H](C)O1 689064619 ZBECIGHIIUFBFA-GXFFZTMASA-N 263.341 2.300 10 20 CECD CCn1c(-c2sccc2O)nnc1N1CC=CCC1 1342568011 FOUDPRBUUPEFSP-UHFFFAOYSA-N 276.365 2.498 10 20 CECD Cc1c(NCc2cccc(Cl)c2O)cnn1CC(=O)O 1600051579 RITAKZPXLRFSFX-UHFFFAOYSA-N 295.726 2.247 10 20 CECD CC1(C)[C@H](N)C[C@H]1NCc1c(O)ccc(Cl)c1F 1576380008 FPNCTUUOBVFBOZ-GHMZBOCLSA-N 272.751 2.400 10 20 CECD COc1cc(O)c(CN(C)Cc2cccn2C)cc1OC 160412256 FBUYDCYUYLAUGB-UHFFFAOYSA-N 290.363 2.380 10 20 CECD CCCC[C@H](NCc1cccc(OC)c1O)C(=O)OC 154587104 YQUZOFHVXNFMEQ-LBPRGKRZSA-N 281.352 2.222 10 20 CECD CC[C@@H](C)[C@@H](NCc1ccc2c(c1)CCO2)C(=O)OC 37363454 ROGZPTOOBJGUIA-IAQYHMDHSA-N 277.364 2.299 10 20 CECD C[C@H](NCc1cc2c(cc1O)OCO2)c1ccccn1 42879410 XVDYHZIHCKESRE-JTQLQIEISA-N 272.304 2.367 10 20 CECD COc1ccc(CN[C@@H]2CS[C@@H](C)C2)c(O)c1 397975960 OSLICDPMZHBWNY-ONGXEEELSA-N 253.367 2.384 10 20 CECD CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 60460185 PVRAEDSPPXCQFW-INIZCTEOSA-N 276.380 2.280 10 20 CECD Cc1cncc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c1 186384295 ZVDAXEQTHQADFA-LLVKDONJSA-N 286.331 2.162 10 20 CECD C[C@@H](NCCNC(=O)C1CC1)c1cc(Cl)ccc1O 184866725 NYHRFARCTIYLKI-SECBINFHSA-N 282.771 2.222 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)C1CC1 122814151 FZOFKKSMQJUMPV-UHFFFAOYSA-N 282.409 2.067 10 20 CECD Oc1ccc(F)cc1CNC[C@]1(O)CCc2ccccc21 180849421 PILDVKYLVYQOGD-QGZVFWFLSA-N 287.334 2.455 10 20 CECD COc1cccc(CNC(=O)c2ccncc2Cl)c1O 72910669 RSOFVUJLYWRUOD-UHFFFAOYSA-N 292.722 2.379 10 20 CECD COCCCN(C)CCN[C@@H](C)c1ccc(C)cc1O 185554093 QHZMNCQPNHNMCQ-AWEZNQCLSA-N 280.412 2.320 10 20 CECD COc1ccc(O)c(CN2CCCO[C@@H](C)C2)c1 134152378 RATGMYAFBAXZRZ-NSHDSACASA-N 251.326 2.012 10 20 CECD COc1cccc(CNc2ncc([N+](=O)[O-])s2)c1O 195512883 BNAOYUFSROFMAT-UHFFFAOYSA-N 281.293 2.378 10 20 CECD C[C@@H](NCC1(CO)CCOCC1)c1ccc(N(C)C)cc1 90662179 VXRWUXGYEZOSDT-CQSZACIVSA-N 292.423 2.192 10 20 CECD Cc1ccc([C@@H](C)NCC2(CO)CCOCC2)c(O)c1C 273447787 FLNIGMDDPVCETR-CQSZACIVSA-N 293.407 2.449 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H]2CCC[C@H]2CCO)c1O 279281453 ONLIMJOLNCNUBC-NHYWBVRUSA-N 295.354 2.375 10 20 CECD CC[C@H](NCc1nnc2n1CCC2)c1ccc(C)cc1O 280274379 YBQXWSZLMSXMTD-ZDUSSCGKSA-N 286.379 2.479 10 20 CECD C[C@H](N[C@@H]1CC(=O)N(C)C1)c1ccc2ccccc2c1O 386973550 RDFTXUIWGBPXIL-WCQYABFASA-N 284.359 2.427 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnn2c1CCC2 294308641 GUJLFPGGHCZHLA-UHFFFAOYSA-N 298.390 2.168 10 20 CECD CCOc1ccc(CN(C)CCN2CCCC2)c(O)c1 809738046 QHQSZJSTIZAIBW-UHFFFAOYSA-N 278.396 2.319 10 20 CECD CCN(C)c1ccc(CN[C@@H]2CCC[C@@H]2C(=O)NC)cc1 815102556 PZXBHWNTMFICAQ-JKSUJKDBSA-N 289.423 2.147 10 20 CECD CCCN1C[C@H](CN[C@H](C)c2cc(F)ccc2O)CC1=O 817589638 OVQUBXKZLLCWAB-NEPJUHHUSA-N 294.370 2.440 10 20 CECD COC(=O)CC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 906344748 HGZWPQCYYQITLH-UHFFFAOYSA-N 292.379 2.053 10 20 CECD C[C@@H](C[C@@H](O)c1ccco1)NC(=O)c1cc(O)cs1 830118776 FPIITVMXIMAOPY-WCBMZHEXSA-N 281.333 2.289 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)C=C2CCCC2)cc1 832281978 WQKBDBMLAQGIKA-MRXNPFEDSA-N 287.407 2.369 10 20 CECD COC[C@H](NC(=O)c1cc(O)cs1)c1ccc(C)o1 746697109 LAHGXVBDDFXURY-JTQLQIEISA-N 281.333 2.473 10 20 CECD CC(C)CNC(=O)[C@H](C)N1CCCc2cc(CN)ccc21 843350213 PLXJGLXOPIDQST-ZDUSSCGKSA-N 289.423 2.059 10 20 CECD CC(C)OCC(C)(C)NC(=O)/C=C/c1ccc(O)c(O)c1 840540100 IWDHUFJXMSHBSL-SOFGYWHQSA-N 293.363 2.431 10 20 CECD COc1cccc(CNCCC[C@H]2CCCN2)c1O 841072628 LPBNPOZZCZXNJR-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](O)COCC(C)C 840930678 OMCJAUNTQSCLAW-KRWDZBQOSA-N 294.439 2.184 10 20 CECD CC(C)N(C)Cc1nc(Cc2ccc(N)cc2)no1 843158677 GMCHJVGMTRXNNG-UHFFFAOYSA-N 260.341 2.083 10 20 CECD CCOc1ccc(CN[C@H]2CC[C@@H](CN)C2)c(O)c1 841084467 JXFYBLWTAHDUGH-YPMHNXCESA-N 264.369 2.008 10 20 CECD CN(C(=O)c1cccc(O)c1O)C(C)(C)CN1CCCC1 841468051 RBOOOKVMNVIUIE-UHFFFAOYSA-N 292.379 2.044 10 20 CECD C[C@@]1(CN)CCN(Cc2cc(Cl)cc(F)c2O)C1 843116940 NLROUEGTWGMUPB-ZDUSSCGKSA-N 272.751 2.355 10 20 CECD CCC/C=C\C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 852792481 XEVIEDZPDUWBHC-IDTUSYRASA-N 275.396 2.225 10 20 CECD CCOc1ccc(CNCCC[C@@H](C)CO)c(O)c1 758577348 DSSIDFLPFWQUFX-GFCCVEGCSA-N 267.369 2.289 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCOC[C@@H]2C)c1 756537345 YHTPVYXYTBCWBV-KBPBESRZSA-N 278.396 2.072 10 20 CECD CC(C)(C)OCCCNC(=O)NCc1ccccc1O 852551827 YMNLLMJQHYATAM-UHFFFAOYSA-N 280.368 2.397 10 20 CECD CN(C[C@@H](O)COc1ccc(F)cc1)c1ccc(N)cc1 923399564 FLMDKWVXCVQUHG-OAHLLOKOSA-N 290.338 2.284 10 20 CECD CC[C@H](NCCN(C)C(=O)OC)c1ccc(F)cc1O 850548380 PPMTUDUQMDMBOG-LBPRGKRZSA-N 284.331 2.270 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNC2CC(F)(F)C2)c1 758598638 PXGXNPISNMJJCQ-UHFFFAOYSA-N 258.224 2.188 10 20 CECD CCOc1ccc(O)c(CNCc2conc2C)c1 865678461 KBFVYWLOCSYUIU-UHFFFAOYSA-N 262.309 2.377 10 20 CECD O=C(NC[C@@H]1CCCC1(F)F)c1c(F)ccc(O)c1O 1117825828 GPFGBBSVSALJJG-ZETCQYMHSA-N 289.253 2.402 10 20 CECD CC(C)[C@H](C(=O)N[C@H](C)c1ccccc1O)[C@H](C)N 870987673 ABYMNZPBDCNQBV-WDMOLILDSA-N 264.369 2.189 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2cc(OC)c(C)cc2O)C1 768464820 AVMWVOFWJCWSNE-AWEZNQCLSA-N 292.423 2.483 10 20 CECD Cc1ccc(CN2CCC(Cn3cncn3)CC2)c(O)c1 877430798 RIZYDHKVCBEZHC-UHFFFAOYSA-N 286.379 2.204 10 20 CECD CC(=O)C1=NN(c2ccc(Br)c(C)c2)C(=O)C1 871948839 DNOOGSZPKQNLSA-UHFFFAOYSA-N 295.136 2.439 10 20 CECD C[C@H](NC(=O)NC1(CO)CCC1)c1ccc(N(C)C)cc1 776250908 YHTXRYGJMZBGJV-LBPRGKRZSA-N 291.395 2.028 10 20 CECD COc1ccc(CNCCc2ccncc2)c(O)c1OC 1119954098 VVYUMBCMGGNGNV-UHFFFAOYSA-N 288.347 2.137 10 20 CECD CN1CCN(c2ccc(CN3CC=CCC3)cc2)CC1 779159365 GPZQIQAQNPXVJK-UHFFFAOYSA-N 271.408 2.200 10 20 CECD COC[C@H](C)NC(=S)N[C@@H](C)c1ccc(N(C)C)cc1 774248733 HNRIXPDLRGELLP-RYUDHWBXSA-N 295.452 2.313 10 20 CECD C[C@H](NC(=O)[C@@H]1[C@H]2CCCO[C@H]21)c1ccc(N(C)C)cc1 773017786 FPGVAUQQZALLOL-AEAUEXCSSA-N 288.391 2.355 10 20 CECD Oc1n[nH]c(CN(Cc2ccccc2O)C2CCCC2)n1 774626803 MJZJNECAEXFKTR-UHFFFAOYSA-N 288.351 2.161 10 20 CECD CC1(C)CNCCN1Cc1ccc(N2CCCC2)cc1 1235823026 RMNNQLXAGHVCSX-UHFFFAOYSA-N 273.424 2.471 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](C(=O)O)[C@H](C)C2)c1 388663116 OQGALDINENZMJD-YPMHNXCESA-N 263.337 2.243 10 20 CECD Cc1ncc(CNCc2cc(Cl)ccc2O)n1C 689197983 FICSQRHBQDHGOJ-UHFFFAOYSA-N 265.744 2.377 10 20 CECD Cc1nn(C)c(C)c1CNCc1cc(F)cc(F)c1O 708480373 HHOVSUCRJSDXCV-UHFFFAOYSA-N 281.306 2.311 10 20 CECD CC(C)[C@@H](CO)CNCc1cc(F)cc(F)c1O 708554101 GSAHZLKATIJKDO-SNVBAGLBSA-N 259.296 2.025 10 20 CECD CCOc1cccc(CNCc2cccnc2O)c1O 714983963 PTBOFYYXAJIZCX-UHFFFAOYSA-N 274.320 2.181 10 20 CECD CCc1nc(C(=O)N(C)Cc2ccccc2O)co1 753835182 NACDMQAEGHWBMH-UHFFFAOYSA-N 260.293 2.215 10 20 CECD C[C@H](N[C@H](C)Cn1cccn1)c1cc(F)ccc1O 94617554 OTZZSGFVYDPKCF-MNOVXSKESA-N 263.316 2.467 10 20 CECD CN(C(=O)NCc1ccc(N)cc1)[C@@H](CO)CC(C)(C)C 1346739694 SZNKOKRMDQEADZ-CQSZACIVSA-N 293.411 2.207 10 20 CECD C[C@H]1[C@@H](C(=O)O)CCN1Cc1cc2c(cc1O)CCC2 1604635152 FPRSGKRQCNWSJZ-HZMBPMFUSA-N 275.348 2.176 10 20 CECD Cc1cccc(CNc2cccc(OCC(N)=O)c2)c1O 158042168 BXDOFJWUOVRWRS-UHFFFAOYSA-N 286.331 2.177 10 20 CECD COc1cccc(CNC(=O)N[C@H]2C=CCCC2)c1O 158696321 WAKUFYMFQGIVCD-LBPRGKRZSA-N 276.336 2.309 10 20 CECD Cc1cc(C)cc(-n2c(C)cc(C(=O)NCCN)c2C)c1 158722685 OOQMSTBRCPIZBL-UHFFFAOYSA-N 285.391 2.399 10 20 CECD C[C@@H]1CC[C@H](CN2CCCc3cc(CN)ccc32)O1 232007581 ZTHJXHXSWHMBOA-IUODEOHRSA-N 260.381 2.465 10 20 CECD CCCNC(=O)CCNCc1ccc(OC)c(C)c1 44351366 YYMAUWXQNMDQBW-UHFFFAOYSA-N 264.369 2.010 10 20 CECD CN1CCCC[C@H](CNCc2ccc3c(c2)CCO3)C1 700814001 SPHBZVPBDNOUPT-OAHLLOKOSA-N 274.408 2.443 10 20 CECD CCc1cccc(CN[C@H](C)CC[S@](C)=O)c1O 691499885 JQYOKBSQRSUODL-ZMZPIMSZSA-N 269.410 2.201 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@@H]2CCOC2)cc1 176564054 JOJIDJSGDGEYOY-CQSZACIVSA-N 276.380 2.186 10 20 CECD Cc1ccc(C(=O)N[C@H](C)CN2CCCCC2)c(O)c1O 177671351 HJGASLNDWGRUOH-GFCCVEGCSA-N 292.379 2.010 10 20 CECD O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccccc1F 33573782 KDRWAXJNYPTMKM-JLHYYAGUSA-N 282.274 2.287 10 20 CECD CCOc1cccc(CN[C@@H](CC)COC)c1O 79737116 DSTYKXODQMBQIG-LBPRGKRZSA-N 253.342 2.306 10 20 CECD CCN1CCCN(Cc2cc(C)c(C)cc2O)CC1=O 189220080 AMAKKDICFBMFFQ-UHFFFAOYSA-N 276.380 2.063 10 20 CECD CO[C@H](C)CCC(=O)NCc1ccc(N(C)C)c(F)c1 181257871 GLIGNFVMLIZNTA-LLVKDONJSA-N 282.359 2.323 10 20 CECD Cn1cc(CNCc2ccccc2O)c(C(F)F)n1 291306877 XGBORJGBUNUFQI-UHFFFAOYSA-N 267.279 2.353 10 20 CECD COC(=O)[C@H]1CC[C@@H](N[C@H](C)c2ccccc2O)C1 193886358 HNBOMDFUJUJMDN-GRYCIOLGSA-N 263.337 2.385 10 20 CECD CCOC1CC(CCNC(=O)c2ccc(C)c(O)c2O)C1 191111974 MXENVIHVVXUJRC-UHFFFAOYSA-N 293.363 2.341 10 20 CECD Cc1ccc(O)c(CNC(C)(C)c2noc(C)n2)c1 264994604 XRRIFHISQPBMLV-UHFFFAOYSA-N 261.325 2.417 10 20 CECD Cc1ccc(C(=O)N2CC3(CCCC3)C2)c(O)c1O 368419601 MTLYUWJXWAVEML-UHFFFAOYSA-N 261.321 2.422 10 20 CECD C[C@@H](NCCOCC(F)F)c1cc([N+](=O)[O-])ccc1O 276650226 MJECVUBKJNYMIE-MRVPVSSYSA-N 290.266 2.233 10 20 CECD C[C@@H](N[C@H](CO)c1cnn(C)c1)c1cc(Cl)ccc1O 273536951 XOEKHWIGISUDCH-NOZJJQNGSA-N 295.770 2.163 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)c2cnn(C)c2)c1O 273251608 CIBXNAAGQXLZBU-SECBINFHSA-N 291.326 2.318 10 20 CECD COC[C@H](CN[C@H](C)c1c(C)cc(C)cc1O)OC 285115159 KVYFNQKFLXAZEB-OLZOCXBDSA-N 267.369 2.321 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccccc2O)[C@@H]1SC 298229947 BFEQGBFOIFCXHF-YUTCNCBUSA-N 267.394 2.391 10 20 CECD CC(=O)C(=O)COC(=O)CCC(=O)c1cc(C)sc1C 808485536 UXRMRKUFLXKUJY-UHFFFAOYSA-N 296.344 2.029 10 20 CECD C[C@@H](N[C@@H]1CCCN(CCCO)C1)c1cc(F)ccc1O 297368741 QJWOIDKDPUYRDD-TZMCWYRMSA-N 296.386 2.029 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2cc3c(cc2O)CCC3)C1 828029263 XFNCUEMXNWCACX-INIZCTEOSA-N 275.348 2.178 10 20 CECD O=C(NCCc1ccc(O)cc1)NCc1ccccc1O 727228648 HYZKWCPNHSPNTJ-UHFFFAOYSA-N 286.331 2.140 10 20 CECD Oc1cccc(Cl)c1CNCCOC[C@@H]1CCOC1 733328396 SZNNJLAGFFAVPL-LLVKDONJSA-N 285.771 2.188 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cc[nH]n1 839916267 QMXXWYHXFZOKFA-LBPRGKRZSA-N 286.379 2.145 10 20 CECD CCCc1ncc(C(=O)NCc2ccc(O)cc2O)s1 910950862 LDQQZAOGYXNARE-UHFFFAOYSA-N 292.360 2.437 10 20 CECD CCN(C)c1ccc(Cn2nccc2[N+](=O)[O-])cc1 747808926 HZEHNVSJKWFPLH-UHFFFAOYSA-N 260.297 2.296 10 20 CECD Cc1cc(Br)c(O)c(CNC2CCNCC2)c1 841027156 XZLLOARVNJOWDE-UHFFFAOYSA-N 299.212 2.305 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1nonc1C 845790300 BBIGNASSUBETPN-UHFFFAOYSA-N 289.335 2.065 10 20 CECD Cc1ccc(O)c(CN[C@H](CCN)C(F)(F)F)c1 841090543 KFRZPHYULFIHFW-LLVKDONJSA-N 262.275 2.070 10 20 CECD Cn1cccc1CNC(=S)Nc1ccc2c(c1)OCO2 743062190 USRGJAJMYCFRJF-UHFFFAOYSA-N 289.360 2.240 10 20 CECD COCCN1CC[C@H](N[C@H](C)c2ccc(Cl)cc2O)C1 841764827 RUUDZDDBEJNAOF-YPMHNXCESA-N 298.814 2.417 10 20 CECD CCCCN(CCOC)C(=O)NCCc1ccc(N)cc1 841955880 QKLXHMKMYFCGOG-UHFFFAOYSA-N 293.411 2.269 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N[C@H]1CC[C@H](O)CC1 845071123 BCURTJCYNITANQ-HAQNSBGRSA-N 298.770 2.148 10 20 CECD CC[C@@H](CNC(=O)NCc1cc(Cl)ccc1O)OC 845208058 YLXAJTKLBZUZEN-NSHDSACASA-N 286.759 2.270 10 20 CECD CCOC(=O)COCCSc1ncc(Cl)s1 850000054 HUZRMPVYHOIGAC-UHFFFAOYSA-N 281.786 2.468 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCOC2CCC2)c1 756839449 RSIBIOIYNUYIFI-LLVKDONJSA-N 293.363 2.399 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2C[C@H](C)Cc3c[nH]nc32)c1 857871901 YEZIGQFKUWNAME-RISCZKNCSA-N 299.374 2.406 10 20 CECD CN(Cc1cccn1C)C(=O)c1cc(O)cs1 761602870 NGDVEABEFORZRK-UHFFFAOYSA-N 250.323 2.064 10 20 CECD Cc1ccc(CN2CCC[C@@H]2c2ncon2)c(O)c1 876662672 QDCXBPNLKXBXKG-GFCCVEGCSA-N 259.309 2.421 10 20 CECD CN(Cc1cc(-c2ccccc2)ccc1O)[C@@H]1CCNC1=O 770377501 ACDNNHKEWFECPG-MRXNPFEDSA-N 296.370 2.380 10 20 CECD Cn1ncc2c1CN(Cc1c(O)cccc1Cl)C2 877632571 FVEWSNDHNVJESJ-UHFFFAOYSA-N 263.728 2.295 10 20 CECD CC1(C)CNCC[C@@H](NCc2cc(F)ccc2O)C1 872251792 NFUNZXAKGGPRMJ-CYBMUJFWSA-N 266.360 2.399 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2cc(C)nc(C)n2)c1 880292410 PCILUEVIWWKQNW-UHFFFAOYSA-N 286.335 2.429 10 20 CECD CN(Cc1ccccc1O)C(=O)NC/C=C\Cl 899054721 DDZBPAMTTVAADQ-DAXSKMNVSA-N 254.717 2.286 10 20 CECD C[C@H]1[C@@H](C)N(C)CCN1Cc1cc(F)cc(F)c1O 894488390 XBYUOHUIUPMNBG-ZJUUUORDSA-N 270.323 2.195 10 20 CECD CC(C)Cc1cc(NC(=O)c2cccc(O)c2O)n[nH]1 790647830 ZKHQSFLRKLZUSJ-UHFFFAOYSA-N 275.308 2.272 10 20 CECD CCn1ncnc1CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 794841098 LNGFZUFVGOMJAU-MWLCHTKSSA-N 290.342 2.481 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(F)cc1O 796829164 ZRDYUZLZQISILC-FZMZJTMJSA-N 292.354 2.335 10 20 CECD CCCN(CC(F)F)C(=O)c1cccc(O)c1O 187049901 QGHVBDMMXIWGCT-UHFFFAOYSA-N 259.252 2.215 10 20 CECD Cc1ccnc(O)c1C(=O)NCc1cc(Cl)ccc1O 1329626223 ZSGYTSZOVXCHLJ-UHFFFAOYSA-N 292.722 2.385 10 20 CECD CCC[C@@H]1C[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 1337609266 VENUUNWQKKDJKD-LWSHCTJVSA-N 261.321 2.416 10 20 CECD COCC(C)(C)C(=O)N(C)Cc1ccccc1O 156821284 ZAVUHONOYBLHFJ-UHFFFAOYSA-N 251.326 2.023 10 20 CECD Cc1ncc(CSc2ncc(C(=O)O)s2)o1 1600737342 HEFBRFJJZVLIAK-UHFFFAOYSA-N 256.308 2.430 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](C)C[C@@H]2C(=O)O)c1 1607811158 LYVOZWUDRHDVRS-WCQYABFASA-N 263.337 2.386 10 20 CECD CC[C@@H](C)C[C@@H](NCc1cc(OC)ccc1O)C(=O)O 1604952179 OXVUMPKHWMSAPL-ZWNOBZJWSA-N 281.352 2.380 10 20 CECD O=C(O)[C@@H]1[C@H]2CN(Cc3ccc(N4CCCC4)cc3)C[C@H]21 1602205107 UZKZUDGCCUIELQ-ZSHCYNCHSA-N 286.375 2.049 10 20 CECD CC1(C)CN[C@H]1C(=O)NCc1c(O)ccc2ccccc12 1573614934 QMNDUXKCVKFXHN-HNNXBMFYSA-N 284.359 2.160 10 20 CECD C[C@H](NCC1(O)CCC(C(=O)O)CC1)c1ccccc1O 1594240764 XEBLZWXYDZUREG-FZWSLVFFSA-N 293.363 2.049 10 20 CECD CCc1cccc(CN(C)[C@@H](C)[C@H](C)S(C)(=O)=O)c1O 848886419 FGROLYTUMQTHSD-RYUDHWBXSA-N 299.436 2.208 10 20 CECD Cn1ncc(Cl)c1CNCc1ccccc1O 275427605 CLKNOUSXKCWFAI-UHFFFAOYSA-N 251.717 2.069 10 20 CECD COc1ccc(O)c(CNC[C@]2(O)CCC[C@H]2C)c1 294002306 MHLSOKBPUJHNHG-IAQYHMDHSA-N 265.353 2.042 10 20 CECD CCc1cnc(CNC(=O)c2cccc(O)c2O)s1 193104944 YZXLNAPKTKGVMA-UHFFFAOYSA-N 278.333 2.047 10 20 CECD C[C@@H]1NC[C@H](C)N(Cc2ccc(N(C)C)cc2)[C@@H]1C 401219580 DZHWHHIREFVQCZ-MELADBBJSA-N 261.413 2.323 10 20 CECD C[C@@H](CN1CCOCC1)N[C@H](C)c1ccc(N(C)C)cc1 37273388 RQFSOJJWCMUCQC-LSDHHAIUSA-N 291.439 2.124 10 20 CECD COCC[C@](C)(O)CN[C@@H](C)c1cc(Cl)ccc1O 185467030 OLPUSRFJLRVBQW-HZMBPMFUSA-N 287.787 2.484 10 20 CECD C[C@H](N[C@@H](C)[C@@H](C)N1CCOCC1)c1ccc(F)cc1O 185375820 NIPUSZWDPYICIS-RWMBFGLXSA-N 296.386 2.291 10 20 CECD C[C@@H](NCCCN1CCC(O)CC1)c1ccc(F)cc1O 185116069 FHNKEJXAULLFCB-GFCCVEGCSA-N 296.386 2.029 10 20 CECD COc1cccc(CNc2cccc(C(N)=O)c2C)c1O 36996172 ODMTYDMCVTXQPE-UHFFFAOYSA-N 286.331 2.420 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)c1c(C)noc1C 189434237 LWVFZOJVNRUUDT-UHFFFAOYSA-N 296.348 2.360 10 20 CECD CCOC(CCNCc1ccccc1O)OCC 228415144 PHWWFTBFBKOUKE-UHFFFAOYSA-N 253.342 2.271 10 20 CECD CC[C@]1(C)CN(C(=O)c2ccc(C)c(O)c2O)CCO1 135446061 QHBBFLDHFKPETL-OAHLLOKOSA-N 279.336 2.047 10 20 CECD C[C@@H]1C[C@@H]1c1cc(NC(=O)c2cccc(O)c2O)[nH]n1 192993319 CIUNUGIXUQAUEJ-APPZFPTMSA-N 273.292 2.197 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNC[C@H]2CCCO2)c1O 238119925 GPDFZYJUADMRQG-SNVBAGLBSA-N 286.715 2.222 10 20 CECD OC[C@H](CNCc1ccccc1O)Cc1ccc(F)cc1 263727051 XMXCBTHVAAWTDX-AWEZNQCLSA-N 289.350 2.472 10 20 CECD O=C(C(F)F)N(Cc1ccccc1O)C[C@H]1CCCO1 279884672 NYNMIXQAPWXYRO-LLVKDONJSA-N 285.290 2.165 10 20 CECD C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@H]1C 272685291 SRXIOSJKDGTZIU-JYBZGJHDSA-N 261.321 2.225 10 20 CECD Cc1cnccc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 274725625 AWCAVEXNZHJDIH-NSHDSACASA-N 286.331 2.162 10 20 CECD C[C@H]1C[C@H](CCNC(=O)c2cccc(O)c2O)CCO1 280461394 MHNJWRMQMJXUIN-WDEREUQCSA-N 279.336 2.033 10 20 CECD O[C@@H]1c2ccccc2OC[C@H]1NCc1ccc2c(c1)CCO2 288528422 JYASRZLQXVCRQN-CRAIPNDOSA-N 297.354 2.206 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CSC[C@H]2C)c1O 809703790 UFKGBBYKANAWSB-PSASIEDQSA-N 298.364 2.150 10 20 CECD Cc1ccc(O)c(CN2CCC(F)(F)[C@H](CO)C2)c1 291028391 BBDTXAPKIAGHQU-LBPRGKRZSA-N 271.307 2.150 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)C[C@@H](CO)C2)c1O 398774038 BCDLTAGMJSOHOC-CMPLNLGQSA-N 295.354 2.184 10 20 CECD CC[C@@H](NCc1cnnn1C)c1ccc(C)cc1O 806660219 TVCGWVAYEZJJRR-CYBMUJFWSA-N 260.341 2.070 10 20 CECD CN(Cc1c(O)ccc2ccncc12)C[C@H]1CCCN1C 817372161 HGQMNKZJHJWPNK-CQSZACIVSA-N 285.391 2.466 10 20 CECD COC[C@](C)(O)CN[C@H](C)c1c(C)cc(C)cc1O 815579741 UBWLWZMJJGOBNJ-IUODEOHRSA-N 267.369 2.057 10 20 CECD CN(Cc1ccc(C(=O)O)o1)Cc1ccccc1O 724850541 BRGHEQJUWHUPGC-UHFFFAOYSA-N 261.277 2.315 10 20 CECD CCO[C@@H]1CCC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 825284663 XEMURRLMQJJOTB-TZMCWYRMSA-N 280.324 2.348 10 20 CECD C/C=C/C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 737857517 NNGUWJCQQZTJDC-NSCUHMNNSA-N 288.391 2.088 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)c1 733806433 CQRWBTGWSHZFTF-AGNJHWRGSA-N 291.347 2.146 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CC[C@@H](F)C1 836320751 SGIZKBGHYKYQDZ-CQSZACIVSA-N 289.354 2.316 10 20 CECD CON1CCC(N(C)Cc2ccc(N(C)C)cc2)CC1 835075801 BQRPXXQTKPJSIN-UHFFFAOYSA-N 277.412 2.210 10 20 CECD CC[C@@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 834909599 SOCJZVYJMCQTJT-NVXWUHKLSA-N 289.423 2.462 10 20 CECD Cc1ccoc1CNCc1cc([N+](=O)[O-])ccc1O 742368939 RURNXQDPZGXOBP-UHFFFAOYSA-N 262.265 2.492 10 20 CECD COCCN(C)CCCN[C@H](C)c1cccc(OC)c1O 846139642 PXOLLJLNEJEHHM-CYBMUJFWSA-N 296.411 2.020 10 20 CECD CC[C@@H](C)[C@H](CNC(=O)NCCc1ccc(N)cc1)OC 841907597 DFBRGAWTRXSXPS-DOMZBBRYSA-N 293.411 2.172 10 20 CECD CCc1cccc(CNCc2cnn(CCOC)c2)c1O 848909435 TYOPXLTVXYPPSE-UHFFFAOYSA-N 289.379 2.087 10 20 CECD CSCCNC(=S)NCc1cc(Cl)ccc1O 844583584 DACDCJHLKIETTB-UHFFFAOYSA-N 290.841 2.373 10 20 CECD CN(C)c1ccc(CNCCC[C@@H]2CCCN2)cc1 841072093 GEZXCQKFGFOSDF-OAHLLOKOSA-N 261.413 2.374 10 20 CECD CN[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 843045770 VYBVCZNMUFHYDG-INIZCTEOSA-N 273.424 2.471 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)c1cnn(C)n1 925082045 TXJKGVDDTLPSDM-LBPRGKRZSA-N 273.384 2.040 10 20 CECD C[C@H]1C[C@H](N)CCN1Cc1c(O)ccc(Cl)c1F 846703697 PMKYGZSFHNYCSY-DTWKUNHWSA-N 272.751 2.496 10 20 CECD CS[C@H](C)CNC(=O)NCc1cc(C)ccc1O 858313107 JGIFCBNUWXOGCX-SNVBAGLBSA-N 268.382 2.251 10 20 CECD O=C(C[C@H]1CSCCS1)NCc1ccccc1O 752130768 VANSWVRYARBLLI-NSHDSACASA-N 283.418 2.247 10 20 CECD COc1ccc(N(C)C[C@@H]2COC(C)(C)O2)cc1F 851808217 MHFXWBSXAOUIRG-LLVKDONJSA-N 269.316 2.422 10 20 CECD C[C@@H]1C[C@@H](O)CN1Cc1c(O)cccc1Br 862339381 RMUWHPROXCMYSU-RKDXNWHRSA-N 286.169 2.110 10 20 CECD CC[C@@](C)(O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 935463624 KIBGIEPUMBTCHC-XHDPSFHLSA-N 264.369 2.091 10 20 CECD Cc1ccc(O)c(CNC(=O)CCCC(=O)C2CC2)c1 862755763 XZXHMVVNHAFWQY-UHFFFAOYSA-N 275.348 2.466 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)[C@H](O)C(F)(F)F)c1O 866463643 OPSFALXZODBGGS-UBJUHAIHSA-N 293.285 2.363 10 20 CECD CC(C)[C@@H](C)N(C)Cc1cc2c(cc1O)OC[C@@H]2O 768439332 KITJRTKQHZJKIA-YGRLFVJLSA-N 265.353 2.294 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CN(C)C2CCC2)c1 863865623 IGTORJGPNNLKOF-NSHDSACASA-N 292.379 2.062 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H]1CCCN(C)C1=O 1118797353 HMSVCAJKRZYEDZ-FRRDWIJNSA-N 288.391 2.459 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCNCC1CC1 870855720 JMIXNIQGHYGMHC-UHFFFAOYSA-N 289.423 2.101 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)NCc1c(C)cccc1O 877147674 ZIBMZWJXLFCKPX-NWDGAFQWSA-N 264.369 2.093 10 20 CECD CCOCc1cc(CNC[C@H]2C[C@H](O)C2)ccc1OC 873177457 NOTJRRPQMFUGGY-CTYIDZIISA-N 279.380 2.092 10 20 CECD Cc1cccc(O)c1CN1CCC2(CC1)CCN(C)C2=O 877481683 PNLAOJWNJSAZJM-UHFFFAOYSA-N 288.391 2.145 10 20 CECD C[C@@H](N[C@H](C)c1ccccc1O)c1nc(N)nc(Cl)n1 879648863 CVRBSYPTULZLNZ-HTQZYQBOSA-N 293.758 2.225 10 20 CECD CO[C@H](CNCc1ccc(C)cc1O)C(F)(F)F 877027077 KCGMAIFKCOWVOX-LLVKDONJSA-N 263.259 2.368 10 20 CECD Cc1cccc(CN2CCCC[C@H]2C2OCCO2)c1O 775674862 MQYAXHKJNFOCBR-AWEZNQCLSA-N 277.364 2.428 10 20 CECD C[C@@H](NC(=O)CN(C)C1CCC1)c1ccccc1O 881441437 WWJIPLRCCJQLKM-LLVKDONJSA-N 262.353 2.054 10 20 CECD C[C@@H](O)[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 780787562 VYBROLNIGNDUBS-RKDXNWHRSA-N 273.735 2.387 10 20 CECD CCOc1ccc(CNCCC2(O)CCC2)c(O)c1 790637721 MUGRQSFRTPJRDI-UHFFFAOYSA-N 265.353 2.186 10 20 CECD Oc1ccc(Cl)c(F)c1CNCc1cocn1 790961492 WDTAJSYFGXKFAR-UHFFFAOYSA-N 256.664 2.463 10 20 CECD Oc1ccc(Cl)cc1CN1CCO[C@H]([C@@H]2CCCO2)C1 91927158 DRFJROCLRRZGKU-GJZGRUSLSA-N 297.782 2.425 10 20 CECD CN(CCOCC(F)(F)F)Cc1ccccc1O 109769090 HZYNXOKHRCGJNX-UHFFFAOYSA-N 263.259 2.403 10 20 CECD C[C@@H](CCCCC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1321907006 LPBDABBWONCMRS-JTQLQIEISA-N 296.323 2.424 10 20 CECD CN(C)c1cc(F)c(CNCCN2CC=CCC2)cc1F 1328701061 AWKGOJGKMRZHPA-UHFFFAOYSA-N 295.377 2.382 10 20 CECD CCCn1ncc(C(=O)NCc2ccc(N)cc2)c1C 1343574705 DBPVOAXHENHQKK-UHFFFAOYSA-N 272.352 2.114 10 20 CECD CN(C)c1ccc(OCc2ccns2)cc1C(=O)O 1606060418 JJNIHKFRVYHCEG-UHFFFAOYSA-N 278.333 2.486 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@@H](C(=O)O)C2)c1 1607277037 LYYMRWQAUDIAIK-HBNTYKKESA-N 279.336 2.305 10 20 CECD Cc1cc(CN[C@](C)(C(=O)O)C2CC2)ccc1N(C)C 1610460047 SSJAKBOHTMFVOZ-INIZCTEOSA-N 276.380 2.404 10 20 CECD c1csc(SCc2ccc(-c3nn[nH]n3)cn2)n1 1593589409 ZAKUGAUNGWOXPB-UHFFFAOYSA-N 276.350 2.011 10 20 CECD COc1cc(C)c(CN2C[C@H](C)C[C@@H](C(=O)O)C2)c(O)c1 1594054280 UKRUCRSZADGZOJ-ZYHUDNBSSA-N 293.363 2.252 10 20 CECD CCOc1ccc(N(C)Cc2cc(=O)n3nccc3[nH]2)cc1 150728595 LPPQXHJEGDHILA-UHFFFAOYSA-N 298.346 2.058 10 20 CECD COCCN(Cc1cc(OC)c(C)cc1O)CC(F)F 160100485 BIFGECCUTHIMNX-UHFFFAOYSA-N 289.322 2.423 10 20 CECD CC(=O)NC[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 155585757 SIMBVBVFXSYUHD-LBPRGKRZSA-N 296.798 2.394 10 20 CECD CC(C)(C)C[C@@H](O)CNC(=O)Nc1ccc(N)cc1 841299331 AHEJMPJNMZWAPP-GFCCVEGCSA-N 265.357 2.187 10 20 CECD CC[C@@H](C)N1CCN(Cc2c(O)cccc2OC)CC1 825098351 HJSYLISPVXYLCB-CYBMUJFWSA-N 278.396 2.317 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](N)[C@H](C)C2)c1O 252849835 INUYZXOVBXQHPS-BXKDBHETSA-N 284.787 2.223 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)c2nncn2C)c(O)c1 37016328 XQLGGOPIOYJTTG-MNOVXSKESA-N 260.341 2.241 10 20 CECD CC[C@H]1COCCN1Cc1cc(F)cc(C(C)=O)c1O 37329006 RCLLFVFTAQPPON-ZDUSSCGKSA-N 281.327 2.345 10 20 CECD CC[C@](C)(CNCc1cccc(OC)c1O)OC 322487439 APAZTNYBYFISSN-CQSZACIVSA-N 253.342 2.306 10 20 CECD Nc1ccc(CNS(=O)(=O)Cc2ccccc2F)cc1 396587741 KVGHXZMUPJDQAG-UHFFFAOYSA-N 294.351 2.028 10 20 CECD COc1ccc(CNCc2cccc(OC)c2O)nc1 894458485 SJMQRNQYSXCNPQ-UHFFFAOYSA-N 274.320 2.094 10 20 CECD COc1cccc(CNC(=O)c2cccc(F)c2)c1O 68488676 CUVDKJZXHKSYTK-UHFFFAOYSA-N 275.279 2.470 10 20 CECD Cc1ccc(O)c(CNC2CCN(C(=O)C3CC3)CC2)c1 71407924 AYTXQIQXQRACTJ-UHFFFAOYSA-N 288.391 2.191 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@]2(C)CCCO2)cc1 126977114 DTKKXNNQDPOVBU-INIZCTEOSA-N 291.395 2.121 10 20 CECD COc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C)C2)c1O 217915635 ZRYRIZJAVFJRRV-DZGCQCFKSA-N 290.407 2.317 10 20 CECD CCN1CCN(Cc2cc(C)ccc2O)C(C)(C)C1=O 190029927 CKMASROCXJUFNX-UHFFFAOYSA-N 276.380 2.143 10 20 CECD O=C(c1c[nH]nc1[C@@H]1CCCNC1)N1CCc2ccccc21 422909793 GVKPUEOFJOYJBW-CYBMUJFWSA-N 296.374 2.080 10 20 CECD CN(C)c1ccc(CNC(=O)Nc2ccncn2)cc1F 194106423 JYEQQCOUWCPEMS-UHFFFAOYSA-N 289.314 2.003 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CN3CCC[C@@H]3CO2)c(O)c1 91666274 AQEPXKZNEPWJBO-RRFJBIMHSA-N 290.407 2.214 10 20 CECD O=C(NCc1ccccc1O)NC[C@@H]1CSCCS1 267838193 KMSGZXKOQCNXQG-LLVKDONJSA-N 298.433 2.040 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1c[nH]c(C)n1 264865142 QANMSSOFTBLAHC-UHFFFAOYSA-N 273.336 2.476 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1C 368963200 IOSZHQATWLYBJD-DUVNUKRYSA-N 288.391 2.095 10 20 CECD C[C@H](N[C@@H]1COC[C@H]1O)c1ccc(Cl)c(Cl)c1O 295982603 OWWPCNURXXSAJR-WQGWLQIFSA-N 292.162 2.109 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCSC1 813513367 LTIFCJDSEZCXGQ-PWSUYJOCSA-N 295.404 2.288 10 20 CECD C[C@H](N[C@@H]1CCCNCC1)c1ccc(F)cc1O 817969760 ZLZQUPNUVPISOF-CMPLNLGQSA-N 252.333 2.324 10 20 CECD Cc1cccc(CN(CC(F)F)C[C@H](C)O)c1O 825098199 CUJGGJQUJOCWKW-JTQLQIEISA-N 259.296 2.149 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCN(C)C2)cc1 729523908 XZEFFXHQENZZQV-HNNXBMFYSA-N 289.423 2.101 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCc2cncn2C1)c1ccccc1O 827946207 AKKQJODCOYJFJW-VXGBXAGGSA-N 285.347 2.029 10 20 CECD CN(C)c1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)nc1 588405545 DOZVSJNVDYQCAH-YWEYNIOJSA-N 299.330 2.211 10 20 CECD COC(=O)C1CCC(NCc2ccc(OC)cc2O)CC1 730107481 LKKCYDMISHCIAP-UHFFFAOYSA-N 293.363 2.222 10 20 CECD COc1ccc(O)c(CN[C@H](C)C2(OC)CCOCC2)c1 834651014 UFUDQQHSYUWXDP-GFCCVEGCSA-N 295.379 2.075 10 20 CECD CCOCc1cc(CN[C@@H](C)C(C)(C)O)ccc1OC 734841396 NMNLPQBFGILVDT-LBPRGKRZSA-N 281.396 2.481 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=S)NCC1CC1 849257105 DMHBPUSLMIUVAY-UHFFFAOYSA-N 277.437 2.435 10 20 CECD CCOc1cccc(CN2C[C@@H]3[C@H](C2)C3(F)F)c1O 846113557 YNBMVNUZZLBGJT-PHIMTYICSA-N 269.291 2.488 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@@H]2CN)cc1F 841029087 FUYCULKQGLITGC-OCCSQVGLSA-N 265.376 2.109 10 20 CECD CN(CCC[C@H]1CCOC1)c1ccc(OCC(=O)O)cc1 846279827 MUZARWITIWZYTP-ZDUSSCGKSA-N 293.363 2.403 10 20 CECD COc1cccc(O)c1CNC[C@H](O)c1ccc(C)o1 741260620 IJXCXGNIAQKXGL-ZDUSSCGKSA-N 277.320 2.125 10 20 CECD CC(C)[C@@H](CNCc1cc(Cl)ccc1O)C(=O)O 848639707 JTXIGIZITLROPU-LLVKDONJSA-N 271.744 2.492 10 20 CECD C[C@@H]1C[C@H](NCc2ccc3c(c2)CCCN3C)c2ncnn21 924868714 CYTWQZPKXUOOBG-DOMZBBRYSA-N 297.406 2.456 10 20 CECD C[C@H](Cn1cccn1)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 756672277 MVFCSAMZFHPILS-GHMZBOCLSA-N 290.323 2.236 10 20 CECD Cc1ncc(CNCc2ccc3c(c2)CCCN3C)n1C 850099015 DDGUWSQKZSBVOS-UHFFFAOYSA-N 284.407 2.401 10 20 CECD CCc1cc(C(=O)NCc2cc(Cl)ccc2O)nn1C 1118269052 FAKOOXKGPJGYOJ-UHFFFAOYSA-N 293.754 2.272 10 20 CECD Cc1ccncc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773766968 FJELARPZOGENST-NSHDSACASA-N 286.331 2.162 10 20 CECD COC[C@@H](NCc1ccc([N+](=O)[O-])c(OC)c1O)C(C)C 775026980 CVMFZRLUVXPFSC-LLVKDONJSA-N 298.339 2.070 10 20 CECD C[C@@H]1CCc2[nH]nc(C(=O)N(C)c3ccc(N)cc3)c2C1 884441689 NHPDOUOFNFJWTQ-SNVBAGLBSA-N 284.363 2.393 10 20 CECD C[C@@H](NCC(=O)NC1CCCC1)c1ccc(N(C)C)cc1 772980902 NAHQVCFIONRKGL-CYBMUJFWSA-N 289.423 2.462 10 20 CECD CCOC[C@H]1CCCCN1C(=O)NCc1ccc(N)cc1 1120677821 XNCOUVHKMPTICK-OAHLLOKOSA-N 291.395 2.369 10 20 CECD Cn1ncc([N+](=O)[O-])c1NCCCSc1nccs1 892515495 TWVNIUDJWWIKRD-UHFFFAOYSA-N 299.381 2.379 10 20 CECD COc1ccc(CNC[C@](C)(OC)C2CC2)c(O)c1OC 894563092 AWQIDYKHBAERRN-INIZCTEOSA-N 295.379 2.314 10 20 CECD COc1ccc(CNCCc2cscn2)c(O)c1OC 893042142 QWTFHLVDJBUALU-UHFFFAOYSA-N 294.376 2.198 10 20 CECD C/C(=C\C(=O)OCC(=O)c1ccc(O)c(O)c1)C1CC1 783087627 VJKKHKYOESYEGW-RMKNXTFCSA-N 276.288 2.180 10 20 CECD CCOC(=O)[C@H](C)[C@H](C)NCc1cc(C)cc(OC)c1O 894453542 HLXUNLWBOCWVCU-NEPJUHHUSA-N 295.379 2.387 10 20 CECD C/C=C/C[C@@H](CO)NCc1cc(C)cc(OC)c1O 894480160 MIPYCZHIGGVOQA-IHVVCDCBSA-N 265.353 2.126 10 20 CECD COc1ccc(CNC(=O)c2ccc(C)cn2)c(O)c1 794374634 WXYUMSHXDMPDOW-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CCOC[C@@H]1C 796497695 ODAOFKPHYRACIQ-RYUDHWBXSA-N 265.353 2.163 10 20 CECD COc1cc(C(=O)NCc2ccc(N(C)C)cc2)ccn1 1318595697 XTDCGJJLPAJBHY-UHFFFAOYSA-N 285.347 2.086 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1cccc(F)c1O 83513815 HSKIRHLPWOHTDC-LBPRGKRZSA-N 269.316 2.209 10 20 CECD CCOc1cccc(CNCCOCC(F)F)c1O 190898735 FZHMKTHLCHJMDZ-UHFFFAOYSA-N 275.295 2.162 10 20 CECD C[C@H](CN1CCCC1=O)N[C@H](C)c1ccc(F)cc1O 62747751 UTXBIPZCMVBGJW-GHMZBOCLSA-N 280.343 2.193 10 20 CECD CC1(CCN[C@H]2CCc3cccc(O)c32)OCCO1 716044965 OVICDUYKGQRABI-LBPRGKRZSA-N 263.337 2.122 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1cc(C)cc(OC)c1O 1332708563 STYMHKMPGWQXAK-GFCCVEGCSA-N 295.379 2.483 10 20 CECD O=C(O)C1(CNCc2cc(F)cc(F)c2O)CCC1 1332017935 VISIBOBSAGSVRG-UHFFFAOYSA-N 271.263 2.015 10 20 CECD O=C(O)C[C@@H](NCc1ccc2c(c1)CCCO2)C1CC1 1355405058 FWHWUKBJCIBLQL-CQSZACIVSA-N 275.348 2.355 10 20 CECD Cc1cccc(O)c1CN(C)[C@@H](COC(C)C)C(=O)O 1607858188 LGLDNEFPMFAGLQ-ZDUSSCGKSA-N 281.352 2.011 10 20 CECD COc1ccc(O)c([C@H](C)Nc2ncc(C(=O)O)cn2)c1 1599598277 KJHOFMIRMPNBDT-QMMMGPOBSA-N 289.291 2.062 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C)[C@H]2CCOC2)c1O 163076468 QPLCXMDQVCOHQC-ONGXEEELSA-N 281.327 2.249 10 20 CECD COc1cccc(CNC(=O)NCCC2CCC2)c1O 152035099 MAOGRIICPOLSMZ-UHFFFAOYSA-N 278.352 2.390 10 20 CECD Cc1nn(C)cc1CN1CCOc2cc(N(C)C)ccc21 154921431 DUXUEDXRAIEUME-UHFFFAOYSA-N 286.379 2.194 10 20 CECD c1cc2c(cc1CNC[C@@H]1CCCNC1)CCCO2 259042243 PPPGLIUSFFKNOP-CQSZACIVSA-N 260.381 2.101 10 20 CECD C[C@@H](C(=O)N[C@H](C)c1ccccc1O)n1cccn1 827922926 DISZQBOPEDAQHH-MNOVXSKESA-N 259.309 2.027 10 20 CECD C[C@@H]1CCN(Cc2cc(F)ccc2O)[C@H](C(=O)O)C1 1594424441 SPONXXLBSLFSBP-SKDRFNHKSA-N 267.300 2.216 10 20 CECD CN1CCC[C@H](CNCc2ccc3c(c2)CCO3)C1 44533025 FUIBIIABFLZOAP-CQSZACIVSA-N 260.381 2.053 10 20 CECD CCOc1cccc(CNC[C@@H]2CCCC[C@H]2O)c1O 77204936 LRXBJMYFWRBPJQ-GXTWGEPZSA-N 279.380 2.432 10 20 CECD CC(C)SCC(=O)NCCc1ccc(N)cc1 700965168 YEXOTLIIJFLTLA-UHFFFAOYSA-N 252.383 2.069 10 20 CECD CC(C)N1CC[C@@H](CNCc2cc(F)cc(F)c2O)C1 708559294 ODOUXTNIOFZLGV-NSHDSACASA-N 284.350 2.490 10 20 CECD O=C(O)[C@H]1CN(C(=O)/C=C/c2cccnc2)c2ccccc21 177469513 LKOPIAIRGNWYIE-NPQIQWPPSA-N 294.310 2.310 10 20 CECD CC(C)CC(=O)NCc1ccc(N2CCOCC2)c(F)c1 55522677 NYOLGCVFAQJRJG-UHFFFAOYSA-N 294.370 2.325 10 20 CECD CC[C@H](NCC1CCS(=O)(=O)CC1)c1ccccc1O 121095812 XMUGRPADFOTJNX-AWEZNQCLSA-N 297.420 2.258 10 20 CECD CC(C)[C@@]1(C)C[C@@H]1C(=O)NCc1ccc(O)c(O)c1 186462332 QDMQKKZOUBTZCQ-IAQYHMDHSA-N 263.337 2.396 10 20 CECD CCOC(=O)[C@H]1CCCN(C(=O)Nc2ccc(N)cc2)C1 217313606 IBBBYWXDZDAKMS-NSHDSACASA-N 291.351 2.076 10 20 CECD COc1ccc(N2CCCN(Cc3ccno3)CC2)cc1 77234922 OLXMUQSJJCBDOC-UHFFFAOYSA-N 287.363 2.396 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@H]2CC[C@@H](C1)N2 132199587 DRRBJWLSOBPCKN-MNOVXSKESA-N 266.772 2.372 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC(C)(C)N)cc1F 236906066 KKYKYVTUMWUFQA-UHFFFAOYSA-N 295.402 2.416 10 20 CECD CCN(CC)[C@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 97987274 OHFQEVNGKOUATK-ZDUSSCGKSA-N 292.379 2.037 10 20 CECD CCOC[C@@H]1CN(Cc2cc(C)c(C)cc2O)CCO1 529666381 KFFAUCRSVUIGSN-HNNXBMFYSA-N 279.380 2.246 10 20 CECD COc1ccc(N2CCC(NC[C@@H](O)C(C)C)CC2)cc1 368644060 VFRHRAWBCRJZQU-QGZVFWFLSA-N 292.423 2.271 10 20 CECD Cc1cc(=O)c(C(=O)NCc2ccccc2O)cn1C1CC1 283256434 CVUOZCMVLDBKTA-UHFFFAOYSA-N 298.342 2.127 10 20 CECD C[C@H]1C[C@@H](C)O[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 282353169 AGRROSAABFUZLP-ZOWXZIJZSA-N 276.380 2.182 10 20 CECD CN(C)c1ccc(CNC(=O)C2CCC2)cc1F 299333537 NLGYFUOXJLPATE-UHFFFAOYSA-N 250.317 2.308 10 20 CECD CCc1nnc(NC(=O)NCc2ccccc2O)s1 299493560 KFHMNPSMXFOHKZ-UHFFFAOYSA-N 278.337 2.128 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@H]2CC(=O)N(C)C2)c1O 808689172 ZLTFJSLXCLUFBV-ONGXEEELSA-N 282.771 2.235 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](CO)C(C)C)c1 806168903 DWQAJQSXXOUADN-WCQYABFASA-N 295.379 2.094 10 20 CECD COCC1(CN[C@@H](C)c2ccccc2O)CCOCC1 293865630 YAHDDDKGEARCGU-ZDUSSCGKSA-N 279.380 2.486 10 20 CECD O=C(NCCC[C@H]1CCCCO1)c1c(F)ccc(O)c1O 295060571 YRFUJNBVWRLEDI-SNVBAGLBSA-N 297.326 2.316 10 20 CECD C[C@H](CCCN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 817977286 GSBQWPLCSUFZEM-NXEZZACHSA-N 267.329 2.078 10 20 CECD CC(C)(C(=O)NCCc1ccc(N)cc1)c1cccnc1 818544961 YBGHZTHAKNOEQP-UHFFFAOYSA-N 283.375 2.300 10 20 CECD COCCNCCN[C@@H](C)c1cc(Cl)cc(C)c1O 817965571 XVJOSIZDVLJEHW-NSHDSACASA-N 286.803 2.241 10 20 CECD Cc1ccc(C(=O)N2CC(C(F)(F)F)C2)c(O)c1O 829144757 RFKMSFDOLJXIFS-UHFFFAOYSA-N 275.226 2.041 10 20 CECD CC[C@@H](O)[C@H](C)C(=O)NCc1ccc(N2CCCC2)cc1 822575911 BMLLUCXYHOLHTF-XJKSGUPXSA-N 290.407 2.310 10 20 CECD CCOc1ccc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(O)c1 824836852 CMAFQRZZHNVPPQ-YALNPMBYSA-N 287.359 2.176 10 20 CECD O=CN1CCCN(Cc2ccc3ccccc3c2O)CC1 827867244 DRQBCFOBYZGZQG-UHFFFAOYSA-N 284.359 2.210 10 20 CECD CC[C@@H](CNC/C=C\c1ccc(N(C)C)cc1)C(=O)O 903709136 CMKUEZDPDFKWPJ-GXMNPTEKSA-N 276.380 2.466 10 20 CECD CNC(=O)C[C@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 834898635 AJZLRXRKYLBSGW-JQWIXIFHSA-N 264.369 2.184 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@H]1CCOC1 739575073 GACXLMLCLDFUQG-CYBMUJFWSA-N 276.380 2.104 10 20 CECD CC(C)(C)SCC(=O)NCc1ccc(O)cc1O 910953482 BYUCGLJGEDXRRD-UHFFFAOYSA-N 269.366 2.246 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@H](C)c1cc2c(cc1O)CCCC2 840826648 RDOSLZQSGANYEM-XQAQDONZSA-N 291.391 2.335 10 20 CECD COC[C@H](CC(C)C)NCCc1ccc(N)cc1 841036542 UUXDOHYOVJFHII-HNNXBMFYSA-N 250.386 2.462 10 20 CECD CCN1C[C@@H](CNCc2cc(Cl)ccc2O)CC1=O 846095700 ZHOQUVFRDLERCA-SNVBAGLBSA-N 282.771 2.004 10 20 CECD Cn1cc(C(=O)NCc2ccccc2O)c(C(F)(F)F)n1 748345848 PPTIRQFXVSXHHZ-UHFFFAOYSA-N 299.252 2.075 10 20 CECD CS[C@H]1CC[C@H](NC(=O)c2cc(O)cs2)C1 743729394 ZNOMKMHAWVCANX-CBAPKCEASA-N 257.380 2.468 10 20 CECD CCn1cnnc1CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756418353 APNIOPMGFAPUGY-ONGXEEELSA-N 290.342 2.481 10 20 CECD CCNC(=O)C(C)(C)CNCc1ccc2c(c1)CCCO2 921914060 FMHHCEIVGYWSIG-UHFFFAOYSA-N 290.407 2.264 10 20 CECD COc1ccc(N(C)Cc2cn(C)nc2C)cc1OC 761221422 KLSMUDGUVJKICJ-UHFFFAOYSA-N 275.352 2.382 10 20 CECD Cn1cc(CN2CCCc3cc(OC(F)F)ccc32)nn1 761673622 SNUTWIMGNBHCSR-UHFFFAOYSA-N 294.305 2.369 10 20 CECD CCOc1ccc(CN2CCO[C@H](C)C2)c(O)c1 768226689 AUNIAIQMSLQGHT-LLVKDONJSA-N 251.326 2.012 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2SCCS2)c1 761967385 MJYGZCFPMYLFLC-QMMMGPOBSA-N 299.417 2.384 10 20 CECD COc1ccc(N(C)Cc2c(C)nn(CCO)c2C)cc1 1118309933 CIQXRRDHGZYQHX-UHFFFAOYSA-N 289.379 2.137 10 20 CECD CN(C)CC1(C(=O)NCCCSc2nccs2)CC1 874466399 OAWXQMXAKJLGSN-UHFFFAOYSA-N 299.465 2.083 10 20 CECD COC(=O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1ccc(C)cc1O)C2 877584262 YHPNHAFNXQMWDK-BPLDGKMQSA-N 289.375 2.474 10 20 CECD Cc1cccc(CN(C)CC(=O)NCc2ccccc2)c1O 775713464 URXQSJJACKDQQL-UHFFFAOYSA-N 298.386 2.449 10 20 CECD CCO[C@@H]1CCCN(Cc2cc(OC)c(OC)cc2O)C1 775634915 ZMWMXHABRIBLRT-CYBMUJFWSA-N 295.379 2.410 10 20 CECD CN(Cc1ccccc1O)C(=O)CCC(=O)c1ccccn1 771409057 WLUZVIPREIPSCK-UHFFFAOYSA-N 298.342 2.409 10 20 CECD N=C(NCc1ccc(N2CC=CC2)cc1)NCC1CC1 887355579 VVBREOVIDFSVSZ-UHFFFAOYSA-N 270.380 2.087 10 20 CECD COc1ccc(CNC/C=C/C2CC2)c(O)c1OC 1120056493 BPHMSRBWLCXREX-ONEGZZNKSA-N 263.337 2.465 10 20 CECD CN(C)c1ccc(CN2CC[C@H]3CC[C@@H](C2)N3)cc1 132222494 LYEWKCMUKXMELX-CABCVRRESA-N 259.397 2.079 10 20 CECD CN(C)c1ccc(CNC[C@H]2COC(C)(C)O2)cc1F 892738811 XONVDNBOVXBDMO-LBPRGKRZSA-N 282.359 2.133 10 20 CECD COc1ccc(CNC(=O)c2cccnc2C)c(O)c1 794387364 FASRQWRZOMBZCB-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COc1ccc(CNCCCNC(=O)[C@H]2C[C@H]2C)cc1C 1154309686 RONPOVYYBBHOAY-DOMZBBRYSA-N 290.407 2.256 10 20 CECD CC(C)SCC(=O)N(C)Cc1ccccc1O 701132732 RQDNVLPKKVKETQ-UHFFFAOYSA-N 253.367 2.492 10 20 CECD CCc1cccc(CN(CC(N)=O)C2CCCC2)c1O 692093622 QUIRVURQNFTMBL-UHFFFAOYSA-N 276.380 2.185 10 20 CECD Cc1cc(CN(C)Cc2ccc(N(C)C)cc2)nn1C 768158711 VBCBHIAKNJODNT-UHFFFAOYSA-N 272.396 2.427 10 20 CECD CCOC(=O)[C@@H](NCc1ccc(OC)c(C)c1)C1CC1 1338877744 BQUMSTMJXOTDOR-HNNXBMFYSA-N 277.364 2.435 10 20 CECD CCn1[nH]cnc1=NCc1cc(Cl)cc(Cl)c1O 1347796738 FSZNVYKRSIPEAU-UHFFFAOYSA-N 287.150 2.344 10 20 CECD CC(C)C[C@@H](CCO)CNC(=O)NCc1ccc(N)cc1 1353367162 OTYVCZYZULUIGY-CQSZACIVSA-N 293.411 2.113 10 20 CECD Nc1ccc(CNC(=O)CCCCN2CCCC2)cc1 1515330864 AZEDANDBUQKYPL-UHFFFAOYSA-N 275.396 2.151 10 20 CECD Cc1oc(/C=C2\SC(=S)N(C)C2=O)cc1C(=O)O 1600838014 LEBYGWOJXLHPKS-YWEYNIOJSA-N 283.330 2.117 10 20 CECD Cc1cnc(CSc2ncc(C(=O)O)s2)cn1 1600622505 PTUVCUGQBYMIDC-UHFFFAOYSA-N 267.335 2.232 10 20 CECD Nc1ccc(CNC(=O)NC[C@@H]2CCC3(CCC3)O2)cc1 1580445563 KJYIAKNPGYQNOK-AWEZNQCLSA-N 289.379 2.170 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCCNC(=O)C1CC1 168734544 WEFIIZHZBLEXKM-AAEUAGOBSA-N 288.391 2.365 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCNC(=O)C1CC1 168734605 WEFIIZHZBLEXKM-DGCLKSJQSA-N 288.391 2.365 10 20 CECD CC(C)(C)C[C@H](O)CNC(=O)Nc1ccc(N)cc1 841299333 AHEJMPJNMZWAPP-LBPRGKRZSA-N 265.357 2.187 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1CCN2CCC[C@@H]2C1 226585177 DNUTZQRRQBOVKY-ZIAGYGMSSA-N 264.344 2.248 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H](O)c1ccccc1 121568402 OAGFXNWTXZZLJQ-OAHLLOKOSA-N 271.316 2.084 10 20 CECD C[C@H](NCc1cc2c(cc1O)OCO2)c1cccnc1 42879453 LNICXYFYIJHQAP-JTQLQIEISA-N 272.304 2.367 10 20 CECD C[C@@H](NCC1([S@](C)=O)CCC1)c1ccc(F)cc1O 281172006 WIHDNIAFVVVNGP-DGIBIBHMSA-N 285.384 2.483 10 20 CECD Cc1ccc(CNCc2cc3c(cc2O)OCO3)o1 53036959 FUDQCYLZOZHIAE-UHFFFAOYSA-N 261.277 2.312 10 20 CECD O=C(CCOc1ccccc1)NCc1ccccc1O 82286180 DXMFFKCINVSGBZ-UHFFFAOYSA-N 271.316 2.478 10 20 CECD Oc1cccc(Cl)c1CNCCC1CC(O)C1 702471317 ZRAJZSIVSJLFBH-UHFFFAOYSA-N 255.745 2.296 10 20 CECD C[C@H](O)C1(NCc2cccc(Br)c2O)CC1 827579693 HJORIAOVBTUYSC-QMMMGPOBSA-N 286.169 2.158 10 20 CECD COc1cccc(CNC(=O)CCc2ccco2)c1O 68488934 IOYLKKYCKOWQGX-UHFFFAOYSA-N 275.304 2.243 10 20 CECD O=C(NC[C@H]1CCCCS1)c1cccc(O)c1O 126490077 XLCXAAOREVPIJN-SECBINFHSA-N 267.350 2.113 10 20 CECD CN(Cc1ccncc1)C(=O)NCc1ccc(N(C)C)cc1 31728832 JLMUQUMMWMMBJP-UHFFFAOYSA-N 298.390 2.489 10 20 CECD COCCCCN[C@H](C)c1cc(OC)ccc1O 44655755 XDSYDXFYXZQLNX-LLVKDONJSA-N 253.342 2.478 10 20 CECD C[C@@H]1CCC[C@H](CO)N1Cc1ccc(N(C)C)cc1 193439783 NFULROIQMQAFPB-CZUORRHYSA-N 262.397 2.488 10 20 CECD Cc1cc(O)c(CN(C)CCNC(=O)C(C)C)cc1C 92103966 NFILRFRSRTWXRU-UHFFFAOYSA-N 278.396 2.213 10 20 CECD COc1ccc(O)c(CN2CC[C@]3(CCOC3)C2)c1 180615925 WUGRSGDGWMQKCO-HNNXBMFYSA-N 263.337 2.013 10 20 CECD Cc1cc(C)c(O)c(CN2CCO[C@H]([C@H]3CCCO3)C2)c1 246764101 OXFPJQNXYNBYBL-CVEARBPZSA-N 291.391 2.389 10 20 CECD COc1cc(CN2C[C@H](C)OC[C@H]2C)c(O)cc1C 245540836 NBELWAXYRWEWAJ-NEPJUHHUSA-N 265.353 2.318 10 20 CECD C[C@H](NC(=O)N(C)Cc1ccccc1O)c1cnn(C)c1 266748059 FBUFPNHOKBUHBB-NSHDSACASA-N 288.351 2.028 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1c1cccnc1 365559833 KIWYCEXORSLUQT-ZDUSSCGKSA-N 284.315 2.470 10 20 CECD CC[C@@H](N[C@@H]1CCN(CCOC)C1)c1ccc(C)cc1O 279973784 DDTHQZBRRHJPMY-GDBMZVCRSA-N 292.423 2.462 10 20 CECD CC[C@@H]1CN(Cc2cccc(C)c2O)C[C@H](C)S1(=O)=O 289970754 ZCFVQSUQLXCDHS-GXTWGEPZSA-N 297.420 2.098 10 20 CECD CC[C@@H](N[C@H](CO)c1cnn(C)c1)c1ccc(C)cc1O 280245552 WGHBTXGVDRNHLL-HUUCEWRRSA-N 289.379 2.208 10 20 CECD CN(Cc1ccccc1O)c1nnc(-c2ccc[nH]2)n1C 809864521 KRMRJNJBNZADPF-UHFFFAOYSA-N 283.335 2.152 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2O[C@@H](C)C[C@H]2C)c1 800519154 MIFLTFRXLBHBQG-DZHLUBAWSA-N 293.363 2.392 10 20 CECD CC1(C)OCC[C@H]1NCc1ccc(N2CCOCC2)cc1 293812142 RQVCVEGGUDZXBA-MRXNPFEDSA-N 290.407 2.180 10 20 CECD CC[C@H](NCC1(CC(N)=O)CC1)c1ccc(N(C)C)cc1 817586837 SSCBCPNOATXIRF-HNNXBMFYSA-N 289.423 2.449 10 20 CECD CCOC(=O)[C@@H](CC)C(=O)N[C@H](C)c1ccccc1O 827952598 YFXPNOGIRWPOCO-MNOVXSKESA-N 279.336 2.159 10 20 CECD C[C@@H](NC(=O)c1cc(C2CC2)[nH]n1)c1ccccc1O 827923703 XTWLVVQSZPAUSO-SECBINFHSA-N 271.320 2.484 10 20 CECD CC[C@H](C)[C@H](NCc1cc(F)cc(C(C)=O)c1O)C(=O)O 820465932 YZTYDPQOLSGXHY-SDBXPKJASA-N 297.326 2.323 10 20 CECD Cc1cc(O)c(CN2CC(=O)N(CC3CC3)C2)cc1Cl 825731988 NDULJSNRWJXLPT-UHFFFAOYSA-N 294.782 2.366 10 20 CECD NC1(CNCc2cc(Cl)cc(Cl)c2O)CC1 904449731 KQGIVCQPEMWKDM-UHFFFAOYSA-N 261.152 2.280 10 20 CECD CC(C)C(CNC(=O)C(=O)Nc1ccc(N)cc1)C(C)C 841113912 PCAMYKZDLDHLIA-UHFFFAOYSA-N 291.395 2.252 10 20 CECD C[C@@]1(CN)CCN(Cc2cccc(Cl)c2O)C1 843118050 ZOKWEENAGZRXSI-ZDUSSCGKSA-N 254.761 2.216 10 20 CECD COc1ccc(N2CCN(C(C)C)CC2)c(OC)c1 846745960 QDJILWQGGTVCRJ-UHFFFAOYSA-N 264.369 2.234 10 20 CECD CC(C)[C@H]1CN(Cc2c(O)cccc2Cl)CCN1 843105008 OPPTTWPIVUQVMI-CYBMUJFWSA-N 268.788 2.475 10 20 CECD O=C(NCC1(O)CCCCCC1)c1cc(O)cs1 748364803 MACWMYLPFJFGRM-UHFFFAOYSA-N 269.366 2.269 10 20 CECD COc1cccc([C@H](C)NCCOCC2CC2)c1O 846146344 QDLDBTBCAYOXLG-NSHDSACASA-N 265.353 2.478 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1cccc(Cl)c1O 846705020 WZOWGWHRAWIQKN-ONGXEEELSA-N 254.761 2.357 10 20 CECD CCOc1cccc(CN(C[C@H](C)O)C2CC2)c1O 848928397 CBOGEVZDIDYERI-NSHDSACASA-N 265.353 2.136 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H]2CCC[C@@]2(N)C1 857226261 JKNSISBCRXUEKZ-DOTOQJQBSA-N 273.424 2.374 10 20 CECD C[C@H](NCCN1CCC[C@H]1C)c1cc([N+](=O)[O-])ccc1O 756617663 PGLLOPUEWBEIDH-NEPJUHHUSA-N 293.367 2.435 10 20 CECD C[C@H](NC(=O)N[C@H]1COC[C@@H]1C)c1ccc(N(C)C)cc1 922055137 MVPSEJPKCPAWBI-HUBLWGQQSA-N 291.395 2.148 10 20 CECD CNCC1CCN(Cc2ccc(N(C)C)c(C)c2)CC1 923289935 KIQSKBRUTMXWGQ-UHFFFAOYSA-N 275.440 2.492 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC[C@@H](C)NC1 863649316 CEOMLPHMYXJFOD-UKRRQHHQSA-N 261.413 2.291 10 20 CECD CCOCC[C@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 769790059 UHQOBAYFBBBMKR-CJNGLKHVSA-N 280.412 2.191 10 20 CECD CCOC1CN(Cc2cc(F)c(N(C)C)cc2F)C1 862389159 OZAWTETWALGCJG-UHFFFAOYSA-N 270.323 2.252 10 20 CECD COc1cccc([C@H](C)N[C@H](C)[C@H](O)C(F)(F)F)c1O 866463642 OPSFALXZODBGGS-SXMVTHIZSA-N 293.285 2.363 10 20 CECD CC[C@@H](NCc1ccnc(N(C)C)n1)c1ccccc1O 775531640 KBISUSMOUJVJPG-CQSZACIVSA-N 286.379 2.489 10 20 CECD COc1ccc(N(C)Cc2cc3c(cn2)OCCO3)cc1 877609637 MQMQHBALKXDNEK-UHFFFAOYSA-N 286.331 2.498 10 20 CECD COc1ccc(CN[C@@H](C[C@H]2CCCO2)C(=O)O)cc1C 1119611984 PNKGNSDUFCNFPB-KGLIPLIRSA-N 293.363 2.116 10 20 CECD C[C@@H](NC(=O)Nc1ncccn1)c1ccc(N(C)C)cc1 888693070 RREGOWURNGIKGI-LLVKDONJSA-N 285.351 2.425 10 20 CECD C[C@@H]1C[C@H](NC[C@]2(O)CCO[C@@H]2C)c2c(O)ccc(F)c21 788623260 KNKPCVNYBWEDPA-CDGODJOISA-N 295.354 2.209 10 20 CECD COc1ccc(CNCC(C)(C)C[C@H](C)O)c(O)c1OC 893018745 HPNVAKVTSTZJMN-NSHDSACASA-N 297.395 2.296 10 20 CECD CC(C)CNC(=O)CN[C@@H](C)c1cc(F)cc(F)c1O 1323828624 BZTSTBYMELSVJX-VIFPVBQESA-N 286.322 2.093 10 20 CECD Oc1cccc(Br)c1CNC[C@H]1CCCO1 706871485 AFEDUBJAPVJNRI-SECBINFHSA-N 286.169 2.423 10 20 CECD Cc1cccc(CCCNC(=O)NCc2ccc(N)cc2)n1 1336877951 ZVGFBZGPOCPVKX-UHFFFAOYSA-N 298.390 2.404 10 20 CECD Nc1ccc(CNC(=O)NC2[C@H]3[C@H]4CC[C@@H](C4)[C@H]23)cc1 1336863088 JOLXDKDNQGWXIQ-IMIFBBOLSA-N 271.364 2.113 10 20 CECD CCOC[C@H]1CCN(Cc2cccc(OC)c2O)C1 93839185 LUNSTJJPPSMMMF-LBPRGKRZSA-N 265.353 2.259 10 20 CECD CCC1(N[C@H](C)c2cccc(-c3nn[nH]n3)c2O)CC1 1604092145 MMSRIZZWEFTCAE-SECBINFHSA-N 273.340 2.166 10 20 CECD Cc1ccc(O)c(CNc2cccc(CC(=O)O)n2)c1 1600466923 IJBSPBZGYMGMTM-UHFFFAOYSA-N 272.304 2.335 10 20 CECD Cc1sc(N(C)Cc2ccccc2O)nc1C(=O)O 1600880824 PMPATRJEOQBSOC-UHFFFAOYSA-N 278.333 2.492 10 20 CECD CC(C)(CNCc1ccc(N2CCCC2)cc1)C(=O)O 1590763138 IZWZGMFXHIKMIG-UHFFFAOYSA-N 276.380 2.487 10 20 CECD COCCO[C@H]1CCCN(Cc2cc(C)ccc2O)C1 802653031 NMNXCYGFKCNHCT-HNNXBMFYSA-N 279.380 2.328 10 20 CECD O=C(NCCc1cccc(F)c1)c1cccc(O)c1O 126261516 KFJDAHTVOYEHGK-UHFFFAOYSA-N 275.279 2.209 10 20 CECD O=C(NC[C@@H]1Cc2ccccc21)c1cccc(O)c1O 126469033 ZIWBSDYMXVCCMD-NSHDSACASA-N 269.300 2.168 10 20 CECD C[S@@](=O)C1(CNCc2cccc(Cl)c2O)CCC1 281685045 BAHORAOOBDRKHX-GOSISDBHSA-N 287.812 2.436 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](CO)CC(F)F)c1 717748052 DASSATKQGZMAIE-VHSXEESVSA-N 259.296 2.367 10 20 CECD Oc1ccc(Br)cc1CNCCn1cccn1 227438872 SSGROHQETVKGPD-UHFFFAOYSA-N 296.168 2.141 10 20 CECD CN(C)c1ccc(CNC(=O)CCC2CCNCC2)cc1 50950060 CIEQQGSGPWRRHT-UHFFFAOYSA-N 289.423 2.149 10 20 CECD CNC(=O)[C@H]1CCCCN1Cc1cc(C)c(C)cc1O 179335552 VJTKONLUYOSGDY-CQSZACIVSA-N 276.380 2.110 10 20 CECD CCCn1cc(C(=O)N(C)Cc2ccccc2O)cn1 183259399 VOLDKSLSWFACCB-UHFFFAOYSA-N 273.336 2.271 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)CO[C@@H]2CCOC2)c1 185673399 CFPTUJKDTYMSCH-MBNYWOFBSA-N 295.379 2.245 10 20 CECD Nc1ccc(CC(=O)NOCc2ccccc2)cc1 70286733 NUUCTJWCBUGSPR-UHFFFAOYSA-N 256.305 2.059 10 20 CECD COC(=O)CN(CCCF)Cc1cc(Cl)ccc1O 137286104 ZNLKQEXDBWXZBY-UHFFFAOYSA-N 289.734 2.380 10 20 CECD O=C1NC(=S)S/C1=C/c1ccn(-c2ccccc2)n1 255120612 FAOLWFJCBXDSGG-DHZHZOJOSA-N 287.369 2.361 10 20 CECD CCc1ocnc1C(=O)NCc1ccc(N(C)C)c(F)c1 265793018 SFSWRWWOAHAMBD-UHFFFAOYSA-N 291.326 2.372 10 20 CECD C[C@@H](N[C@H]1CC12CCNCC2)c1cc(F)cc(F)c1O 817976581 OGDVTOLMXNWHRQ-RNCFNFMXSA-N 282.334 2.463 10 20 CECD CC1(CNCc2ccc3ccccc3c2O)OCCO1 816558884 OVKDWIVRENNYOT-UHFFFAOYSA-N 273.332 2.398 10 20 CECD C[C@@H]1C[C@H](NCCc2ccc(N)cc2)c2nccn21 817957799 PGFAYDPOPIXJAG-RISCZKNCSA-N 256.353 2.303 10 20 CECD C[C@@H]1C[C@H](NCC(C)(C)N)c2c(O)ccc(F)c21 817960278 LNJFZNVVJKFKTE-SCZZXKLOSA-N 252.333 2.407 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NOCC2CCC2)c1 824042794 GMRDIJXCAKRYDR-JTQLQIEISA-N 294.351 2.493 10 20 CECD Cc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)nc1 588403735 XPQWUHBLEDTLCM-DAXSKMNVSA-N 270.288 2.453 10 20 CECD CC[C@@H](NC(COC)COC)c1ccc(C)cc1O 834890551 LAAJTQMAKRFLKY-CQSZACIVSA-N 267.369 2.403 10 20 CECD CC1=NO[C@@](C)(C(=O)NCc2ccc(N(C)C)cc2C)C1 903442188 LLNDOQBYUXOIHS-MRXNPFEDSA-N 289.379 2.232 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)CC(C)(C)C)cc1 832293619 YYSLNOZMSVHUIW-AWEZNQCLSA-N 277.412 2.305 10 20 CECD O=C(NCCc1ccc(O)cc1)c1cc(O)cs1 732274140 CXHKYYVMZLLADJ-UHFFFAOYSA-N 263.318 2.132 10 20 CECD CCO[C@H]1C[C@@H]1C(=O)NCc1ccc(N(C)C)cc1C 734405689 WUTNQFKQVNDYTE-GJZGRUSLSA-N 276.380 2.102 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@]2(C)CCC(=O)N2)c1 834910331 WMPZDSWORBROLB-ABAIWWIYSA-N 262.353 2.020 10 20 CECD C[C@@H]1CN(C(=O)c2cc(O)cs2)CC2(CCC2)O1 844153813 RSFGABFRLNMTDJ-SECBINFHSA-N 267.350 2.237 10 20 CECD C[C@@H]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)[C@@H]1C 840999923 RBLVBELSIPVSLJ-JTNHKYCSSA-N 289.379 2.148 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CS[C@H](C)C2)c1O 840958569 MVFZRZVMPHVVHY-SCZZXKLOSA-N 298.364 2.293 10 20 CECD CC[C@@H](OC)C(=O)NCc1cc(Cl)ccc1O 846473256 SKAVWBMYVODKBG-LLVKDONJSA-N 257.717 2.087 10 20 CECD C[C@H](NCc1cnnn1C)c1ccc(Cl)cc1O 841757980 QQHVONQMPBXDLN-QMMMGPOBSA-N 266.732 2.025 10 20 CECD CNC(=S)N(Cc1ccc(N(C)C)cc1)C1CC1 917595022 VMXPMHLSOGVBOK-UHFFFAOYSA-N 263.410 2.221 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCNC2(CCC2)C1 841090184 WXCIMRDWDRNOSZ-GFCCVEGCSA-N 276.380 2.165 10 20 CECD C[C@@H]1C[C@@H](N)CCN1Cc1cccc(Cl)c1O 846705014 WZOWGWHRAWIQKN-KOLCDFICSA-N 254.761 2.357 10 20 CECD CC[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CC[C@H]1N 843376554 AXEXLBAIKFXIGQ-IAQYHMDHSA-N 294.370 2.293 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)C[C@@H](C)N)c1 843129232 OEEQVDNNUHVJCN-GHMZBOCLSA-N 252.358 2.006 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)C(C)C)cc1 844851620 CLJGSWLZWICJGY-UHFFFAOYSA-N 264.369 2.246 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1cc(CO)on1 924575685 ZZXIQGLPVJNCHF-LLVKDONJSA-N 275.352 2.084 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)N[C@H]2C=CCC2)c1 852510165 QXTLRXZHPYEMQX-QWRGUYRKSA-N 276.336 2.480 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2COC[C@H]2OC)cc1 842752719 SBPGNTXZLMMKTN-HZPDHXFCSA-N 278.396 2.036 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@](C)(O)C2CC2)c1 756767590 VFNMRFMZDITSMP-HWPZZCPQSA-N 293.363 2.129 10 20 CECD CCCN(CC(=O)NC(C)C)Cc1ccccc1O 69009942 WJJRARUDAAVMQC-UHFFFAOYSA-N 264.369 2.129 10 20 CECD CCO[C@@H](CN(C)c1ccc(OCC(=O)O)cc1)C1CC1 863467115 NTMYAIMAMOXZNU-HNNXBMFYSA-N 293.363 2.401 10 20 CECD CCOC(=O)[C@@H]1CCCN(Cc2c(O)cccc2OC)C1 769078602 QKLPIELUMXXYSC-GFCCVEGCSA-N 293.363 2.176 10 20 CECD O=C1N[C@@H](c2cc(F)ccc2O)N2CCc3ccccc3[C@@H]12 877856469 SLQNSYOBYRLCPP-JKSUJKDBSA-N 298.317 2.259 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H](C)C(=O)N(C)C)cc1 773048430 RCBPVKKTCPCSON-CHWSQXEVSA-N 277.412 2.270 10 20 CECD Cc1ccc(CN2CCOC[C@@H]2[C@@H]2CCCC2=O)c(O)c1 877465850 YXJQBXWBQUOSMN-LSDHHAIUSA-N 289.375 2.271 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H](OCCO)C2)cc1 773751731 GKRDHHJQJYZRCQ-QGZVFWFLSA-N 292.423 2.116 10 20 CECD COC(=O)c1cc(CN(C)c2ccc(OC)cc2)on1 877609020 CQCDQSWHHPQLPJ-UHFFFAOYSA-N 276.292 2.106 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@@H](C(=O)Nc2ccc(N)cc2)C1 884009453 WTDVCQFRWYQMII-ZANVPECISA-N 270.336 2.297 10 20 CECD Cc1cc(O)c(CNCc2cn(C)cn2)cc1Cl 898042387 OSXGKVBFXJLHSU-UHFFFAOYSA-N 265.744 2.377 10 20 CECD c1n[nH]cc1CCNCc1ccc2c(c1)CCCO2 1333505866 WMJTWZCHMWBXKD-UHFFFAOYSA-N 257.337 2.067 10 20 CECD COc1ccc(CNC(=O)N[C@H](C)c2ccc[nH]2)c(O)c1 793029190 QASJABRCTSMEDC-SNVBAGLBSA-N 289.335 2.289 10 20 CECD COc1cccc(O)c1CNC1CCC(C)(O)CC1 749294968 GGCHYKBLNWKYLO-UHFFFAOYSA-N 265.353 2.184 10 20 CECD c1cc(N2CCCC2)ccc1CNCCO[C@H]1CCOC1 1334329632 HLADYZVSDVLSPU-KRWDZBQOSA-N 290.407 2.182 10 20 CECD Cc1ncncc1C(=O)NCc1cc(Cl)ccc1O 1334802390 GNJUJCYISUAFNT-UHFFFAOYSA-N 277.711 2.074 10 20 CECD CCCc1cc(C(=O)NCc2ccc(N)cc2)cc(O)n1 1263304166 UNIXRURJWBSIQR-UHFFFAOYSA-N 285.347 2.252 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccc1N 1577939838 STGNSTRHGVQERZ-UHFFFAOYSA-N 291.347 2.390 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)C[C@H]1C(=O)O 1599866305 ZGDGPYZLWLHJGO-VXNVDRBHSA-N 287.718 2.337 10 20 CECD C[C@@H]1[C@@H](C(=O)O)CCN1Cc1c(O)ccc2ccncc12 1594165479 CTJHIQCFUIINSN-PWSUYJOCSA-N 286.331 2.235 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](C)[C@@H]2C(=O)O)c1O 1776210718 PFRBHJOEQDCOCH-ISVAXAHUSA-N 295.310 2.029 10 20 CECD COc1ccc(N2CCC(N[C@H](CO)C(C)C)CC2)cc1 162760623 BHWCCHZLBMIOSO-QGZVFWFLSA-N 292.423 2.271 10 20 CECD CCOc1ccc(N(C)C(=O)/C=C/c2cnn(C)c2)cc1 155062068 BKIHXWQNSYJJDX-BJMVGYQFSA-N 285.347 2.495 10 20 CECD O=Cc1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)[nH]1 156346725 LIVZHMFUMDMFJO-UHFFFAOYSA-N 298.342 2.342 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cccn2C)c1 157851069 NAICOGNZQPFZML-JTQLQIEISA-N 274.320 2.230 10 20 CECD C1=CCN(c2ccc(CNc3cnccn3)cc2)C1 156709608 USWBVSOYDYUOHO-UHFFFAOYSA-N 252.321 2.465 10 20 CECD COc1cccc(CN[C@]2(C)CCO[C@@H]2C)c1O 230154037 WPKFLCTWONQEEX-QMTHXVAHSA-N 251.326 2.058 10 20 CECD COc1cccc(O)c1C(=O)N(C)c1ccc(N)cc1 405361995 USACYKZCKCEQMS-UHFFFAOYSA-N 272.304 2.260 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)C1CC1 1355217045 YQPRNLXIZRPFAE-UHFFFAOYSA-N 251.326 2.394 10 20 CECD CCn1c(C)cc(C(=O)NCc2ccc(O)c(O)c2)c1C 182518607 UDULQLMUMSXURP-UHFFFAOYSA-N 288.347 2.466 10 20 CECD CC(C)OCCCCNC(=O)/C=C/c1ccc(O)c(O)c1 180928564 NTVROCARTMWTJM-SOFGYWHQSA-N 293.363 2.432 10 20 CECD COc1ccc(O)c([C@H](C)NCCC(=O)NC(C)(C)C)c1 135727894 YEHAORHBWXRVSS-NSHDSACASA-N 294.395 2.356 10 20 CECD CCOc1cccc(CN(C)C[C@@H](C)OC)c1O 289176914 ABSYDTRJHNXRFQ-LLVKDONJSA-N 253.342 2.258 10 20 CECD CCOc1cccc(CNC[C@@H](CC)OC)c1O 289885354 SETJISXAFHOWGL-GFCCVEGCSA-N 253.342 2.306 10 20 CECD CCCN(Cc1ccccc1O)CC(OC)OC 161328071 TXGUBTQYSIJVRP-UHFFFAOYSA-N 253.342 2.223 10 20 CECD Nc1ccc(CC(=O)Nc2ccc(-n3cncn3)cc2)cc1 237924312 UVPSITIGGZYRLK-UHFFFAOYSA-N 293.330 2.031 10 20 CECD CCC[C@H](N)C(=O)N(CCC)Cc1ccccc1O 236795039 QVZYPJQGSKAXKI-ZDUSSCGKSA-N 264.369 2.258 10 20 CECD Cc1cc(C(=O)NCc2c(C)c3ccccc3n2C)n(C)n1 348657900 DAIVYHISUSDQOO-UHFFFAOYSA-N 296.374 2.459 10 20 CECD C[C@H](NC[C@]1(O)CCO[C@@H]1C)c1cc(Cl)ccc1O 278909019 VPAQOIHPWHZEPJ-IMSIIYSGSA-N 285.771 2.236 10 20 CECD Cc1cc(C)c([C@H](C)NCC(C)(C)C(N)=O)c(O)c1 284966590 FQFGCPUSZSXNMF-NSHDSACASA-N 264.369 2.171 10 20 CECD C[C@H]1C[C@@H](O)CCN1Cc1ccc(N(C)C)c(F)c1 292891216 YWNQPFBNHRFWGF-AAEUAGOBSA-N 266.360 2.237 10 20 CECD C[C@@H](CN[C@H](C)c1cc([N+](=O)[O-])ccc1O)CN(C)C 293604095 IYYJJECKPPCFQC-WDEREUQCSA-N 281.356 2.149 10 20 CECD O=C(O)/C=C\c1ccc(N2CC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 706901882 PJKSOAVLKPFWMM-ZVIBEBPTSA-N 274.276 2.291 10 20 CECD Cc1cc(NS(=O)(=O)CCCCF)ccc1O 294182276 KFMPBZIFOYXIGO-UHFFFAOYSA-N 261.318 2.192 10 20 CECD CCc1nc(C)c(CNC(=O)c2ccc(C)c(O)c2O)o1 293841739 BGUFWASHGHSKKI-UHFFFAOYSA-N 290.319 2.195 10 20 CECD Cc1cccc(CN(C)[C@@H]2CC(C)(C)OC2=O)c1O 814180695 RCKQNLBTKMZEHA-GFCCVEGCSA-N 263.337 2.227 10 20 CECD CN(Cc1ccccc1O)Cc1cnc2n1CCC2 824593982 WRHAKBLWNOXPAD-UHFFFAOYSA-N 257.337 2.167 10 20 CECD CCN(CC)c1ccc(CNC(=O)C[C@@H](N)C2CC2)cc1 827341245 YEANBUULJTUFSW-MRXNPFEDSA-N 289.423 2.276 10 20 CECD O=C1CC[C@H]2CN(Cc3cc(Cl)ccc3O)CC[C@H]2N1 827140147 IFXABRRMONNGTE-GXFFZTMASA-N 294.782 2.146 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)CN(C)C)cc1 727298887 DJGNBERAGAJWGR-UHFFFAOYSA-N 277.412 2.053 10 20 CECD CC(C)[C@@H](NC1CCOCC1)C(=O)Nc1ccc(N)cc1 832250695 YLZHQXYJZLVYJI-OAHLLOKOSA-N 291.395 2.001 10 20 CECD Oc1ccccc1CN(C[C@H]1CCOC1)C[C@H]1CCCO1 732203616 YYGINVANUUEGCA-GDBMZVCRSA-N 291.391 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10 20 CECD O=C(Cc1ncc[nH]1)NCc1ccc(N2CCCCC2)cc1 824261382 BROPMMHVJCJGIP-UHFFFAOYSA-N 298.390 2.259 10 20 CECD O=C(CNCc1cc(-c2ccccc2)ccc1O)NC1CC1 725845108 LHKCWTAMDMLPCE-UHFFFAOYSA-N 296.370 2.427 10 20 CECD Cc1ccncc1/C=C\C(=O)N1C[C@@H](O)Cc2ccccc21 493632926 PXQUASZPCLHUHS-WLMCBFPDSA-N 294.354 2.353 10 20 CECD COC(=O)/C(C)=C/CSc1ncc(C(=O)OC)s1 829680597 BKJOESSQWQQAFX-QPJJXVBHSA-N 287.362 2.141 10 20 CECD Oc1ccc(Cl)cc1CN1CCC[C@H](n2ccnn2)C1 822503318 FZNRMVZEHACNOK-ZDUSSCGKSA-N 292.770 2.474 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cc(CC2CC2)[nH]n1 830876870 JYJMBYOWUULHMM-GQCTYLIASA-N 299.330 2.425 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@@H]12)OCC(=O)c1ccc(O)c(O)c1 838122583 FHELNVGVGAPENC-JBLDHEPKSA-N 290.315 2.260 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](N)C2CC2)cc1 841049286 JBTMFBPEAYXBPO-MRXNPFEDSA-N 261.413 2.360 10 20 CECD COC[C@@H](CC(C)C)NC[C@@H](N)c1ccc(N(C)C)cc1 841045918 SQQATQOLHWBISW-NVXWUHKLSA-N 293.455 2.403 10 20 CECD O=C1CC[C@@H](C(=O)NCc2cc(Cl)ccc2O)C1 846478066 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292.379 2.349 10 20 CECD C[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)c1cnn(C)c1 273620691 YZIQLTDDYXBBLV-UWVGGRQHSA-N 290.323 2.446 10 20 CECD C[C@@H](N[C@H](C)c1nncn1C)c1ccc(F)c(F)c1O 276896652 INBQECQIBGRBQX-HTQZYQBOSA-N 282.294 2.211 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc[n+]([O-])c1 274296457 ACDXAELZAYQDKD-UHFFFAOYSA-N 299.374 2.048 10 20 CECD COCCn1cc(CN[C@H](C)c2cc(F)ccc2O)cn1 281912930 ABSWQYYRIXGYPX-LLVKDONJSA-N 293.342 2.225 10 20 CECD CC(C)ONC(=O)NCc1ccc(N2CCCC2)cc1 295884296 HIXMZZOZFACKIF-UHFFFAOYSA-N 277.368 2.426 10 20 CECD COc1cccc(CN2CCN(C3CC3)C[C@@H](C)C2)c1O 295946708 GREMDJIAXPEVNQ-ZDUSSCGKSA-N 290.407 2.317 10 20 CECD C[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCC1(F)F 296004681 KXNZOXDJVLWMMQ-ZETCQYMHSA-N 289.253 2.354 10 20 CECD COc1cccc(CN2CC(O)(c3ccccc3)C2)c1O 291575738 OJQJWGLYBAKODG-UHFFFAOYSA-N 285.343 2.104 10 20 CECD Cc1ncsc1COC(=O)c1cccc(O)c1O 811188958 FWOGXUGGNXSHNO-UHFFFAOYSA-N 265.290 2.220 10 20 CECD COC[C@H](C)[C@@H](C)C(=O)N[C@H](C)c1cc(OC)ccc1O 812498264 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COc1ccc(N(C)CCNC(=O)NC(C)C)cc1Cl 827995248 AHPLCUGYDVHUBQ-UHFFFAOYSA-N 299.802 2.492 10 20 CECD CC1CCN(c2ccc(CNCC[N+](=O)[O-])cc2)CC1 905101265 ILGFRDIVXWSQEX-UHFFFAOYSA-N 277.368 2.289 10 20 CECD CCc1nnc(NC(=O)c2cc(O)cs2)s1 731867575 MTHHVCKVQHFWQQ-UHFFFAOYSA-N 255.324 2.120 10 20 CECD CC[C@H](CNCc1cc(Cl)c(F)cc1O)C(=O)O 903708837 HDXNCNKLPUNNHT-SSDOTTSWSA-N 275.707 2.385 10 20 CECD CCOc1ccc(CNCc2cnn(CC)c2)c(O)c1 735676045 DWSMLERODHPEFL-UHFFFAOYSA-N 275.352 2.297 10 20 CECD CCN(CC)c1ccc(CN2CCCO[C@@H](CN)C2)cc1 841100961 QCSLNHKIUDTHJF-KRWDZBQOSA-N 291.439 2.082 10 20 CECD C[C@@H]1[C@H](CO)CCCN1Cc1ccc(N(C)C)c(F)c1 840978245 MQBPYAVYAYLSGJ-OCCSQVGLSA-N 280.387 2.485 10 20 CECD CCc1cccc(CNC2CCC(C(=O)NC)CC2)c1O 848895190 QMAXROQNIACVLH-UHFFFAOYSA-N 290.407 2.349 10 20 CECD Nc1ccc(CCNC(=O)Nc2cc3n(n2)CCCC3)cc1 841238345 TZQUJOSJVWICAZ-UHFFFAOYSA-N 299.378 2.166 10 20 CECD COc1cccc([C@@H](C)NC[C@H]2CCOC2)c1O 846146473 RVIHCZFACBZNIP-GHMZBOCLSA-N 251.326 2.088 10 20 CECD CCOc1ccc(CN2CCC([C@@H](C)N)CC2)c(O)c1 843051699 CERAOXZKUQPFJK-GFCCVEGCSA-N 278.396 2.350 10 20 CECD COc1ccc(N(C)CCN(C)Cc2cnns2)cc1 844402774 VVPCSFLUOVRZEQ-UHFFFAOYSA-N 292.408 2.115 10 20 CECD CNC(=O)c1ccc(NC(=O)NCc2ccccc2O)cc1 748444768 ZSQINCZGABCHBT-UHFFFAOYSA-N 299.330 2.074 10 20 CECD C[C@H](CCCCN)NCc1ccc(N2CCOCC2)cc1 841078283 DYIQSJZDGCNMND-OAHLLOKOSA-N 291.439 2.130 10 20 CECD C[C@H](CCO)N(C)Cc1cc(Cl)cc(F)c1O 846112659 WHQIZLTYCPMQPG-MRVPVSSYSA-N 261.724 2.387 10 20 CECD Cc1nonc1[C@@H](C)NCc1ccc(N(C)C)cc1 924572769 DPWGEBVIXLKZOF-SNVBAGLBSA-N 260.341 2.295 10 20 CECD CCOCc1cc(CN[C@@H]2C[C@]2(C)OC)ccc1OC 850409712 YXZYFXTXWMMGNK-CVEARBPZSA-N 279.380 2.499 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCN(C(C)(C)C)C2)c(O)c1O 855287409 BYLMAKPMGJUKSG-LLVKDONJSA-N 292.379 2.009 10 20 CECD COC[C@H](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 755084642 FSGVLKBTOSLTSJ-CYBMUJFWSA-N 278.396 2.384 10 20 CECD CN(CCn1cccn1)Cc1cc(F)c(N(C)C)cc1F 862243335 HWFMNBWYFWQZBC-UHFFFAOYSA-N 294.349 2.359 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCC2(O)CCC2)c1 866764479 MYONWISMAJEITO-LLVKDONJSA-N 293.363 2.273 10 20 CECD CCCCN(Cc1nc[nH]n1)Cc1ccccc1O 1118563031 AHNAGPWMONVEGD-UHFFFAOYSA-N 260.341 2.313 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCCCCN 1117966328 FRWZQYVUMBJDRU-UHFFFAOYSA-N 293.411 2.443 10 20 CECD COCCO[C@@H]1CCCN(Cc2ccc(C)cc2O)C1 877502973 XMOQOPVQGCDONC-OAHLLOKOSA-N 279.380 2.328 10 20 CECD COc1ccc(CNC[C@H]2CCOC[C@H]2C)c(O)c1OC 894419503 GIIFFYMBTLCSCB-VXGBXAGGSA-N 295.379 2.172 10 20 CECD CSC1(CNC(=O)NCc2ccccc2O)CC1 788938636 IIEZUDLRCOPGLK-UHFFFAOYSA-N 266.366 2.087 10 20 CECD CN(C)c1ccc([C@H](CNCc2ccon2)N(C)C)cc1 898449571 HSSLZTOLWOLXBJ-INIZCTEOSA-N 288.395 2.133 10 20 CECD COc1ccc(CNC(=O)c2ccc(C(C)=O)o2)c(O)c1 794381327 KWMYMMASOMXFRU-UHFFFAOYSA-N 289.287 2.126 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1cc(F)ccc1O 798954967 IKLVTYGILXQNSZ-JTQLQIEISA-N 269.316 2.305 10 20 CECD CCO[C@@]1(C(F)(F)F)CCN(CCN=[N+]=[N-])C1 409433407 MTFRUBDZEYPFRD-QMMMGPOBSA-N 252.240 2.340 10 20 CECD CCCc1noc(CN(C)Cc2ccccc2O)n1 109769042 FAXGJHLVOBLCBR-UHFFFAOYSA-N 261.325 2.360 10 20 CECD C[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)[C@H]1CO 1321701262 JRPOTLAVJJSAKH-PBHICJAKSA-N 274.408 2.490 10 20 CECD COC(=O)N(C)CCN[C@H](C)c1ccc(C)cc1O 689583940 KQVKNXAIQAIXOC-LLVKDONJSA-N 266.341 2.049 10 20 CECD Cc1nnc(CN[C@@H](C)c2cc(C(=O)O)ccc2O)s1 1610571916 UBPGDBLPRIXFEL-ZETCQYMHSA-N 293.348 2.101 10 20 CECD Cc1ccc(CN[C@@H](CCN)C(F)(F)F)c(O)c1 1579696963 PONNYGXQJDKLKZ-NSHDSACASA-N 262.275 2.070 10 20 CECD C[C@H](N[C@@H]1C[C@@H]2CCC[C@H]21)c1cccc(-c2nn[nH]n2)c1O 1589957706 SJJUVCQDWUMCRZ-BQSGVUBFSA-N 299.378 2.412 10 20 CECD C[C@H](N[C@H](C)c1ccnn1C)c1cc(C(=O)O)ccc1O 1593204705 VNHNVQTTXYFJOJ-VHSXEESVSA-N 289.335 2.236 10 20 CECD COc1ccc(N2CCN(CCOCC3CC3)CC2)cc1 158277100 KIGKUQFNPXPFSC-UHFFFAOYSA-N 290.407 2.244 10 20 CECD CC(C)OCCCNC(=O)Nc1ccc(N)cc1 217313616 BOGCGQMNQUGKQZ-UHFFFAOYSA-N 251.330 2.205 10 20 CECD CC[C@H](NCCc1cnn(C)c1)c1ccccc1O 128143178 KJSXDSZYMCUBFO-AWEZNQCLSA-N 259.353 2.409 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCOC(C)(C)C2)c1 159951008 AEBVMJATUNGZEW-GFCCVEGCSA-N 265.353 2.448 10 20 CECD COc1cccc(CN2CCCC[C@@H]2[C@H](C)N)c1O 63191264 XHYLCCOROGYTHP-WCQYABFASA-N 264.369 2.103 10 20 CECD COc1ccc(O)c(CNCc2c(C)noc2C)c1 78749263 FOHSZDJOJQSPFE-UHFFFAOYSA-N 262.309 2.295 10 20 CECD COc1ccc(O)c([C@H](C)NCCC2(CO)CC2)c1 395866971 HLDPHXMHULHVRL-NSHDSACASA-N 265.353 2.214 10 20 CECD COc1cccc(CN[C@H]2CS[C@@H](C)C2)c1O 397976655 PIJHWWZXFHOLGM-GXSJLCMTSA-N 253.367 2.384 10 20 CECD CN1CCCc2cc(CNC(=O)[C@H]3CCCOC3)ccc21 170798052 JREDBCUYTQIWAI-HNNXBMFYSA-N 288.391 2.112 10 20 CECD CN(Cc1ccccc1O)C(=O)CC1(O)CCCCC1 305108476 FXPCGEFTOFOPCT-UHFFFAOYSA-N 277.364 2.436 10 20 CECD CCOc1ccc(O)c(CNC[C@H](O)c2ccco2)c1 304527934 MCPHGFSWAVZKQE-AWEZNQCLSA-N 277.320 2.207 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc[nH]c1 68238144 OZMRTBMFDFRRSL-UHFFFAOYSA-N 257.337 2.353 10 20 CECD COCCOCCN[C@@H](C)c1cc(Cl)ccc1O 185136670 BLERMLUSLCZAFE-JTQLQIEISA-N 273.760 2.359 10 20 CECD COc1ccc(N(C)Cc2nc(C)no2)cc1F 121747444 APJVASHYRCRJGR-UHFFFAOYSA-N 251.261 2.162 10 20 CECD Cc1[nH]ncc1C(=O)NCc1c(O)ccc2c1CCCC2 75159733 OFPMRQLZUKSQPS-UHFFFAOYSA-N 285.347 2.233 10 20 CECD CNCCCN(C)Cc1cc(Cl)cc(OC)c1O 229104515 GRZRMIIMDIFYGN-UHFFFAOYSA-N 272.776 2.096 10 20 CECD O=c1cc(CSc2nccs2)nc2ccccn12 48874931 BOQVKCASOWUCDG-UHFFFAOYSA-N 275.358 2.443 10 20 CECD Cc1cc(CNCc2ccc(N3CCOCC3)cc2)no1 44692507 SDYPBHUFBOOHIH-UHFFFAOYSA-N 287.363 2.109 10 20 CECD CC(C)CC(=O)N[C@@H](C(=O)Nc1ccc(N)cc1)C(C)C 236621504 JHXBAFYXASONIB-OAHLLOKOSA-N 291.395 2.394 10 20 CECD O=C(/C=C\c1ccco1)NCCc1ccc(O)c(O)c1 255779251 YMFOUAOFYFZNSH-XQRVVYSFSA-N 273.288 2.063 10 20 CECD Cc1c(CNC(=O)c2cn[nH]c2)n(C)c2ccccc12 352112186 QYQMYCVSOSSASA-UHFFFAOYSA-N 268.320 2.140 10 20 CECD CCn1ccnc1C(=O)N(C)Cc1ccc(N(C)C)cc1 279217445 NBANDZUZHGKLTG-UHFFFAOYSA-N 286.379 2.241 10 20 CECD Cc1cccc(CN2CCc3ccccc3[C@H]2C(N)=O)c1O 361797614 JUQSOMLKCXCIPN-INIZCTEOSA-N 296.370 2.285 10 20 CECD Cc1cc(CN2CC[C@H](C)[C@@H]2CO)ccc1N(C)C 294757048 YBTGOTVDDQRGPD-LRDDRELGSA-N 262.397 2.264 10 20 CECD C[C@H](N[C@@H]1CCCN(CCCO)C1)c1ccc(F)cc1O 297404038 SRJDWBFDLAATEE-GXTWGEPZSA-N 296.386 2.029 10 20 CECD CC(C)[C@H](C(=O)O)[C@@H](C)NCc1ccc2c(c1)CCO2 819163576 KXVOBPALTWGOGT-ABAIWWIYSA-N 277.364 2.456 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](N)C(C)C)c1 817959722 URKCHXMUPHBMEH-GWCFXTLKSA-N 252.358 2.035 10 20 CECD CCc1cc(=NCc2cccc(OC)c2O)cc[nH]1 827547858 KXHZJMIELFNFKP-UHFFFAOYSA-N 258.321 2.392 10 20 CECD OCC1(CCNCc2c(O)ccc(Cl)c2F)CC1 825040699 SQEQEUZCWCTBQH-UHFFFAOYSA-N 273.735 2.437 10 20 CECD C[C@@H](O)C1(NCc2cc(Cl)cc(F)c2O)CC1 827585956 ROQGCXPRSWXELK-SSDOTTSWSA-N 259.708 2.188 10 20 CECD Cc1ncsc1/C=C\C(=O)N1CCOc2ccncc21 492742416 NHPSXVVIFWDFKC-IHWYPQMZSA-N 287.344 2.285 10 20 CECD CC[C@@H](C)C[C@H](NCc1ccccc1O)C(=O)O 901679360 CXQDNRJPUIKJGB-PWSUYJOCSA-N 251.326 2.371 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@@H](C)c1c(O)cccc1F 903338051 BDPZICQONKUCSN-STQMWFEESA-N 296.386 2.293 10 20 CECD COC(=O)NC1CCN(Cc2cc(C)ccc2O)CC1 827934694 OEVFQBKUEAVWET-UHFFFAOYSA-N 278.352 2.021 10 20 CECD CSC1(CNC(=O)/C=C\c2ccc(O)c(O)c2)CC1 588611221 UCWFHWPPFVKJKG-HYXAFXHYSA-N 279.361 2.123 10 20 CECD O=C(O)/C=C\c1ccc(N2CC[C@@H](CF)C2)c([N+](=O)[O-])c1 906148932 NROUKFYFBLEHLZ-MORRKMRCSA-N 294.282 2.488 10 20 CECD COc1ccc2ccc(O)c(CN3CC[C@H]3CO)c2c1 902631468 WZJFNZLFUCPHDF-LBPRGKRZSA-N 273.332 2.121 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCOC1 734405736 IZIWOQGXXLMJJR-CQSZACIVSA-N 276.380 2.104 10 20 CECD CC[C@@H](O)[C@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 912125197 MHWNFBGHXQHWJX-CHWSQXEVSA-N 293.363 2.172 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)CCC(=O)O)cc1 842518973 BUEGEHCTCLZBHV-UHFFFAOYSA-N 292.379 2.356 10 20 CECD CC1(C)CNCCN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 843054087 CYGRUKNOBWGPFR-UHFFFAOYSA-N 299.758 2.138 10 20 CECD COC(=O)CCCN1CCCc2cc(OC)ccc21 745455982 NAGSWWMEOKYPBI-UHFFFAOYSA-N 263.337 2.401 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H](C)c1cc2c(cc1O)CCCC2 842912131 RDOSLZQSGANYEM-UXEPBGEESA-N 291.391 2.335 10 20 CECD CCN(CC(=O)O)Cc1ccc(N(C)CC)cc1 846265346 GVGCYTBARJUXSF-UHFFFAOYSA-N 250.342 2.049 10 20 CECD C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc(N)cc1 841299990 PSDACFVRJOAKHV-WFASDCNBSA-N 288.395 2.359 10 20 CECD Oc1c(F)cc(Cl)cc1CNC1CCNCC1 841026517 GLKOTPORZRUGAL-UHFFFAOYSA-N 258.724 2.026 10 20 CECD C[C@@H]1C[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CO1 842773554 APGMVHADYVVJAF-XCBNKYQSSA-N 286.715 2.221 10 20 CECD C/C(=C/C(=O)N1CCc2ncc(C)cc21)c1cnccn1 857872728 GZBIRVVUPAWXKG-WQLSENKSSA-N 280.331 2.173 10 20 CECD O=C(CC1CC1)NCc1ccc(N2CCC(O)CC2)cc1 856210148 PPKXVPWJMXDWIN-UHFFFAOYSA-N 288.391 2.064 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](C)Cn2ccc(C)n2)c1 869409608 BPMVQDGOONCBHB-GFCCVEGCSA-N 287.363 2.158 10 20 CECD C[C@H](O)C[C@H](C)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776248417 IXUNAJODOYTRFO-AVGNSLFASA-N 293.411 2.272 10 20 CECD OC1CCN(c2ccc(CN3CCCC3)cc2)CC1 876524462 RAFKQKGANJGUIA-UHFFFAOYSA-N 260.381 2.244 10 20 CECD CCO[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 779481779 OJXKWWJWLFWLFW-CFNZNRNTSA-N 291.347 2.139 10 20 CECD COc1ccc(O)c(CNCCO[C@H]2CCCCO2)c1 894799300 LJCVJDMHUIRNQU-HNNXBMFYSA-N 281.352 2.034 10 20 CECD Cc1ccc(CNC(=O)c2c(F)ccc(O)c2O)cc1 789942044 QNRHMKNHPRBMKZ-UHFFFAOYSA-N 275.279 2.475 10 20 CECD C[C@@H]1NC(=O)[C@@H](C)N(Cc2cc(Cl)ccc2O)[C@@H]1C 895113768 KDCPPPUASINNGI-IVZWLZJFSA-N 282.771 2.143 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2CCS(=O)(=O)CC2)c1 186185239 ZCQBPVXGCKMVLA-LBPRGKRZSA-N 297.420 2.176 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1170525241 QXRNVLJHWHMZFZ-KGLIPLIRSA-N 277.364 2.435 10 20 CECD CCOc1cccc(CNC[C@@H]2CCCN2CC)c1O 83594691 VDUKZBOFCPNVEY-AWEZNQCLSA-N 278.396 2.365 10 20 CECD CCOC(=O)[C@@H](NCc1cc(F)cc(F)c1O)C1CC1 1353592389 DRHQOXZPRSZPAZ-LBPRGKRZSA-N 285.290 2.102 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)C[C@H](C(=O)O)C2)c1O 1604695471 ZMSJBBPZWHOHDE-AAEUAGOBSA-N 293.363 2.252 10 20 CECD O=C(O)c1cnc(SCCC2OCCCO2)s1 1602537669 ZZLMMWHIIZRVIU-UHFFFAOYSA-N 275.351 2.087 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCC[C@@H]2C(=O)O)c1 1610042494 HFWZCAHWIHXCBH-STQMWFEESA-N 279.336 2.134 10 20 CECD CCN1CCc2cc(CNCC3CC(C(=O)O)C3)ccc21 1776877236 AFFNGLBDHZSVSY-UHFFFAOYSA-N 288.391 2.269 10 20 CECD COCCCCN(C)Cc1c(O)cccc1OC 841893223 BWRSVSCINANUBD-UHFFFAOYSA-N 253.342 2.259 10 20 CECD CCC(CC)[C@H](O)CNCc1cc2c(cc1O)OCO2 111404457 JRBBMWBUUHDRGP-CYBMUJFWSA-N 281.352 2.008 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)CN2CCOCC2)c(O)c1 36932530 MCRDXJBHDAOPEN-UONOGXRCSA-N 278.396 2.072 10 20 CECD C[C@@H](NC[C@](C)(O)C(F)(F)F)c1ccc(F)cc1O 273354405 CHQLDTFAEPFDED-HQJQHLMTSA-N 281.249 2.495 10 20 CECD CC[C@@]1(NCc2cc(F)cc(F)c2O)CCOC1 708497316 RIIMDXDAIUUFBX-CYBMUJFWSA-N 257.280 2.329 10 20 CECD COc1ccc(CN[C@H]2CSC[C@H]2C)c(O)c1 397913096 ZEJUJFLNBOYMCW-SKDRFNHKSA-N 253.367 2.242 10 20 CECD COc1cccc(O)c1CN(CCN)Cc1ccccc1 843059256 IMFGWMYDZCQVAZ-UHFFFAOYSA-N 286.375 2.362 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C)OCC2CC2)c1 103529196 ULFIBONWWZTXDV-WDEREUQCSA-N 293.363 2.393 10 20 CECD COc1ccc(O)c(CNC(=O)Cc2ccccc2F)c1 114541769 RSXAVTNCZJGAHN-UHFFFAOYSA-N 289.306 2.399 10 20 CECD O=C(/C=C/c1cncc(F)c1)N1CCOc2ncccc21 177240849 XPTLZYJZTOPNHL-ONEGZZNKSA-N 285.278 2.055 10 20 CECD COc1cc(NCc2ccc(N(C)C)cc2C)ncn1 124828697 NGRJNJPDAAXPDT-UHFFFAOYSA-N 272.352 2.472 10 20 CECD COc1cccc(CN2CCS[C@H](C)C2)c1O 131388295 QGSYNYXPNOTGEK-SNVBAGLBSA-N 253.367 2.338 10 20 CECD CN(C)Cc1cccc(C(=O)NCCc2ccc(N)cc2)c1 237055775 YYFIWCOCPFAWEX-UHFFFAOYSA-N 297.402 2.303 10 20 CECD NCC[C@@H]1CCCCN1Cc1cc(F)ccc1O 236162972 OGVVPKCXVYEGRN-ZDUSSCGKSA-N 252.333 2.235 10 20 CECD CCOC[C@@H]1CN(Cc2cc(OCC)ccc2O)CCO1 529667382 UQJKWCBCJMTUHR-HNNXBMFYSA-N 295.379 2.028 10 20 CECD COc1cccc(CN2CCC[C@H]2c2ncc[nH]2)c1O 375353551 CAMRKAQKADTYFG-LBPRGKRZSA-N 273.336 2.461 10 20 CECD CCN(C)C(=O)N1CCCN(c2ccc(OC)cc2)CC1 376249338 XCCKWNHIHHSVGL-UHFFFAOYSA-N 291.395 2.279 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1cc(OC)ccc1O 281225384 KPPHWRNGWUAIGK-NSHDSACASA-N 281.352 2.174 10 20 CECD CNC(=O)OC[C@@H]1CCCCN1Cc1cc(F)ccc1O 290065266 FNYQUFIJCPBRIG-ZDUSSCGKSA-N 296.342 2.242 10 20 CECD COc1cccc(CN(C)CCCn2ccnc2)c1O 290328777 DNRCVZHJXAWYKS-UHFFFAOYSA-N 275.352 2.119 10 20 CECD CC[C@@H](NC[C@H]1CNCCCO1)c1ccc(N(C)C)cc1 817982289 QXLHDEFFUUCOAF-IAGOWNOFSA-N 291.439 2.172 10 20 CECD C[C@@H](NCc1cc2c(cc1O)OCO2)c1ccnc(O)c1 815148477 XDKCYSTYUNOGKJ-SECBINFHSA-N 288.303 2.072 10 20 CECD COC[C@H](C)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 818116072 GGDODXCIWWKDJX-KBPBESRZSA-N 278.396 2.146 10 20 CECD Cc1cc(O)c(CN2C[C@H](O)C[C@@H]2C)cc1Cl 825666083 GWCKXIWNWMVLBU-GXSJLCMTSA-N 255.745 2.309 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2[C@H]3[C@@H]4CC[C@@H](C4)[C@H]32)cc1 906627010 IUXPOYVUPYPBKU-OPTZYUCBSA-N 256.349 2.177 10 20 CECD CNC(=O)C[C@H](C)N[C@H](C)c1c(C)cc(C)cc1O 834901986 YQWXJJDNTQSMNE-NWDGAFQWSA-N 264.369 2.184 10 20 CECD CCN(CC)C[C@@H]1CCN(C(=O)c2cc(O)cs2)C1 743758415 DHHDURDLUHPSIA-NSHDSACASA-N 282.409 2.258 10 20 CECD CC(C)n1[nH]cnc1=NCc1c(O)cccc1Cl 840887236 UAXHYKHMPPRHMS-UHFFFAOYSA-N 266.732 2.252 10 20 CECD C[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)c1ccn(C)n1 840816784 PXZCGLSNEVYDRZ-NXEZZACHSA-N 290.323 2.446 10 20 CECD CCCC[C@H](CN)NCc1ccc(N2CCOCC2)cc1 841029009 LEITZRIPJBSUHV-MRXNPFEDSA-N 291.439 2.130 10 20 CECD COc1cccc([C@H](C)NCCN2CCSCC2)c1O 846142792 CJZAIJMPPJYUKW-LBPRGKRZSA-N 296.436 2.100 10 20 CECD CCc1cccc(CN[C@@H]2CCc3n[nH]cc3C2)c1O 848897514 QTLNDOOVCXGCOQ-CQSZACIVSA-N 271.364 2.325 10 20 CECD CCc1cccc(CN[C@H](C)[C@H](C)N2CCOCC2)c1O 848894951 ITYNSGJPHARXOJ-KGLIPLIRSA-N 292.423 2.153 10 20 CECD CCOCCOCCN(C)c1ccc(OC)cc1OC 846752085 AXIZXQOLNSJZIX-UHFFFAOYSA-N 283.368 2.193 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)N(C)C 750021317 FTYVKLUFAHMGGW-LBPRGKRZSA-N 264.369 2.081 10 20 CECD C[C@@H](NC[C@@H]1COCCO1)c1cc(Cl)ccc1O 756434960 RXLKDBZFEPZWGB-MWLCHTKSSA-N 271.744 2.112 10 20 CECD Cc1ccc2c(c1)N(C(=O)/C=C\c1cn(C)cn1)CC2 931152812 JYHYFZMSIHVOLL-WAYWQWQTSA-N 267.332 2.331 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2ccccc2O)CCC1=O 764071143 TZCKMWNZYQXVLD-QWRGUYRKSA-N 261.321 2.014 10 20 CECD Cn1ccc(C(=O)NCCCSc2nccs2)c1 763386375 KXSLKVMNGFLBOM-UHFFFAOYSA-N 281.406 2.394 10 20 CECD CC(F)(F)CNCc1ccc(N2CCC(O)CC2)cc1 877551924 OGCLUZQNKWCJRZ-UHFFFAOYSA-N 284.350 2.393 10 20 CECD CC(C)CN1CCN(Cc2ccccc2O)[C@@H](C)C1=O 779202422 OHGHZPCKCZUISZ-ZDUSSCGKSA-N 276.380 2.081 10 20 CECD C[C@H](NC[C@H](O)COc1ccccc1)c1ccccc1O 775131815 WKFMYZQGNFPONS-KBPBESRZSA-N 287.359 2.483 10 20 CECD CNC(=O)CCCN(C)Cc1cc(Cl)cc(F)c1O 775724715 HEMSSRDQXJBEBO-UHFFFAOYSA-N 288.750 2.143 10 20 CECD CN(C)c1ccc(CNCc2ccc(Cl)nn2)cc1 876906341 WYXYNRNIJQBYAA-UHFFFAOYSA-N 276.771 2.486 10 20 CECD CCC1(C(=O)N(C)c2ccc(N)cc2)CCOCC1 877076940 XOUOYFFMMOZXSY-UHFFFAOYSA-N 262.353 2.438 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1cccc(Cl)c1O 776251979 GFOGXGKWVBTWTB-ZYHUDNBSSA-N 282.771 2.050 10 20 CECD C[C@@H](NC(=O)C[C@@H]1CCOC1)c1ccc(N(C)C)cc1 773010410 PJRVEWRIDFTWKR-OLZOCXBDSA-N 276.380 2.356 10 20 CECD C[C@H](NCC1(CS(C)(=O)=O)CCC1)c1ccccc1O 775131919 ZBZFPGAZWMYBNI-LBPRGKRZSA-N 297.420 2.258 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2c(O)cccc2F)CC1 886493442 LJWLOJXDHZKBTP-SNVBAGLBSA-N 280.343 2.193 10 20 CECD CCC[C@@H](N)c1cn(Cc2ccc(N(C)C)cc2)nn1 881272152 ODQYKKCBXBFJHH-CQSZACIVSA-N 273.384 2.192 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H]3CC[C@H]2[C@H](O)C3)c1O 887044134 GKABQVGBGCLZJJ-NZVBXONLSA-N 293.338 2.079 10 20 CECD COc1cc(C)cc(CNC(C)(C)c2nc(C)no2)c1O 894691325 ZNUHEUABGTYESF-UHFFFAOYSA-N 291.351 2.426 10 20 CECD CC[C@@H](NC[C@@](C)(O)COC)c1ccc(C)cc1O 794811359 WZQHTSCGJKKEGB-UKRRQHHQSA-N 267.369 2.139 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H](C)S1=O 792193241 UIHPOVSKAKEJLN-UWVGGRQHSA-N 287.812 2.387 10 20 CECD COc1ccc(CNC(=O)c2csc(C=O)c2)c(O)c1 794378533 UXQDGYSCVZRFKP-UHFFFAOYSA-N 291.328 2.205 10 20 CECD CC(C)(O)CNCc1ccc(Br)cc1O 701014871 LGNFMUCJYOHIAS-UHFFFAOYSA-N 274.158 2.015 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC(F)(F)CN 1325724357 WJEKBONAQNDKPE-VHSXEESVSA-N 270.323 2.433 10 20 CECD CCc1cccc(CNCc2cccnc2O)c1O 714976041 FBYMDXRNEJPKIO-UHFFFAOYSA-N 258.321 2.345 10 20 CECD CN1CCN(c2ccc(CN3CC[C@H](F)C3)cc2F)CC1 1347791483 FQFFUDDIZISJFF-AWEZNQCLSA-N 295.377 2.121 10 20 CECD Cc1cc(O)c(CN[C@H](C(=O)O)C2CC2)cc1Cl 1600285416 BJMPJBLQBWWBSM-LBPRGKRZSA-N 269.728 2.307 10 20 CECD COCCN(C(=O)/C=C\[C@@H]1CCCNC1)c1ccccc1 1579027000 MBQYTGPFWZMADD-KVPUOBJLSA-N 288.391 2.222 10 20 CECD CCOc1cccc(CN[C@H]2CC=C(C(=O)O)C2)c1O 1597155932 WHRHGQTVWBLEMV-LBPRGKRZSA-N 277.320 2.054 10 20 CECD C[C@@H](NCCCn1cccn1)c1cc(C(=O)O)ccc1O 1593266999 INXWNOMGABCQSY-LLVKDONJSA-N 289.335 2.028 10 20 CECD CCc1nc(CN2CCOc3cc(N(C)C)ccc32)no1 163188513 LKGLPGVVWWPKTP-UHFFFAOYSA-N 288.351 2.097 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCOCCOC)cc1 153997544 IFMOBMDMRDOYFX-CQSZACIVSA-N 280.412 2.456 10 20 CECD CCc1nnsc1C(=O)N(C)Cc1ccccc1O 48606762 MTQZNZAJOXAQBF-UHFFFAOYSA-N 277.349 2.078 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H]1CCc2cccc(O)c21 297794711 QBMMJPIAADOBRT-IRUJWGPZSA-N 267.394 2.082 10 20 CECD CCCN1CC[C@@H](NCc2ccc(N(C)C)cc2)C1 328166559 IZNNOMGFERTLEZ-OAHLLOKOSA-N 261.413 2.327 10 20 CECD Cn1cnc(CNCc2ccc(Br)cc2O)c1 898042261 NLSWJFWWVMIPCR-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccccn2)cc1F 60214109 GKBHAOUTYDZWPA-UHFFFAOYSA-N 273.311 2.217 10 20 CECD Nc1ccc(CC(=O)N(Cc2ccncc2)C2CC2)cc1 37803399 RKMPQGINAGNEBU-UHFFFAOYSA-N 281.359 2.398 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)CN2CCCC2=O)c1 37782159 VZEANOFGAXEAJX-VXGBXAGGSA-N 292.379 2.062 10 20 CECD C[C@H](O)CCN(C)Cc1ccc(N(C)C)c(F)c1 127666920 XBBRVLDMGLQARD-NSHDSACASA-N 254.349 2.094 10 20 CECD COc1cccc(CNC[C@@](C)(O)c2ccsc2)c1O 77460794 WUJNVJPTBKDBBG-OAHLLOKOSA-N 293.388 2.460 10 20 CECD CC(C)COC[C@H](O)CN[C@H](C)c1cc(F)ccc1O 185117712 AKEQERDXOCAVPQ-DGCLKSJQSA-N 285.359 2.215 10 20 CECD COc1ccc(O)c([C@H](C)NCCC[C@H](C)O)c1 228044709 WMACOPKNVDSJBC-QWRGUYRKSA-N 253.342 2.212 10 20 CECD Cc1nnc(CCNCc2ccc3c(c2)CCO3)s1 289901103 RAFYBWHBMJMUSE-UHFFFAOYSA-N 275.377 2.114 10 20 CECD CN(C)c1ccc(CN(CCn2cncn2)C2CC2)cc1 263876176 JKVPCDYHRUVPIB-UHFFFAOYSA-N 285.395 2.009 10 20 CECD C[C@H](N[C@@H](C)c1ccc(F)c(F)c1O)c1ncn(C)n1 277003737 ZRMPFPTYKFMOIF-YUMQZZPRSA-N 282.294 2.211 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCC2(SC)CC2)c1O 279505250 ZUAPMJLPJRCKGD-UHFFFAOYSA-N 298.364 2.294 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@]2(C)CCCOC2)cc1F 272601520 FEQDLZWUQKSGPK-INIZCTEOSA-N 294.370 2.325 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@](O)(C3CC3)C2)c1O 377265694 HFIPOSXRBHPXME-INIZCTEOSA-N 293.338 2.081 10 20 CECD CCCOc1ccc(CN2CCC[C@](F)(CO)C2)c(O)c1 289816634 NWTOFVALOGCRGU-MRXNPFEDSA-N 297.370 2.477 10 20 CECD COC[C@H](C)NC1CCN(c2ccc(OC)cc2)CC1 371796193 LINIHIHSULBFTC-ZDUSSCGKSA-N 278.396 2.289 10 20 CECD CNC(=O)C(C)(C)CN[C@H](C)c1c(C)cc(C)cc1O 285089190 JXEMMPSXEVCGNX-GFCCVEGCSA-N 278.396 2.432 10 20 CECD Cc1cc(CN(CCOCCO)C(C)C)ccc1N(C)C 294014893 GYOOQQYVANGBOX-UHFFFAOYSA-N 294.439 2.280 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1cn[nH]c1 807835737 KHFWYIPXSBKPCE-UHFFFAOYSA-N 286.118 2.352 10 20 CECD Cc1cc(CN2CC[C@@H](C)[C@@H]2CO)ccc1N(C)C 294757051 YBTGOTVDDQRGPD-WBMJQRKESA-N 262.397 2.264 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1oc(C)nc1C 808095770 RWKLAKONDQGOPO-UHFFFAOYSA-N 295.335 2.413 10 20 CECD CC[C@H](C)[C@H](CNC(=O)NCc1ccccc1O)OC 297711021 IAWQFVLAGAYAQV-FZMZJTMJSA-N 280.368 2.253 10 20 CECD CC(=O)C(=O)COC(=O)c1occc1-c1ccccc1 808490107 AHQKWOHDDTXQBN-UHFFFAOYSA-N 272.256 2.262 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@@H](C)C(=O)N(C)C)c1O 808716095 JBIHUBGZZQGNTN-ZJUUUORDSA-N 284.787 2.481 10 20 CECD CC[C@H](NCCNC)c1cc(Br)ccc1O 817953217 XJIRSVBWDKXDIZ-NSHDSACASA-N 287.201 2.415 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@H]([S@@](C)=O)C2)c1 826910382 GHQAQUJAOXQXJC-TUXXCZFBSA-N 297.420 2.180 10 20 CECD CCOCc1cc(CN[C@@H](CC)[C@@H](C)O)ccc1OC 824921470 MHLUECNHJJYKNO-DOMZBBRYSA-N 281.396 2.481 10 20 CECD COc1cc(Cl)cc(CN(C)Cc2noc(C)n2)c1O 827892566 ZZZXKYLRDIWROQ-UHFFFAOYSA-N 297.742 2.378 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCCN2C)c1 732287665 ZKHPNKYEMJUOML-BXUZGUMPSA-N 292.379 2.062 10 20 CECD CCN(CC)c1ccc(CN[C@H](C(=O)O)[C@@H](C)OC)cc1 900059972 YZFDJUHUDUELLS-DOMZBBRYSA-N 294.395 2.111 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](C)NC[C@@H]1C 843119899 LZHMNELCAFSCSQ-KBPBESRZSA-N 261.413 2.243 10 20 CECD CC1CCC(OCC(=O)NCc2ccc(O)cc2O)CC1 910946514 OILGPHAGFCSXJS-UHFFFAOYSA-N 293.363 2.309 10 20 CECD C[C@H](NCCCn1cncn1)c1cc(Cl)ccc1O 756830018 NWRSZPRAVGLGAG-JTQLQIEISA-N 280.759 2.378 10 20 CECD COc1ccc2c(c1)CCCN2CCn1cccn1 920085011 HQLJGCANQHLBNK-UHFFFAOYSA-N 257.337 2.345 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@H]1CO 856796012 MXALOZWQBPCNQL-ZFWWWQNUSA-N 262.397 2.203 10 20 CECD Cc1ccc(O)c(CNC(=O)NC2CC(F)(F)C2)c1 858394153 HOANCYOMDNFHMJ-UHFFFAOYSA-N 270.279 2.298 10 20 CECD Cc1ccc(/C=C2/SC(=S)N(C)C2=O)nc1 761785419 ICLVTPMYKQDPRR-WEVVVXLNSA-N 250.348 2.221 10 20 CECD CC(=O)NCC[C@@H]1CCCN(Cc2c(C)cccc2O)C1 877530924 ZHXMNPPZZQTHBY-HNNXBMFYSA-N 290.407 2.439 10 20 CECD CC(C)S(=O)(=O)CCCN[C@H](C)c1ccccc1O 879648430 ONYHWCMSFFYMOF-GFCCVEGCSA-N 285.409 2.256 10 20 CECD COCc1nc(CN[C@@H](C)c2ccc(N(C)C)cc2)no1 775835648 HKFWNEBBYYDOSE-NSHDSACASA-N 290.367 2.133 10 20 CECD CC1(C)C[C@@H]1CNC(=O)/C=C/c1ccc(O)c(O)c1 779517304 PHQHKUZPRPTXPB-DUMNWFOQSA-N 261.321 2.273 10 20 CECD Cc1cccc(O)c1CN[C@@H](C)C(=O)OCC(C)C 877469754 UDFMWXXTUDEDJR-LBPRGKRZSA-N 265.353 2.378 10 20 CECD COc1ccc(CNCC(F)F)cc1Cn1cccn1 873126165 OORZQQAKNILNHC-UHFFFAOYSA-N 281.306 2.295 10 20 CECD C[C@H](N[C@@H](C)[C@@H](C)N1CCOCC1)c1c(O)cccc1F 886524043 BMDXNBJHICEKST-RWMBFGLXSA-N 296.386 2.291 10 20 CECD Cc1nccc(NCc2ccc(N3CCN(C)CC3)cc2)n1 882880528 XDUJXSHNAGBFBW-UHFFFAOYSA-N 297.406 2.149 10 20 CECD C[C@H](NC[C@H]1CC[C@@H](O)C1)c1cc(F)cc(F)c1O 788984312 KNXPSXHCAJWXTA-ATZCPNFKSA-N 271.307 2.482 10 20 CECD Cn1cc(CNCc2ccccc2O)c(C2CC2)n1 892791840 PJXAWLNIMKLBEV-UHFFFAOYSA-N 257.337 2.293 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC[C@@H](n2ccnn2)C1 895053700 SGFOYIFBXGRSCW-GFCCVEGCSA-N 294.305 2.099 10 20 CECD CCOCCOCCNCc1ccc(N(C)C)cc1C 897204358 OAGCSNAQOMMZIO-UHFFFAOYSA-N 280.412 2.204 10 20 CECD CCn1ncnc1CN[C@H](C)c1ccc(C)c(C)c1O 794838816 ATTWEGFZVLKZKU-GFCCVEGCSA-N 274.368 2.471 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@@H](C)N1 1235897452 SQNYFOYBGDGILG-GASCZTMLSA-N 273.424 2.469 10 20 CECD CN(Cc1ccccc1O)c1ccnc(C(=O)O)c1 1777076893 IIIULEPXVUEAEN-UHFFFAOYSA-N 258.277 2.122 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(C)(C)CCO)c1 185608849 TYKAXCDEUOXKQL-LLVKDONJSA-N 267.369 2.460 10 20 CECD CCOC(=O)[C@H](NCc1cc(OCC)ccc1O)C1CC1 1326220250 UWDFIDPJMJPXCL-OAHLLOKOSA-N 293.363 2.222 10 20 CECD CN(CCC(=O)N1CCCCC1)Cc1ccccc1O 732202917 JDYPJJXOTVXWSW-UHFFFAOYSA-N 276.380 2.227 10 20 CECD CC(C)(C)OC(=O)NOCCCNCc1ccccc1O 1334338386 YNCIYNDZRZBOBU-UHFFFAOYSA-N 296.367 2.328 10 20 CECD CN(C)c1ccc(CNCc2cc(C(N)=O)cs2)cc1 93685452 LETBFGXLKUILNF-UHFFFAOYSA-N 289.404 2.203 10 20 CECD C/C=C/C[C@H](CO)N[C@H](C)c1cc(C(=O)O)ccc1O 1604851105 JTZXLKYSFJEGOY-ISBNUJHVSA-N 279.336 2.068 10 20 CECD C[C@H](O)C[C@H](C)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1609789236 YWJUGLOUWGSERD-DCAQKATOSA-N 281.352 2.148 10 20 CECD CO[C@H]1CCN(Cc2cccc(Cl)c2O)[C@H](C(=O)O)C1 1606757246 PKFLNZRFGJUZJX-JQWIXIFHSA-N 299.754 2.110 10 20 CECD O=C(O)[C@]1(NCc2ccc3c(c2)CCO3)CCC[C@@H]2C[C@H]21 1777600228 XLJCRYNNIASPCO-MRRJBJDNSA-N 287.359 2.355 10 20 CECD C[C@@H]1C[C@@H]1[C@H](NCc1ccc2c(c1)CCCO2)C(=O)O 1776603054 OWWHPMFMEVCJCE-DGFSRKRXSA-N 275.348 2.210 10 20 CECD C[C@@H]1C[C@H]1[C@@H](NCc1cc(F)c(N(C)C)cc1F)C(=O)O 1776602427 JBMDNBJJNJMPTD-PJCOJXEDSA-N 298.333 2.230 10 20 CECD CC1CCN(c2ccc(CNC(=O)C3(N)CC3)cc2)CC1 167858314 QBZGQYWVWOPMDB-UHFFFAOYSA-N 287.407 2.030 10 20 CECD CC(C)C[C@H](CN)CC(=O)NCc1ccccc1O 228420706 GYXWDEZQGHDSBT-LBPRGKRZSA-N 264.369 2.020 10 20 CECD CCOc1cccc(CNCC2(OC)CCC2)c1O 181089263 YPTMYXJPDKCNDS-UHFFFAOYSA-N 265.353 2.450 10 20 CECD CCOc1cccc(CNC[C@@]2(C)CCOC2)c1O 397119664 LWNDKJUEUSJARC-OAHLLOKOSA-N 265.353 2.307 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccnc(C)c2)c1 119717529 WRIUQDNITYIDCV-UHFFFAOYSA-N 287.319 2.426 10 20 CECD COc1ccc(N2CCCN(C(=O)c3cc[nH]c3)CC2)cc1 68291636 QOGVPTDUDYQDIM-UHFFFAOYSA-N 299.374 2.376 10 20 CECD Cc1cccc(CN2CCC3(CC2)OCCO3)c1O 179665590 DFQSUDWWQNBSGY-UHFFFAOYSA-N 263.337 2.040 10 20 CECD C[C@H](O)[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 305824293 BYSFBFVKAHWZIS-UWVGGRQHSA-N 255.745 2.248 10 20 CECD C[C@H](NCC(C)(C)N1CCN(C)CC1)c1ccccc1O 20200360 BIROWBNXWJOSGC-AWEZNQCLSA-N 291.439 2.069 10 20 CECD CC[C@@H](CSC)NC(=O)c1ccc(C)c(O)c1O 182989062 QOEDSFFYGPJGMA-VIFPVBQESA-N 269.366 2.278 10 20 CECD Oc1c(Cl)cccc1CNC1CCC(O)CC1 123515502 IRJLCBVTOLYMRL-UHFFFAOYSA-N 255.745 2.439 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1cc(C)c(C)cc1O 123835251 BEPJBAGVEVBIFC-GFCCVEGCSA-N 265.353 2.250 10 20 CECD Oc1c(Cl)cccc1CNC[C@H]1CC[C@@H](O)C1 187985956 VLIWGFPBZJPGGH-GXSJLCMTSA-N 255.745 2.296 10 20 CECD CC(C)CN1CCO[C@@H](CN[C@@H](C)c2ccccc2O)C1 183385184 HSXGHLZSOFBXKJ-GJZGRUSLSA-N 292.423 2.400 10 20 CECD CSC(C)(C)CNC(=O)c1ccc(C)c(O)c1O 182535411 AULYMWZSSSNLTB-UHFFFAOYSA-N 269.366 2.278 10 20 CECD C[C@@H](CO)N[C@H](C)c1cc(Br)c(F)cc1O 134925998 SHKGBUCMWJMMOY-NKWVEPMBSA-N 292.148 2.325 10 20 CECD C[C@@H]1CSCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 191577365 HYRJXLKIZGOWDK-TZNOJPMFSA-N 293.388 2.323 10 20 CECD CCCOc1ccc(CN(C)CC(=O)NC(C)C)c(O)c1 133389885 LAIWUOUIYBYFMM-UHFFFAOYSA-N 294.395 2.137 10 20 CECD CCc1cc(Sc2nccs2)n2ncnc2n1 48894049 XOSMHUNMZQRTSG-UHFFFAOYSA-N 263.351 2.294 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C(=O)OC(C)(C)C 274039112 CRNDTDCVINRIMR-UHFFFAOYSA-N 293.363 2.473 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](CC)C(=O)OC 278917421 RLERMQBWZMYHEJ-ZDUSSCGKSA-N 293.363 2.330 10 20 CECD CCOCCN(C)Cc1ccc(N(C)C)c(F)c1 272360898 NCZNXQAEJFMTDT-UHFFFAOYSA-N 254.349 2.360 10 20 CECD Oc1ccc(-c2ccccc2)cc1CNC[C@@]1(O)CCOC1 270003976 SFOKLICDZZISQJ-SFHVURJKSA-N 299.370 2.300 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)[C@H]1OC 272683491 TWIOIYQQONZKDW-FVQBIDKESA-N 296.386 2.174 10 20 CECD COCC[C@@H](CO)N[C@@H](C)c1cc(Cl)ccc1O 281587933 LMJNZTBEWUDCCL-ONGXEEELSA-N 273.760 2.094 10 20 CECD CCOC(=O)CCCSc1ncc(C(=O)OC)s1 295159615 GPEWCCCZVZXFKG-UHFFFAOYSA-N 289.378 2.365 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C[C@H](O)C1CC1 809751687 IZAHULCOMIQWFY-LBPRGKRZSA-N 273.735 2.387 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC(=O)NCC1CC1 393003166 ZWJYPJCIKBSNSG-YPMHNXCESA-N 288.391 2.365 10 20 CECD COCC(C)(C)N(C)Cc1cc(OC)c(OC)cc1O 292678298 ALWHVEMGHXXSQO-UHFFFAOYSA-N 283.368 2.266 10 20 CECD CC(=O)C(=O)COC(=O)c1cccc(Cl)c1Cl 808488995 XOKIXBWNIQRTDQ-UHFFFAOYSA-N 275.087 2.308 10 20 CECD C[C@H](NC[C@H]1CCCCN1)c1cc([N+](=O)[O-])ccc1O 817950029 QHEMOVVKBSBLIT-WDEREUQCSA-N 279.340 2.093 10 20 CECD CCOCC[C@H](O)CNc1ccccc1OCC 819392494 FXLWVPSEDIXEKW-LBPRGKRZSA-N 253.342 2.285 10 20 CECD CC[C@@](C)(NCc1ccc(N(C)C)c(C)c1)C(=O)OC 815080353 AFZVVJCZBDWAIS-MRXNPFEDSA-N 278.396 2.492 10 20 CECD CCN(CC)c1ccc(CNC(=O)C[C@H](N)C2CC2)cc1 827341244 YEANBUULJTUFSW-INIZCTEOSA-N 289.423 2.276 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCCCCCN)c1 828667451 PYTNOYNHLLDDBY-LBPRGKRZSA-N 294.395 2.487 10 20 CECD CO[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)CC1(C)C 824820714 KYSCBRVQDATXPQ-OAHLLOKOSA-N 293.363 2.368 10 20 CECD C[C@H]1C[C@H](C(=O)N[C@H](C)c2ccccc2O)CCO1 827940943 LINNASZYZQSTHM-QJPTWQEYSA-N 263.337 2.385 10 20 CECD CC[C@H]1CCCCN1CCNC(=O)c1cc(O)cs1 733365953 VMTODOOJRYJBHP-NSHDSACASA-N 282.409 2.448 10 20 CECD C[C@@H]1CC[C@H](CNC(=O)NCc2ccc(N(C)C)cc2)O1 836251923 RNUIOCDBGHBOIC-IUODEOHRSA-N 291.395 2.119 10 20 CECD O=C(O)CN(Cc1ccccc1O)C(=O)[C@@H]1CC=CCC1 911483555 CUUWHUNQQKFSIA-GFCCVEGCSA-N 289.331 2.162 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CCNC2)cc1F 841045491 WONKDZFBAAICIW-CYBMUJFWSA-N 265.376 2.123 10 20 CECD CNC(=S)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840870912 VXVCYEONVOMPTC-NSHDSACASA-N 265.426 2.086 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](CO)C(C)C)c1O 846169865 GNMFGKWGFYTXKV-NEPJUHHUSA-N 267.369 2.316 10 20 CECD CC(C)[C@H](N)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 841882098 WFYUYNYUMASYFS-SWLSCSKDSA-N 292.427 2.096 10 20 CECD NCc1ccc2c(c1)CCCN2CC1=CCCOC1 863642359 YUFOJZVYRGSKQB-UHFFFAOYSA-N 258.365 2.245 10 20 CECD CC[C@@](C)(CC(=O)OC)NCc1cccc(OC)c1O 748241576 AEZDPDAZQUNSOC-HNNXBMFYSA-N 281.352 2.222 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCCN[C@H]1C 841063149 IWFXHLGXXHBPLH-XJKSGUPXSA-N 261.413 2.291 10 20 CECD Cc1ccc(O)c(CN2CCC([C@@H]3OCC[C@H]3N)CC2)c1 843125038 LWKIQRSZUXFIBQ-WBVHZDCISA-N 290.407 2.029 10 20 CECD Cc1ccc([C@H](C)N[C@H](CO)CCF)c(O)c1C 846209338 QJEANJRWWPHIRQ-RYUDHWBXSA-N 255.333 2.380 10 20 CECD NC[C@@H]1CC[C@H](NCc2cc(Cl)cc(F)c2O)C1 841084652 MNQSMHHSVMEDJH-KCJUWKMLSA-N 272.751 2.402 10 20 CECD C[C@H](Cc1ccco1)NC(=O)NCCc1ccc(N)cc1 841702612 XNHCRSDNSKBFRQ-GFCCVEGCSA-N 287.363 2.335 10 20 CECD CCN(CCN)C(=O)NCc1ccc(N(CC)CC)cc1 861562608 ZTDNCCWSABXKBK-UHFFFAOYSA-N 292.427 2.023 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)CC(=O)NC)cc1F 765883701 YGDFNQYJULPTMS-GFCCVEGCSA-N 295.402 2.286 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H](CO)C2CC2)c1O 771807801 LXHYBVXELUDHDQ-ZDUSSCGKSA-N 283.755 2.109 10 20 CECD C[C@@H](CO)CCCNC(=O)N[C@H](C)c1ccccc1O 875430706 NTYJJGLBLLCKMM-VXGBXAGGSA-N 280.368 2.161 10 20 CECD CCc1cccc(CN2Cc3cnn(C)c3C2)c1O 877632997 VIQHDVVDILRWQO-UHFFFAOYSA-N 257.337 2.204 10 20 CECD C[C@H](NC(=O)[C@H]1CCCCO1)c1ccc(N(C)C)cc1 773013816 ZWVBMAMLBWASRM-SWLSCSKDSA-N 276.380 2.499 10 20 CECD N=C(NCc1c(O)ccc2c1CCCC2)NCC1CC1 887355358 MXCGPHCMHWFQIN-UHFFFAOYSA-N 273.380 2.295 10 20 CECD CCN(C)c1ccc(CN(C)CC(=O)N2CCCC2)cc1 773734339 QOVWBOQYSBQFAH-UHFFFAOYSA-N 289.423 2.197 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)N1C[C@H]2C[C@@H]2C1 888343431 IHRVELGAYDVERT-HUUCEWRRSA-N 283.375 2.224 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)c1ncco1 886275938 QZOYWBSYCWUHQM-ZDUSSCGKSA-N 287.363 2.362 10 20 CECD COc1cccc(CNC(=O)[C@@H](F)C(C)C)c1O 784440814 CSZHXRSRXNVFMS-NSHDSACASA-N 255.289 2.011 10 20 CECD CC[C@H](NC(=O)c1ccc(C)c(O)c1O)C1CCOCC1 780954386 DQDKVQBWIJIEFP-ZDUSSCGKSA-N 293.363 2.341 10 20 CECD COCC[C@H](C)CNCc1ccc(OC)c(OC)c1O 894897635 WYVRMOCFFCEOHS-NSHDSACASA-N 283.368 2.172 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2C[C@H]2C(F)(F)F)cc1 892039808 ZNGKMKAYQWLEEM-GHMZBOCLSA-N 287.285 2.061 10 20 CECD CC[C@@H](COC)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898450672 SONNWIGHKWZNAZ-RDJZCZTQSA-N 293.455 2.370 10 20 CECD CC[C@H](NCc1ccc(OC)c(OC)c1O)C(C)(C)O 894631664 NMFNTIXCTJMRPJ-LBPRGKRZSA-N 283.368 2.049 10 20 CECD COc1ccc(CN2CC[C@H](OC)[C@H](C)C2)c(O)c1OC 894716740 BDUWRMMCUWBIIL-YPMHNXCESA-N 295.379 2.266 10 20 CECD C[C@@H](NC(=O)CC1OCCCO1)c1ccc(N(C)C)cc1 793857340 UTOPCVDQXWSYRH-GFCCVEGCSA-N 292.379 2.083 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1cnc[nH]1 793512128 LBGPCDKMXXUTIS-UHFFFAOYSA-N 286.379 2.033 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2C[C@@H](O)C2(C)C)cc1F 1329389547 LYSCXYJPJAOBFC-ZIAGYGMSSA-N 284.350 2.280 10 20 CECD c1nc(CNCc2ccc(N3CCOCC3)cc2)cs1 67222123 WGPHGJMVTVXYAL-UHFFFAOYSA-N 289.404 2.270 10 20 CECD C[C@H](N[C@H](CO)CC(F)F)c1cc(F)ccc1O 717765968 AHOJWHGSLMJJQI-CBAPKCEASA-N 263.259 2.198 10 20 CECD CCOC[C@H](NC(=O)NCc1ccc(N)cc1)C(C)C 1353493265 UWEBYDBTPPNYHD-AWEZNQCLSA-N 279.384 2.129 10 20 CECD COc1cc(C)c(CN2CCC(C)(N)CC2)c(O)c1 1579144745 OPTMSKQWQJVZNP-UHFFFAOYSA-N 264.369 2.022 10 20 CECD COC[C@H](C)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1599157334 RCWOGXVSMJPVNF-ZJUUUORDSA-N 267.325 2.024 10 20 CECD COc1cc(CN2CCC3(CC2)OCCO3)c(O)cc1C 159727036 VYQQBGVXRHRVDB-UHFFFAOYSA-N 293.363 2.048 10 20 CECD CC1(C)NCC[C@H]1NCc1ccc2c(c1)CCCO2 904357793 BHZNGWFLWOKRTF-OAHLLOKOSA-N 260.381 2.242 10 20 CECD CCCN(CCCC(=O)NC)Cc1ccccc1O 846810621 YSIFOZKWJCZATI-UHFFFAOYSA-N 264.369 2.130 10 20 CECD CSC[C@@](C)(O)CNCc1ccc(N2CCCC2)cc1 217865684 OXXJBTPMHOGFII-INIZCTEOSA-N 294.464 2.490 10 20 CECD CCOc1cccc(CN[C@@H](C)c2cn[nH]c2)c1O 229883644 IACKTVGXMKRTSZ-JTQLQIEISA-N 261.325 2.365 10 20 CECD CCOC[C@@H]1CCN(Cc2cc(OC)ccc2O)C1 180622088 SNBYDDQBPCYCCQ-GFCCVEGCSA-N 265.353 2.259 10 20 CECD CCOc1cccc(CN2CCC[C@H](C)[C@@H]2CN)c1O 70175515 OROJWMQXNUNPKK-JSGCOSHPSA-N 278.396 2.350 10 20 CECD COc1cccc(CN[C@@H]2CCS[C@H]2C)c1O 310564138 KXXCQSUUOPJVNN-GXSJLCMTSA-N 253.367 2.384 10 20 CECD CN(Cc1ccccc1O)C[C@H](O)Cc1ccccc1 111235472 ATHODBQZUJFLRK-MRXNPFEDSA-N 271.360 2.428 10 20 CECD Cc1ccc(C(=O)N(CCN(C)C)CC(C)C)c(O)c1O 182386714 GHDJIHPIBMMUMG-UHFFFAOYSA-N 294.395 2.066 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H](OCC(C)C)C2)c(O)c1O 182605586 ABEHKYGMNVDRMX-GFCCVEGCSA-N 293.363 2.293 10 20 CECD COCCN(Cc1ccccn1)Cc1ccccc1O 196205584 RKKQWCXWJQMYEF-UHFFFAOYSA-N 272.348 2.436 10 20 CECD Cc1noc(C)c1C[C@@H](C)NC(=O)c1cccc(O)c1O 193081799 RLESXGWUDGXJAI-MRVPVSSYSA-N 290.319 2.064 10 20 CECD COCc1ccc(/C=C2/SC(=S)NC2=O)cc1 132416144 PJTQZTMIJZTXHT-UXBLZVDNSA-N 265.359 2.322 10 20 CECD COc1cccc(CN2CCc3ccccc3[C@H]2CO)c1O 93455543 FHAHNBNRNVYECZ-MRXNPFEDSA-N 299.370 2.493 10 20 CECD CCC[C@](C)(O)C(=O)N(C)Cc1ccc(N(C)C)cc1 269312718 OUCVXTOAEYGTCT-INIZCTEOSA-N 278.396 2.262 10 20 CECD Cc1cc(O)c(CN2CC[S@@](=O)C[C@H](C)C2)cc1C 277442679 KEOYKJGADDLXAU-NSPYISDASA-N 281.421 2.209 10 20 CECD CCCOc1ccc(CN[C@H](C)c2ncn(C)n2)c(O)c1 275389852 ASLMEZMWLFPQNJ-LLVKDONJSA-N 290.367 2.160 10 20 CECD C[C@@H](NCC1(N2CCOCC2)CC1)c1cc(F)ccc1O 278597573 ZHRYRLQJRVWFPE-GFCCVEGCSA-N 294.370 2.047 10 20 CECD COC[C@H](O)CN[C@@H](C)c1cc(Cl)c(Cl)cc1O 278680497 JVERQGHXSRKFKE-JGVFFNPUSA-N 294.178 2.357 10 20 CECD CCN(CC)c1ccc(CN2CCNC(=O)C[C@@H]2C)cc1 377889486 OVKJCSPMJCQQBG-AWEZNQCLSA-N 289.423 2.243 10 20 CECD C[C@@H]1CCCN(c2ccc(CNC(=O)CO)cc2Cl)C1 282396936 ZSTOXSNIBOJDPC-LLVKDONJSA-N 296.798 2.185 10 20 CECD C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C(F)(F)F 291710108 HJTHSCLOFYWCTC-OHCKJTPYSA-N 275.226 2.178 10 20 CECD Cc1cc(CN(C)CCNC(=O)C(C)C)ccc1N(C)C 293824011 PGEURCXWROUFQY-UHFFFAOYSA-N 291.439 2.265 10 20 CECD Cc1cccc(CNCCc2nccnc2C)c1O 293547324 DOIWXVAKUABMRZ-UHFFFAOYSA-N 257.337 2.131 10 20 CECD CC(=O)C(=O)CSc1nnc2cc(C)c3ccccc3n12 808013340 YLNWECZCECHGBZ-UHFFFAOYSA-N 299.355 2.441 10 20 CECD CCN(C)c1ccc(CN[C@@H]2CCC[C@H]2C(=O)NC)cc1 815102553 PZXBHWNTMFICAQ-HZPDHXFCSA-N 289.423 2.147 10 20 CECD COC(=O)[C@@H]1CCC[C@H](C(=O)Nc2ccc(N)cc2)C1 818556528 YQBUAZCZGWEPHB-WDEREUQCSA-N 276.336 2.187 10 20 CECD COC1([C@@H](C)NCc2cc(C)ccc2O)CCOCC1 817419408 GSLQIKLNDBVXHZ-CYBMUJFWSA-N 279.380 2.374 10 20 CECD Cc1cc(CN2CC[C@H](O)[C@@H](C)C2)ccc1N(C)C 815096660 UIZKBPIGNZDNQQ-BBRMVZONSA-N 262.397 2.264 10 20 CECD CC[C@@H](CNCc1ccc(N2CCOCC2)c(F)c1)OC 810176732 TVDAOYVQNITSCY-AWEZNQCLSA-N 296.386 2.177 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](n3cccn3)C2)c1O 812296889 RZKNUADJBJRMIF-CQSZACIVSA-N 287.363 2.353 10 20 CECD C[C@@H](O)CCN(C)Cc1ccc(Br)cc1O 824828751 FABSMGRGBWALNH-SECBINFHSA-N 288.185 2.357 10 20 CECD COc1cccc(CNC(=O)/C=C\c2cccc(O)c2)c1O 588537019 LONHVIQTWNJERO-HJWRWDBZSA-N 299.326 2.436 10 20 CECD C[C@@H](NC(=O)[C@H]1CSCCS1)c1ccccc1O 827937150 MAYZXBHXELWNBK-BXKDBHETSA-N 283.418 2.418 10 20 CECD COC1(C)CN(Cc2c(O)ccc(Cl)c2F)C1 839100970 GXYDYROXNRLOMA-UHFFFAOYSA-N 259.708 2.405 10 20 CECD CC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)[C@H]1CCCO1 588408614 OSEQOLKFARLUPO-PGGQVOCTSA-N 291.347 2.185 10 20 CECD CCc1nocc1C(=O)N[C@H](C)c1cc(OC)ccc1O 830540469 KNGVUSNSQFQUMM-SECBINFHSA-N 290.319 2.442 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)CCC2(C)CC2)cc1 911667715 QYCKHFARLKBUBR-OAHLLOKOSA-N 289.423 2.449 10 20 CECD Cc1cccc(CN[C@@H](CCN)C(F)(F)F)c1O 841090005 CYISLDOSEIMGQF-JTQLQIEISA-N 262.275 2.070 10 20 CECD C/C=C(\CC)C(=O)N(CC(=O)O)Cc1ccccc1O 911489646 VHAHNAIXVBPIGF-QDEBKDIKSA-N 277.320 2.162 10 20 CECD CCOc1ccc(O)c([C@@H]2NC(C)(C)C(=O)N2CC)c1 840833697 TWJUXTRJOOZLTO-CYBMUJFWSA-N 278.352 2.020 10 20 CECD C[C@H](NCC1(C)OCCO1)c1ccc(Cl)cc1O 841751417 MRYLUJONJBOXGO-VIFPVBQESA-N 271.744 2.459 10 20 CECD Cn1cccc1CNC(=S)NC(C1CC1)C1CC1 743061623 MTXRSEOWBSVJEF-UHFFFAOYSA-N 263.410 2.178 10 20 CECD CCc1cccc(CN2CCn3cnnc3[C@H]2C)c1O 848905895 MCUHLIRHCWCWFA-LLVKDONJSA-N 272.352 2.123 10 20 CECD CCOc1ccc(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)c(O)c1 843059725 RBAODYCQKLEMRJ-MAZHCROVSA-N 290.407 2.350 10 20 CECD Cc1cc(C(N)=O)c(C)n1-c1ccc(Br)cn1 916641184 DIJATGDCFNDKLV-UHFFFAOYSA-N 294.152 2.351 10 20 CECD CCC(O)(CC)CCNC(=O)Nc1ccc(N)cc1 841294411 BMCCLYMXAISDEB-UHFFFAOYSA-N 265.357 2.332 10 20 CECD C[C@H]1C[C@H](CN(C)c2ccc(OCC(=O)O)cc2)CCO1 846279874 OWZNDATWFSDCLT-QWHCGFSZSA-N 293.363 2.401 10 20 CECD CCOC(=O)C1(C(=O)NCc2ccccc2O)CCCC1 843832465 NMPOIYYPNBNEKT-UHFFFAOYSA-N 291.347 2.132 10 20 CECD NC(=O)c1cccc(CNCc2ccc3c(c2)CCCO3)c1 921501341 KIRFSSDZRWJPKX-UHFFFAOYSA-N 296.370 2.400 10 20 CECD CC(C)[C@@](C)(O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756576310 MEPXOEBBVHGYKD-YGRLFVJLSA-N 282.340 2.358 10 20 CECD CSCCCOC(=O)/C=C\c1ccc(O)c(O)c1 759588752 OIJATDLETUHBBZ-XQRVVYSFSA-N 268.334 2.407 10 20 CECD Cc1cc(O)nc(/C=C/c2ccc(N3CCOCC3)cc2)n1 752880173 HLPQLDTWDDUISW-QPJJXVBHSA-N 297.358 2.498 10 20 CECD Cc1cccc(O)c1CNC[C@@H]1CC(=O)N(C(C)(C)C)C1 877636014 KKFOIPRYJGEHGT-ZDUSSCGKSA-N 290.407 2.437 10 20 CECD CCOC(=O)c1ccc(CNCc2cc(C)ccc2O)[nH]1 877652355 HFVHWXOTBTXJFF-UHFFFAOYSA-N 288.347 2.495 10 20 CECD CO[C@H]1CCC[C@H]1CNCc1cc2c(cc1O)OCO2 774830411 CNUWGFNUZHOHKH-GWCFXTLKSA-N 279.336 2.026 10 20 CECD C[C@@H](NC(=O)[C@H]1C[C@H]2CC[C@H]1O2)c1ccc(N(C)C)cc1 773012353 XJZQBJHTVDQHOQ-BQDHKBFISA-N 288.391 2.497 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)C1(F)CCCC1 773397348 KNRVYPBANIVMKG-UHFFFAOYSA-N 267.300 2.039 10 20 CECD COc1cccc(O)c1CNCC1CCN(C2CC2)CC1 775024024 QJLZMEKIZPDYJC-UHFFFAOYSA-N 290.407 2.365 10 20 CECD CC[C@H]1CN(C(=O)NCc2ccc(N)cc2)[C@@H](CC)CO1 1120677070 IKDQDAAESXDAFK-GJZGRUSLSA-N 291.395 2.368 10 20 CECD CON1CCC(N[C@H](C)c2c(O)cccc2F)CC1 886628509 SNDDHRGAOWHEFF-SNVBAGLBSA-N 268.332 2.208 10 20 CECD C[C@@H](O)CCCNCc1ccc(Br)cc1O 701013146 BJDCYMRJWSUCDA-SECBINFHSA-N 288.185 2.405 10 20 CECD C[C@@H]1CC[C@H](COC(=O)/C=C/c2ccc(O)c(O)c2)O1 789071756 CVMBBEPULXMUIN-UHLPNAGUSA-N 278.304 2.222 10 20 CECD C[C@@H](NC(=O)CCc1cnc[nH]1)c1ccc(N(C)C)cc1 793855638 KXKDHYHAYLDWNB-GFCCVEGCSA-N 286.379 2.286 10 20 CECD C[S@@](=O)C1(CNCc2cc(Cl)cc(F)c2O)CC1 799739247 SFJMHGDIAMQGFV-GOSISDBHSA-N 291.775 2.185 10 20 CECD C[C@@H](NCCCCCO)c1cc(F)cc(F)c1O 790498271 QYGQWUMSIJJEKD-SECBINFHSA-N 259.296 2.484 10 20 CECD CC[C@H](C)[C@H](OC)C(=O)NCc1cc(OC)ccc1O 793690685 XGBLXKSMHBSMHT-HZMBPMFUSA-N 281.352 2.078 10 20 CECD Cc1cc(Br)cc([C@H](C)NCCO)c1O 186939291 GCFIKCKHFABFBD-QMMMGPOBSA-N 274.158 2.106 10 20 CECD Cc1csc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 1321558566 FIPFAVSPSFYXLH-QMMMGPOBSA-N 292.360 2.224 10 20 CECD Cc1cc(O)c(CNC[C@]2(C)CCC(=O)N2)cc1Cl 1330807712 GYSRSRYCXIECJI-AWEZNQCLSA-N 282.771 2.112 10 20 CECD COc1cc(C)cc(CN(C)C(C)(C)C(=O)O)c1O 1607149334 IPZYFCGOZNROQS-UHFFFAOYSA-N 267.325 2.004 10 20 CECD Cc1ccc(CN[C@H](CC(F)(F)F)C(=O)O)c(O)c1 1600418639 CPNFUARJAOKRMW-SECBINFHSA-N 277.242 2.196 10 20 CECD O=C(O)[C@@H]1[C@@H](CNCc2cccc(Cl)c2O)C1(F)F 1601751191 LIACUPXEHIECFA-APPZFPTMSA-N 291.681 2.101 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1ccc(C(=O)O)o1 1608258941 UIMVNFROWWQKDF-UHFFFAOYSA-N 286.331 2.389 10 20 CECD CCOC(=O)C1=CC[C@@H](NCc2ccc(N)cc2)C1 1577932907 UXAVQKBQRQOIJA-CQSZACIVSA-N 260.337 2.010 10 20 CECD Nc1ccc(CN[C@@H]2Cc3cccc(O)c3C2)cc1 1580445721 RNQXQVPLFJWIAT-CQSZACIVSA-N 254.333 2.231 10 20 CECD C[C@H](NC(=O)c1ccc(C(=O)O)o1)c1ccccc1O 1599900752 WDPCUMIOIMQESG-QMMMGPOBSA-N 275.260 2.174 10 20 CECD CN(C)c1ccc(CN[C@H]2C[C@@H](CCC(=O)O)C2)cc1 1777040134 NZRDDNBNWFOYTB-OKILXGFUSA-N 276.380 2.486 10 20 CECD CCC[C@H](CC(=O)O)NCc1cc(F)cc(F)c1O 1776828899 PLQUKWSFUXXTSD-SNVBAGLBSA-N 273.279 2.403 10 20 CECD C[C@H]1CCN(Cc2cc(Cl)ccc2O)C[C@@H]1CN 163442191 KGHBBNJMCHHLCD-JQWIXIFHSA-N 268.788 2.462 10 20 CECD COC[C@@]1(C)CCN(Cc2c(O)cccc2OC)C1 824577044 YTQJFKSBUCLGJA-HNNXBMFYSA-N 265.353 2.259 10 20 CECD CCc1cccc(CN(C)[C@H](C)CS(=O)(=O)CC)c1O 848885889 BYWLCTVAORGNOC-GFCCVEGCSA-N 299.436 2.210 10 20 CECD COc1cc(Cl)cc(CNCc2cnn(C)c2C)c1O 230935464 ZPWHHQFYCTZCOU-UHFFFAOYSA-N 295.770 2.386 10 20 CECD Nc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1 713135384 IHJWMBSSFIFSNX-KFWWJZLASA-N 258.365 2.316 10 20 CECD Oc1cc2c(cc1CNCCc1ccoc1)OCO2 692729043 KFNQWDXTFRUROV-UHFFFAOYSA-N 261.277 2.046 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@@H]1CCCC[C@@H]1N 294944717 CXENDGZVRFLVNN-JSGCOSHPSA-N 276.380 2.258 10 20 CECD CCOc1cccc(CN2CCSCC2)c1O 126191546 UDXQUGBALWUESS-UHFFFAOYSA-N 253.367 2.340 10 20 CECD Oc1c(Br)cccc1CNCC1(O)CCC1 123172590 LBMSDWIYVDGRKL-UHFFFAOYSA-N 286.169 2.159 10 20 CECD CC(C)NC(=O)CN(C)Cc1c(O)cccc1Cl 133384592 ACFHZMLSMXYTOC-UHFFFAOYSA-N 270.760 2.002 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)c1cccc(O)c1O 193096430 HSXCDDMJLZEXSH-SECBINFHSA-N 267.325 2.031 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](OC)C2CC2)c1 293602205 DMUSMZHDSNKPMH-ZUZCIYMTSA-N 265.353 2.476 10 20 CECD COC[C@@H](CN[C@H](C)c1cc(C)ccc1O)OC 230672153 JXJSSYPIJARHBM-VXGBXAGGSA-N 253.342 2.013 10 20 CECD CO[C@H](C)CNC(=O)NCc1c(C)c2ccccc2n1C 350256150 RKMTYCYGSBFSNW-LLVKDONJSA-N 289.379 2.321 10 20 CECD COC(=O)[C@H]1CCCCCN1Cc1cc(F)ccc1O 360023312 YTBZVGOGYDTNPX-CYBMUJFWSA-N 281.327 2.449 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2C[C@H]3[C@H](C2)C3(C)C)c1O 278207394 JSIMOFRKTYIEDD-QWRGUYRKSA-N 292.335 2.397 10 20 CECD CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)CCCO1 281276186 OCAFCQFGHSVBNS-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H](C)CO)cc1F 289176399 ABEWAOFJCWLBOV-GFCCVEGCSA-N 268.376 2.485 10 20 CECD CC(F)(F)C(=O)NCc1cccc(Br)c1O 289094062 CYRCXSCJGWMORX-UHFFFAOYSA-N 294.095 2.426 10 20 CECD CC[C@@](C)(NCc1cc(F)cc(C(C)=O)c1O)C(=O)OC 293057859 GHDWCWSZHAEFOP-OAHLLOKOSA-N 297.326 2.165 10 20 CECD COc1cccc(CN[C@H](C)C2(OC)CCOCC2)c1O 817419142 BVDAQNJNPSORGU-GFCCVEGCSA-N 295.379 2.075 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C(C)C)[C@@H](C)N 829763990 DYDZGMMAVUANHH-CZUORRHYSA-N 291.439 2.297 10 20 CECD Cc1ncsc1/C=C/C(=O)N1CCc2ccncc21 492711132 DTVCLMAMJBUQSI-NSCUHMNNSA-N 271.345 2.449 10 20 CECD CC[C@@H](N[C@@H]1CCC[C@H]1O)c1ccc(F)cc1O 834916409 XTSZBCSOYSNFIK-JHJVBQTASA-N 253.317 2.485 10 20 CECD CCn1nnc(C)c1/C=C1\C(=O)N(C)c2ccc(C)cc21 834441602 OLFRCPWPLTUXNE-LCYFTJDESA-N 282.347 2.432 10 20 CECD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)NC1CCCC1 731912285 UATRQCWIPCMXEB-MRVPVSSYSA-N 283.349 2.058 10 20 CECD C[C@@H]1C[C@H]1C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 833597129 JCNLDAYVTMWBJJ-LDYMZIIASA-N 297.738 2.115 10 20 CECD CCC(CC)(CNC(=O)Nc1ccc(N)cc1)C(=O)OC 841297845 IWKKEALYSMZXPV-UHFFFAOYSA-N 293.367 2.370 10 20 CECD CO[C@@H](CS(=O)(=O)Nc1ccc(O)cc1)C1CCCC1 849306657 YXEQKISHLGWFAT-AWEZNQCLSA-N 299.392 2.339 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H]([C@@H](C)N)C1 843057379 JSRZCHFPANMWJY-HIFRSBDPSA-N 261.413 2.230 10 20 CECD CO[C@@H](C)CCNC(=O)NCc1cc(Cl)ccc1O 844946922 VBOHVYDUVZVLDL-VIFPVBQESA-N 286.759 2.270 10 20 CECD COC(=O)[C@@H](CNC(=O)Nc1ccc(N)cc1)CC(C)C 841300870 VAILNTJTYZFSDZ-LLVKDONJSA-N 293.367 2.226 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1N 843052333 OPTXIDQXOITQHN-ZFWWWQNUSA-N 279.403 2.451 10 20 CECD CCCN1CCN(Cc2cc(C)cc(OC)c2O)CC1 915817194 WHMGDPIZDYYTRF-UHFFFAOYSA-N 278.396 2.237 10 20 CECD CC(C)(C)OC(=O)C(=O)NCc1cc(Cl)ccc1O 844776152 FHNCKRXETLGOIK-UHFFFAOYSA-N 285.727 2.004 10 20 CECD Cc1ccc(C)c(NC(=O)C(=O)NCc2ccccc2O)c1 748484934 AFGXUTUZYCTCEN-UHFFFAOYSA-N 298.342 2.264 10 20 CECD CCc1noc(NC(=O)NCc2cc(Cl)ccc2O)n1 844687752 ZRDSRQQWNNVIGT-UHFFFAOYSA-N 296.714 2.313 10 20 CECD Cc1ccc(CNC[C@H]2COC3(CCCC3)O2)c(O)c1 877133451 BIZLSRHBWVUQNP-AWEZNQCLSA-N 277.364 2.476 10 20 CECD CCC[C@H]1NC(=O)N(Cc2ccc(N(C)C)c(F)c2)C1=O 777628209 RJOUZOMFRWZRFM-GFCCVEGCSA-N 293.342 2.112 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@H](S(C)(=O)=O)C2)c(O)c1 877049536 GRFFXTQBOZMGMA-KGLIPLIRSA-N 297.420 2.146 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CC[C@H](C)C2)c1 780461667 NFKYLRJBLDDSHV-JQWIXIFHSA-N 278.352 2.389 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN(C)[C@@H](C)C2)c1O 894313001 QCUGOQAKEVVCED-JSGCOSHPSA-N 278.396 2.282 10 20 CECD COc1ccc(CNC(=O)NCCc2ccco2)c(O)c1 792763697 WRSSHPZRFNHDSZ-UHFFFAOYSA-N 290.319 2.036 10 20 CECD CCCCO[C@H](C)C(=O)NCc1ccc(OC)cc1O 794378270 TZBJGUGJEGNSGY-LLVKDONJSA-N 281.352 2.222 10 20 CECD Cc1noc([C@@H](C)NCc2cc(F)cc(F)c2O)n1 894543235 OQHSKAFUSWRRBA-ZCFIWIBFSA-N 269.251 2.213 10 20 CECD CCC[C@@](C)(O)CNCc1c(O)cccc1OC 732821219 YCNVXPOWOMAIEL-CQSZACIVSA-N 253.342 2.042 10 20 CECD CCOCCNCc1c(O)cccc1Br 706829910 GWBABYXYOXWQNC-UHFFFAOYSA-N 274.158 2.281 10 20 CECD OC[C@H]1C[C@@H](NCc2ccc(Br)cc2O)C1 707674270 SKZSPTUQGKYUTR-DKTWLAJQSA-N 286.169 2.015 10 20 CECD CO[C@H](CNCc1cc(F)ccc1O)C(F)(F)F 779077589 LHMNYTZPCIABFY-SNVBAGLBSA-N 267.222 2.198 10 20 CECD CCO[C@H](C)C(=O)Nc1c(Cl)ccc2nonc12 1344042769 OYMOGIWXQLGKLE-ZCFIWIBFSA-N 269.688 2.240 10 20 CECD CCc1cccc(CN2CCC[C@H](C(=O)O)C2)c1O 1603975031 AIAKBNFCWMYAHD-ZDUSSCGKSA-N 263.337 2.251 10 20 CECD C[C@@H](Oc1cccc(F)c1)C(=O)NCc1ccc(N)cc1 1576295125 KIGKUHLDOMCDCW-LLVKDONJSA-N 288.322 2.492 10 20 CECD CC(C)c1ccc(O)c(CN(C)CCC(=O)O)c1 1573567383 VQNUHBZGUQDWDX-UHFFFAOYSA-N 251.326 2.422 10 20 CECD N[C@H]1C[C@@H](CNCc2ccc(N3CCCC3)cc2)C1 1580421619 NTFSCQDYTJGSBK-GASCZTMLSA-N 259.397 2.114 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1cnn(C)c1C 162614271 ZBCLZZMHVHGJCD-UHFFFAOYSA-N 272.396 2.393 10 20 CECD O=C(O)CN(Cc1ccc(Cl)cc1O)CC1CC1 1595072903 YFLRCKAYDYOSTF-UHFFFAOYSA-N 269.728 2.342 10 20 CECD CC[C@H](C)N(C)CCNCc1cc(OC)ccc1O 224699059 ZQKHEVDZTKWZJS-LBPRGKRZSA-N 266.385 2.221 10 20 CECD COc1cc(Cl)cc(CNCCn2ccnc2)c1O 228669554 NZEIIYKITJFVFB-UHFFFAOYSA-N 281.743 2.041 10 20 CECD Cc1nnsc1CNCc1cccc(Cl)c1O 292803841 NVWJKCKMFUTALM-UHFFFAOYSA-N 269.757 2.495 10 20 CECD CCCS(=O)(=O)N(CC)Cc1ccc(N(C)C)cc1 70265396 WATIKXTVUFZZOD-UHFFFAOYSA-N 284.425 2.314 10 20 CECD CN(C(=O)C1CCSCC1)c1ccc(N)cc1 401904693 OATQYKMLQJJHCH-UHFFFAOYSA-N 250.367 2.375 10 20 CECD CNC(=O)CCCN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 398351642 JWROKTNPLDPBEZ-RYUDHWBXSA-N 276.380 2.365 10 20 CECD CC(=O)c1c[nH]c(C(=O)NCc2ccc(N(C)C)cc2)c1 7243631 CBGSHCUVBUYSCJ-UHFFFAOYSA-N 285.347 2.213 10 20 CECD CCOc1ccc(O)c(CNC(C)(C)COC)c1 66995950 WRXTTXCEIPKBBV-UHFFFAOYSA-N 253.342 2.306 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc(=O)[nH]c1 70899742 AXYIVFAAOHIYLS-UHFFFAOYSA-N 299.374 2.103 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(C)cc2O)C1 185788553 UHGFOBPWLBJWAZ-QWHCGFSZSA-N 276.380 2.362 10 20 CECD CN(CC(=O)Nc1ccccc1)c1ccc2c(c1)OCO2 121356830 FNROCHHQXZRTKT-UHFFFAOYSA-N 284.315 2.490 10 20 CECD C[C@@H](CN1CCOCC1)N[C@H](C)c1cc(Cl)ccc1O 185028670 JAUQQINCCNMSAX-NWDGAFQWSA-N 298.814 2.417 10 20 CECD CN(C)c1ccc(CNCC2(CO)CCCC2)cc1 135062497 XUCWNHFFSPVJSK-UHFFFAOYSA-N 262.397 2.395 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)CN(C)C)c1O 229053750 RCUKWZZOTULOOM-VIFPVBQESA-N 272.776 2.094 10 20 CECD COc1ccc(N(C)CCOC[C@@H]2CCCO2)c(OC)c1 132219121 DOFSWNYFBNKGFZ-AWEZNQCLSA-N 295.379 2.336 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(N)cc2)nn1C 236606891 MUJPBAHNHJOJFI-UHFFFAOYSA-N 286.379 2.098 10 20 CECD Nc1ccc(CC(=O)NCCc2ccc3c(c2)CCO3)cc1 237901733 SJXHSNBSCNCMOR-UHFFFAOYSA-N 296.370 2.105 10 20 CECD CCN(CC)c1ccc(CN(CC(N)=O)CC(C)C)cc1 92012066 YRLLLFNGLWLJSU-UHFFFAOYSA-N 291.439 2.476 10 20 CECD COc1cccc(CNC(=O)[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1O 528861566 NMIPIMOEEYGTII-PUHVVEEASA-N 293.363 2.077 10 20 CECD Cc1ccn(CC(=O)NCc2c(C)c3ccccc3n2C)n1 451317355 VFBYTLHFMCMNBI-UHFFFAOYSA-N 296.374 2.308 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)C[C@@H](C)[S@]1=O 289699249 ONRKAKPFMRWWQT-JNHSQIPHSA-N 297.420 2.132 10 20 CECD CCCOc1ccc(CNCC(C)(C)OCCO)c(O)c1 288492841 RAXLFEJZNXUFFD-UHFFFAOYSA-N 297.395 2.058 10 20 CECD CCOC1CC(C(=O)NCc2ccc(N(C)C)cc2)C1 286824277 XYZVELPPOZCGOV-UHFFFAOYSA-N 276.380 2.184 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@]2(CCOC2)O1 280254008 LIZAENSJEZJFJV-PBHICJAKSA-N 290.407 2.132 10 20 CECD CC[C@H](NC[C@H](O)c1cnn(C)c1)c1ccc(C)cc1O 280239241 VWYHDBWPDXSFIW-HOCLYGCPSA-N 289.379 2.208 10 20 CECD CN(C)c1ccc(CNC(=O)CCC(C)(C)[N+](=O)[O-])cc1 294475168 QIPUSXHWQZPNKR-UHFFFAOYSA-N 293.367 2.204 10 20 CECD CCN(C)C(=O)[C@@H](NCc1ccc2c(c1)CCO2)C(C)C 295001844 IMNHYYIVGZLFJR-INIZCTEOSA-N 290.407 2.214 10 20 CECD CC1(C)COCCN1CCN[C@@H]1CCc2cccc(O)c21 297734118 NRKJSKFZKLCSOE-CQSZACIVSA-N 290.407 2.080 10 20 CECD CC(C)[C@H](CO)CNCc1ccc(N(C)C)c(F)c1 808421663 OZQDQJVVPDMADY-ZDUSSCGKSA-N 268.376 2.246 10 20 CECD CCC[C@@H](CNCc1cc([N+](=O)[O-])ccc1O)OC 295056255 GCKMHFXESZNUQB-LBPRGKRZSA-N 268.313 2.205 10 20 CECD C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)C(C)(F)F 815490559 VCNPXZBFRHVWAK-ZETCQYMHSA-N 288.246 2.115 10 20 CECD C[C@H](N[C@H]1CCNC1)c1cc2c(cc1O)CCCC2 817945223 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CCC(O)(CC)CCNC(=O)NCCc1ccc(N)cc1 841885969 HNKCJDBCGXFXEO-UHFFFAOYSA-N 293.411 2.052 10 20 CECD C[C@H](N[C@@H]1CO[C@H](C)C1)c1cc([N+](=O)[O-])ccc1O 842929330 OWTZDUCBHKJVMD-UTLUCORTSA-N 266.297 2.128 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](C)c1ccc(F)cc1O 756775751 SMZXVZOWZUCGDC-BIMULSAOSA-N 280.343 2.097 10 20 CECD CCn1c(-c2cn[nH]c2)nnc1N(C)Cc1ccccc1O 858917651 WQOSLSCGJHFRIY-UHFFFAOYSA-N 298.350 2.030 10 20 CECD CN(C)c1cc(F)c(CN(CCCO)C2CC2)cc1F 862243536 MBPGBKVFLZRQJI-UHFFFAOYSA-N 284.350 2.378 10 20 CECD CCOc1ccc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c(O)c1 769465540 HCWIHTXLNDEAIQ-ZBUHCNDUSA-N 297.420 2.132 10 20 CECD C[C@@H](NC[C@H]1CC2(CC2)C(=O)O1)c1ccccc1O 879649578 WLEWJUVRPTZGFJ-GHMZBOCLSA-N 261.321 2.139 10 20 CECD C[C@H](NCC1([S@](C)=O)CC1)c1c(O)cccc1F 886607134 LMAMVCXKQSSUPX-YYSFKGJASA-N 271.357 2.093 10 20 CECD CC[C@@H](NC(=O)NCc1cccc(OC)c1O)C(F)F 881010916 PBWCXLFYUQERRE-SECBINFHSA-N 288.294 2.244 10 20 CECD Cc1cccc(CN(C)C(=O)c2ccc(C)c(O)c2O)n1 780949624 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CC[C@@H](N[C@H]1CC(=O)N(C)C1)c1cc(Cl)ccc1O 775500934 MJLMXDUCKIMGIT-CMPLNLGQSA-N 282.771 2.317 10 20 CECD C[C@H](NCCCCS(C)(=O)=O)c1c(O)cccc1F 886627979 BWAOCBJOHAFWOC-JTQLQIEISA-N 289.372 2.007 10 20 CECD CN(C)c1cc(NCc2ccc(N(C)C)c(F)c2)ncn1 892132163 ZRMZATSEIJTWAV-UHFFFAOYSA-N 289.358 2.360 10 20 CECD COc1ccc(NC(=O)c2cccc(O)c2O)c(O)c1 785426958 UZKZSLVYDRWNQS-UHFFFAOYSA-N 275.260 2.064 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(C)c(C)cc2O)C1 896962669 PWRKRXUTRODMFE-ZDUSSCGKSA-N 277.364 2.394 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H](CO)[C@@H]2C)c1O 895014740 MUKNFLUTXUZYGW-STQMWFEESA-N 279.380 2.302 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)[C@H]([C@@H](C)O)C1 785987792 IMVHDZDISARFTL-WZRBSPASSA-N 293.363 2.102 10 20 CECD CC[C@@H](NC[C@@H]1COCCO1)c1ccc(C)cc1O 794798814 YTKPCXNXOGTBKN-TZMCWYRMSA-N 265.353 2.157 10 20 CECD COc1cc(Cl)cc(CNCC[C@H](O)C2CC2)c1O 898202423 BDTXVPJQXFNHKF-LBPRGKRZSA-N 285.771 2.305 10 20 CECD CCOc1cccc(CNC[C@@H]2CCCCO2)c1O 42812102 MATQKMXIWKZHQB-ZDUSSCGKSA-N 265.353 2.450 10 20 CECD CCCNCCNCc1ccc(N2CCCC2)cc1 1326073907 BAFZTLGYRFFUKB-UHFFFAOYSA-N 261.413 2.376 10 20 CECD COC(=O)CC[C@@H]1CCCN(Cc2ccc(N)cc2)C1 1334774801 OJPJWLFOSLIBSA-ZDUSSCGKSA-N 276.380 2.434 10 20 CECD C[C@@H]1C[C@@H](C(=O)N(C)Cc2ccccc2O)CCO1 776466530 YVPGAKWNNPBLBK-NEPJUHHUSA-N 263.337 2.166 10 20 CECD CSC(C)(C)CNC(=O)NCc1ccc(N)cc1 1357791924 QJTAQIJHZFXUNO-UHFFFAOYSA-N 267.398 2.210 10 20 CECD CCc1cccc(CN(C)CCCC(=O)O)c1O 1603975249 QHTPBULCOGZHJA-UHFFFAOYSA-N 251.326 2.251 10 20 CECD C[C@H]1[C@H](C(=O)O)CCN1Cc1ccc(N(C)C)c(F)c1 1609836045 VZOPAOOUVINPFZ-CMPLNLGQSA-N 280.343 2.187 10 20 CECD COC[C@H]1C[C@@H](N[C@@H](C)c2cc(C(=O)O)ccc2O)C1 1599277620 MJDDXRGJVGBWTL-JBLDHEPKSA-N 279.336 2.166 10 20 CECD CC[C@@H](CCNCc1ccc(N(C)C)cc1)C(=O)O 1776711650 NKJFONACAIVFGF-ZDUSSCGKSA-N 264.369 2.343 10 20 CECD Cc1cc(C)c(O)c(CN(CCS(C)(=O)=O)C2CC2)c1 164605363 URWXAPWMQXVNPB-UHFFFAOYSA-N 297.420 2.018 10 20 CECD C[C@H]1CCC[C@H](OCC(=O)NCc2ccc(O)c(O)c2)C1 159026430 ZVQCJUBZEQXJKV-AAEUAGOBSA-N 293.363 2.309 10 20 CECD O=C(O)CCCCNCc1ccc2c(c1)CCCO2 258860898 JXXXMIIYNUMNIX-UHFFFAOYSA-N 263.337 2.356 10 20 CECD C[C@](O)(CNCc1cccc(Cl)c1O)C(F)(F)F 271765127 AHMUDIYINMFBCC-JTQLQIEISA-N 283.677 2.449 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H]1CF)OCO2 294056457 PTRGRKCQULCVFG-SNVBAGLBSA-N 253.273 2.055 10 20 CECD CC[C@H](N[C@@H]1CCCN(C)C1=O)c1ccccc1O 704340976 OBJGAYDPIOWPRV-QWHCGFSZSA-N 262.353 2.054 10 20 CECD C[C@@H](NCc1cc2c(cc1O)OCO2)[C@@H]1CCCOC1 389002319 QWIASQQLNINFFD-GHMZBOCLSA-N 279.336 2.026 10 20 CECD CCOC[C@@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)C1 179498730 LLUSQRVSLBUESV-GFCCVEGCSA-N 293.363 2.295 10 20 CECD CC[C@@H](C)[C@@H](C)C(=O)NCCc1ccc(O)c(O)c1 184232467 PEYBOYLMCQOWOY-GHMZBOCLSA-N 265.353 2.439 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(C)(C)C 183484456 INRHHOAEZHSQRE-VIFPVBQESA-N 251.326 2.191 10 20 CECD Cn1cnnc1CNCc1ccc(N2CCCCC2)cc1 37989022 LARVXYYWSAWCGM-UHFFFAOYSA-N 285.395 2.095 10 20 CECD COCC1=CCN(Cc2cc(F)ccc2O)CC1 187616620 NFLKMNKZFBFRQE-UHFFFAOYSA-N 251.301 2.310 10 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2.423 10 20 CECD Nc1ccc(NC(=O)C(=O)N[C@@H]2CC23CCCCC3)cc1 841080925 RPPRKIVFHOLEJK-CYBMUJFWSA-N 287.363 2.046 10 20 CECD Nc1ccc(CCNS(=O)(=O)CCC2CCCC2)cc1 842823209 PKFOKQNJFHSRQK-UHFFFAOYSA-N 296.436 2.311 10 20 CECD N[C@@H]1CCO[C@H](C2CCN(Cc3ccccc3O)CC2)C1 841103872 LMWPGFOOTLPAJI-WBVHZDCISA-N 290.407 2.111 10 20 CECD C[C@H](CN1CCCC1=O)N[C@H](C)c1cc(F)cc(F)c1O 756450962 WWRLDNHOQXPOOA-NXEZZACHSA-N 298.333 2.332 10 20 CECD Cc1cc(CNCc2cc(C)c(C)cc2O)ncn1 756989749 FXAIWWPKLLCOBU-UHFFFAOYSA-N 257.337 2.397 10 20 CECD C[C@@H]1COC[C@@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 922640484 FAZSVLKCNAAAOJ-XCBNKYQSSA-N 286.715 2.078 10 20 CECD CCCC[C@@H](OC(=O)c1ccc(C)c(O)c1O)C(=O)OC 762805487 GTCZACVCUPWLJP-LLVKDONJSA-N 296.319 2.295 10 20 CECD CCOc1ccc(O)c(CN(CCCO)C2CC2)c1 769405763 XSWRBOPBBFFZSX-UHFFFAOYSA-N 265.353 2.138 10 20 CECD CC[C@@H]1NC(=O)N([C@H](C)c2ccc(N(C)C)cc2)C1=O 761579903 QNPIHYKHZKWAEH-MFKMUULPSA-N 275.352 2.144 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2ccc(C)cc2O)C1 876512471 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296.798 2.312 10 20 CECD CC(=O)NCCCCCC(=O)N[C@H](C)c1ccccc1O 827923259 NARYDEIUWHUUFU-GFCCVEGCSA-N 292.379 2.266 10 20 CECD CN1CCCc2cc(CNS(=O)(=O)C3(C)CC3)ccc21 830298097 RMHCELDVUQSPRZ-UHFFFAOYSA-N 294.420 2.041 10 20 CECD O=C(O)c1cc(NCc2c(O)ccc3c2CCCC3)ncn1 910362745 NPHXZZCPUACWIB-UHFFFAOYSA-N 299.330 2.371 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1NCC1(C)C 843412139 AYWUKFWQTCIJAZ-CQSZACIVSA-N 276.380 2.129 10 20 CECD Nc1ccc(NC(=O)NCC[C@]2(O)C[C@H]3CC[C@H]2C3)cc1 841298407 CSAULKLKYOOGBA-MKBNYLNASA-N 289.379 2.332 10 20 CECD CCc1cccc(CNC[C@H](O)COCC(C)C)c1O 848893324 CDQKSYFKHQEZEH-HNNXBMFYSA-N 281.396 2.078 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2cccc(OC)c2O)C1 846144311 CDWHGHDNLPQIRU-RYUDHWBXSA-N 292.379 2.062 10 20 CECD CCOc1ccc(O)c(CNCC2(N)CCCC2)c1 849350132 RLDKQYGUMBOZRZ-UHFFFAOYSA-N 264.369 2.152 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)CC2CC2)cc1 844852252 GRUAKSDJJVCOPJ-UHFFFAOYSA-N 276.380 2.390 10 20 CECD CC[C@@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 268573874 RQSUQNCUCJUYMU-HUUCEWRRSA-N 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CECD CCCCN(C)CCNC(=O)NCc1cc(C)ccc1O 858282625 MSJLDCTYYGMPNQ-UHFFFAOYSA-N 293.411 2.232 10 20 CECD CN1CCCC[C@H]1CCOC(=O)c1cccc(O)c1O 758547263 JJOVRCXKJVBIPR-NSHDSACASA-N 279.336 2.129 10 20 CECD COc1ccc(N(C)CCn2ccccc2=O)cc1F 757856354 AIBYOPPYUVDYBY-UHFFFAOYSA-N 276.311 2.132 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2ccncc2C)c1 862756987 CNQAGZDDGJEHKP-UHFFFAOYSA-N 270.332 2.263 10 20 CECD C[C@H](NCCn1ccccc1=O)c1ccc(N(C)C)cc1 765396021 LAGFKROYDYMTNS-AWEZNQCLSA-N 285.391 2.265 10 20 CECD Cc1ccc(CN2CCC(OC(=O)N(C)C)CC2)c(O)c1 877552838 UDGVSXJFPXVGLZ-UHFFFAOYSA-N 292.379 2.363 10 20 CECD COC(=O)[C@@H]1CCN(Cc2c(C)cccc2O)[C@@H]1C 877467005 VDZYZJHKKPOWBW-VXGBXAGGSA-N 263.337 2.084 10 20 CECD CN(C)c1cc(F)c(CN[C@H](CC2CC2)C(=O)O)cc1F 1119060165 CRIJCVWBFHOPNX-CYBMUJFWSA-N 298.333 2.374 10 20 CECD CC[C@H](NCCOCCO)c1cc(Cl)ccc1O 775485536 WAPKQNXGPCIBDW-LBPRGKRZSA-N 273.760 2.095 10 20 CECD CCN(C)c1ccc(CN2C[C@@H](C)[C@H](C(=O)OC)C2)cc1 773765827 NULIJGLHBCKWCM-CZUORRHYSA-N 290.407 2.384 10 20 CECD 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CN(CC[C@H]1CCCOC1)c1ccc(OCC(=O)O)cc1 1777056162 MELYDUJXGWWMTM-CYBMUJFWSA-N 293.363 2.403 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)OC[C@@H]2C)c1O 163953320 VHLLDWGBZOCDJC-RYUDHWBXSA-N 265.353 2.318 10 20 CECD CC[C@@H]1COCCN1Cc1cc(C)cc(OC)c1O 164358622 ZKQAJCZCFYBNGB-CYBMUJFWSA-N 265.353 2.320 10 20 CECD COc1cccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1O 159672363 BMONBHLVXBCDOV-RCBQFDQVSA-N 289.375 2.448 10 20 CECD CC(C)[C@H]1CN(C)CCN1C(=O)Nc1ccc(N)cc1 841296502 UGRLXWLNWBVYDT-CQSZACIVSA-N 276.384 2.073 10 20 CECD COc1cccc(CNCC(C)(C)CCCO)c1O 221396104 GSYIYUNLKVGGQI-UHFFFAOYSA-N 267.369 2.289 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H]([C@@H](C)N)C2)c1O 229104940 HYQBRHYMTUHHRU-NXEZZACHSA-N 284.787 2.223 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)[C@@H]1OC 156979755 NMMGHTBSGUQCKX-OAGGEKHMSA-N 278.396 2.035 10 20 CECD C[C@@H](NCC1([S@](C)=O)CCC1)c1ccccc1O 281125102 SOPYOABRXSYZAR-ZMZPIMSZSA-N 267.394 2.344 10 20 CECD CC(C)N1CC[C@H](N[C@H](C)c2ccc(F)cc2O)C1=O 186047886 XHZZLJZVJIJIFI-MFKMUULPSA-N 280.343 2.191 10 20 CECD COc1ccc(CN[C@H](C)[C@@H]2CCCOC2)c(O)c1 389071618 MINGBMOHPYURNX-DGCLKSJQSA-N 265.353 2.306 10 20 CECD C[C@@H](CO)N[C@@H](C)c1ccc(Br)cc1O 134926033 RTNXFNJTAWYOGD-YUMQZZPRSA-N 274.158 2.186 10 20 CECD CC[C@@H](SC)C(=O)N(C)Cc1ccccc1O 124860789 BZMIDUBDJLTBJI-GFCCVEGCSA-N 253.367 2.492 10 20 CECD CCCc1nnc(SCC(=O)c2ccc(O)c(O)c2)o1 122026101 YXCXEXFXECPKTH-UHFFFAOYSA-N 294.332 2.408 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 126801796 SNLQXCVZMLVHCW-NXEZZACHSA-N 254.761 2.215 10 20 CECD COCCN1CCC(N[C@H](C)c2ccc(C)cc2O)CC1 185145099 HYNYCSDXBPOXOB-CQSZACIVSA-N 292.423 2.462 10 20 CECD CN1C[C@@H](NCc2cc(Cl)cc(Cl)c2O)CC1=O 263722334 KKPBKLOUFNMWJW-VIFPVBQESA-N 289.162 2.019 10 20 CECD CCN(CC)c1ccc(CNC(=O)NC[C@H](C)OC)cc1 190359038 VTGRVAHHEMWRKX-ZDUSSCGKSA-N 293.411 2.367 10 20 CECD CN(Cc1ccc2c(c1)OCO2)C(=O)Cc1ccc(N)cc1 237227257 ARXIMIFUAIJWAW-UHFFFAOYSA-N 298.342 2.199 10 20 CECD COC[C@@H](CCO)N[C@@H](C)c1ccc(C)c(C)c1O 273587006 OAXGDCVGZICDDC-QWHCGFSZSA-N 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10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCCOC1CCC1 805508602 LAGDHHUMJYFVGW-ALCCZGGFSA-N 278.304 2.223 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](n3cccn3)C2)c1 291299484 QMAHMIUNNAVVBK-CYBMUJFWSA-N 273.336 2.044 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCSC1 813513365 LTIFCJDSEZCXGQ-CMPLNLGQSA-N 295.404 2.288 10 20 CECD COCCCN(CCO)Cc1cc(Cl)c(F)cc1O 816586812 UCECTKNDGCGRNA-UHFFFAOYSA-N 291.750 2.016 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H](C)OC 821465002 VNUKWRFBAHOYKA-LBPRGKRZSA-N 280.368 2.349 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN[C@H]1C 828144360 DAECABJXORRNFX-GXTWGEPZSA-N 276.380 2.129 10 20 CECD CCOc1ccc(CN[C@@H](CC)COC)c(O)c1 738441051 ZZIWDDKUWNQALS-LBPRGKRZSA-N 253.342 2.306 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)C(=O)OC(C)C)c1 825117707 KFEZFTFEEARNJH-NSHDSACASA-N 251.326 2.130 10 20 CECD CN(C)[C@@H](CNC(=O)c1cc(O)cs1)c1ccccc1 731863871 IEFBCYXNVPCZKF-ZDUSSCGKSA-N 290.388 2.486 10 20 CECD COc1ccc(N(C)Cc2cnccn2)cc1OC 839011942 SYISHGRFVVMDCR-UHFFFAOYSA-N 259.309 2.130 10 20 CECD CCC(C)(C)OCCNC(=O)/C=C\c1ccc(O)c(O)c1 837280809 JHIKGZZBAIMFBU-VURMDHGXSA-N 293.363 2.432 10 20 CECD CC[C@H](C)[C@@H](C)C(=O)N(CC(=O)O)Cc1ccccc1O 911491682 PKVXVJISTXAYPD-NWDGAFQWSA-N 293.363 2.488 10 20 CECD C[C@H](NCC[C@]1(O)CCCOC1)c1cc(F)ccc1O 846214136 SKEUTHVDMOFDAV-XHDPSFHLSA-N 283.343 2.114 10 20 CECD COC[C@H]1CCCCN1C(=O)NCCc1ccc(N)cc1 841955802 ODFWBHBEBWKQMY-OAHLLOKOSA-N 291.395 2.022 10 20 CECD Nc1ccc(Cc2noc([C@@H]3CCCCO3)n2)cc1 843158703 HIBXDZIBVXHWIZ-LBPRGKRZSA-N 259.309 2.484 10 20 CECD CCOC(=O)[C@@H](C)NCc1ccc(N(C)C)cc1C 840941631 FNPLAEYVDJOBLS-GFCCVEGCSA-N 264.369 2.102 10 20 CECD CCN(CC)c1ccc(CNCCOC)cc1F 62734116 MNGYSHULSOBICV-UHFFFAOYSA-N 254.349 2.408 10 20 CECD O=C(CSCc1cscn1)NCc1ccccc1O 747418742 LZRKVAWNTCHBFL-UHFFFAOYSA-N 294.401 2.398 10 20 CECD C[C@@H](NC(=O)NCCc1ccc(N)cc1)c1ccccn1 841632325 MMVJZWWMSRZLQZ-GFCCVEGCSA-N 284.363 2.267 10 20 CECD C[C@H](NC[C@@H]1COCCO1)c1cc2c(cc1O)CCCC2 756435106 VSOAQGGOEPPZDT-SWLSCSKDSA-N 291.391 2.337 10 20 CECD Cc1cc(CN(C)[C@@H]2CCNC2=O)c(O)c(C(C)(C)C)c1 758398234 IHFMWYOCBBSOOV-CQSZACIVSA-N 290.407 2.318 10 20 CECD CC[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCS1 768465617 JCRAVYHGFYBPGT-BXUZGUMPSA-N 295.404 2.145 10 20 CECD O=C(NCc1ccccc1O)c1cccc(-c2nc[nH]n2)c1 767773083 LOILXVZYHSEJFO-UHFFFAOYSA-N 294.314 2.107 10 20 CECD Cc1cccc(O)c1CN1CCO[C@]2(CCO[C@H]2C)C1 877485877 BMROHJBTOVITQN-XJKSGUPXSA-N 277.364 2.080 10 20 CECD Cc1ccc(CNCCNC(=O)OC(C)(C)C)c(O)c1 877147537 XZHGIIUUGQZDPC-UHFFFAOYSA-N 280.368 2.315 10 20 CECD CC[C@]1(O)CCCN(Cc2ccc(N(C)C)cc2)C1 877692631 MJOJPLBILOSHJM-INIZCTEOSA-N 262.397 2.490 10 20 CECD Cc1cc(Br)cc(CN2CCN[C@@H](C)C2)c1O 775638870 JVLRZSFXNVAANN-JTQLQIEISA-N 299.212 2.257 10 20 CECD COCC1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CC1 778558230 WZTJYCYUMGCQEP-UHFFFAOYSA-N 276.380 2.138 10 20 CECD COC(=O)c1cnc(Sc2nc(C)cnc2C)s1 882410382 XSRTWZAODSEFAS-UHFFFAOYSA-N 281.362 2.488 10 20 CECD Cn1cc(C(=O)NCc2ccccc2O)c(-c2ccoc2)n1 789996834 UZOHVKDCMFPUMQ-UHFFFAOYSA-N 297.314 2.316 10 20 CECD O=C(COC(=O)[C@H]1CC12CCC2)c1ccc(O)c(O)c1 784141370 XZLYJHKEILQDTD-SNVBAGLBSA-N 276.288 2.014 10 20 CECD CC1(C)CN(Cc2cc(Cl)cc(F)c2O)C[C@H]1O 790937120 ILEWJOYIRCRQCV-LLVKDONJSA-N 273.735 2.387 10 20 CECD Oc1ccc(Cl)c(F)c1CNCc1ccon1 790974416 UOPOWIXAMXNMEF-UHFFFAOYSA-N 256.664 2.463 10 20 CECD CC[C@H](Nc1cnn(CCO)c1)c1ccc(F)cc1O 796893306 QUGRLTVWCIIRPB-ZDUSSCGKSA-N 279.315 2.283 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@H](C)N1 1236423152 SQNYFOYBGDGILG-GJZGRUSLSA-N 273.424 2.469 10 20 CECD C[C@@H](CO)NCc1cc(Cl)cc(Br)c1O 708159548 YTOCZFGWIYBMMQ-LURJTMIESA-N 294.576 2.279 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1[C@H]2Cc3ccccc3[C@H]21 1263896447 ZJWFZMDJNFPTMU-NUEKZKHPSA-N 295.338 2.300 10 20 CECD CC[C@@H](C)C[C@@H](N)C(=O)NCc1ccc(N(C)C)c(F)c1 1340839040 NGOMQEVLYOMALO-BXUZGUMPSA-N 295.402 2.271 10 20 CECD C[C@@H](Nc1ccc(C(N)=O)cn1)c1ccc(N(C)C)cc1 1342817534 AJLBXYHCMSKVQP-LLVKDONJSA-N 284.363 2.420 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CCC[C@H](F)C1 1352669616 JXXLXMMOHXLDSF-KOLCDFICSA-N 267.300 2.242 10 20 CECD Cc1ccc(O)c(CNCc2ccc(C(=O)O)cn2)c1 1607811278 HAXZXDKOJHMEJM-UHFFFAOYSA-N 272.304 2.084 10 20 CECD CC[C@@H](N[C@@H](C)c1ccc(N2CCOCC2)cc1)C(=O)O 1605090062 QOTYOZIZKOUNSN-SWLSCSKDSA-N 292.379 2.037 10 20 CECD CC(C)c1ccc(O)c(CN2CC[C@@H](C(=O)O)C2)c1 1588968895 SRRCPCCKASKFEU-GFCCVEGCSA-N 263.337 2.422 10 20 CECD COc1cc(C)c(CNCC2(C(=O)O)CCCC2)c(O)c1 1599390927 BKIMTBWXPVADGS-UHFFFAOYSA-N 293.363 2.444 10 20 CECD CO[C@@H]1CC[C@H](N[C@@H](C)c2cc(C(=O)O)ccc2O)C1 1599104441 NVXYFOOUPHRZHK-ZMLRMANQSA-N 279.336 2.309 10 20 CECD CO[C@H]1CCN(Cc2ccc(Cl)cc2O)[C@H](C(=O)O)C1 1599123012 GARSFWMRFCMLLG-RYUDHWBXSA-N 299.754 2.110 10 20 CECD COCc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1 158872970 DCDRZMBQIKYACB-UHFFFAOYSA-N 287.315 2.174 10 20 CECD CC(C)CCO[C@H](C)C(=O)NCc1ccc(O)c(O)c1 159135538 TYKSQJQNPQOFBW-LLVKDONJSA-N 281.352 2.165 10 20 CECD CC(C)(C)C(=O)NCCCC(=O)Nc1ccc(N)cc1 236787230 UUTNHSFYIDIZTE-UHFFFAOYSA-N 277.368 2.150 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N[C@H](C)C(N)=O)c2C)c1 53394537 YHWTZILCNPXDEP-GFCCVEGCSA-N 299.374 2.006 10 20 CECD COc1ccc(N2CCN(CCCCC(=O)O)CC2)cc1 20474640 ATJAVHAYKZBBOW-UHFFFAOYSA-N 292.379 2.072 10 20 CECD Cc1ccc([C@H](C)NCC(C)(C)N2CCOCC2)c(O)c1 20120756 FKYJOJANCMMKQG-AWEZNQCLSA-N 292.423 2.462 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1cccnc1 180889550 LSQAZDKJPCQSDS-ZRQQLDRUSA-N 284.315 2.383 10 20 CECD Cc1ccc([C@H](C)NCCN2CCOC(C)(C)C2)c(O)c1 185361491 PBRAKAYAEDEUGD-AWEZNQCLSA-N 292.423 2.462 10 20 CECD C[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1C 181159413 LAIKIUNKBCDKQU-XDFYEUQUSA-N 261.321 2.368 10 20 CECD COC(=O)[C@@H](NCc1cc(C)ccc1O)C(C)(C)C 136869251 OMJZDVKCVHIIKD-CYBMUJFWSA-N 265.353 2.378 10 20 CECD Oc1ccccc1CNCc1c[nH]nc1-c1cccnc1 134236142 XFIYPHOFASLIKB-UHFFFAOYSA-N 280.331 2.467 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(N)cc2)cc1 40825808 CQLLIJHNUKPHIJ-UHFFFAOYSA-N 269.348 2.265 10 20 CECD CC(C)c1noc(CCC(=O)Nc2ccc(N)cc2)n1 236667436 MENLLKPCWQHJMW-UHFFFAOYSA-N 274.324 2.347 10 20 CECD Cc1ccc(O)c(CN[C@]2(CO)COc3ccccc3C2)c1 527768498 BLQZWBKAWUEROI-GOSISDBHSA-N 299.370 2.156 10 20 CECD Cc1onc(-c2cccnc2)c1C(=O)N(C)c1ccn(C)n1 367675877 QSLONHJXNXYTDF-UHFFFAOYSA-N 297.318 2.055 10 20 CECD COC(=O)CCN(Cc1cc(OC)ccc1O)C(C)C 271880260 UWLRBMSGZNJBTF-UHFFFAOYSA-N 281.352 2.174 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N[C@H](C)CN)c2C)c1 274457152 UIFWWEKEQLYHMA-GFCCVEGCSA-N 285.391 2.480 10 20 CECD CC(C)C[C@@H](C)NC(=O)c1c(F)ccc(O)c1O 278681426 IJHIKYVPOYNICO-MRVPVSSYSA-N 255.289 2.401 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC[C@H]1CCCO1 274919694 KYYQKEQBXLWVSD-DGCLKSJQSA-N 293.363 2.104 10 20 CECD C[C@@H]1COCCN(Cc2ccc(N(C)C)c(F)c2)C1 370188057 ZXVBPRURZFFRKF-LBPRGKRZSA-N 266.360 2.360 10 20 CECD CCN(CCCN(C)C)Cc1cc(OC)c(OC)cc1O 289525739 VSSVKWHPDNGABC-UHFFFAOYSA-N 296.411 2.183 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)OC[C@H]2CCCO2)c1 805011559 LKCZQRNOELPTCT-ZYHUDNBSSA-N 295.335 2.367 10 20 CECD CC(C)N(CCNC(=O)NCc1ccccc1O)C(C)C 299549505 XCPAJEFAPPZRNE-UHFFFAOYSA-N 293.411 2.310 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1ccc(N(C)C)c(C)c1 292962338 CVJPOFVZCAAKOC-HNNXBMFYSA-N 276.380 2.198 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2ccccc2C)o1 808013071 XYRLMHCSHFATHX-UHFFFAOYSA-N 276.317 2.295 10 20 CECD C[C@@H](CN1CCCCC1)NC(=O)NCc1ccccc1O 299467896 BYCWOZRMOJUODM-ZDUSSCGKSA-N 291.395 2.066 10 20 CECD CC(F)(F)CCN1C(=O)CN(Cc2ccccc2O)C1=O 819169458 JTAPWFDVYJMJLL-UHFFFAOYSA-N 298.289 2.202 10 20 CECD C[C@H](O)C[C@H](C)NCc1cc(Cl)c(F)cc1O 816566942 LYHINPJQSBQVSD-YUMQZZPRSA-N 261.724 2.434 10 20 CECD COCCNCCN[C@H](C)c1cc(Cl)cc(C)c1O 817965567 XVJOSIZDVLJEHW-LLVKDONJSA-N 286.803 2.241 10 20 CECD COc1ccc(O)c(CNCc2ncccc2OC)c1 825249610 JVXXUWZRYAAFQY-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CC1=NO[C@@H](CNCc2cc(Br)ccc2O)C1 820265209 LFHAQLMUXUTCEF-LLVKDONJSA-N 299.168 2.409 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cnc(C2CC2)nc1 588404126 NODGUXSVLYWLNT-KXFIGUGUSA-N 297.314 2.417 10 20 CECD CC[C@@H](CNCc1cc(Cl)ccc1O)C(=O)O 903705444 VRJGEFZURVNTNV-QMMMGPOBSA-N 257.717 2.246 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H](C(=O)O)C2)c1 833662875 LETQNQITGKQFMZ-LLVKDONJSA-N 279.336 2.088 10 20 CECD C[C@H](NCC(C)(C)C(N)=O)c1ccc(Cl)cc1O 841750838 JLRIDGGOUYIYIO-QMMMGPOBSA-N 270.760 2.208 10 20 CECD CCOc1ccc(CN[C@H]2CCN[C@@H](C)C2)c(O)c1 841061423 IVJGSIFVHFZJSH-AAEUAGOBSA-N 264.369 2.021 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H]([C@H](C)N)C1 843057377 JSRZCHFPANMWJY-DZGCQCFKSA-N 261.413 2.230 10 20 CECD CCOc1ccc(O)c(CN2CCC(CCN)CC2)c1 844912366 SPPUKHVYULHUQZ-UHFFFAOYSA-N 278.396 2.352 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CCCN(C)C2=O)cc1 748242807 RDMRPSHHUDXMPE-MRXNPFEDSA-N 289.423 2.243 10 20 CECD Nc1ccc(NC(=O)CCCCN2CCCC2)cc1 844163329 ZAROAPPVDBWULQ-UHFFFAOYSA-N 261.369 2.473 10 20 CECD COC1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCCC1 754678423 YGPSMSMNSMYWOK-NSHDSACASA-N 293.363 2.104 10 20 CECD COc1ccc(N(C)C(=O)/C=C\c2cnn(C)c2)cc1F 757760329 CJOLPSNOUBRGKA-DAXSKMNVSA-N 289.310 2.244 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c1 834907267 MPAGOWKLYYXREG-SDDRHHMPSA-N 262.353 2.005 10 20 CECD CCCCn1nnnc1CN(C)c1ccc(OC)c(F)c1 757857228 NBSYJFHBPHUYKL-UHFFFAOYSA-N 293.346 2.257 10 20 CECD CCCN1CC(=O)N(Cc2ccc(N(C)C)cc2C)C1=O 761350748 BMNFFQQQHGESRA-UHFFFAOYSA-N 289.379 2.235 10 20 CECD CC[C@H](C)[C@](C)(O)CNC(=O)/C=C\c1ccc(O)c(O)c1 779525844 SUIPCFBZOVHNEM-OLHGATSESA-N 293.363 2.024 10 20 CECD OCCN(Cc1cccc(Cl)c1O)CC1CC1 775662859 WRGMCVIEONXZOE-UHFFFAOYSA-N 255.745 2.250 10 20 CECD Cc1ccc(O)c(CNc2ccc(C(N)=O)cc2)c1 71403902 DWQZKODGVOQZPV-UHFFFAOYSA-N 256.305 2.412 10 20 CECD C[C@@H](NC[C@H]1C[C@H](O)C1)c1cc(Cl)ccc1O 872127524 WWMGQRLHTWZEBJ-FXPVBKGRSA-N 255.745 2.467 10 20 CECD Cc1ccc(CN[C@H]2CCN3CCC[C@@H]3C2)c(O)c1 876940377 SFBCEJXPTXVOBU-LSDHHAIUSA-N 260.381 2.417 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H](C2OCCO2)C1 876678215 IPIJEKMTCPZWAG-ZDUSSCGKSA-N 277.364 2.286 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc2cccnn12 777796805 FJFYJCYBYHRJBY-UHFFFAOYSA-N 281.315 2.312 10 20 CECD Cc1cccc(CN2CCC[C@@H](N3CCCC3=O)C2)c1O 775687104 VQWBWXMQTXBBCN-OAHLLOKOSA-N 288.391 2.287 10 20 CECD CC[C@@H](NC[C@H](C)S(C)(=O)=O)c1ccc(N(C)C)cc1 773101152 ANZKKUGLAARCRC-SWLSCSKDSA-N 298.452 2.226 10 20 CECD Cc1cc(Cn2cc([C@H](N)C(C)C)nn2)ccc1N(C)C 881377967 ZYMYUWUVPHGGKX-MRXNPFEDSA-N 287.411 2.357 10 20 CECD C[C@H](O)[C@@H]1C[C@H](C)CCN1Cc1cc2c(cc1O)OCO2 785987788 IMVHDZDISARFTL-MDZLAQPJSA-N 293.363 2.102 10 20 CECD COc1cc(C)cc(CNCc2cc(C)[nH]n2)c1O 894291348 KWDRRIOUBLJEKL-UHFFFAOYSA-N 261.325 2.031 10 20 CECD c1csc(SCCCNc2cncc3ncnn23)n1 782953607 UVXPVRBKLOQYPW-UHFFFAOYSA-N 292.393 2.175 10 20 CECD OCC[C@@H](NCc1c(O)ccc(Cl)c1F)C1CC1 790971054 JUNMRFXPWGITQO-LLVKDONJSA-N 273.735 2.435 10 20 CECD COc1ccc(N(C)CC(=O)c2cccn2C)cc1 49970725 KFQVNKOTQSIGLC-UHFFFAOYSA-N 258.321 2.353 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@H]1CCCNC1=O 1325575031 SXNVKONDHZPLPR-AGIUHOORSA-N 288.391 2.365 10 20 CECD C[C@@]1(NCc2ccc(Br)cc2O)CCOC1 691429590 QQAOCTBGEHIOIH-GFCCVEGCSA-N 286.169 2.423 10 20 CECD COC1(CNC(=O)NCc2ccc(N)cc2)CCCC1 1336100834 QHRJCANQGDFKTK-UHFFFAOYSA-N 277.368 2.027 10 20 CECD C[C@@H]1CC[C@@H](C(=O)NCCc2ccc(O)c(O)c2)C1 776491805 ZJYPKPACWFZKSH-ZYHUDNBSSA-N 263.337 2.193 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@H](CF)C2)cc1 1346738808 LFYIUTGLVLGDFC-GFCCVEGCSA-N 265.332 2.160 10 20 CECD O=C(O)c1cnc(CNCc2cccc(Cl)c2O)s1 1608972796 OFOOFKHTXNVQMT-UHFFFAOYSA-N 298.751 2.490 10 20 CECD C[C@@H](NCC(C)(F)F)c1cc(C(=O)O)ccc1O 1593241229 YEHBKQLVSSPJQL-SSDOTTSWSA-N 259.252 2.396 10 20 CECD CCN(C)c1ccc(CNC(C)(C)C(=O)O)c(C)c1 1776857104 NAUCRUUHJIADAI-UHFFFAOYSA-N 264.369 2.404 10 20 CECD Cc1ccc(S(=O)(=O)NCc2ccccc2O)s1 158589110 NQPPVVBIIPDAKY-UHFFFAOYSA-N 283.374 2.241 10 20 CECD CC[C@@H](C)N(C)CCNC(=O)Nc1ccc(N)cc1 220267510 LNZNGHNCASAOBF-LLVKDONJSA-N 264.373 2.121 10 20 CECD CCOc1cccc(CNC[C@]2(O)CCC[C@H]2C)c1O 293052764 RRHQFAPPKBDTGE-MLGOLLRUSA-N 279.380 2.432 10 20 CECD C[C@H]1[C@@H](C)NCCN1Cc1cc(Cl)ccc1O 379501897 WWQPNGIJJIBBJI-ZJUUUORDSA-N 254.761 2.228 10 20 CECD CCOc1cccc(CNCC2(CC)COC2)c1O 393968940 IPOVMORGHBXFHG-UHFFFAOYSA-N 265.353 2.307 10 20 CECD COc1ccc(N2CCN(CCCCCCO)CC2)cc1 175739954 NPRQCFISICMDEQ-UHFFFAOYSA-N 292.423 2.370 10 20 CECD Cc1nn(C)cc1C(=O)NCCCSc1nccs1 114375286 SPBCWDUIISVSRA-UHFFFAOYSA-N 296.421 2.097 10 20 CECD Cc1ccn(C)c1C(=O)NCc1ccc(N(C)C)cc1 188922453 SNKMEZFNUBAJAI-UHFFFAOYSA-N 271.364 2.330 10 20 CECD COc1cccc(CNCCCOC[C@H]2CCCO2)c1O 20146695 IJRLXLZQPSSXBC-CQSZACIVSA-N 295.379 2.076 10 20 CECD O=C(Cc1ccc(F)cc1F)NCc1ccc(O)c(O)c1 182535625 PALXUXZPLUFRES-UHFFFAOYSA-N 293.269 2.235 10 20 CECD O=C1NCCCC[C@@H]1NCc1ccc(N2CCCC2)cc1 37282701 MCWPFFGNEGAXDW-INIZCTEOSA-N 287.407 2.045 10 20 CECD CCO[C@H]1C[C@](CO)(NCc2cccc(C)c2O)C1(C)C 188908072 VREXSYRLETYNSF-WMLDXEAASA-N 293.407 2.356 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCCC[C@H]2O)c1 186798226 LDEBEVOUTOHZAM-WDBKCZKBSA-N 265.353 2.355 10 20 CECD COCc1nc(C)cc(NCc2ccccc2O)n1 75048026 UVDPCBJIFUINPZ-UHFFFAOYSA-N 259.309 2.249 10 20 CECD CCOC(=O)CCCN(C)c1ccc(OC)cc1OC 131666973 TYRUTKUDZNGTPP-UHFFFAOYSA-N 281.352 2.483 10 20 CECD c1cc(N2CCOCC2)ccc1CNCC[C@H]1CCOC1 230164656 KAHVTNIKFMTQIV-INIZCTEOSA-N 290.407 2.039 10 20 CECD CC1CCN([C@H](C)CNC(=O)Cc2ccc(N)cc2)CC1 236723713 QXVRYPGWMXLATB-CQSZACIVSA-N 289.423 2.048 10 20 CECD CN(C)c1ccc(CN2CC[C@](O)(C3CC3)C2)cc1F 369676695 RRFLYMWBFQQLFG-MRXNPFEDSA-N 278.371 2.239 10 20 CECD CCOc1cccc(CN2CC[C@@H]3CCN(C)C[C@@H]32)c1O 272700958 YQMGXUFWANMAGS-ZFWWWQNUSA-N 290.407 2.317 10 20 CECD Cc1ccc(C(=O)N2CC3CCC2CC3)c(O)c1O 371678151 YIKVUTXCQZDHTA-UHFFFAOYSA-N 261.321 2.421 10 20 CECD C[C@@H](N[C@H]1CC[C@@H](CO)C1)c1ccc(F)c(F)c1O 296659062 ZPRBHFHHCVUVPK-BBBLOLIVSA-N 271.307 2.482 10 20 CECD COCC1(CNCc2cccc(C)c2O)CCOCC1 292820668 PXRVXPKDYQBLKV-UHFFFAOYSA-N 279.380 2.233 10 20 CECD CCOC1CC(C(=O)N[C@H](C)c2cc(OC)ccc2O)C1 806792291 LYYXJZLKQHPNCT-XSRFYTQQSA-N 293.363 2.393 10 20 CECD O=C1OC[C@H]2CN(Cc3ccc4ccccc4c3O)CCN12 816515184 RMUXWJCWKDHTFT-CQSZACIVSA-N 298.342 2.182 10 20 CECD Cc1cc(CN2CC[C@@H](C)[S@@](=O)CC2)ccc1N(C)C 815103733 XRLJRZJFQAOQAS-VLIAUNLRSA-N 294.464 2.404 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](C(N)=O)C2)cc1Cl 824474767 SFNMZSLUWNRBHF-JTQLQIEISA-N 282.771 2.051 10 20 CECD CC1(C)CN(C(=O)c2cc(O)cs2)C(C)(C)CO1 827891332 HZJULYFHBBECHT-UHFFFAOYSA-N 269.366 2.483 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(CN(C)C)CC1 820041772 QWWWUYAVUMIWBP-UHFFFAOYSA-N 289.423 2.019 10 20 CECD Cc1cc(O)c(CN(C)C2(CO)CC2)cc1Cl 827897889 AUEAAFCPEZJBQB-UHFFFAOYSA-N 255.745 2.311 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CC2(F)F)c1 825736553 CFOYGNQAZVBWMB-XCBNKYQSSA-N 271.263 2.233 10 20 CECD COCC(COC)N[C@@H](C)c1ccc(C)c(C)c1O 834889940 HLIDYELWUKARPS-LBPRGKRZSA-N 267.369 2.321 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CC(F)F)C(=O)O 901815405 ZGPWHXIXKIIEJA-GFCCVEGCSA-N 286.322 2.259 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@H](C)c1ccc(F)cc1O 903343191 NJWUUJFMYNFWLJ-OCCSQVGLSA-N 296.386 2.293 10 20 CECD CC[C@H](O)[C@@H](C)C(=O)NCc1c(O)ccc2c1CCCC2 901131586 MFLRTKMLXKJOOP-ABAIWWIYSA-N 291.391 2.294 10 20 CECD O=C(N[C@@H]1CCCc2nc(O)ccc21)c1cc(O)cs1 732267366 ZIZQGVLLIAURDE-LLVKDONJSA-N 290.344 2.362 10 20 CECD Cc1noc(C)c1N(C)C(=O)/C=C\c1cccnc1 746012634 QNLKGYZMWHJYFP-SREVYHEPSA-N 257.293 2.363 10 20 CECD CCc1cccc(CN2CCN(c3cnccn3)CC2)c1O 848880144 ATZDVIWYAHFPDS-UHFFFAOYSA-N 298.390 2.067 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2ccc(CO)o2)c1 845972380 NTWDPSDXQZHOAM-SNVBAGLBSA-N 277.320 2.337 10 20 CECD CC1=C(C(=O)N(CC(=O)O)Cc2ccccc2O)CCC1 911484620 DQARTTGWBWZZJZ-UHFFFAOYSA-N 289.331 2.306 10 20 CECD CCOc1cccc(CN[C@H]2CCNC2(C)C)c1O 841086327 MZUJVJZPJHHUFF-ZDUSSCGKSA-N 264.369 2.021 10 20 CECD CCn1cc([C@H](C)NC(=O)Nc2ccc(N)cc2)cn1 841297931 LRUMUTASTYSJHK-JTQLQIEISA-N 273.340 2.368 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCC(=O)C1 843757736 DPWIVUFLDNQVBJ-ZDUSSCGKSA-N 274.364 2.080 10 20 CECD CCOc1ccc(CN[C@@H]2CCOC[C@@H]2OCC)c(O)c1 759172291 HLMKIUAHHDRULP-ZBFHGGJFSA-N 295.379 2.075 10 20 CECD CC1CC(CNC(=O)NCCc2ccc(N)cc2)C1 857103271 FTUNXBXGOOUAPY-UHFFFAOYSA-N 261.369 2.157 10 20 CECD Cc1ccc([C@H](C)NCCN2CCOC[C@H]2C)c(O)c1 756533049 HOOHVXKISUMQMM-KGLIPLIRSA-N 278.396 2.072 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1cc(F)cc(F)c1O 756585599 KZTRVYOBLXVCBB-OTYXRUKQSA-N 289.322 2.109 10 20 CECD C[C@@H](Cn1cccn1)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756672284 MVFCSAMZFHPILS-QWRGUYRKSA-N 290.323 2.236 10 20 CECD O=C(COc1cccnc1)NCc1cc(Cl)ccc1O 857547437 DHFGRMWQKHWHRD-UHFFFAOYSA-N 292.722 2.136 10 20 CECD CCOc1ccc(CN[C@](C)(CC)CCO)c(O)c1 761973274 KSNWYUJEBDKZNR-OAHLLOKOSA-N 267.369 2.432 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2ccncc2C)c1 875513446 YZSTWJSKTDHHBN-UHFFFAOYSA-N 285.347 2.403 10 20 CECD CCOc1ccc(N2CCN(C(=O)OCCF)CC2)cc1 1118874149 ZEEDADMBEFSAJI-UHFFFAOYSA-N 296.342 2.313 10 20 CECD Cc1ncsc1CNC(=O)/C=C/c1ccc(O)c(O)c1 779484560 UMACFWYHYYXHFO-HWKANZROSA-N 290.344 2.192 10 20 CECD Cc1ccc2c(c1)N[C@H](c1cc3c(cc1O)OCO3)NC2=O 877863855 JFGDYYUMWVPMHO-HNNXBMFYSA-N 298.298 2.283 10 20 CECD Cc1ccc(CN2CCOCC3(CCOCC3)C2)c(O)c1 877316992 SLHNBMKHNVPINP-UHFFFAOYSA-N 291.391 2.330 10 20 CECD O=C(NOCCC(F)(F)F)c1cc(O)cs1 779493583 FELPAGOOVCDJHG-UHFFFAOYSA-N 255.217 2.068 10 20 CECD CN(Cc1ccccc1O)C[C@H](O)CC1(O)CCCCC1 878242129 NCIPLYGNQGRKDY-OAHLLOKOSA-N 293.407 2.270 10 20 CECD COc1cccc(CNCc2cnn(C)c2C2CC2)c1O 894458420 QXXNQFGJQQPTTI-UHFFFAOYSA-N 287.363 2.302 10 20 CECD CCOCCCCNCc1ccc(OC)c(OC)c1O 892624463 UJOAHQSQUFKUHD-UHFFFAOYSA-N 283.368 2.316 10 20 CECD C/C=C/C[C@H](CO)NCc1cc(C)cc(OC)c1O 894480161 MIPYCZHIGGVOQA-MUBLQREKSA-N 265.353 2.126 10 20 CECD Cc1cc(O)c(CN[C@H](CO)C[C@@H]2CCCO2)cc1Cl 895750195 XXDXXFZQFZSNLU-STQMWFEESA-N 299.798 2.374 10 20 CECD OC[C@H](NCc1c(O)ccc(Cl)c1F)C1CC1 790964863 PAFOYWZKOYZQSX-JTQLQIEISA-N 259.708 2.045 10 20 CECD CC[C@@H](O)CCNCc1ccc(Br)cc1O 701016887 ZYSINOSQJIPYSP-LLVKDONJSA-N 288.185 2.405 10 20 CECD O=C(O)[C@H]1[C@H](CNCc2cc(Cl)ccc2O)C1(F)F 715276175 APCCOTDWIASCOD-WCBMZHEXSA-N 291.681 2.101 10 20 CECD C[C@H]1SCCN(C(=O)NCc2ccc(N)cc2)[C@@H]1C 1262603189 AGIXUUBCYTZYMM-GHMZBOCLSA-N 279.409 2.304 10 20 CECD C[C@H]1Cc2cc(CNC(=O)Cc3ccc(N)cc3)ccc2O1 1341160774 JEGSVHVECDZMAW-LBPRGKRZSA-N 296.370 2.451 10 20 CECD CNCCCNC(=O)c1ccc(-n2c(C)ccc2C)cc1 1578686784 JJPGSZFLOHPSRN-UHFFFAOYSA-N 285.391 2.433 10 20 CECD CC1(C)[C@@H](NCc2c(O)ccc(Cl)c2F)C[C@H]1N 1576380009 FPNCTUUOBVFBOZ-MNOVXSKESA-N 272.751 2.400 10 20 CECD CN(Cc1ccccc1O)c1cc(CC(=O)O)ccn1 1598530519 JCEIMFGKTVQUDT-UHFFFAOYSA-N 272.304 2.051 10 20 CECD CC(C)C[C@@H](CN)N[C@H](C)c1cc(C(=O)O)ccc1O 1591144637 RXJPUMLDWIKOGR-PWSUYJOCSA-N 280.368 2.114 10 20 CECD COc1ccc(CNc2ncc(C(=O)O)s2)c(O)c1 1777364787 GOOABZPRJJIKCP-UHFFFAOYSA-N 280.305 2.168 10 20 CECD C[C@H](CNCc1ccc(N2CCCC2)cc1)N(C)C 38087616 VTJMHADISUXRGZ-CQSZACIVSA-N 261.413 2.327 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CCCC[C@H]2O)cc1 77204366 XJVRFIPPMPHEIT-GOEBONIOSA-N 262.397 2.393 10 20 CECD CCCN1CC[C@@H](N[C@H]2CCc3cccc(O)c32)C1 389205086 ATUONIACFVAWCX-KGLIPLIRSA-N 260.381 2.453 10 20 CECD CCOc1cccc(CN[C@@H](C)C(C)(C)O)c1O 393969933 ZEGWRURXJPBEPF-JTQLQIEISA-N 253.342 2.040 10 20 CECD CCN(CC)c1ccc(CN2CCN(C(C)=O)CC2)cc1 112119208 GFYCBXILHYYEEC-UHFFFAOYSA-N 289.423 2.197 10 20 CECD CCCN(CCS(=O)(=O)CC)Cc1ccccc1O 118396340 YLVGQDNMIAEKTO-UHFFFAOYSA-N 285.409 2.039 10 20 CECD Cc1nc2ncnn2c(NCc2ccc(N(C)C)cc2)c1C 301288737 OAEFTIFQIOPDQU-UHFFFAOYSA-N 296.378 2.419 10 20 CECD Cc1ccc(C(=O)NCCC[C@H]2CCCCO2)c(O)c1O 184354368 XZMZCPODZDROBK-GFCCVEGCSA-N 293.363 2.485 10 20 CECD CCOC(=O)N1CC[C@H](NCc2ccc(N(C)C)cc2)C1 185786687 QPKQEROSNSIBIO-AWEZNQCLSA-N 291.395 2.073 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)Nc1ccon1 183620861 IHDLQKXACYDIBN-UHFFFAOYSA-N 284.319 2.373 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)CO[C@H]2CCOC2)c1 185673415 CFPTUJKDTYMSCH-OBJOEFQTSA-N 295.379 2.245 10 20 CECD Cc1ccc(O)c(CN2CCN(CC3CC3)CC2)c1 130678207 ZQOUABRKTAWCJP-UHFFFAOYSA-N 260.381 2.228 10 20 CECD CC(C)CN1CCN(Cc2ccc(N(C)C)cc2)CC1=O 190100643 FYJUZEVBULMKKT-UHFFFAOYSA-N 289.423 2.053 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H](N)C1CC1 137316854 GYJXGTKYNCSAQD-MRXNPFEDSA-N 289.423 2.229 10 20 CECD CCO[C@@H]1C[C@@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 236866936 JSAZKYOTQKZORY-HUUCEWRRSA-N 290.407 2.473 10 20 CECD CNCCCN(C)Cc1cc(Br)ccc1O 234369008 VIKPZVQNVDWXOH-UHFFFAOYSA-N 287.201 2.196 10 20 CECD CC(C)CCO[C@@H](C)C(=O)NCCc1ccc(N)cc1 236749287 OWQGQWJSZDYMGB-ZDUSSCGKSA-N 278.396 2.379 10 20 CECD C[C@@H]1OCCN(Cc2ccc(N3CCOCC3)cc2)[C@H]1C 93418094 YSJKWDJUNDSTDW-GJZGRUSLSA-N 290.407 2.132 10 20 CECD CC(C)CCS(=O)(=O)NCc1ccc(N(C)C)cc1 264232029 YTZMTCKIJUPPGD-UHFFFAOYSA-N 284.425 2.218 10 20 CECD COc1ccc(N(C)Cc2cnnn2C)cc1Cl 272506191 HZMQDMZUKGQFOP-UHFFFAOYSA-N 266.732 2.114 10 20 CECD CN(C)c1ccc(CN2CC[C@H](c3nccn3C)C2)cc1 368133341 IQMKOZPALLAJOR-HNNXBMFYSA-N 284.407 2.476 10 20 CECD C[C@H]1C(=O)CC[C@H]1CC(=O)NCc1ccccc1O 279858382 KNYXFZVSMKPPAX-MNOVXSKESA-N 261.321 2.014 10 20 CECD COC(=O)C(C)(C)CCNCc1ccccc1O 280852070 LJSZYRCISABUSM-UHFFFAOYSA-N 251.326 2.071 10 20 CECD COc1cccc(CNCc2cnn(CC(F)F)c2)c1O 293848438 HPINJDULGOTKPP-UHFFFAOYSA-N 297.305 2.152 10 20 CECD CCn1nc(C)c(CNCc2ccc3c(c2)CCCN3C)n1 296546002 UDTBKHYDAPZAEJ-UHFFFAOYSA-N 299.422 2.279 10 20 CECD CC[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cccc(Cl)c1O 817977730 NTGHMKRVJGYGJE-JULQROHOSA-N 266.772 2.304 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2CCNCC2)c1 817941414 QDCMXHNVYJPBRS-LLVKDONJSA-N 264.369 2.051 10 20 CECD COCCCNCc1cc(Br)cc(F)c1O 715743439 BIROYCFNWDUJLG-UHFFFAOYSA-N 292.148 2.420 10 20 CECD COc1ccc(CNCc2cn(C)nc2C(F)F)c(O)c1 812759303 VJBJPPCZZGAMBT-UHFFFAOYSA-N 297.305 2.362 10 20 CECD CCn1nnc(C)c1/C=C1\C(=O)N2CCCc3cccc1c32 817345011 CDWQVOHPYWGVLB-UVTDQMKNSA-N 294.358 2.440 10 20 CECD C[C@]1(CN[C@H]2CCc3cccc(O)c32)CCCNC1 817966442 NZWKBZQDYSCCAP-BBRMVZONSA-N 260.381 2.359 10 20 CECD C[C@H](Oc1ccccn1)C(=O)NCc1ccc(N(C)C)cc1 823730074 QJZJOPJKHSWSSY-ZDUSSCGKSA-N 299.374 2.231 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1cc(Cl)c(C)cc1O 824895121 QRYKZVNFVHVMKR-CYBMUJFWSA-N 296.798 2.455 10 20 CECD COc1ccc(N2CC[C@H](CNC3CC(OC)C3)C2)cc1 822494031 DTNFZMZOEVGQDB-TUBUQKNSSA-N 290.407 2.289 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H](N2CCCC2)C1 733806343 ZGVZHPVXMJWJGG-LLVKDONJSA-N 280.393 2.154 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NC(CF)CF 836530454 WGYAJYBQKJVVFC-UHFFFAOYSA-N 285.338 2.168 10 20 CECD CCOc1ccc(CNC(CC)(CC)CO)c(O)c1 734843222 HCWOGZRQERCKMR-UHFFFAOYSA-N 267.369 2.432 10 20 CECD CC[C@H](CNC/C=C/c1ccc(N(C)C)cc1)C(=O)O 903709137 CMKUEZDPDFKWPJ-VBROQKIQSA-N 276.380 2.466 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)COC(C)C 734407464 XNRUGUZZQRQZEL-UHFFFAOYSA-N 264.369 2.102 10 20 CECD CN(C[C@@H]1CCCCO1)C(=O)c1cc(O)cs1 732276977 YZFTWWNEEFJDLI-JTQLQIEISA-N 255.339 2.095 10 20 CECD CC(C)O[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 843921992 WEWSBJMWWGTMGW-DIECRNLCSA-N 291.347 2.137 10 20 CECD C[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)[C@H]1CCN 844902560 QPALCNXJJMNRJU-YPMHNXCESA-N 292.379 2.070 10 20 CECD COc1cccc([C@H](C)NC[C@@H](C)C[C@H](C)O)c1O 846145135 MYINUAQMRMBVGF-SRVKXCTJSA-N 267.369 2.458 10 20 CECD C[C@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(O)cc1O 910951945 ZCIDQTCJEGANSX-NHYWBVRUSA-N 293.363 2.309 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H](C)C(=O)O)cc1 740120322 ZMRYSJUVJLQPBG-GFCCVEGCSA-N 286.331 2.297 10 20 CECD Oc1c(Br)cccc1CNC[C@H]1CCCNC1 841032549 GSLKQXCSXQVRHN-JTQLQIEISA-N 299.212 2.244 10 20 CECD CCc1cccc(CN2CC[C@@](F)(C(=O)OC)C2)c1O 848891504 ZIZOVCDDWUPAKF-HNNXBMFYSA-N 281.327 2.042 10 20 CECD CCCOCCOC(=O)NCc1cc(OC)ccc1O 859008980 WUXRNKUTXWMNLE-UHFFFAOYSA-N 283.324 2.054 10 20 CECD Cc1noc([C@@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)n1 759595964 SJRHJRFRDATMOQ-YZCDNWJKSA-N 290.275 2.107 10 20 CECD COC(=O)c1cc(/C=C2\C(=O)Nc3ccccc32)c[nH]1 753135044 MUCOZLYAJCFZNM-WDZFZDKYSA-N 268.272 2.294 10 20 CECD Cc1nnc([C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)o1 759597443 ZPRZYTYXTPDBNO-JQTRYQTASA-N 290.275 2.107 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](CO)C2CCOCC2)c(O)c1C 757656445 AAOVNZDMLQIUAL-CJNGLKHVSA-N 293.407 2.447 10 20 CECD CC[C@@H]1OCC[C@H]1NC(=O)NCc1cc(C)ccc1O 858538507 WQVLXKVKASGKCB-OCCSQVGLSA-N 278.352 2.067 10 20 CECD COC(=O)NC1CCN(Cc2cc(C)c(C)cc2O)CC1 853623345 AZJMLMSKXPWMGZ-UHFFFAOYSA-N 292.379 2.329 10 20 CECD CC(C)[C@@H](C)N(C)Cc1cc2c(cc1O)OC[C@H]2O 768439329 KITJRTKQHZJKIA-QMTHXVAHSA-N 265.353 2.294 10 20 CECD C[C@@H]1[C@H](N(C)C)CCN1Cc1ccc(N(C)C)cc1 931041062 GILQFVXMMBUDJS-CZUORRHYSA-N 261.413 2.277 10 20 CECD O=C(C1CC1)N1CCN(Cc2c(O)cccc2Cl)CC1 768194434 ZKOSVIIUCXILJR-UHFFFAOYSA-N 294.782 2.100 10 20 CECD C[C@H]1C[C@H](NC(=O)NCc2ccccc2O)C[C@@H](C)O1 767323325 WZPGQBMWJBJHOH-PTEHBNRSSA-N 278.352 2.147 10 20 CECD OC1CCN(c2ccc(CN3CC4(CC4)C3)cc2)CC1 877556455 RIKAZHFMGJKZHZ-UHFFFAOYSA-N 272.392 2.244 10 20 CECD Cc1ccc(CN2CCC(OCCN(C)C)CC2)c(O)c1 876720593 HMHBTRCITOTJQQ-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CC(C)CO[C@@H]1CCN(C(=O)NCc2ccc(N)cc2)C1 1120592509 ZLCRGYIOUDYTJQ-OAHLLOKOSA-N 291.395 2.225 10 20 CECD C[C@@H](NCCCN1CCC(O)CC1)c1c(O)cccc1F 886511462 UNNGTVZFJSYSKC-GFCCVEGCSA-N 296.386 2.029 10 20 CECD Cc1ccc(C(=O)N2CC(Oc3ccccc3)C2)c(O)c1O 780926616 KOYPRJDUFRJRND-UHFFFAOYSA-N 299.326 2.310 10 20 CECD S=C(NNc1nc2ccccn2n1)Nc1ccccc1 790345086 NYTIMBSRADMLIK-UHFFFAOYSA-N 284.348 2.043 10 20 CECD CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)C[C@H](C)O1 891806056 VSTXHFZACINORZ-WCQYABFASA-N 295.379 2.409 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)S(=O)[C@@H](C)C2)c1 792191789 ADTWPHKWLYXNTH-RYUDHWBXSA-N 267.394 2.042 10 20 CECD COc1ccc(CNC(=O)C2=C(C)OCCC2)c(O)c1 794387705 JZUAGCQQYFWMBQ-UHFFFAOYSA-N 277.320 2.101 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1 84950147 XLWMPEIUPZAYSH-CQSZACIVSA-N 276.380 2.138 10 20 CECD C[C@@H](CO)CCCNCc1cc(F)cc(F)c1O 708455524 WEHIPSNNTXDYSL-SECBINFHSA-N 259.296 2.169 10 20 CECD Nc1ccc(CNC(=O)NCC[C@@H]2CCCCO2)cc1 1336871071 GBTLETHRNQETEW-AWEZNQCLSA-N 277.368 2.027 10 20 CECD CC(F)(F)C(C)(C)C(=O)NCc1cccc(O)c1O 1263894761 UQUNECMNXOYVKY-UHFFFAOYSA-N 273.279 2.395 10 20 CECD O=C(NCc1ccccc1O)NC[C@@H]1C[C@H]2C=C[C@H]1C2 1352045114 CBCICRYYQRYJKZ-OBJOEFQTSA-N 272.348 2.404 10 20 CECD O=C(O)c1csc(NC(=O)c2c(F)ccc(O)c2O)c1 1602563171 ZUSHKMBQTVEMQA-UHFFFAOYSA-N 297.263 2.249 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)[C@H]1C[C@H]1C(=O)O 1600236047 HYYWDCVQVGSBIW-KCPJHIHWSA-N 276.380 2.260 10 20 CECD O=C(O)Cc1cccc(NCc2cc(F)cc(F)c2O)n1 1602140826 FHDDVYPSUYWHFN-UHFFFAOYSA-N 294.257 2.305 10 20 CECD CC(C)C[C@H](CN)N[C@@H](C)c1cc(C(=O)O)ccc1O 1591144564 RXJPUMLDWIKOGR-CMPLNLGQSA-N 280.368 2.114 10 20 CECD CC[C@@H](CN[C@H](C)c1cc(C(=O)O)ccc1O)OC 1595166541 UVYFIMWVHHWLTP-KOLCDFICSA-N 267.325 2.166 10 20 CECD C[C@@H]1CC[C@H](C(=O)O)N1Cc1ccc(F)c(F)c1O 1594220108 NSVKBXHCRFCXEB-GMSGAONNSA-N 271.263 2.108 10 20 CECD COC(=O)C1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 159197039 ICPTXDKKRQZORT-UHFFFAOYSA-N 294.370 2.277 10 20 CECD CC(C)(C)OC(=O)NCCNCc1cc(F)ccc1O 226619415 SYCVLKZGERPFSJ-UHFFFAOYSA-N 284.331 2.146 10 20 CECD COc1cc(F)ccc1NC(=O)c1cccc(O)c1O 126321866 GTNMBPMTXVOTRS-UHFFFAOYSA-N 277.251 2.498 10 20 CECD COc1cccc(CN[C@H](C)CN(C)C(C)C)c1O 289974393 ZEDHMMROJUYRDH-GFCCVEGCSA-N 266.385 2.219 10 20 CECD CCCN(CCC)C(=O)CN(C)c1ccc(N)cc1 702104158 MDPOIZBNYUIQCY-UHFFFAOYSA-N 263.385 2.354 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@@H](C)CCO)c1O 844446512 HSCQJRUKOQIIHN-VIFPVBQESA-N 285.771 2.451 10 20 CECD CCC[C@@](C)(O)CNCc1cccc(OC)c1O 226250407 XCHHCNJWWQFMRL-CQSZACIVSA-N 253.342 2.042 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CCCC[C@@H]2O)c1 51991918 LDEBEVOUTOHZAM-DGFSRKRXSA-N 265.353 2.355 10 20 CECD CN(C)c1ccc(CNC(=O)CC2CCOCC2)cc1F 117137227 PMUXFXFMZLEVCB-UHFFFAOYSA-N 294.370 2.325 10 20 CECD COc1ccc(O)c([C@H]2NC(=O)CN2Cc2ccccc2)c1 112369105 NASVODXVMFBSDP-KRWDZBQOSA-N 298.342 2.031 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCOC2)c1 103528314 LWIIIAICJUYIMM-WDEREUQCSA-N 279.336 2.005 10 20 CECD Cc1ncncc1C(=O)NCCCSc1nccs1 114374343 VIIJSVNIGQNPED-UHFFFAOYSA-N 294.405 2.154 10 20 CECD Nc1ccc(CNC(=O)c2cc(F)c(F)c(O)c2F)cc1 37666197 OXRXDKWYSBXEKV-UHFFFAOYSA-N 296.248 2.322 10 20 CECD C[C@H](NCC1(CO)CCOCC1)c1cc(Cl)ccc1O 186149509 GFRRXTBQPLNNRE-NSHDSACASA-N 299.798 2.485 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CCN(C)C2CC2)c1O 186784428 IFKZLULDCOGYFL-UHFFFAOYSA-N 294.370 2.260 10 20 CECD CCOC(=O)CN(C)Cc1cc(Cl)ccc1O 128565371 LCHWXTNAMQNVMF-UHFFFAOYSA-N 257.717 2.041 10 20 CECD C[C@H](N[C@@H](C)c1nnnn1C1CC1)c1cc(F)ccc1O 189122032 IKJIZPZXDPTBFA-IUCAKERBSA-N 291.330 2.265 10 20 CECD CN(C(=O)/C=C/c1ccc(O)c(O)c1)[C@@H]1CCSC1 181263682 VCSLVNSTUKNPDJ-JOAKQRRISA-N 279.361 2.075 10 20 CECD CN(C)CCN(C)Cc1cccc(Br)c1O 132736647 IFBXWASBXRTJQY-UHFFFAOYSA-N 287.201 2.148 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2cccc(F)n2)c1 134288250 LITCAYKICNFBFU-UHFFFAOYSA-N 291.282 2.257 10 20 CECD CCN(CC)c1ccc(CNc2cnn(CCO)c2)cc1 236939213 UGKVSTBDSLXDJW-UHFFFAOYSA-N 288.395 2.334 10 20 CECD CCOc1cccc(CN2CCC(OC(C)=O)CC2)c1O 93453893 UUOYMNMYXNOZBY-UHFFFAOYSA-N 293.363 2.318 10 20 CECD CN(C)c1ccc(CN2CCC(OCCCN)CC2)cc1 94070648 MIKHBODEXJSHPH-UHFFFAOYSA-N 291.439 2.082 10 20 CECD C[C@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 276687940 PVBKGJPYFXVETA-QMMMGPOBSA-N 253.273 2.109 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)CN2CCOCC2)c(O)c1C 273379302 HVOUXOVEEPISAC-UKRRQHHQSA-N 292.423 2.380 10 20 CECD CCn1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)cn1 273470912 JUHWEJGCJHOFCT-SNVBAGLBSA-N 290.323 2.368 10 20 CECD CCCCN(Cc1ccccc1O)[C@H]1CCN(C)C1=O 282533525 VIBAEMCZHPYXCG-AWEZNQCLSA-N 276.380 2.225 10 20 CECD Cc1cnc(C(=O)NCc2ccc(N3CC=CC3)cc2)o1 291748600 LIXLAZRBUNQICE-UHFFFAOYSA-N 283.331 2.289 10 20 CECD CC[C@@H](N[C@H](C)CC(N)=O)c1cccc(Cl)c1O 806143754 OSPOTDMEKGAECI-LDYMZIIASA-N 270.760 2.350 10 20 CECD CC[C@H](NC[C@H]1CC[C@@H](CO)O1)c1ccc(C)cc1O 293708321 MPKSXSBQNPFGSR-IPYPFGDCSA-N 279.380 2.281 10 20 CECD C[C@H](N[C@H]1CCN[C@H](C)C1)c1cc(F)cc(F)c1O 817972658 ZHJVJGDTMADSBO-YWVKMMECSA-N 270.323 2.462 10 20 CECD C[C@H](C1CCC1)N1C(=O)CN(Cc2ccccc2O)C1=O 819168024 KZTHQWHYDZKFCI-LLVKDONJSA-N 288.347 2.345 10 20 CECD CCn1ccnc1C(=O)N[C@@H](C)c1cc(OC)ccc1O 813488636 AXXAGRBHEPIQRT-JTQLQIEISA-N 289.335 2.108 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2c(C)noc2C)c1 729278703 STFLVYUIVLTAIM-MRVPVSSYSA-N 290.319 2.497 10 20 CECD CN(Cc1cc(F)ccc1O)[C@H]1CC(C)(C)OC1=O 814179794 YTQRJAPZALYETI-NSHDSACASA-N 267.300 2.057 10 20 CECD Cc1cc(O)c(CNCCc2cnccn2)cc1Cl 825400459 LJDVAVJOANPBRT-UHFFFAOYSA-N 277.755 2.476 10 20 CECD CN(Cc1cccc(-c2nn[nH]n2)c1)Cc1ccccc1O 736821948 IRCYLCRUPJTADH-UHFFFAOYSA-N 295.346 2.204 10 20 CECD COc1ccc(CN[C@]2(C(=O)O)CCSC2)cc1C 841800565 HFLRKVSRPNLMIL-CQSZACIVSA-N 281.377 2.054 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCOC1 846472141 HNRRJSBUMODGBJ-SECBINFHSA-N 269.728 2.088 10 20 CECD COc1cccc(O)c1CN1C[C@@H](N)Cc2ccccc21 841106756 PCWOKDYAZGRWBY-ZDUSSCGKSA-N 284.359 2.291 10 20 CECD COc1cccc([C@H](C)NC[C@H](C)C[C@@H](C)O)c1O 846145141 MYINUAQMRMBVGF-UTUOFQBUSA-N 267.369 2.458 10 20 CECD Cc1cc(CN(CC(=O)O)CC2CC2)ccc1N(C)C 846268395 GZKIVHUFZIGXKT-UHFFFAOYSA-N 276.380 2.358 10 20 CECD CO[C@@H](C)[C@@H](C)NC(=O)NCc1cc(Cl)ccc1O 845208143 ZMQHGXSXDDYZAD-BDAKNGLRSA-N 286.759 2.268 10 20 CECD C[C@H]1CN(Cc2cccc(Br)c2O)[C@@H](C)CN1 843120055 SSFVMXNXGJWLQX-UWVGGRQHSA-N 299.212 2.337 10 20 CECD CCOc1ccc(CNCc2ccn(CC)n2)c(O)c1 840956039 HRYDLXMIWFNIOH-UHFFFAOYSA-N 275.352 2.297 10 20 CECD C[C@@H](NCC1(N(C)C)CC1)c1cc(F)cc(F)c1O 841763622 OEWWSPCVIXMXTN-SECBINFHSA-N 270.323 2.415 10 20 CECD COc1ccc(CN[C@H]2C[C@H](NC(=O)C3CC3)C2)cc1C 1019916692 MULKYGYXCKLHHV-SHTZXODSSA-N 288.391 2.150 10 20 CECD Cc1nc(Cn2cc(COc3ccc(N)cc3)nn2)oc1C 864639142 XACOFTLDKIENCJ-UHFFFAOYSA-N 299.334 2.092 10 20 CECD CO[C@@H](C)CN(C)Cc1cc(F)c(N(C)C)cc1F 862366522 RTMCLWQJMSTRDK-JTQLQIEISA-N 272.339 2.498 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@@H]1CCCOC1 760766841 DVVRCZWOWMJERL-FVOPLDGLSA-N 278.304 2.081 10 20 CECD CCc1noc(C)c1C(=O)NCc1cc(C)ccc1O 862759953 NTZOJYKPAQAICD-UHFFFAOYSA-N 274.320 2.489 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@H](C)S(C)(=O)=O)cc1 773104983 PMHJKATVJIKPPW-STQMWFEESA-N 298.452 2.226 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)c1nccc(N)n1 879648814 APWUODGKYVEQEU-ZJUUUORDSA-N 258.325 2.176 10 20 CECD CCOC(=O)[C@H](F)C1CN(Cc2c(C)cccc2O)C1 877550731 RIAKPPXZIFUKSR-CQSZACIVSA-N 281.327 2.034 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@]1(OC)CCOC1 877180498 NUSCHAYKIXWDBF-INIZCTEOSA-N 277.364 2.253 10 20 CECD CC(C)(C)N1C[C@@H](NCc2cc(F)cc(F)c2O)CC1=O 883027328 YBCRFFFUFVHTGD-NSHDSACASA-N 298.333 2.159 10 20 CECD C[C@@H](NCC(=O)NC1CCCC1)c1c(O)cccc1F 886547988 VQSMANVYFZNETR-SNVBAGLBSA-N 280.343 2.241 10 20 CECD CC(C)c1cc(NS(=O)(=O)C2CC2)ccc1O 882799032 MWAKXESQZUYNAF-UHFFFAOYSA-N 255.339 2.420 10 20 CECD C[C@H](NCC(=O)NC1CCCC1)c1c(O)cccc1F 886547987 VQSMANVYFZNETR-JTQLQIEISA-N 280.343 2.241 10 20 CECD C[C@H](NC(=O)CCn1cccn1)c1ccc(N(C)C)cc1 773022273 VIYJZOQUPUUCIH-ZDUSSCGKSA-N 286.379 2.217 10 20 CECD CCOC(=O)[C@H]1CSCCN1Cc1cc(F)ccc1O 778995579 ZIMALEMDPQGMSL-GFCCVEGCSA-N 299.367 2.012 10 20 CECD OCCC[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1 894959762 UXLPEVOCWJWMCP-JTQLQIEISA-N 271.307 2.265 10 20 CECD C[C@@H](NC(=O)N[C@H](CN)C1CCCC1)c1ccccc1O 892091710 LTOSACNARJMZGM-BXUZGUMPSA-N 291.395 2.270 10 20 CECD COc1ccc(CNCCC(F)(F)F)c(O)c1OC 893083869 ONBAMULBUAPXFW-UHFFFAOYSA-N 279.258 2.451 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](OC)C2CC2)c1 792237721 HRDLVUVDMUZEQL-XPTSAGLGSA-N 279.336 2.003 10 20 CECD COc1ccc(CN2CCC[C@H](CCO)C2)c(O)c1OC 891948690 VYPIDFBFBIRAER-GFCCVEGCSA-N 295.379 2.004 10 20 CECD COc1cccc(O)c1CN1C[C@H](C)O[C@@H](C2CC2)C1 793215940 YPQWQWZQVATBHI-MEDUHNTESA-N 277.364 2.400 10 20 CECD C[C@@]1(CNCc2cc(F)cc(F)c2O)CCOC1 708481350 QTHKDJGXESWJFI-ZDUSSCGKSA-N 257.280 2.187 10 20 CECD CCCCOCCNCc1cccc(OC)c1O 40506247 IYZXOZHMYOKRCD-UHFFFAOYSA-N 253.342 2.307 10 20 CECD Nc1cccc(C(=O)NCc2ccc(N3CCCC3)cc2)n1 1328143826 VOMQRWWRCYIYOH-UHFFFAOYSA-N 296.374 2.194 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccnc(N)c1 1334084937 AZMCBLVQHHFDCT-UHFFFAOYSA-N 284.363 2.002 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1csnn1 1331741877 LMQXZLMIARHPOO-UHFFFAOYSA-N 262.382 2.202 10 20 CECD COC1([C@H](N[C@H](C)c2ccccc2O)C(=O)O)CCC1 1606712935 BTRXYDXSLBJIJI-ZWNOBZJWSA-N 279.336 2.065 10 20 CECD C[C@]1(N)CCCC[C@H]1C(=O)N1Cc2cccc(O)c2C1 1576531293 SVBUVCWZMRWRDZ-BBRMVZONSA-N 274.364 2.142 10 20 CECD CCOC(=O)C(CC)(CC)NC(=O)Cc1ccc(N)cc1 1577908236 DJKFFTCJQGEEIA-UHFFFAOYSA-N 292.379 2.049 10 20 CECD CN(C)c1ccc(C(=O)NCc2ccc(N)cc2)c(F)c1 1578424763 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Cc1cc(N(C)C)ccc1CN1CCn2cnnc2[C@@H]1C 840941763 KQLRRKMAIBKTBR-ZDUSSCGKSA-N 285.395 2.229 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CCO[C@H](CF)C1 840953952 DLHFUNMCUZAFAI-MRVPVSSYSA-N 277.698 2.355 10 20 CECD Cc1ccc(O)c(CNC(=O)NCC2(C)CCOCC2)c1 858273094 AEBXDWKNKVYPTH-UHFFFAOYSA-N 292.379 2.317 10 20 CECD COCCOc1ccccc1/C=C1/SC(=S)NC1=O 751444106 WAZLKQIPWQUQDE-DHZHZOJOSA-N 295.385 2.201 10 20 CECD CN(C)[C@@H](CNCc1ccc2c(c1)CCCO2)C1CC1 921555313 FQBBFCKOVZTEMP-INIZCTEOSA-N 274.408 2.441 10 20 CECD CCN(CC)c1ccc(CN(C)Cc2ncnn2C)cc1 750036637 MBIZXQBPAXINQX-UHFFFAOYSA-N 287.411 2.293 10 20 CECD Cc1ncccc1CNC(=O)NCc1ccc(N(C)C)cc1 858824253 AMVZTLKSYKPLTO-UHFFFAOYSA-N 298.390 2.455 10 20 CECD Cc1cnc(CN(C)c2ccc(OCCN(C)C)cc2)[nH]1 862327077 XVALUSBCMRIWRM-UHFFFAOYSA-N 288.395 2.295 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C(=O)O)[C@@H](C)C2)c1 863738843 FOXKWBXGXHMLRY-SMDDNHRTSA-N 293.363 2.334 10 20 CECD O=C1CN(Cc2cc(-c3ccccc3)ccc2O)CCCN1 769115960 QRJBVYSBXFBZNU-UHFFFAOYSA-N 296.370 2.381 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCSC1 762177523 FVDCMMREOHGJIF-CYBMUJFWSA-N 278.421 2.430 10 20 CECD C[C@H](NC[C@H]1C[C@@H](N)C1)c1cc(Cl)ccc1O 873252039 OXCPEWQXFFJOAW-ATZCPNFKSA-N 254.761 2.434 10 20 CECD Cc1ccc(CN[C@H]2CCO[C@@]3(CCOC3)C2)c(O)c1 877132821 OKUNPWRRNWALRT-HOCLYGCPSA-N 277.364 2.128 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](CC)CO 779649475 VQSMJCFRBKYQKB-LBPRGKRZSA-N 265.353 2.149 10 20 CECD OC[C@@H](CNCc1cc(F)cc(F)c1O)Cc1ccco1 883051351 YGPBTBYTUPANGU-SNVBAGLBSA-N 297.301 2.204 10 20 CECD OC[C@@H]1CCCN1Cc1cc(Cl)cc(F)c1O 775660516 FSFTXFSHWRUHJP-JTQLQIEISA-N 259.708 2.141 10 20 CECD OC[C@@H](CC1CCC1)NCc1cc(F)cc(F)c1O 883107897 OPIODXNMLOBZSY-GFCCVEGCSA-N 271.307 2.311 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cc(C)cc(OC)c2O)C1 896954731 AQAIIKMDLXPTON-GFCCVEGCSA-N 293.363 2.094 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccc(O)cc2CC1 790626536 FWIKKSABMVQYHN-UHFFFAOYSA-N 299.326 2.044 10 20 CECD O=C(O)C1(NCc2ccc3c(c2)CCCO3)CCC1 900033064 LNZYXHWESHQQDO-UHFFFAOYSA-N 261.321 2.109 10 20 CECD CCn1ncnc1CN[C@@H](C)c1ccc(C)cc1O 794842103 PSVVAIPAHLTSTR-NSHDSACASA-N 260.341 2.163 10 20 CECD COC[C@@H](NC(=O)NCc1ccc(N)cc1)c1ccco1 1357669316 ZBWBUSBGRVVMSF-CYBMUJFWSA-N 289.335 2.049 10 20 CECD C[C@H](CC(=O)O)NCc1cc(Cl)cc(F)c1O 1609888357 IINUOWUWHQVMAT-ZCFIWIBFSA-N 261.680 2.138 10 20 CECD CCN(C)c1ccc(CNC(C)(C)C(=O)O)cc1 1589715627 XUOJVZCNESWJDV-UHFFFAOYSA-N 250.342 2.096 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@H](C)c1cc(C(=O)O)ccc1O 1594920810 LSFMVZGLOHUIPY-RBZYPMLTSA-N 281.352 2.148 10 20 CECD C[C@H](NCC1CCN(C)CC1)c1cc(C(=O)O)ccc1O 1593256796 JLDKNUSHJPAIMK-NSHDSACASA-N 292.379 2.083 10 20 CECD CN(C)c1ccc(CN2[C@H]3CC[C@H]2[C@H](C(=O)O)C3)cc1 250362604 VDXRREQZDCAIEP-ZNMIVQPWSA-N 274.364 2.190 10 20 CECD CCSCC[C@H](C)NC(=O)Cc1ccc(N)cc1 157045637 OZWQQKSHJJOZBF-NSHDSACASA-N 266.410 2.459 10 20 CECD COc1ncccc1CNCc1cccc(C)c1O 124697505 SHWNLEGIOCXLCX-UHFFFAOYSA-N 258.321 2.394 10 20 CECD C[C@H](C(=O)O)N(C)Cc1cc(Br)ccc1O 235160298 PHLUJJJVMLCUKV-SSDOTTSWSA-N 288.141 2.060 10 20 CECD C[C@@H](NCc1cccc(Cl)c1O)c1ncn(C)n1 276140657 DBEPFSIWAXEONB-MRVPVSSYSA-N 266.732 2.025 10 20 CECD CN(C[C@H]1CCCCO1)C(=O)Nc1ccc(N)cc1 48950549 VAUCNQVRGMCDGB-CYBMUJFWSA-N 263.341 2.302 10 20 CECD CCOc1cccc(CN2CCOC[C@H](C)C2)c1O 370187144 WAQPAKWXCOHZQD-GFCCVEGCSA-N 265.353 2.259 10 20 CECD O=C(NC[C@H]1CCCC1(F)F)c1cccc(O)c1O 391057091 YHPRGEWIOAESBO-MRVPVSSYSA-N 271.263 2.263 10 20 CECD COC[C@](C)(O)CN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 382546797 GASHOSLJJGDMNU-BFQNTYOBSA-N 279.380 2.236 10 20 CECD CCOC(=O)CC[C@H](O)CNc1ccccc1OCC 385406810 FLQZDGHDIFQYNS-LBPRGKRZSA-N 281.352 2.201 10 20 CECD CC[C@@H](NC(COC)COC)c1ccccc1O 388407202 UNGZXJAFVACBPC-CYBMUJFWSA-N 253.342 2.094 10 20 CECD C[C@](O)(CNCc1cc(Cl)ccc1O)C(F)(F)F 698618250 YECQNKGNFHWVAV-JTQLQIEISA-N 283.677 2.449 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](CO)C[C@H]2CCCO2)c1 886670010 HVWFQMRGPXTXHC-MELADBBJSA-N 279.380 2.281 10 20 CECD C[C@H](c1ccccc1)N(CC(N)=O)Cc1ccccc1O 176673386 JTHDASFCMNZKMF-CYBMUJFWSA-N 284.359 2.441 10 20 CECD C[C@@H](NCC1(O)CCC1)c1ccc(N2CCOCC2)cc1 305150724 TYHSIASQAQVYGQ-CQSZACIVSA-N 290.407 2.089 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1nccs1 184926928 AFIVGBUSNPHTQR-QMMMGPOBSA-N 293.348 2.307 10 20 CECD C[C@@H](NCCCO)c1cc(Br)cc(F)c1O 134903993 SELSMXPZGFJZKB-SSDOTTSWSA-N 292.148 2.327 10 20 CECD C=Cn1cc(CN(C)c2ccc3c(c2)OCO3)cn1 194601554 LBDWVLVLISMPIY-UHFFFAOYSA-N 257.293 2.349 10 20 CECD CC[C@@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 268573868 RQSUQNCUCJUYMU-CABCVRRESA-N 279.380 2.144 10 20 CECD COC[C@H](NC(=O)NCc1ccccc1O)c1ccco1 266924205 DCATXHYYAFYDMR-LBPRGKRZSA-N 290.319 2.172 10 20 CECD CC1(C)[C@H](NC(=O)Cc2ccc(N)cc2)[C@@H]2CCCO[C@H]21 369761842 WCQDGKPFYFDYPK-NUEKZKHPSA-N 288.391 2.131 10 20 CECD Cc1cccc(CNC[C@H]2COC3(CCCC3)O2)c1O 271778723 DDNCILACGNWPHC-AWEZNQCLSA-N 277.364 2.476 10 20 CECD COc1cc(Cl)cc(CN(C)[C@@H]2CCC[C@H]2O)c1O 289882344 WDHZRNMOUZVSNK-VXGBXAGGSA-N 285.771 2.399 10 20 CECD CCCc1cc(NCc2ccccc2O)n2ncnc2n1 299471263 GJKGTLRBJHRHPH-UHFFFAOYSA-N 283.335 2.395 10 20 CECD CC(=O)N1C[C@@H]2CCC[C@@H](NCc3ccccc3O)[C@H]2C1 808445183 AIIWYUARLCKPMM-HRCADAONSA-N 288.391 2.129 10 20 CECD C[C@H](NC[C@@H]1C[C@H](F)CN1)c1ccc(N(C)C)cc1 817976387 KZMLFDAJMPGDEB-UBHSHLNASA-N 265.376 2.103 10 20 CECD Oc1cc(F)c(Cl)cc1CNCC1(O)CCC1 816550796 CREGQGZSSMXGKN-UHFFFAOYSA-N 259.708 2.189 10 20 CECD CCC[C@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O 819165865 FTXPAIRKHURMPL-NSHDSACASA-N 276.336 2.345 10 20 CECD NC(=O)C[C@H](NCc1ccccc1O)c1ccccc1 815154190 DHAQQSHJZFUAIX-AWEZNQCLSA-N 270.332 2.099 10 20 CECD CCC[C@@](C)(NCc1cc(F)cc(C(C)=O)c1O)C(=O)O 829202536 PYXFXKOTYBSXAU-OAHLLOKOSA-N 297.326 2.467 10 20 CECD Cc1cc(O)c(CNC2([C@H](C)O)CC2)cc1Cl 827585230 CQOYVOKYWBDTFG-VIFPVBQESA-N 255.745 2.357 10 20 CECD CC[C@H]1NCC[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 825942566 CWTVZOOOCNSROC-HZPDHXFCSA-N 289.423 2.099 10 20 CECD Cc1ccc(C(=O)N2CCSC[C@@H]2C2CC2)c(O)c1O 836857629 CHLBRWBVDVRWSN-GFCCVEGCSA-N 293.388 2.374 10 20 CECD Cc1ncc2c(n1)CC[C@@H](NCc1ccc(N(C)C)cc1)C2 915228892 FGSAGUNJPOERKX-MRXNPFEDSA-N 296.418 2.498 10 20 CECD O=C(NCCCNc1ccccn1)c1cc(O)cs1 736680820 WMISIRLGBQKVNR-UHFFFAOYSA-N 277.349 2.081 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](C)CCO 840935635 WTOJBNCRGDANKH-LBPRGKRZSA-N 250.386 2.169 10 20 CECD O=C1C[C@@H](CNCc2c(O)cccc2Cl)CN1C1CC1 846074989 JUUFLTRPAHFHDE-JTQLQIEISA-N 294.782 2.146 10 20 CECD Cc1cc(O)c(CNCCN2CC[C@@H](C)C2)cc1C 744450603 XMKGWTOXZUWCQU-GFCCVEGCSA-N 262.397 2.440 10 20 CECD Cc1nc(S)sc1CC(=O)NCc1ccccc1O 748349258 CXIYSILMDCHOSZ-UHFFFAOYSA-N 294.401 2.305 10 20 CECD CC[C@@H](NCCN1CCCC1=O)c1ccc(N(C)C)cc1 846207766 DUUCZAXRDTUTKW-MRXNPFEDSA-N 289.423 2.416 10 20 CECD COc1cccc([C@@H](C)NC[C@@H]2CCCO2)c1O 846138934 XZDBSUMIARXOAK-MNOVXSKESA-N 251.326 2.230 10 20 CECD CN(C)c1ccc(CN(CCO)C2CCCC2)cc1 748816070 PRKIPIGMDOQIFG-UHFFFAOYSA-N 262.397 2.490 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](C)C(=O)O)cc1F 841802160 FZFSWERKEMNZGJ-LLVKDONJSA-N 282.359 2.482 10 20 CECD CCNCc1nc(-c2ccc(O)c(O)c2)cs1 843289576 VDFGTJLKEMSVSI-UHFFFAOYSA-N 250.323 2.331 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@@]2(C)C(=O)O)cc1 756391805 YIIGDYBZHVOERM-GDBMZVCRSA-N 276.380 2.486 10 20 CECD Cc1cc(CC(=O)NCc2cc(Cl)ccc2O)on1 857548869 YJQCDGXBZCIYEL-UHFFFAOYSA-N 280.711 2.201 10 20 CECD CCOC(=O)C1(C(=O)N(C)Cc2ccccc2O)CCC1 752088746 OVAQYWWIRAIUQF-UHFFFAOYSA-N 291.347 2.084 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CS[C@@H](C)C2)c1 858538579 ODYKCGFDJCFOQV-CMPLNLGQSA-N 280.393 2.394 10 20 CECD Oc1c(F)cc(F)cc1CNc1nncn1C1CC1 922655989 WEWKVCXHDYUMEW-UHFFFAOYSA-N 266.251 2.209 10 20 CECD CN(Cc1ccccc1O)C(=O)c1nc[nH]c1C(F)(F)F 857466722 DZJNMJSUFUODQW-UHFFFAOYSA-N 299.252 2.406 10 20 CECD C[C@@H](NCc1ccnc(N(C)C)n1)c1cc(F)ccc1O 756790728 OSBGZFWRMRILSB-SNVBAGLBSA-N 290.342 2.238 10 20 CECD COc1cc(CNC/C=C\CO)c(O)c(C(C)(C)C)c1 850357577 OJHSVSDZJYRJPI-WAYWQWQTSA-N 279.380 2.336 10 20 CECD COc1cccc2c1N(C(=O)/C=C\c1cn(C)cn1)CCC2 931514370 PUTCSXRGQFMRFO-HJWRWDBZSA-N 297.358 2.421 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@](C)(OC)C1CC1 935946071 WGYQFKVXXKASGD-INIZCTEOSA-N 298.379 2.309 10 20 CECD C[C@@H](NC(=O)NC[C@@]1(C)CCOC1)c1ccccc1O 868248458 OOTMPKFZXLWXEX-IAQYHMDHSA-N 278.352 2.179 10 20 CECD CCn1ncc(C(=O)NCc2ccc(N(C)C)cc2)c1C 864573589 OCMBAFMNPFPTDZ-UHFFFAOYSA-N 286.379 2.207 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)cc2)C[C@H]1C 769379597 BYKMINZZUCCXKO-CQSZACIVSA-N 261.413 2.279 10 20 CECD CCCOc1ccc(CN[C@H](CO)CCOC)cc1C 873120312 RBVADIAEEKFOOC-HNNXBMFYSA-N 281.396 2.271 10 20 CECD CCC1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)COC1 773009690 QAJMZZQNUJPQFV-GFCCVEGCSA-N 276.380 2.356 10 20 CECD Cc1cccc(O)c1CN1CC[C@@H](n2cccn2)C1 877543733 FXWJYBKSBLVQDB-CYBMUJFWSA-N 257.337 2.344 10 20 CECD C[C@H](N[C@H]1CCN(C2CC2)C1=O)c1ccc(N(C)C)cc1 1116673900 QICMWGHIJBCKBL-LRDDRELGSA-N 287.407 2.167 10 20 CECD O=C(NCc1ccccc1O)c1cnc(C(F)(F)F)nc1 779000915 LEMLHVBJVJVBSE-UHFFFAOYSA-N 297.236 2.131 10 20 CECD C[C@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1c(O)cccc1F 886633283 QUNUFSIJCHQJHT-QWRGUYRKSA-N 292.354 2.193 10 20 CECD CCN(CC)CCN(CCOC)Cc1ccc(N)cc1 1120371101 QFRAMPPDWJAQDC-UHFFFAOYSA-N 279.428 2.059 10 20 CECD COCC1(C(=O)N[C@@H](C)c2cc(OC)ccc2O)CCC1 786411760 YBBBPLJDXKEPIC-NSHDSACASA-N 293.363 2.395 10 20 CECD CC[C@H](N[C@@H](C)CC(N)=O)c1ccc(C)cc1O 794810575 LWONYQYUTMRRJN-JQWIXIFHSA-N 250.342 2.005 10 20 CECD Cn1cnc(CNCc2ccc(N3CCCC3)cc2)c1 1334234987 XALUSCKDCBVDNI-UHFFFAOYSA-N 270.380 2.310 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1cncc(F)c1 795561000 DRRBFYKOJPXSSU-RQOWECAXSA-N 289.262 2.389 10 20 CECD O=C(NCc1ccccc1O)[C@H]1Cc2ccccc21 135358694 WCLCIIAJHAYGSU-AWEZNQCLSA-N 253.301 2.348 10 20 CECD CCOc1cccc(CNCCCCCCO)c1O 83495515 UQXLMMWSFCPLAM-UHFFFAOYSA-N 267.369 2.433 10 20 CECD COCCCC(=O)Nc1c(Cl)ccc2nonc12 1320946705 KYDICJPRUVYSCU-UHFFFAOYSA-N 269.688 2.241 10 20 CECD Cc1ccccc1OCC(=O)NCc1ccccc1O 706247856 GRDOWSWSIYQSQA-UHFFFAOYSA-N 271.316 2.396 10 20 CECD COC1(CNCc2cc(F)cc(F)c2O)CCC1 708438058 USAOCSUFQZWUET-UHFFFAOYSA-N 257.280 2.329 10 20 CECD Nc1ccc(CN2CCC[C@@H]2CN2CCCC2)cc1 1336284745 CMMUEWSBCZMUHD-MRXNPFEDSA-N 259.397 2.329 10 20 CECD CCCNC(=O)C1CCN(Cc2ccc(N)cc2)CC1 1335284899 HGGCMTQGUNYTRL-UHFFFAOYSA-N 275.396 2.007 10 20 CECD COc1cc(C)cc(CNCCCN2CCCC2)c1O 1334357441 DYNWRZASZXRUSK-UHFFFAOYSA-N 278.396 2.285 10 20 CECD CSCCN(CC(=O)O)Cc1cc(Cl)ccc1O 696924682 IXUUOTGJIDBEFS-UHFFFAOYSA-N 289.784 2.295 10 20 CECD CCN(CC)c1ccc(CNc2nccnc2CN)cc1 1262679556 SMDTXCNJIGWMBF-UHFFFAOYSA-N 285.395 2.394 10 20 CECD C[C@@H]1C[C@@H](C)CN(C(=O)NCc2ccc(N)cc2)C1 1262604666 ZLPNMZJXBCKUHG-VXGBXAGGSA-N 261.369 2.456 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnc(C(C)C)[nH]2)c1 1351631591 MCXPJBWLBCYJTB-UHFFFAOYSA-N 273.336 2.477 10 20 CECD Nc1ccc(CN2CCNC(=O)[C@@H]2c2cccs2)cc1 1356082734 DSYMNHACEQGUTJ-AWEZNQCLSA-N 287.388 2.003 10 20 CECD Cc1ccc(CN(C)[C@H](COC(C)C)C(=O)O)c(O)c1 1600409525 BSMWBMVCNRJFSW-CYBMUJFWSA-N 281.352 2.011 10 20 CECD CCOc1ccc(CN2CCC[C@](C)(C(=O)O)C2)c(O)c1 1605690476 MDYGVIGYZCBXPI-INIZCTEOSA-N 293.363 2.478 10 20 CECD CN(Cc1cccc(C(=O)O)n1)Cc1ccccc1O 1598526861 GVJBZUWTEUYQSR-UHFFFAOYSA-N 272.304 2.117 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCCCO1 159771291 AHCSEDQEROLDOP-MRXNPFEDSA-N 289.375 2.456 10 20 CECD CN(CCNCc1cc(F)ccc1O)C(=O)OC(C)(C)C 226589198 SAWZXCOCKBWJHR-UHFFFAOYSA-N 298.358 2.488 10 20 CECD COc1ccc(O)c(CNCC2(C)CCN(C)CC2)c1 227520944 ZVMNEDGTLFHDJT-UHFFFAOYSA-N 278.396 2.222 10 20 CECD C[C@@H](C[S@@](C)=O)N(C)Cc1cccc(Cl)c1O 131041381 JUQJAQWLMOTIMH-XYZCENFISA-N 275.801 2.244 10 20 CECD C[C@H](NCC1([S@](C)=O)CCC1)c1ccc(F)cc1O 281172013 WIHDNIAFVVVNGP-OVWNDWIMSA-N 285.384 2.483 10 20 CECD CCCN(Cc1ncnn1CC)c1ccc(CN)cc1 88585885 RAMOQTMMHIWCBD-UHFFFAOYSA-N 273.384 2.173 10 20 CECD CC[C@]1(C(=O)NCc2ccc(N(C)C)cc2C)CCNC1 119714728 UESJIJWQXFMJBJ-KRWDZBQOSA-N 289.423 2.067 10 20 CECD CCCNC(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 68549017 KOFLUURIFFXLHP-ZDUSSCGKSA-N 291.395 2.293 10 20 CECD CCOCCN1CCN(Cc2cc(C)c(C)cc2O)CC1 111164164 MPINNWMESOGKAC-UHFFFAOYSA-N 292.423 2.163 10 20 CECD CC[C@@H](C)CC(=O)NCc1cc(OC)ccc1O 189554292 WAZFNTJXUNNACB-SNVBAGLBSA-N 251.326 2.453 10 20 CECD O=C(Cc1c(F)cccc1F)NCc1ccc(O)c(O)c1 182526153 WSQFGENYWSLVLZ-UHFFFAOYSA-N 293.269 2.235 10 20 CECD CO[C@H](C)c1noc(CN(C)c2ccc3c(c2)OCO3)n1 121347473 IGROGQRAIWGRAL-SECBINFHSA-N 291.307 2.142 10 20 CECD Cc1cccc(CN2CCS[C@@H]3COCC[C@@H]32)c1O 180683164 RHFWDEYAKFTKBH-UONOGXRCSA-N 279.405 2.407 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H](C)CCSC)c1 77600122 KDQSWUJHJFUDAG-SNVBAGLBSA-N 298.408 2.342 10 20 CECD COC(=O)[C@H](C)N(Cc1cc(F)ccc1O)C1CCC1 191641042 NVEIWQLMHCSIOR-JTQLQIEISA-N 281.327 2.447 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@H]2CCCS2)cc1 134075479 LGANRUATFPHWTJ-CQSZACIVSA-N 293.436 2.447 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C[C@@H]2CCCN2C)c1O 92632640 AVRLDMFSCDNYNR-AWEZNQCLSA-N 294.370 2.260 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](CC(N)=O)C2)cc1C 93808728 DGNBEWPHNCPOQP-CYBMUJFWSA-N 276.380 2.096 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CCCSC1 267251586 BPHADKWTFVBVNF-LBPRGKRZSA-N 280.393 2.429 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ncccc2F)cc1 279690164 FSLHPXKUMRVABQ-UHFFFAOYSA-N 287.338 2.146 10 20 CECD CO[C@H]1CCCC[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272721486 ZNRQJLQVFQMVLR-VJFPMYOSSA-N 291.347 2.185 10 20 CECD COc1cc(O)c(CN2CCC=C(F)C2)cc1OC 272761937 LMXGQWLEPJRXRJ-UHFFFAOYSA-N 267.300 2.469 10 20 CECD CC[C@@H](NCCNC(=O)C1CC1)c1ccc(C)cc1O 280022416 HOKUEAVPTNJLSQ-CQSZACIVSA-N 276.380 2.268 10 20 CECD c1csc(SCCN2C[C@@H]3CC[C@H](C2)O3)n1 371556599 ZOWIEPNDNPDUEC-AOOOYVTPSA-N 256.396 2.098 10 20 CECD Cc1cccc(CN2CCC[C@@H](OC(=O)N(C)C)C2)c1O 294733259 GLZZBZFWCRWEAK-CQSZACIVSA-N 292.379 2.363 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H](O)CC(C)(C)C2)c(O)c1O 297128192 ZDERLNSJFAMHEZ-LLVKDONJSA-N 293.363 2.029 10 20 CECD CCCN1CCC[C@H]1CNC(=O)NCc1ccccc1O 806644967 OLPIFRCBAWTTQS-AWEZNQCLSA-N 291.395 2.066 10 20 CECD CCN(CCOCCO)Cc1cc(Cl)cc(F)c1O 800531266 AOHYBARGMVZKLM-UHFFFAOYSA-N 291.750 2.016 10 20 CECD COc1cccc(O)c1CN1C[C@H](N2CCCC2)C[C@@H]1C 809703906 RRYCHNBJOLYPPD-UONOGXRCSA-N 290.407 2.459 10 20 CECD C[C@H](NC[C@@H]1CCCCN1)c1cc(F)ccc1O 817950801 ZGECGCNAYHRQBA-JQWIXIFHSA-N 252.333 2.324 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CCC[C@@H](OC)C2)c1O 815834761 YFIDBDVRTUJYPO-DGCLKSJQSA-N 293.363 2.222 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CC23CCNCC3)c(O)c1 817976492 MAVAAACEGPQWON-IUODEOHRSA-N 260.381 2.493 10 20 CECD CCOc1ccc(CN[C@@H](CC)C(C)(C)O)c(O)c1 815154474 CXPQKHWKZFRHES-AWEZNQCLSA-N 267.369 2.430 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)C(C)(F)F)c(O)c1 816550306 NUPBKBRRNZYNJY-MRVPVSSYSA-N 273.279 2.308 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CCCO1 729630572 AHAMEUDXGBSQBN-AWEZNQCLSA-N 292.379 2.493 10 20 CECD CCO[C@H]1C[C@H]1C(=O)NCCCSc1nccs1 733974491 VBEISZDJSHTNJK-ZJUUUORDSA-N 286.422 2.167 10 20 CECD CCOCc1cc(CNCCC[S@](C)=O)ccc1OC 735084983 GAVVLKOERABWFX-FQEVSTJZSA-N 299.436 2.090 10 20 CECD C[C@H]1CCCCN1[C@H](C)CNC(=O)c1cc(O)cs1 732271203 QRFLTHLODUJGOC-WDEREUQCSA-N 282.409 2.446 10 20 CECD CCOc1ccc(CNc2nc3n(n2)CCCC3)c(O)c1 834482359 FXMVRFXMUVEEID-UHFFFAOYSA-N 288.351 2.331 10 20 CECD O=C(OCc1cc(O)nc(C2CC2)n1)c1cc(O)cs1 837516556 ZRTODNRQMPKIHV-UHFFFAOYSA-N 292.316 2.184 10 20 CECD Cc1nc(C)c(CC(=O)NCc2ccc(O)cc2O)s1 910957328 RHYTVQXAXLDMRW-UHFFFAOYSA-N 292.360 2.030 10 20 CECD C[C@H](NCCN1CCC1)c1ccc(Cl)cc1O 841752438 SNKZDJHEPRXHSQ-JTQLQIEISA-N 254.761 2.402 10 20 CECD CC(C)c1nc([C@H](C)NC(=O)Nc2ccc(N)cc2)n[nH]1 841297277 DJELUTQPNMMMJA-VIFPVBQESA-N 288.355 2.393 10 20 CECD COc1cccc([C@H](C)NCCC(=O)NC(C)(C)C)c1O 846148974 DNFYETMNGJFAST-NSHDSACASA-N 294.395 2.356 10 20 CECD CCc1cccc(CN(C)CCN(C)C2CC2)c1O 848912408 QSWNZGDKBYUHTD-UHFFFAOYSA-N 262.397 2.481 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CNCC[C@H]1C 841059733 WIWRZHAOFBMBNS-MLGOLLRUSA-N 261.413 2.149 10 20 CECD Oc1cc2c(cc1CN1CCO[C@@H](CF)C1)CCC2 840171663 NUANISJVXAQQSO-AWEZNQCLSA-N 265.328 2.051 10 20 CECD COc1cccc([C@H](C)NCCOC[C@@H]2CCCO2)c1O 846142580 ATWPFCQRXLMCDI-STQMWFEESA-N 295.379 2.247 10 20 CECD CC[C@@H](C)[C@H](C)C(=O)N(CC(=O)O)Cc1ccccc1O 911491681 PKVXVJISTXAYPD-NEPJUHHUSA-N 293.363 2.488 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2CC=CCC2)cc1 841827618 AFFNHOSLFXVTHY-CQSZACIVSA-N 259.353 2.219 10 20 CECD COCCOCCCN[C@@H](C)c1cccc(OC)c1O 846137033 QLUJHNPLGQRRLK-LBPRGKRZSA-N 283.368 2.105 10 20 CECD COc1cccc(O)c1CNCCCCCCN 843126495 HFRNCBVCLKILNN-UHFFFAOYSA-N 252.358 2.010 10 20 CECD CN(CCCN)Cc1ccc(N2CCCCC2)cc1 841002901 HUZOLBCDYFGQPF-UHFFFAOYSA-N 261.413 2.458 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H]2CCNCC2(C)C)c1O 842476280 KPNNSZHWNJRKCJ-AWEZNQCLSA-N 294.370 2.212 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](O)c2ccccn2)c1 851900102 PDDGCEFXMAJQKC-BZNIZROVSA-N 288.347 2.180 10 20 CECD CNC[C@@H](C)NCc1ccc(N(C)C)cc1C(F)(F)F 853248730 JIIOIDIDMOJPCB-SNVBAGLBSA-N 289.345 2.469 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2nc(C)cs2)c1 858107627 GKCJPHVYWIUYQD-UHFFFAOYSA-N 291.376 2.465 10 20 CECD Cc1ccc([C@H](C)NCc2ccc(C(N)=O)nc2)c(O)c1C 756641069 RUAHXZUHXFUNLS-LBPRGKRZSA-N 299.374 2.354 10 20 CECD Cc1cc(CNC(=O)N[C@H](C)c2ccccc2O)ncn1 868443435 GYRYXVOUSSYSIY-LLVKDONJSA-N 286.335 2.051 10 20 CECD CN(C)c1cc(F)c(CN(C2CC2)C2COC2)cc1F 862382726 ZBQWXDAMMQQMFR-UHFFFAOYSA-N 282.334 2.394 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)CCS1 768465618 JCRAVYHGFYBPGT-FZMZJTMJSA-N 295.404 2.145 10 20 CECD CC[C@@H](CO)N(C)Cc1cc(F)c(N(C)C)cc1F 862382688 WRLUHDZOKLCPSY-NSHDSACASA-N 272.339 2.234 10 20 CECD Cc1ccc(CNC[C@@H]2CC(=O)N(C(C)(C)C)C2)c(O)c1 877636498 YTQZSIBNMSYXRO-ZDUSSCGKSA-N 290.407 2.437 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)COC(C)(C)C 778005898 YNSUJHDQHQKVGK-UHFFFAOYSA-N 278.396 2.492 10 20 CECD CSCC(C)(C)NC(=O)/C=C/c1ccc(O)c(O)c1 890873912 DNPSHSKPYAZJBG-FNORWQNLSA-N 281.377 2.369 10 20 CECD C[C@@H]1C[C@@H](O)CN1Cc1cccc(Br)c1O 788269422 NOUQDWOFXMRTLC-PSASIEDQSA-N 286.169 2.110 10 20 CECD COc1cc(C)cc(CN2CCC[C@H](CCO)C2)c1O 894004705 XKKRCSDTQGWNFL-CYBMUJFWSA-N 279.380 2.304 10 20 CECD CON(C)CCNCc1ccc(N2CCCCC2)cc1 883173095 CDMDAKQKNJYKSB-UHFFFAOYSA-N 277.412 2.260 10 20 CECD COC(=O)C(C)(C)N(C)Cc1cc(F)cc(F)c1O 893995691 ZDQBWLILQOKJKJ-UHFFFAOYSA-N 273.279 2.054 10 20 CECD CCC[C@@H](C)C(=O)NCc1ccc(OC)cc1O 794389714 CJYCPJCJCBKHGS-SNVBAGLBSA-N 251.326 2.453 10 20 CECD O=C(NCCc1ccc(F)cc1F)c1cccc(O)c1O 790708405 VXRFMIRGGSNIAX-UHFFFAOYSA-N 293.269 2.349 10 20 CECD Oc1cc2c(cc1CNCC[C@H]1CCCC[C@H]1O)OCO2 897538940 IWXYLTCHUKOHFX-DGCLKSJQSA-N 293.363 2.152 10 20 CECD COc1ccc(CNC(=O)c2cccs2)c(O)c1 794381894 RFVJCVMOHXYYGD-UHFFFAOYSA-N 263.318 2.392 10 20 CECD Cc1cccc(C(=O)NCc2ccccc2O)c1O 133778489 ZDRCPQJFMBJGDI-UHFFFAOYSA-N 257.289 2.336 10 20 CECD Cc1nnc(O)c(CNCc2cccc(Cl)c2O)c1C 1323475236 IAGHDYAZCRGFIM-UHFFFAOYSA-N 293.754 2.448 10 20 CECD C[C@H](CCNCc1ccc2c(c1)CCO2)CC(=O)O 1320866103 DXWHVCQHTNTNSL-LLVKDONJSA-N 263.337 2.212 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CCO)C2CC2)c1 756740592 SAPXDQBSRZZMIR-QMTHXVAHSA-N 265.353 2.212 10 20 CECD Cc1nc(C(=O)Nc2c(Cl)ccc3nonc23)co1 1261139899 BCUMTHWZDXYMMA-UHFFFAOYSA-N 278.655 2.425 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@@H]1F 1263714211 AEZXWZVKOWKSEZ-KGLIPLIRSA-N 264.344 2.459 10 20 CECD CC[C@H](C)N(CC(=O)O)Cc1ccc(F)c(F)c1O 1604961485 QWABGSMPDXLSPP-QMMMGPOBSA-N 273.279 2.356 10 20 CECD CC(C)n1cc(CSc2ncc(C(=O)O)s2)nn1 1609723933 DCELNBPUKDXCNJ-UHFFFAOYSA-N 284.366 2.306 10 20 CECD Cc1ccc(CN2C[C@@H]3CCC[C@]3(C(=O)O)C2)c(O)c1 1600416355 YGUCAFAOZUCFTJ-BBRMVZONSA-N 275.348 2.387 10 20 CECD COc1ccc2c(c1)CCN2Cc1ncc(C(=O)O)s1 1599629100 NLFSNCDYZXXAPM-UHFFFAOYSA-N 290.344 2.413 10 20 CECD C[C@H](NCCc1cccnc1)c1cc(C(=O)O)ccc1O 1593272799 BXBRQPCVWOVTDM-NSHDSACASA-N 286.331 2.379 10 20 CECD C[C@H](NCC[C@@H]1CCCNC1)c1cc(C(=O)O)ccc1O 1593264717 MDLFJYJRNDAKMW-RYUDHWBXSA-N 292.379 2.131 10 20 CECD COc1cccc(CN(C)[C@@H]2CCN(C(C)C)C2)c1O 825332171 SMVRNRMVPRXRLG-CQSZACIVSA-N 278.396 2.315 10 20 CECD OC[C@@H]1CC[C@H](NCc2c(O)cccc2Cl)C1 295122460 WVHWICJEPLMRII-ZJUUUORDSA-N 255.745 2.296 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@@H]2NCC[C@@H]2C1 311210130 KZKNJEBSCHJXAB-MFKMUULPSA-N 266.772 2.229 10 20 CECD CC[C@@H](NCCCCS(C)(=O)=O)c1ccccc1O 692842331 NNLSBBDMBVDXCF-CYBMUJFWSA-N 285.409 2.258 10 20 CECD COC[C@H](C)CNC(=O)N[C@H](C)c1cc(OC)ccc1O 170888421 YBNQPZZWSYORTR-GHMZBOCLSA-N 296.367 2.044 10 20 CECD C[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)n1cccn1 54367073 IRQSYTOVYAVXLQ-AWEZNQCLSA-N 298.390 2.361 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2cccc(Cl)c2O)C1 186475353 MQOHVUNJTIBPKT-LLVKDONJSA-N 298.770 2.366 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)O[C@H](C)C2)c1O 125090389 JEBTUQKNLZUWEG-TXEJJXNPSA-N 265.353 2.318 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCC[C@@H](N(C)C)C2)c(O)c1O 182563169 RAFQAVPHDPFSKE-VXGBXAGGSA-N 292.379 2.009 10 20 CECD CCOC(=O)[C@@H](C)NCc1ccc(OC)c(C)c1 49370913 BVPIDDMACVOYCS-LLVKDONJSA-N 251.326 2.045 10 20 CECD CCN(C)c1ccc(/C=C2/SC(=S)NC2=O)cn1 190220554 GMTXOMKAXYDFQM-RMKNXTFCSA-N 279.390 2.027 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cnn(C)c2)cc1 193750571 YLTMDBAQXOISPL-UHFFFAOYSA-N 286.379 2.196 10 20 CECD C[C@@H](CC(=O)Nc1ccc(N)cc1)[C@@H]1CCCNC1 237596648 FKDRRVDWCAYFNR-NWDGAFQWSA-N 261.369 2.233 10 20 CECD CNC(=O)C1CCC(N[C@@H](C)c2cc(F)ccc2O)CC1 273623219 ZTNTZFZNBBXISP-ZBOXLXRLSA-N 294.370 2.487 10 20 CECD CC(C)C[C@H](CCO)CNC(=O)c1c(F)ccc(O)c1O 276563105 JGPKUTHBQQOLID-JTQLQIEISA-N 299.342 2.011 10 20 CECD C[C@@H](CCCO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273556393 HAQPFBWMSDMTEO-VHSXEESVSA-N 268.313 2.112 10 20 CECD C[C@@H]1C[C@@H](C)[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)O1 282194741 PJTYXSODFFCZFR-HFAKWTLXSA-N 294.370 2.321 10 20 CECD Cc1ccc(O)c(CNCC2(S(C)(=O)=O)CCCC2)c1 285435745 HRDYYJINPZROES-UHFFFAOYSA-N 297.420 2.148 10 20 CECD Cc1ccc([C@H](N)C(=O)NCc2ccc(N(C)C)cc2)cc1 280810366 VRGOONWPYFXWCX-KRWDZBQOSA-N 297.402 2.377 10 20 CECD CCN(CC)c1ccc(CNCC(=O)NCC(F)F)cc1 280291068 MSKKJWGILLCBAI-UHFFFAOYSA-N 299.365 2.004 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2ccc(C)cc2)o1 808014541 MFEDOARMAJPCLW-UHFFFAOYSA-N 276.317 2.295 10 20 CECD CC(C)[C@H]1C[C@H](NC(=O)c2c(F)ccc(O)c2O)CCO1 297548213 QMTXFNVNBOUGTN-BXKDBHETSA-N 297.326 2.170 10 20 CECD CCCN1C[C@H](CN[C@@H](C)c2ccccc2O)CC1=O 817590161 UYYSORBSIZSHAG-STQMWFEESA-N 276.380 2.301 10 20 CECD C[C@@H]1C[C@H](O)CN(Cc2c(O)ccc(Cl)c2F)C1 825316907 YAJUIJIMOCYMFL-BDAKNGLRSA-N 273.735 2.387 10 20 CECD Cc1cc(O)c(CNCCN2CCO[C@@H](C)C2)cc1Cl 825246466 ATWRBNDXZLEMQV-LBPRGKRZSA-N 298.814 2.164 10 20 CECD CNC(=O)[C@H]1CCC[C@H]1NCc1cc(Cl)c(C)cc1O 825384893 LIBKUUGZPQZSGF-WCQYABFASA-N 296.798 2.358 10 20 CECD O=C(Nc1cnn(CC(F)(F)F)c1)c1cc(O)cs1 735689974 JDNSVUBNMIEJBT-UHFFFAOYSA-N 291.254 2.465 10 20 CECD CCO[C@H]1CCCN(C(=O)c2cc(O)cs2)C1 732278178 VMROSDRPQVJFBG-JTQLQIEISA-N 255.339 2.095 10 20 CECD CS(=O)(=O)CCN(Cc1ccccc1O)C1CCCC1 731846166 WIFSCSHFFOMOHC-UHFFFAOYSA-N 297.420 2.181 10 20 CECD CC[C@@H](CNCc1cc(C)c(C)cc1O)C(=O)O 903705136 HTBFBICPCAKBAS-NSHDSACASA-N 251.326 2.209 10 20 CECD CCOc1ccc(CNC[C@H]2CC[C@H](C)O2)c(O)c1 835086402 GZYPSBKLUHZFLQ-SMDDNHRTSA-N 265.353 2.448 10 20 CECD O=C(Cc1cnc[nH]1)NCc1ccc(N2CCCCC2)cc1 900405385 WBFCOJXSNYFWCI-UHFFFAOYSA-N 298.390 2.259 10 20 CECD CC(C)OCC(C)(C)NC(=O)/C=C\c1ccc(O)c(O)c1 840540101 IWDHUFJXMSHBSL-VURMDHGXSA-N 293.363 2.431 10 20 CECD C[C@H]1C[C@H]1C(=O)NCc1ccc2c(c1)CCCN2C 746809273 QWBOIWZFGUBSIS-SMDDNHRTSA-N 258.365 2.341 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1cccc(OC)c1O 846155997 RKDQTBBVVCOCAY-NWDGAFQWSA-N 283.368 2.103 10 20 CECD CCCNCCNCc1cc(Cl)cc(OC)c1O 841046393 DHIRKOFFBFQFIE-UHFFFAOYSA-N 272.776 2.143 10 20 CECD CC(C)Cc1nsc(NC(=O)c2cccc(O)c2O)n1 855706539 KGKGNZXUPXSRFD-UHFFFAOYSA-N 293.348 2.400 10 20 CECD Cc1cc(C)n(CCCC(=O)NCc2ccc(N)cc2)n1 927768124 NTKLDVWFFFNTJC-UHFFFAOYSA-N 286.379 2.179 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)CC1(C)COC1 862476482 ALJRMIYQKCYUMR-UHFFFAOYSA-N 266.360 2.360 10 20 CECD COc1cccc(CNCC[C@@H](O)C2CCCC2)c1O 865874762 IGNJPTPXTFTDOR-CQSZACIVSA-N 279.380 2.432 10 20 CECD CC1(C)CN(Cc2cc3c(cc2O)OC[C@H]3O)CCS1 768463061 FPFOTVLJCBEECH-CYBMUJFWSA-N 295.404 2.145 10 20 CECD Cc1ccc(O)c(CN(C)CCCNC(=O)C2CCC2)c1 763628156 UDHJGLSLWUNTHT-UHFFFAOYSA-N 290.407 2.439 10 20 CECD CCOC(=O)[C@@H](NCc1ccc(C)cc1O)C1CC1 1119245776 UBHRXVAYGCUTGJ-AWEZNQCLSA-N 263.337 2.132 10 20 CECD Cc1ccc(CNCCCCN2CCC[C@@H]2CO)c(O)c1 877041944 PLIGVHCAFHTXRT-MRXNPFEDSA-N 292.423 2.027 10 20 CECD CCOc1cccc(CN2CC[C@](O)(CC)C2)c1O 779219066 LHMOZUSVIDPRNY-OAHLLOKOSA-N 265.353 2.138 10 20 CECD Cc1ccc(CN(CC(F)F)C[C@H](C)O)c(O)c1 877571555 DBYFCSTXIGNDMV-JTQLQIEISA-N 259.296 2.149 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2CC23CCC3)cc1 871763182 ZVBQPZNDQJNFQM-AWEZNQCLSA-N 273.380 2.494 10 20 CECD C[C@@H](NC[C@H]1C[C@H](O)C1)c1ccc(Cl)cc1O 872126121 IPTIWRKRCCLWPO-FXPVBKGRSA-N 255.745 2.467 10 20 CECD O=C(NCc1ccccc1O)Nc1cnc2c(c1)COCC2 777739518 JBJXEVZBZQFXBS-UHFFFAOYSA-N 299.330 2.182 10 20 CECD C[C@@H](N[C@@H]1CCn2ccnc2C1)c1c(O)cccc1F 886594722 SLCAIABDIFLJAZ-GHMZBOCLSA-N 275.327 2.393 10 20 CECD C[C@H](NCCOC[C@@H]1CCOC1)c1ccccc1O 783507886 CAIDFDZUUADXNL-QWHCGFSZSA-N 265.353 2.096 10 20 CECD CN(C)c1ccc([C@H](CNc2ncccn2)N(C)C)cc1 897522365 MTXJKAZLYBXEDZ-HNNXBMFYSA-N 285.395 2.257 10 20 CECD COc1ccc(CN2CCOC(C)(C)[C@H]2C)c(O)c1OC 892068844 UTPVJMMOSMFHEY-LLVKDONJSA-N 295.379 2.409 10 20 CECD COc1cc(C)cc(CN[C@@H](C)c2csnn2)c1O 894998873 IGZXEXUPHCFXNO-VIFPVBQESA-N 279.365 2.412 10 20 CECD CC[C@@H](NCCN1CCC1)c1ccc(F)cc1O 796838901 FCJPYDZPXZTFER-CYBMUJFWSA-N 252.333 2.278 10 20 CECD COc1ccc(CNC(=O)Cc2cccc(F)c2)c(O)c1 794377956 BEQLWVIGFNTCHZ-UHFFFAOYSA-N 289.306 2.399 10 20 CECD C[C@H](NC[C@@H](CO)CC1CCOCC1)c1ccccc1O 1256035332 MHVBRBPHUNTOQQ-ZFWWWQNUSA-N 293.407 2.468 10 20 CECD CN1CCN(c2ccc(CNC3(C)CC3)cc2)CC1 1254083444 YINVXFQXAPMECH-UHFFFAOYSA-N 259.397 2.081 10 20 CECD CCCN(Cc1ccccc1O)[C@H]1CCN(C2CC2)C1=O 1330962450 GLWNUYWZEMRKOP-HNNXBMFYSA-N 288.391 2.368 10 20 CECD COc1ccc(CNCc2cnc(N(C)C)s2)c(O)c1 793385644 DTZCYTPSNOCQIQ-UHFFFAOYSA-N 293.392 2.213 10 20 CECD C[C@@H](NC(=O)[C@H]1CCC[C@@H](C(=O)O)C1)c1ccccc1O 1607420396 WOMXRXPCVYRHMN-GRYCIOLGSA-N 291.347 2.460 10 20 CECD C[C@H](NCCC(=O)O)c1ccc(Br)cc1O 1609921581 RJSKYELZLJWQNC-ZETCQYMHSA-N 288.141 2.280 10 20 CECD COC(=O)[C@](C)(NCc1ccc(N)cc1)c1ccccc1 1578769347 MQODIDPYEZEYRO-QGZVFWFLSA-N 284.359 2.447 10 20 CECD C[C@@H](N[C@]1(C)CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589952859 YELCEUIZONCQEX-RFAUZJTJSA-N 287.367 2.412 10 20 CECD O=C(/C=C\[C@H]1CCCNC1)N1CCc2cc(F)ccc21 1580491949 WNKSFTJNBNGZHX-GCLPIYDQSA-N 274.339 2.271 10 20 CECD CO[C@@H]1CC[C@@H](N[C@H](C)c2cc(C(=O)O)ccc2O)C1 1599104439 NVXYFOOUPHRZHK-YUSALJHKSA-N 279.336 2.309 10 20 CECD CN(C)c1ccc(OCc2ccon2)cc1C(=O)O 1598328331 HMWNRRLEFJLASU-UHFFFAOYSA-N 262.265 2.018 10 20 CECD Cn1c(-c2ccccc2)cnc1SCC(=O)NC1CC1 5263725 MZHGEWOPYYRBCX-UHFFFAOYSA-N 287.388 2.458 10 20 CECD CC(C)Cn1cc(NC(=O)Cc2ccc(N)cc2)cn1 161641613 AMHQYIOWIUFHCQ-UHFFFAOYSA-N 272.352 2.303 10 20 CECD COc1ccc(N(C)CC(=O)N[C@@H](C)C(C)C)cc1 844353278 KDKZVGYCFYFAES-LBPRGKRZSA-N 264.369 2.292 10 20 CECD CCC[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCO1 152514043 KWEUVZARRRQBGE-GFCCVEGCSA-N 279.336 2.122 10 20 CECD CC[C@H](N[C@H]1CCCCNC1=O)c1ccccc1O 36976949 RSUDVEGYJVJYAW-STQMWFEESA-N 262.353 2.102 10 20 CECD C[C@@H](N[C@H]1CCCCNC1=O)c1ccc(N(C)C)cc1 37282687 VPZRJARNOYWIMO-DOMZBBRYSA-N 275.396 2.072 10 20 CECD C[S@@](=O)C1(CNCc2ccc3c(c2)CCCO3)CCC1 922093445 FLQHANKSPNVYJV-HXUWFJFHSA-N 293.432 2.402 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)c1nnnn1C1CC1 189132057 OGOPAELGNBJECA-ZJUUUORDSA-N 273.340 2.125 10 20 CECD Cc1ccc(C(=O)N2CCCC3(CC3)C2)c(O)c1O 184115647 OJKZNKJELCQYPE-UHFFFAOYSA-N 261.321 2.422 10 20 CECD Cc1ccc(C(=O)N2CCS[C@@H](C)CC2)c(O)c1O 191945906 NDNJWHVIQDELQA-JTQLQIEISA-N 281.377 2.374 10 20 CECD Cc1cc(C(=O)N[C@H](C)C(=O)O)c(C)n1-c1ccccc1 237326113 IYXFKMGIDFUKLU-LLVKDONJSA-N 286.331 2.297 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2ccc(N(C)C)cc2)C1 93813395 ZLLUQUQUHACEAD-INIZCTEOSA-N 276.380 2.138 10 20 CECD CN1CCCc2cc(CNCc3ccc(CO)o3)ccc21 266243699 YFJAEQSTLSOFBC-UHFFFAOYSA-N 286.375 2.444 10 20 CECD CC(C)N1CCN(Cc2c(O)cccc2Cl)CC1=O 272540611 PBFPEHYKFLQCKT-UHFFFAOYSA-N 282.771 2.098 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H]2CCCO2)c1 273426104 UEBSIJBKOUSANV-JQWIXIFHSA-N 279.336 2.008 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](O)CN2CCCC2)c(O)c1C 273418193 RLJHUVCDEZGGNN-LSDHHAIUSA-N 292.423 2.116 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCC1OCCCO1 271598855 AHEDAOXBTKSHKO-UHFFFAOYSA-N 292.379 2.105 10 20 CECD COC(=O)C(C)(C)CCNCc1cc(C)ccc1O 285660351 ZASKZDIIARUXJL-UHFFFAOYSA-N 265.353 2.380 10 20 CECD CC[C@@H](NC[C@](C)(O)CCOC)c1ccc(F)cc1O 285914483 DKORNRZLNYWCID-UKRRQHHQSA-N 285.359 2.360 10 20 CECD CC[C@@H](NC[C@H](O)CN1CCCC1)c1ccc(F)cc1O 286334437 YBETXTIWWOIRLE-DZGCQCFKSA-N 296.386 2.029 10 20 CECD CCCCN(CCCO)Cc1cccc(OC)c1O 289447121 MSOAWNFLRJGOJN-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CC(C)OCCCNC(=O)NCc1ccccc1O 299512105 OEUMODKUFJYMAK-UHFFFAOYSA-N 266.341 2.007 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC[C@H](C)CCO)c1 297284342 LNERKJWZIXTHJG-RYUDHWBXSA-N 295.379 2.238 10 20 CECD Cc1cnc(C(=O)NCc2c(O)ccc3c2CCCC3)o1 291775021 OCVBLISUEHNBFF-UHFFFAOYSA-N 286.331 2.497 10 20 CECD Cc1ccc(CN[C@H]2CCc3cccc(O)c32)c(=O)n1C 296518789 QUWMQGQIPQNGEP-AWEZNQCLSA-N 284.359 2.176 10 20 CECD C[C@H](NCCC[C@H]1CCCN1)c1cc([N+](=O)[O-])ccc1O 817981854 VVYIAMJOJYMVKB-RYUDHWBXSA-N 293.367 2.483 10 20 CECD C[C@@H]1C[C@H](CO)CN(Cc2ccc(N(C)C)c(F)c2)C1 817412783 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YZGUEQDMJXQAKD-UHFFFAOYSA-N 294.358 2.322 10 20 CECD O=C(C[C@@H]1CCOC1)NCc1c(O)ccc2c1CCCC2 743719661 NPJWNLAFFMTFMK-LBPRGKRZSA-N 289.375 2.314 10 20 CECD COC(=O)c1cc(CNCCc2ccc(N)cc2)oc1C 841034622 IKSZYUNNVBTDLJ-UHFFFAOYSA-N 288.347 2.289 10 20 CECD C[C@H](NC(=O)NCCc1ccc(N)cc1)C1CCC1 841863728 DFNKWNAYSKILLV-NSHDSACASA-N 261.369 2.299 10 20 CECD CC(C)(C)n1cc(CN2CCCc3cc(CN)ccc32)nn1 843058617 XAGYQDMHAOQRGP-UHFFFAOYSA-N 299.422 2.445 10 20 CECD COC[C@H](O)CN(C)c1ccc(-c2nccs2)cc1 846996315 RANKVAAROWNEHD-CYBMUJFWSA-N 278.377 2.254 10 20 CECD NCCC1CCN(Cc2cccc(F)c2O)CC1 844911493 MTYTWFPELRYWJE-UHFFFAOYSA-N 252.333 2.092 10 20 CECD CCOc1ccc(CN[C@@]2(C)CCOC2)c(O)c1 756040697 BAKZXTSWDBFUBQ-AWEZNQCLSA-N 251.326 2.060 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C)n(C)c2C)c1 769541055 YREOVPJKFKQDON-UHFFFAOYSA-N 288.347 2.286 10 20 CECD C[C@@H](NC(=O)NCC1CCOCC1)c1ccccc1O 868354049 CNBOBGBUZVWNLT-LLVKDONJSA-N 278.352 2.179 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](O)C(C)(C)C 765047032 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125866515 YOTBVSXOLDJLGW-SNVBAGLBSA-N 272.142 2.033 10 20 CECD C[C@H](N[C@H](C)CN1CCCC1=O)c1ccccc1O 37782035 IWVFYIFRMQJMNZ-NEPJUHHUSA-N 262.353 2.054 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@H](C)c1ccccc1O 37782036 IWVFYIFRMQJMNZ-NWDGAFQWSA-N 262.353 2.054 10 20 CECD O=C(NCc1ccccc1O)c1cc(C2CC2)on1 269151065 QBHCBFXKDSNQDY-UHFFFAOYSA-N 258.277 2.188 10 20 CECD Oc1c(F)cc(F)cc1CNCCCn1cccn1 708494893 RABBWSVGFSTZAG-UHFFFAOYSA-N 267.279 2.047 10 20 CECD COc1cccc(CNC[C@H]2CC[C@H](C)O2)c1O 398174439 VJEYAUXHGJBKFV-CMPLNLGQSA-N 251.326 2.058 10 20 CECD CCOC1CC(NCc2cc(OC)ccc2O)C1 224426170 INSGUEZEYWENLL-UHFFFAOYSA-N 251.326 2.058 10 20 CECD C[C@H](NCCCN1CCOC1=O)c1ccc(N(C)C)cc1 178586823 SKVMSVDLCBFUAN-ZDUSSCGKSA-N 291.395 2.246 10 20 CECD C[C@]1(O)CCCN(Cc2c(O)cccc2Cl)C1 129512515 DOOKUZHWFPTHHK-ZDUSSCGKSA-N 255.745 2.392 10 20 CECD CCO[C@H]1C[C@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 185716699 GUSSLHRGMOMTSE-STQMWFEESA-N 293.363 2.373 10 20 CECD COc1cccc(CN2C[C@H](C)OC[C@@H]2C)c1O 217780678 UHXZMTLMWQZGOA-QWRGUYRKSA-N 251.326 2.010 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2ncc([N+](=O)[O-])cn2)c1 302174975 WRBOWLTUZVZKAT-MRVPVSSYSA-N 290.279 2.272 10 20 CECD CCOC(=O)[C@@H](C)[C@@H](C)NCc1cc(F)ccc1O 184568972 LMUCOYQKLYPMFG-VHSXEESVSA-N 269.316 2.209 10 20 CECD OC[C@H](CC1CC1)NCc1ccc2c(c1)CCCO2 921935823 VEYJFDAESKJPCG-HNNXBMFYSA-N 261.365 2.262 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCC[C@H]3C1)OCO2 147936647 VAXNJMZMWCSZGM-PHIMTYICSA-N 261.321 2.353 10 20 CECD COC1(CNCc2c(O)cccc2Cl)CCOCC1 123148827 DIUCVRGAUBTODD-UHFFFAOYSA-N 285.771 2.331 10 20 CECD COc1ccc(O)c(CN(CC(C)(C)O)C2CC2)c1 189942749 CTYDIPWCONILDQ-UHFFFAOYSA-N 265.353 2.136 10 20 CECD CN(CC(F)(F)F)C(=O)/C=C/c1ccc(O)c(O)c1 180970056 ZMOPYNXYTWJNEX-HWKANZROSA-N 275.226 2.132 10 20 CECD COc1ccc(O)c(CN[C@H](CO)C2CCCC2)c1 290808213 FWSQKRUKFDTUHZ-CQSZACIVSA-N 265.353 2.042 10 20 CECD Cn1cnc(CNCc2ccc(N3CCCCC3)cc2)n1 92851311 UPFQPEHZFUNKGN-UHFFFAOYSA-N 285.395 2.095 10 20 CECD Cc1nn(C)c(C)c1C[C@H](C)C(=O)Nc1ccc(N)cc1 237506888 OLPDWQQEPBWGBX-JTQLQIEISA-N 286.379 2.436 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCCN1C 269187679 VZPRXKCZVRCUBS-AWEZNQCLSA-N 276.380 2.225 10 20 CECD COC(=O)[C@@H]1CC12CCN(Cc1cc(F)ccc1O)CC2 272253532 IRWFJPVPEHNUMP-ZDUSSCGKSA-N 293.338 2.306 10 20 CECD CC(=O)N1CCC[C@@H](CN[C@@H](C)c2cc(F)ccc2O)C1 280939594 IRVILVLIDOQSGH-AAEUAGOBSA-N 294.370 2.440 10 20 CECD COc1cccc(CN2C[C@@H](N3CCCC3)C[C@@H]2C)c1O 289698716 OLWJJLGCBULLNZ-ZFWWWQNUSA-N 290.407 2.459 10 20 CECD CCOC(=O)[C@@H](CC)Sc1ncc(C(=O)OC)s1 295307544 MWVCKBJFBJZUJM-SSDOTTSWSA-N 289.378 2.364 10 20 CECD CC(C)OCCCC(=O)NCc1ccc(N)cc1 297220685 OBPUWUBOBPRTHI-UHFFFAOYSA-N 250.342 2.090 10 20 CECD CC(=O)NCC[C@@H]1CCCN(Cc2cccc(C)c2O)C1 809777996 KTZFDZAJVMLXHN-HNNXBMFYSA-N 290.407 2.439 10 20 CECD CC(C)(CO)NCc1cc(Br)cc(F)c1O 715743669 CYQCFUIPSWVJPK-UHFFFAOYSA-N 292.148 2.154 10 20 CECD COC(=O)N1CC(N[C@@H](C)c2cc(Cl)cc(C)c2O)C1 808706745 SPZGDKQMFLFXPN-VIFPVBQESA-N 298.770 2.455 10 20 CECD CCOc1ccc(CN2CCOC[C@@H]2CCOC)c(O)c1 812786383 IPOQAPXMELDIDI-AWEZNQCLSA-N 295.379 2.028 10 20 CECD C[C@H]1C[C@@H](CO)CN(Cc2c(O)cccc2Cl)C1 817413330 WKPKYSJEJLZCIT-WDEREUQCSA-N 269.772 2.496 10 20 CECD C[C@@H]1CC[C@@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 819168519 QBNSPSUVHZLOSX-DGCLKSJQSA-N 288.347 2.345 10 20 CECD COc1ccc(O)c(CN2CC[C@H](O)C23CCCC3)c1 816630853 UWLBWIKXQKBSOJ-HNNXBMFYSA-N 277.364 2.280 10 20 CECD CCOc1ccc(CNC[C@H]2CCCO2)c(O)c1 725841457 JIDDVWQPLLMANO-CYBMUJFWSA-N 251.326 2.060 10 20 CECD Cc1nccnc1C(=O)NCc1ccc(N2CCCC2)cc1 821843397 RESARIHWZLVHRW-UHFFFAOYSA-N 296.374 2.315 10 20 CECD C[C@H](NC1CCN(C(=O)O)CC1)c1ccccc1O 827727220 HFDDPYLQSUQZGH-JTQLQIEISA-N 264.325 2.185 10 20 CECD Cc1cc(Br)cc(CNCCC(=O)O)c1O 820953799 CZUGHYIVXZLFBF-UHFFFAOYSA-N 288.141 2.027 10 20 CECD CCO[C@H]1C[C@@H]1C(=O)NCCCSc1nccs1 733974489 VBEISZDJSHTNJK-UWVGGRQHSA-N 286.422 2.167 10 20 CECD CCCOC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 908460458 ULEIIKINFJDFAQ-OAHLLOKOSA-N 293.411 2.492 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NC2CCC2)c1 730584415 XMELZZLNEVBFTL-VIFPVBQESA-N 264.325 2.314 10 20 CECD C[C@H](c1ncccn1)N1CCCc2cc(CN)ccc21 903423581 XNPKWDICEFSDMQ-GFCCVEGCSA-N 268.364 2.449 10 20 CECD Oc1cccc2c1[C@@H](NCCOC[C@@H]1CCOC1)CC2 834578566 UWSVPAVFYQBSEI-OCCSQVGLSA-N 277.364 2.022 10 20 CECD Nc1ccc(CCN[C@@H]2CCC[C@@H]2[C@H]2CCCN2)cc1 841038235 HXCMDTFWQAYKKN-GVDBMIGSSA-N 273.424 2.322 10 20 CECD O=C(O)CCCNCc1c(O)ccc(Cl)c1F 843040539 JVUZBMJFQZDRGV-UHFFFAOYSA-N 261.680 2.139 10 20 CECD CC[C@@H](C)[C@@](C)(O)CNC(=O)Nc1ccc(N)cc1 841300832 WQILZIQKZBLMLW-YGRLFVJLSA-N 265.357 2.187 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCC(C)(C)N 844186651 MKHVIFFVCOJDQN-UHFFFAOYSA-N 277.412 2.195 10 20 CECD CCc1nocc1/C=C1\SC(=S)N(C)C1=O 841494907 FFWNFZMUXINHHU-YWEYNIOJSA-N 254.336 2.068 10 20 CECD Cc1cc(O)c(CN2CCN(C)C(=O)C2)cc1C(C)C 844729829 UXZAIDUCXBDGAG-UHFFFAOYSA-N 276.380 2.098 10 20 CECD CN(C)c1ncc(CNCc2cc(Cl)ccc2O)cn1 846058488 PXYJMCJMNVSSGA-UHFFFAOYSA-N 292.770 2.191 10 20 CECD CC1(NCc2c(O)ccc(Cl)c2F)CCNCC1 841065302 NNHTVTLPWIATQH-UHFFFAOYSA-N 272.751 2.416 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1CCCCO1 759595949 SIRHXMHOXYZAPR-HOSRBBHYSA-N 278.304 2.223 10 20 CECD CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(O)cs1 751403498 SKAYXQPBOWJSIA-MNOVXSKESA-N 280.393 2.153 10 20 CECD CCCC(=O)COC(=O)/C=C/c1ccc(O)c(O)c1 759587656 BZNHLFPLGDEVPI-FNORWQNLSA-N 264.277 2.023 10 20 CECD Cc1nnc([C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)o1 759597446 ZPRZYTYXTPDBNO-RZAAKKIOSA-N 290.275 2.107 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](O)CC(C)C)c1 756496334 GOKCJXPXMMQYRB-AAEUAGOBSA-N 295.379 2.236 10 20 CECD COCCOC[C@@H](C)N[C@H](C)c1cc(F)ccc1O 756731399 ABWIPSRITWDOPL-GHMZBOCLSA-N 271.332 2.233 10 20 CECD Cc1nonc1CNCc1c(O)cccc1Br 862367615 PEYCPPXJOYZQHY-UHFFFAOYSA-N 298.140 2.136 10 20 CECD COc1cc(Cl)cc(CNC[C@H](O)c2ccco2)c1O 761199190 XEOQFVADVYZQTA-NSHDSACASA-N 297.738 2.470 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@H](C)COC)cc1 769712031 KQCIRPSDHFVOAF-CYBMUJFWSA-N 293.411 2.367 10 20 CECD Cc1ccc(O)c(CNC(=O)CC2CCOCC2)c1 862759793 IQGHSOSXPIXNKM-UHFFFAOYSA-N 263.337 2.134 10 20 CECD COc1cc(O)c(CNC[C@H]2CCC[C@@H]2OC)cc1OC 776257552 YFXBDDNGPIUTFU-RISCZKNCSA-N 295.379 2.314 10 20 CECD Cc1cc(CN[C@H](CCO)C(F)(F)F)ccc1N(C)C 887079815 ZWVWQRJVWFYQGV-CYBMUJFWSA-N 290.329 2.464 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3F)CC2)cc1 1123767384 IRDCEDCVNRQWJZ-HUUCEWRRSA-N 292.354 2.092 10 20 CECD CCOC[C@@H](NC(=O)c1cc(O)cs1)C(C)C 789918244 PCOHYOZQOBUYME-SNVBAGLBSA-N 257.355 2.245 10 20 CECD Cc1ccsc1CCNC(=O)c1cccc(O)c1O 790918400 QXEMUFUETWMJSF-UHFFFAOYSA-N 277.345 2.440 10 20 CECD COCCN(Cc1cc(F)cc(F)c1O)CC(F)F 893995673 YKWGZUJYEUXJTA-UHFFFAOYSA-N 281.249 2.384 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](OC)C2CC2)c1 792237723 HRDLVUVDMUZEQL-YMTOWFKASA-N 279.336 2.003 10 20 CECD Nc1ccc(CC(=O)NCCc2ccc(F)cc2)cc1 19399158 VUKDVMPDMCEMSA-UHFFFAOYSA-N 272.323 2.309 10 20 CECD CCC[C@H](CNC(=O)NCc1ccc(N)cc1)OCC 1338660776 QODIUIGEJREKAL-CQSZACIVSA-N 279.384 2.273 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2nccc(C)n2)c1 775368774 FGZWKWACDRMQMR-LLVKDONJSA-N 273.336 2.350 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)c1cc(O)cs1)OC 1351011641 AQNDANFWWHBAEL-WCBMZHEXSA-N 257.355 2.245 10 20 CECD Cc1cc(Cl)cc(CN[C@H](C(=O)O)C2CC2)c1O 1600218938 HQHFDOMBROAOTM-NSHDSACASA-N 269.728 2.307 10 20 CECD COc1cc(C)cc(CN[C@@](C)(CCF)C(=O)O)c1O 1607149620 YCBXJODPVQJCJH-AWEZNQCLSA-N 285.315 2.002 10 20 CECD O=C(O)[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 1606016036 QTNFRAVZCRAXBF-SSDOTTSWSA-N 273.691 2.091 10 20 CECD C[C@H](N[C@@H]1CCCC[C@H]1CN)c1cc(C(=O)O)ccc1O 1609778125 MWRNWHYHSAQTKD-VHRBIJSZSA-N 292.379 2.259 10 20 CECD C[C@H](N[C@@H]1CC[C@@H]2C[C@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589953727 FQQMVPBFOZYIEW-WHOHXGKFSA-N 299.378 2.412 10 20 CECD O=C(O)c1cc(=NCc2cc(Cl)ccc2O)cc[nH]1 1777667008 UUWUITWGFXHZJA-UHFFFAOYSA-N 278.695 2.173 10 20 CECD CC(C)N1CCC[C@H](CNC(=O)Cc2ccc(N)cc2)C1 166350631 YMIFNPKIKMPABI-OAHLLOKOSA-N 289.423 2.048 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CCC[C@H](N)C2)cc1F 166458715 ZENKZZNWBJGFJI-STQMWFEESA-N 293.386 2.025 10 20 CECD O=C(Cc1ccccc1F)NCc1ccc(O)c(O)c1 159008408 YLMRPZSKIMZKTD-UHFFFAOYSA-N 275.279 2.096 10 20 CECD COc1cccc(O)c1CN1CC[S@](=O)C(C)(C)CC1 825024746 UBCLPYRRPWRTIO-FQEVSTJZSA-N 297.420 2.134 10 20 CECD CC(C)N1CC[C@@H](N[C@@H](C)c2cc(F)ccc2O)C1=O 186048806 DXLLWGGYJQNATR-GXFFZTMASA-N 280.343 2.191 10 20 CECD COCC1(NCc2cccc(OC)c2O)CCC1 378695660 KVYCUEXNVBSIIU-UHFFFAOYSA-N 251.326 2.060 10 20 CECD C[C@@H]1C[C@@H](CNC(=O)Nc2ccc(N)cc2)CCO1 388927401 BJOOXROQNWDXMT-MNOVXSKESA-N 263.341 2.205 10 20 CECD CN(C)c1ccc(CNC(=O)NCCc2cccnc2)cc1 58733784 QUZRHJITPMHVPU-UHFFFAOYSA-N 298.390 2.190 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCSCCCO)c1 185378629 ONALHQRZFWREPX-GFCCVEGCSA-N 269.410 2.467 10 20 CECD CCC1(CNC(=O)NCc2cccc(OC)c2O)CC1 79128895 UNIDWMCRIPAITF-UHFFFAOYSA-N 278.352 2.390 10 20 CECD CN(C)c1ccc(CNCCCc2cnn(C)c2)cc1 237087994 UGJZKINYOQFDCE-UHFFFAOYSA-N 272.396 2.209 10 20 CECD CNC[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 40591737 MYITXGBPYMUGSU-HNNXBMFYSA-N 261.413 2.184 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCCN)cc1F 236906108 PYVUPCLZYWMUQO-UHFFFAOYSA-N 281.375 2.027 10 20 CECD COc1cccc(CNC[C@@](C)(O)c2cccs2)c1O 265780945 OKAVDXNTDUJBRB-OAHLLOKOSA-N 293.388 2.460 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2ccc(OC)c(C)c2)C1 279459412 QXRNVLJHWHMZFZ-UONOGXRCSA-N 277.364 2.435 10 20 CECD CC(C)c1nnc(NC(=O)c2c(F)ccc(O)c2O)s1 276644216 VMUXCMYFNSJVBL-UHFFFAOYSA-N 297.311 2.464 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC(C)(C)C)c1O 278112415 BNKGZIDSCNNYBI-UHFFFAOYSA-N 254.286 2.197 10 20 CECD C[C@@H](NC1CCN(C)CC1)c1cc([N+](=O)[O-])ccc1O 273424089 STWPJWNRFIRLJE-SNVBAGLBSA-N 279.340 2.045 10 20 CECD CC[C@H](CO)N(C)Cc1cc(Cl)cc(OC)c1O 295137026 PHDKBPUSRPAZCP-LLVKDONJSA-N 273.760 2.257 10 20 CECD CCCCOc1ccc(C(=O)OCC(=O)C(C)=O)cc1 808486341 PISRXNPUTNQODK-UHFFFAOYSA-N 278.304 2.180 10 20 CECD COc1ccc(CN[C@@H](C)c2ccc(N(C)C)cc2)nn1 801544755 UGTMVLHDZMRQEF-LBPRGKRZSA-N 286.379 2.402 10 20 CECD CC(C)[C@@H]1C[C@@H](NC(=O)c2c(F)ccc(O)c2O)CCO1 297548217 QMTXFNVNBOUGTN-CABZTGNLSA-N 297.326 2.170 10 20 CECD Cc1ncsc1CCC(=O)NCc1ccccc1O 298504711 UXTYYCHZJWAGGA-UHFFFAOYSA-N 276.361 2.406 10 20 CECD Cc1cccc(CN(CCN(C)C)C[C@H]2CCCO2)c1O 809738420 XDFDBBKORZZTJE-MRXNPFEDSA-N 292.423 2.243 10 20 CECD C[C@H](NCC1(N)CCC1)c1cc(F)cc(F)c1O 817965157 QLZKQRRZWKKWBL-QMMMGPOBSA-N 256.296 2.202 10 20 CECD Cc1ccn(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 828860734 GLBPHPYLMBBLLA-CYBMUJFWSA-N 286.379 2.135 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3ccc(F)cc32)cn1 493255240 NJEOTOXUIZJJMQ-DJWKRKHSSA-N 299.305 2.227 10 20 CECD OCC1(CCNCc2cc(Cl)c(F)cc2O)CC1 825040592 OQEFGOVLCSTUGX-UHFFFAOYSA-N 273.735 2.437 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C(F)(F)F)O1 829414994 IKPQUSPAVVSWCU-RCOVLWMOSA-N 295.282 2.246 10 20 CECD CCCN(CCO)Cc1ccc(Br)cc1O 824522515 QEUNZHQXRDLBLL-UHFFFAOYSA-N 288.185 2.359 10 20 CECD C[C@@H](CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1)N(C)C 836405862 MWEXLOADJKMDGH-QWHCGFSZSA-N 292.427 2.063 10 20 CECD CNC(=O)c1ccc(C)c(NC(=O)c2cc(O)cs2)c1 732269888 ZVAVWJLHPVYWOD-UHFFFAOYSA-N 290.344 2.374 10 20 CECD COc1cccc(CNC(=O)COCC2CCCC2)c1O 836778443 XMYNJBQBJAKZRO-UHFFFAOYSA-N 293.363 2.224 10 20 CECD CC[C@@H]1C[C@H](CC(=O)NCc2ccc(O)cc2O)CCO1 910949361 KHXKUARQNIEDDI-BXUZGUMPSA-N 293.363 2.309 10 20 CECD Cc1nc(CC(=O)NCc2ccc(O)cc2O)c(C)s1 910951909 YEQZQHPRXFTTIC-UHFFFAOYSA-N 292.360 2.030 10 20 CECD C[C@@]1(CNCc2cc(F)ccc2O)CCCNC1 841056944 KJEYCUALPTZQDY-CQSZACIVSA-N 252.333 2.011 10 20 CECD COC/C(C)=C/C(=O)NCc1c(O)ccc2c1CCCC2 845833167 DDNUXKXNYJGQMA-FMIVXFBMSA-N 289.375 2.480 10 20 CECD CC[C@@H](NC[C@@H]1CNC(=O)C1)c1cccc(Cl)c1O 840837735 LVJWCRFCYQTDBU-BXKDBHETSA-N 282.771 2.222 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CS[C@H](C)C2)c1O 840420569 RZXFAGBULHJWGM-MWLCHTKSSA-N 296.392 2.094 10 20 CECD Cc1cc(C)c([C@H](C)NCCN2CCCC2=O)c(O)c1 846207072 XXTIRHYQWWDMNU-ZDUSSCGKSA-N 276.380 2.282 10 20 CECD COc1cccc([C@@H](C)NCCCO[C@@H]2CCOC2)c1O 846149837 MVNAICRLBMCVGJ-CHWSQXEVSA-N 295.379 2.247 10 20 CECD C[C@@H]1NCCN(Cc2cccc(Br)c2O)[C@@H]1C 843056856 AZMBWBPQWOXUGE-VHSXEESVSA-N 299.212 2.337 10 20 CECD COc1cccc(O)c1CN1CCC([C@H]2CCCN2)CC1 843046428 VRGIRGNYAQRHOZ-OAHLLOKOSA-N 290.407 2.365 10 20 CECD Cc1nccnc1CCNCc1ccc2c(c1)CCCO2 922147418 WDMQHOQRVXBFOD-UHFFFAOYSA-N 283.375 2.442 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCO2)c1nnnn1C1CC1 922054093 XYMNJAWMACZBPA-LLVKDONJSA-N 299.378 2.184 10 20 CECD CCCc1nc(C(=O)NCc2cc(OC)ccc2O)co1 759958694 LJJOEXQDGFYMFE-UHFFFAOYSA-N 290.319 2.271 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2ccc(C)o2)c1 862758081 OAVWANZFMCOUSZ-UHFFFAOYSA-N 259.305 2.461 10 20 CECD CCOc1ccc(CN2CC[C@@H](N3CCCC3)C2)c(O)c1 769228965 FJCLDBBADIWBHX-OAHLLOKOSA-N 290.407 2.461 10 20 CECD C[C@H](NCCN1CCO[C@H](C)C1)c1ccc(N(C)C)cc1 765789091 OWVSXOMMYYTSJM-CABCVRRESA-N 291.439 2.124 10 20 CECD CCc1cccnc1C(=O)NCc1ccccc1O 767089803 WCLLROACVVCOBO-UHFFFAOYSA-N 256.305 2.280 10 20 CECD Cc1ccc(CN(C)Cc2ncnn2CC(F)F)c(O)c1 877483210 PURCPAFZBNJVOQ-UHFFFAOYSA-N 296.321 2.189 10 20 CECD Cc1cccc(O)c1CNCc1ccc2c(c1)C(=O)NCC2 877333076 NSISXQTYEXZYPE-UHFFFAOYSA-N 296.370 2.276 10 20 CECD Cc1ccc(CN[C@H]2CCN3CCCC[C@H]23)c(O)c1 876933831 AEFUQLUUDCYPBR-LSDHHAIUSA-N 260.381 2.417 10 20 CECD CC[C@H](C[C@H](C)CO)NCc1cc(F)ccc1O 779088636 SPIJDKVWCPCRTD-GXFFZTMASA-N 255.333 2.418 10 20 CECD C[C@H](N[C@@H](CO)C[C@@H]1CCCO1)c1ccc(N(C)C)cc1 886666003 KYZQNLBYYNNRGX-LXZKKBNFSA-N 292.423 2.333 10 20 CECD CCc1nn(C)cc1NC(=O)/C=C\c1ccc(O)c(O)c1 779544945 PRVSKTCTXFWLKK-ALCCZGGFSA-N 287.319 2.046 10 20 CECD C[C@@H](N[C@H]1CCn2ccnc2C1)c1c(O)cccc1F 886594723 SLCAIABDIFLJAZ-MNOVXSKESA-N 275.327 2.393 10 20 CECD O=C(NCc1ccccc1F)c1c(F)ccc(O)c1O 789939969 UEBJISKZEHVTPG-UHFFFAOYSA-N 279.242 2.306 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2[C@@H](C)C2(F)F)c1 1123770539 SMLTXNRJXDMJBL-RWYTXXIDSA-N 285.290 2.479 10 20 CECD CN(C)c1cc(F)c(CNCC[C@@H](O)C2CC2)cc1F 898199054 JLSYCWCAORLGJM-OAHLLOKOSA-N 284.350 2.281 10 20 CECD COc1cccc(O)c1CNCCOC1CCSCC1 898442243 JQDZBLDZEWXKMC-UHFFFAOYSA-N 297.420 2.403 10 20 CECD CNc1ccccc1C(=O)NCc1ccc(N)cc1 91352059 NVQQXAYHRBKMPX-UHFFFAOYSA-N 255.321 2.241 10 20 CECD COCCN1CC[C@H](N[C@H](C)c2cc(C)ccc2O)C1 273610453 VRMBGPUWSRLMCM-KGLIPLIRSA-N 278.396 2.072 10 20 CECD CN[C@H](C)CCNCc1cc(Cl)cc(OC)c1O 1327414384 AFHLEMOFUDJTCX-SECBINFHSA-N 272.776 2.142 10 20 CECD COc1ccccc1S(=O)(=O)Nc1ccc(O)cc1 192718143 YFEHMNSRTJUTCA-UHFFFAOYSA-N 279.317 2.202 10 20 CECD CCc1cccc(CN2CCC(NC(C)=O)CC2)c1O 692093877 VIOPCBBERDTXLP-UHFFFAOYSA-N 276.380 2.055 10 20 CECD Cc1ccc(CNC[C@H](CO)CC2CCOCC2)c(O)c1 1336754935 NPCUWXDDAFTAFC-OAHLLOKOSA-N 293.407 2.215 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1261482827 ZVBQIYCEELBPEB-ZBFHGGJFSA-N 273.424 2.456 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@]1(F)CCOC1 1347473151 HWPAUOKXLPSMMZ-INIZCTEOSA-N 294.370 2.230 10 20 CECD Cc1cccc([C@@H](NC(=O)c2cc(O)cs2)C(=O)O)c1 1574390810 FGNPQCOFHXUMHV-GFCCVEGCSA-N 291.328 2.318 10 20 CECD CCN1CCc2cc(CN[C@H](CC(F)F)C(=O)O)ccc21 1776877166 RCUDQHWJNJPSTH-GFCCVEGCSA-N 298.333 2.267 10 20 CECD CO[C@@H]1CCN(Cc2cc(F)ccc2O)C[C@@H]1C 824815476 QJLCUNZDLJELPH-IINYFYTJSA-N 253.317 2.388 10 20 CECD Cc1ccc(CN[C@@H](CC(C)C)C(=O)O)c(O)c1 1574367453 GTTRLBXAISEKTJ-LBPRGKRZSA-N 251.326 2.290 10 20 CECD COc1cccc(CN2CCC3(CCOCC3)C2)c1O 271231271 UKBNCTVGABJEMU-UHFFFAOYSA-N 277.364 2.403 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCOC2)c1 38043965 VUWDCXPWQNHNLH-NEPJUHHUSA-N 265.353 2.478 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(=O)OC(C)C)c1 308753783 HHCLYXPAFXRGEE-SNVBAGLBSA-N 267.325 2.003 10 20 CECD COc1ccc(N(C)C[C@H](O)COCc2ccco2)cc1 8697952 IIPAJMXHXLBGDI-AWEZNQCLSA-N 291.347 2.302 10 20 CECD CCCOCC(=O)NCCCSc1nccs1 114374991 OKPBAVYCWDJGBP-UHFFFAOYSA-N 274.411 2.168 10 20 CECD CC[C@@H](C)[C@](C)(O)CNCc1cc2c(cc1O)OCO2 112380122 VFVSSMSWRNQPDJ-MEBBXXQBSA-N 281.352 2.008 10 20 CECD COc1cccc(CNS(=O)(=O)CC2CCCC2)c1O 178683692 FVPXSPFQQPFFNU-UHFFFAOYSA-N 299.392 2.010 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1cc(C)cc(C)c1O 128689943 USBHSVJQPNJIHP-AWEZNQCLSA-N 276.380 2.110 10 20 CECD COc1ccc(N(C)CCn2cc([N+](=O)[O-])cn2)cc1F 121764073 XDCUDXRRTZYHQP-UHFFFAOYSA-N 294.286 2.075 10 20 CECD C[C@H](NCc1nnc2n1CCCC2)c1cc(F)ccc1O 183867643 UYVWTTCYQKHDOB-JTQLQIEISA-N 290.342 2.310 10 20 CECD CCC(=O)N1CC[C@@H](NCc2c(O)cccc2Cl)C1 134524159 HVCMJEOBTPHTFO-SNVBAGLBSA-N 282.771 2.146 10 20 CECD CCC[C@H](C)C(=O)NCc1cc(OC)ccc1O 78726259 MOBDBGIYISGUAG-JTQLQIEISA-N 251.326 2.453 10 20 CECD O=C(CCn1cccn1)NCc1ccc(N2CCCC2)cc1 194438009 JRHZZNXVIJUZTK-UHFFFAOYSA-N 298.390 2.190 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCCSC2)cc1 136435054 QQSADTGHPWNMSK-LLVKDONJSA-N 251.355 2.286 10 20 CECD CCOc1cccc(CNC[C@@H](CC)CCO)c1O 94948290 AVCVRXIZMRJZFH-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CC[C@H]1CC[C@H](C(=O)NCc2ccc(N(C)C)cc2)O1 268248529 BLCADVLMTWQPSG-LSDHHAIUSA-N 276.380 2.326 10 20 CECD C[C@@H](NCC1(N(C)C)CCC1)c1cc([N+](=O)[O-])ccc1O 275726593 OJOJGZAGMWUZBL-LLVKDONJSA-N 293.367 2.435 10 20 CECD CN(C)c1ccc(CN2CCC(CCC(N)=O)CC2)cc1 271221434 ZLVRLPBXKCNNNE-UHFFFAOYSA-N 289.423 2.230 10 20 CECD Cc1ccc([C@H](C)NCC2(N3CCOCC3)CC2)c(O)c1 278511777 RMOWYERFHSWBNB-AWEZNQCLSA-N 290.407 2.216 10 20 CECD CC(C)[C@@]1(CO)CCN(Cc2cc(F)ccc2O)C1 378140096 YNXMQFBAYJWPRW-HNNXBMFYSA-N 267.344 2.372 10 20 CECD Cc1ccc([C@@H](C)NCC2(S(C)(=O)=O)CC2)c(O)c1C 280879912 DJKWLXFWXYMQQZ-GFCCVEGCSA-N 297.420 2.237 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@]2(CCOC2)O1 280363183 UOMJYSWZOWSSSE-NHYWBVRUSA-N 297.782 2.425 10 20 CECD CC[C@H](N[C@@H]1CCCN(CCCO)C1)c1ccccc1O 295193036 XNUKLRZVPXFQSU-ZBFHGGJFSA-N 292.423 2.280 10 20 CECD CC[C@@H](C)[C@H](CNC(=O)NCc1ccccc1O)OC 297711025 IAWQFVLAGAYAQV-RISCZKNCSA-N 280.368 2.253 10 20 CECD COC(=O)c1cnc(SCC(=O)C2(C)CC2)s1 295377655 SYNQQMXZZSLNPI-UHFFFAOYSA-N 271.363 2.391 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCCCCC(=O)O 818475460 GQOFHFXBYJJGPG-UHFFFAOYSA-N 294.351 2.179 10 20 CECD C[C@@H](C(=O)O)N(C)Cc1cc(C(C)(C)C)cc(O)c1O 817779117 AIEXGWLAZQBTDV-VIFPVBQESA-N 281.352 2.300 10 20 CECD CC1(C)C[C@@H](O)CCN(Cc2cc3c(cc2O)OCO3)C1 825091010 QYRCYHFRBVRMSQ-LBPRGKRZSA-N 293.363 2.104 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@@H](C)c1ccc(C)cc1O 903342994 LVQTXLRGEYTREO-GJZGRUSLSA-N 292.423 2.462 10 20 CECD C[C@H](N)C[C@H](C)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 831150167 HDADPTWZZRHCNC-RWMBFGLXSA-N 292.427 2.239 10 20 CECD CC(C)n1cccc1C(=O)NCc1ccc(O)cc1O 910949667 OJVIILYGKVBLHG-UHFFFAOYSA-N 274.320 2.410 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](CO)C(C)C 840946267 MLIIYHPNPOBXTF-HNNXBMFYSA-N 264.413 2.415 10 20 CECD Nc1ccc(NC(=O)N[C@H](C2CC2)[C@H](CO)C2CC2)cc1 841299691 MOVSSNJLBIWCMU-HUUCEWRRSA-N 289.379 2.187 10 20 CECD COC[C@H]1CN(Cc2ccc(N(C)C)cc2C)C[C@H](C)O1 840940095 UKABSFHGLYCHGL-WMLDXEAASA-N 292.423 2.297 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCN(C(C)(C)C)C2=O)cc1 842720375 GRKUPTGQWGEIEM-OAHLLOKOSA-N 289.423 2.242 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@@H]1CCCCNC1=O 840912915 PABHPPZDMVUFPK-MRXNPFEDSA-N 289.423 2.162 10 20 CECD C[C@@H](NCCCS(C)(=O)=O)c1ccc(Cl)cc1O 841746889 MAFMQOBENQGNDP-SECBINFHSA-N 291.800 2.131 10 20 CECD COc1cccc([C@@H](C)NCCc2cncn2C)c1O 846165072 RZPVVSGPNXLEPW-LLVKDONJSA-N 275.352 2.028 10 20 CECD CCOc1cccc(CN[C@H](CCN)C(F)(F)F)c1O 841089853 AYSLQXMBXYJHJB-LLVKDONJSA-N 292.301 2.160 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H]2NCC[C@H]2C1 843125916 CLJWJPXDSSWJEJ-RDJZCZTQSA-N 273.424 2.245 10 20 CECD CC(C)(C)NC(=O)CCNCc1ccc2c(c1)CCCO2 921692484 GOBIHWBOSSUGOH-UHFFFAOYSA-N 290.407 2.406 10 20 CECD CNC(=O)C(C)(C)CN[C@H](C)c1cc(F)cc(F)c1O 756782648 SUFZQAURHCSUGF-MRVPVSSYSA-N 286.322 2.093 10 20 CECD Cc1ccc(CN(CCO)C(=O)c2cc(O)cs2)cc1 753477282 ZXFBXHHLFNMBFU-UHFFFAOYSA-N 291.372 2.397 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@H](C)c1cc(F)ccc1O 756776128 WPRGWVYLXLGWBX-IRUJWGPZSA-N 280.343 2.097 10 20 CECD C[C@H](NCCC1CC(O)C1)c1cc(F)cc(F)c1O 762650315 QFCNITDJOJDRMY-SILCLGDVSA-N 271.307 2.482 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCNC(C)(C)C)c1 934940643 SLKRZHXNVZMTIF-LLVKDONJSA-N 294.395 2.356 10 20 CECD C[C@H](NC(=O)CC(C)(C)C)C(=O)N(C)c1ccc(N)cc1 877076186 NPSYZSDYKPHKOG-NSHDSACASA-N 291.395 2.173 10 20 CECD Cc1ccc(CN2CCC[C@H](S(C)(=O)=O)CC2)c(O)c1 877500338 SBJVEDJVYVJODA-AWEZNQCLSA-N 297.420 2.100 10 20 CECD Cc1ccc(CN2CC[C@H](c3nccn3C)C2)c(O)c1 877528925 NYAOFSBGDCQIFV-AWEZNQCLSA-N 271.364 2.424 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@H](C)c1ccc(N(C)C)cc1 773130266 HUAXDAGWXJSHSI-DAXOMENPSA-N 289.423 2.318 10 20 CECD Cc1ccc(CN[C@@H]2CCn3ccnc3C2)c(O)c1 877429724 MEJRWFPMFNIPKJ-CYBMUJFWSA-N 257.337 2.002 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)CC(F)F)c1O 774856951 ISZOCHFSFYWQSE-UHFFFAOYSA-N 276.239 2.006 10 20 CECD COC(=O)[C@@H](CC(F)F)NCc1ccc(OC)c(C)c1 789581864 PJOVNWBTKTYWOU-LLVKDONJSA-N 287.306 2.290 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(OC)c(C)cc2O)[C@H]1C 787246488 QEEMHISXVLZIRA-WCQYABFASA-N 293.363 2.093 10 20 CECD Cc1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)co1 784844621 NGKXVMYNBUWXRH-UHFFFAOYSA-N 276.244 2.039 10 20 CECD O=C(OCc1nnc(-c2ccco2)o1)c1cc(O)cs1 783606838 BJUYDGCPEBNAPN-UHFFFAOYSA-N 292.272 2.454 10 20 CECD COCC[C@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898449384 DDDNPSSWSDFRHW-YOEHRIQHSA-N 293.455 2.370 10 20 CECD Nc1ccc(CC(=O)N2CC[C@H]3CC[C@@H](C3)C2)cc1 1355425742 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C[C@H]1CCC[C@H](C)N1NC(=O)c1cccc(O)c1O 126515204 VDUXSSSDDWVTPZ-UWVGGRQHSA-N 264.325 2.006 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)Cn2cccn2)c1 37155339 PYSBDYJKCMVGAY-RYUDHWBXSA-N 275.352 2.337 10 20 CECD COc1cccc(CN[C@H](C)CCCCO)c1O 295128563 XQUDDPORYWJYCK-LLVKDONJSA-N 253.342 2.042 10 20 CECD COCC[C@@](C)(O)CN[C@@H](C)c1ccc(C)cc1O 185467683 QNZIWECOGNTLQQ-SWLSCSKDSA-N 267.369 2.139 10 20 CECD Oc1cccc2c1[C@@H](NC[C@H]1CCN(C3CC3)C1)CC2 313395032 SOJYKKGPVQKIER-DOMZBBRYSA-N 272.392 2.453 10 20 CECD C[C@@H]1O[C@H](C)C[C@H]1CNCc1cc2c(cc1O)OCO2 686514813 KGCPZTNYTHZTFE-VWYCJHECSA-N 279.336 2.024 10 20 CECD CC[C@H](N[C@@H]1CC(=O)N(CC)C1)c1ccccc1O 391464460 BMYHGXNTUHXPSM-YPMHNXCESA-N 262.353 2.054 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@H](CN)C2)c1O 50250128 WREXTMSOIZHJIA-SNVBAGLBSA-N 282.771 2.029 10 20 CECD C[C@@H](CO)N[C@H](C)c1ccc(Br)cc1O 134926058 RTNXFNJTAWYOGD-JGVFFNPUSA-N 274.158 2.186 10 20 CECD CCCN(CC(=O)OC)Cc1cc(C)ccc1O 178871194 IENZGBUVSFEXLV-UHFFFAOYSA-N 251.326 2.086 10 20 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2.018 10 20 CECD O=C(O)c1cnc(SCOC2CCOCC2)s1 1602537157 LKLMOXFZAMGHPX-UHFFFAOYSA-N 275.351 2.087 10 20 CECD CCCN(Cc1ccccc1O)C(COC)COC 929753765 VUDQUYCZDIRPKQ-UHFFFAOYSA-N 267.369 2.266 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H]2CC[C@@]21CN 1579616629 CQEBHQWCYSVUHK-DOTOQJQBSA-N 273.424 2.374 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@@H]3C[C@@H](C(=O)O)C[C@H]32)cc1 1777039933 DVJABGDKIFAMMA-SJXGUFTOSA-N 288.391 2.342 10 20 CECD CCN(C)c1ccc(CNCCCC(=O)O)c(C)c1 1776856272 AZEXFUZDQFVALZ-UHFFFAOYSA-N 264.369 2.406 10 20 CECD COC(=O)c1cnc(SC2CCOCC2)s1 829681089 NNMPFEPSVGOMEA-UHFFFAOYSA-N 259.352 2.201 10 20 CECD C[C@@H](CN(Cc1ccc(N(C)C)cc1)C1CC1)C(=O)O 833515952 BRFWMBJQHNKNSC-LBPRGKRZSA-N 276.380 2.438 10 20 CECD CC(C)(C)OC(=O)NC/C=C/CNCc1ccc(N)cc1 1575219533 YGSKLKDMLJLXQU-SNAWJCMRSA-N 291.395 2.439 10 20 CECD COc1cccc(CNC[C@@H]2CCC[C@@H](O)C2)c1O 230670211 HFHPMVXHSOALPS-DGCLKSJQSA-N 265.353 2.042 10 20 CECD Nc1ccc(NC(=O)CCNC(=O)c2ccsc2)cc1 238136671 WBBMGWZBUQKVOF-UHFFFAOYSA-N 289.360 2.089 10 20 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CECD COc1ccc(N(C)CCN(C)C(=O)NC2CCC2)cc1 845001815 HQICRTGJCHCCHO-UHFFFAOYSA-N 291.395 2.325 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)[C@@H]2C[C@@H]2C)cc1 844851609 BXVUYWPYQKSEPU-SWLSCSKDSA-N 276.380 2.246 10 20 CECD CCN(C[C@@H]1CCNC1)c1ccc(OC)c(OC)c1 843357494 NQPQCFSCIZBORF-GFCCVEGCSA-N 264.369 2.140 10 20 CECD COC[C@H](NC(=O)NCc1cc(C)ccc1O)C(C)C 858247165 RCNZZVZUJQTYQV-ZDUSSCGKSA-N 280.368 2.171 10 20 CECD COc1ccc(O)c([C@H](C)NCCN(C)CC(F)F)c1 858597807 XMQHSXTWFJECIT-JTQLQIEISA-N 288.338 2.248 10 20 CECD C[C@](O)(CNC(=O)c1cc(O)cs1)c1ccc(F)cc1 760857814 ZHOJGBBYEGCKJP-AWEZNQCLSA-N 295.335 2.230 10 20 CECD CN(C)c1ccc(CN(c2nccc(CO)n2)C2CC2)cc1 767181665 LGCGTNIEGKDJRK-UHFFFAOYSA-N 298.390 2.204 10 20 CECD COc1ccc(O)c(CNc2cc(C)nc(OC)n2)c1 760543056 XBSXOCXDZMOKQP-UHFFFAOYSA-N 275.308 2.120 10 20 CECD CCC[C@H](O)CC(=O)N[C@@H](C)c1cc(OC)ccc1O 761968213 TUOLSKUSYIYWRB-QWRGUYRKSA-N 281.352 2.129 10 20 CECD C[C@@H](NCCc1ccn(C)n1)c1cc(F)cc(F)c1O 760896447 MAKHGUZMLNGRLP-SECBINFHSA-N 281.306 2.297 10 20 CECD CCCNC(=O)[C@H]1CCCN(Cc2c(C)cccc2O)C1 876657518 GRYYQLQRYCCDMC-AWEZNQCLSA-N 290.407 2.439 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@H]([S@](C)=O)C2)c(O)c1 877623015 GVLJGIJCHPXWLG-TYILLQQXSA-N 281.421 2.480 10 20 CECD CCOc1ccc(N2CCN(C[C@@H](C)OC)CC2)cc1 1116533558 BUACLFCZHUGADN-CQSZACIVSA-N 278.396 2.242 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)CC[C@H]1N 1118241674 KBEZQXQIVTVVFD-WMLDXEAASA-N 273.424 2.456 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2c(O)cccc2F)C1 886541698 ZYGLEYJXIWUCLH-GHMZBOCLSA-N 280.343 2.193 10 20 CECD Cc1cc(Cn2cc(C3(O)CCC3)nn2)ccc1N(C)C 881377513 OQUBAJCCUXAWLI-UHFFFAOYSA-N 286.379 2.072 10 20 CECD O=C(CCC1CCC1)OCC(=O)c1ccc(O)c(O)c1 784000553 WGEKSSGDOBAIOV-UHFFFAOYSA-N 278.304 2.404 10 20 CECD O=C(NCc1cccc(O)c1O)C(F)=C1CCC1 1123887918 FWAALOKQFPBTBV-UHFFFAOYSA-N 251.257 2.122 10 20 CECD COC[C@H](NCc1ccc(OC)c(OC)c1O)C(C)C 892966128 QWDBLFWMIQYFSE-LBPRGKRZSA-N 283.368 2.170 10 20 CECD CCOC(=O)C1(CNCc2cc(C)cc(OC)c2O)CC1 894478645 BCNUJINTXIOQEV-UHFFFAOYSA-N 293.363 2.142 10 20 CECD COc1ccc(CNC(=O)Nc2nc(C)cs2)c(O)c1 794761935 LOKQELMPZNXLDH-UHFFFAOYSA-N 293.348 2.487 10 20 CECD COc1ccc(O)c(CN2CCCN3CCC[C@@H]3C2)c1 134199654 MTPZZSPEYINCCM-CQSZACIVSA-N 276.380 2.071 10 20 CECD COc1ccc(CNCC2(C)CCOCC2)c(O)c1OC 1333738224 BIDDYFWPKIBVHL-UHFFFAOYSA-N 295.379 2.316 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCC[C@H]2OC)c1 1338905043 OEMWICYSCFDDOH-JVLSTEMRSA-N 293.363 2.393 10 20 CECD CCOCC(C)(C)CNC(=O)NCc1ccc(N)cc1 1353406697 QWFJXYPKSGQWRV-UHFFFAOYSA-N 279.384 2.131 10 20 CECD N[C@H]1C[C@@H]1C1CCN(Cc2cc(F)c(F)cc2O)CC1 1574268872 JKQWRYDZTMANOH-RISCZKNCSA-N 282.334 2.230 10 20 CECD N[C@@H]1CCC[C@H]2CN(Cc3cc(F)c(F)cc3O)C[C@H]12 1580177497 PJDNSELZRHIIMC-NURSFMCSSA-N 282.334 2.230 10 20 CECD C[C@H](N[C@@H]1COC2(CCC2)C1)c1cc(C(=O)O)ccc1O 1593230785 FZMCIBYGUPCTRR-JQWIXIFHSA-N 291.347 2.453 10 20 CECD CC(C)(C)c1cnc(SCc2nc(N)nc(N)n2)s1 164136151 WDHFBZUDZCIRDE-UHFFFAOYSA-N 296.425 2.082 10 20 CECD CCOC(=O)c1coc(N(C)Cc2ccccc2O)n1 842033659 ATNWOPXLLKOQNE-UHFFFAOYSA-N 276.292 2.193 10 20 CECD COc1cc(Cl)cc(CN2CCC(CN)CC2)c1O 229102551 PHXDJRFWEDSKQP-UHFFFAOYSA-N 284.787 2.225 10 20 CECD COC[C@H](CCO)N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 230663304 PTGGMHIRDFUQMJ-FRRDWIJNSA-N 279.380 2.236 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)CN2CCOCC2)c1 36933342 DVJPPXAUASXYHM-KBPBESRZSA-N 278.396 2.072 10 20 CECD CN(C)C1(CNCc2c(O)cccc2Br)CC1 706881111 NOCGGHPSTQYYTH-UHFFFAOYSA-N 299.212 2.339 10 20 CECD OCC[C@@H](NCc1ccc2c(c1)CCCO2)C(F)(F)F 922345503 RCSYVIBUNTUFNE-CYBMUJFWSA-N 289.297 2.415 10 20 CECD Cc1ccc(C(=O)N(C)CCc2ccccn2)c(O)c1O 179478190 ULYJHOUGXGFVGY-UHFFFAOYSA-N 286.331 2.116 10 20 CECD Cc1ccn(-c2ccc(N(C)Cc3ccccc3O)nn2)n1 302675475 UEXMPXKXAUXZMQ-UHFFFAOYSA-N 295.346 2.313 10 20 CECD CO[C@@H](C)CCC(=O)NCc1ccc(N(C)C)c(F)c1 181257855 GLIGNFVMLIZNTA-NSHDSACASA-N 282.359 2.323 10 20 CECD COc1cccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)c1 180592335 IIKJGEICLKIHMW-SOFGYWHQSA-N 299.326 2.436 10 20 CECD NC[C@@H]1CCCN(Cc2cc(Br)ccc2O)C1 219712734 IQLCNRHJGXVSBB-JTQLQIEISA-N 299.212 2.325 10 20 CECD CCCCOCCNCc1ccc(N2CCOCC2)cc1 40506629 RZTURTXEDQEWMR-UHFFFAOYSA-N 292.423 2.430 10 20 CECD C[C@H]1C[C@@H]1CNC(=O)NCc1ccc(N(C)C)cc1 48141303 IHKRITFLXQGLRY-WCQYABFASA-N 261.369 2.208 10 20 CECD C[C@@H](NCCCc1cnn(C)c1)c1ccccc1O 179885056 VPTBCHOUTHXVDG-GFCCVEGCSA-N 259.353 2.409 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@@H](O)C(F)(F)F 183923130 UKBQFGYXNWSQCC-GFCCVEGCSA-N 276.302 2.108 10 20 CECD CSC[C@](C)(O)CNCc1cc(C)c(C)cc1O 266168142 QCUSGXOKOLPNNU-CQSZACIVSA-N 269.410 2.213 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H]3CCN(C)C[C@@H]32)c1 272261104 ARCLJNKWMYBRKH-ZFWWWQNUSA-N 260.381 2.227 10 20 CECD CN(C)c1ccc(CNC(=O)C2SCCS2)cc1 270425376 DZGQHXIYCSMKLX-UHFFFAOYSA-N 282.434 2.175 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@@H]2[C@H]2CCCC2=O)c1 372756986 ICHRQMRYFAFHJI-HUUCEWRRSA-N 289.375 2.271 10 20 CECD CCCOc1ccc(CN(C)[C@H](C)C(=O)OC)c(O)c1 280748202 DPOCVMUBOCGEFX-LLVKDONJSA-N 281.352 2.174 10 20 CECD COC1(CCNC(=O)/C=C/c2ccc(O)c(O)c2)CCC1 293769426 ADRLOHIJZVZCIB-GQCTYLIASA-N 291.347 2.186 10 20 CECD COc1cc(O)c(CN[C@@H](CO)C2CCCC2)cc1OC 291010241 WTQOFIFUVFWOEL-ZDUSSCGKSA-N 295.379 2.050 10 20 CECD CCC[C@@](C)(O)C(=O)N1CCOc2cc(N(C)C)ccc21 569246663 KBNOWBDPQIMCCA-MRXNPFEDSA-N 292.379 2.029 10 20 CECD CC1(C)CN(Cc2c(O)cccc2Cl)C[C@@H](CO)O1 817413147 UTVDXHXAEJKVQW-JTQLQIEISA-N 285.771 2.017 10 20 CECD CC[C@@H](NCC1(CC(N)=O)CC1)c1ccccc1O 817410867 IXXRLGHPKRAYJZ-GFCCVEGCSA-N 262.353 2.089 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCCC[C@H]2O)cc1OC 825061564 IBGHHSOHPCGRFC-WCQYABFASA-N 295.379 2.050 10 20 CECD CCOc1ccc(CN2CC[C@@H](CCCO)C2)c(O)c1 825338666 SWDSQVAALZTBQJ-CYBMUJFWSA-N 279.380 2.385 10 20 CECD COc1ccc(CN[C@H](C)[C@H](C)C(=O)O)cc1C 901446265 SOKMWTMWWJQQQL-WDEREUQCSA-N 251.326 2.202 10 20 CECD COc1cccc(CNC(=O)C2CC3(CC3)C2)c1O 830540484 KVTPEZFVOXMWQF-UHFFFAOYSA-N 261.321 2.207 10 20 CECD CC(C)[C@@H](CO)[C@H](NC(=O)c1cc(O)cs1)C(C)C 834044665 NMWCPMQOUIHDIF-DGCLKSJQSA-N 285.409 2.473 10 20 CECD O=C1CCCCC[C@@H](C(=O)NCc2ccc(O)cc2O)C1 910945419 VQZMMVOWQUIZMN-LLVKDONJSA-N 291.347 2.254 10 20 CECD CCc1cccc(CN2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)c1O 848905803 OKRVOMPNYNQXHA-CFVMTHIKSA-N 288.391 2.040 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)NCc1cocn1 740914527 DOFKHASSDDNOBN-UHFFFAOYSA-N 298.346 2.050 10 20 CECD COC[C@@H](NCc1ccc(N(C)C)cc1C)[C@H]1CCCO1 840941110 SGSJJXWAQBBFKT-IAGOWNOFSA-N 292.423 2.345 10 20 CECD CC(=O)c1cc(F)cc(CN(C2CC2)[C@@H](C)C(=O)O)c1O 842471172 LZZTXKPIWNERIY-QMMMGPOBSA-N 295.310 2.171 10 20 CECD CCOc1ccc(CN2CC[C@H](N)[C@@H](CC)C2)c(O)c1 843053876 VRRZMOWPNWPWHX-WFASDCNBSA-N 278.396 2.350 10 20 CECD C[C@H]1OCC[C@@H]1c1nc(Cc2ccc(N)cc2)no1 843159179 MAUCRHJDINIUNS-SKDRFNHKSA-N 259.309 2.135 10 20 CECD COC[C@@H](CN[C@@H](C)c1ccc(Cl)cc1O)OC 841754999 XHTWKQXWUULLOT-GXSJLCMTSA-N 273.760 2.358 10 20 CECD CON1CCC(NCc2cc(F)c(N(C)C)cc2F)CC1 858180400 TZURGLHFFNWKMJ-UHFFFAOYSA-N 299.365 2.146 10 20 CECD Cc1cc(CN[C@H]2C[C@@H](N)C2(C)C)ccc1N(C)C 923423618 YBCHCOISJFJVRY-CABCVRRESA-N 261.413 2.276 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1CO 857061203 LXPZOBDMRFAHNT-JSGCOSHPSA-N 280.387 2.342 10 20 CECD CCOc1ccc(O)c(CN[C@H]2C[C@H](OC)C2)c1 858322552 ZYQDGTSDZQTHRQ-AULYBMBSSA-N 251.326 2.058 10 20 CECD COCc1nc(C)c(C(=O)NCc2ccccc2O)s1 759607631 FPKZJYSJBCYECV-UHFFFAOYSA-N 292.360 2.234 10 20 CECD C[C@H](N[C@H](C)C(=O)N(C)C)c1cc2c(cc1O)CCCC2 756738233 DQISIRQHNGWMGA-NWDGAFQWSA-N 290.407 2.398 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2[C@H]3Cc4ccccc4[C@@H]32)cc1 859593093 AKOOQKVSVDHKBJ-YESZJQIVSA-N 278.355 2.471 10 20 CECD COc1cccnc1C(=O)N(C)Cc1ccc(N(C)C)cc1 864634199 OOGQSLCSHRZAHI-UHFFFAOYSA-N 299.374 2.428 10 20 CECD CCOCC1(C(=O)NCc2cc(C)ccc2O)CC1 862755897 MUAKGMHYXUHALP-UHFFFAOYSA-N 263.337 2.134 10 20 CECD CCCC[C@H](OC(=O)c1ccc(C)c(O)c1O)C(=O)OC 762806053 GTCZACVCUPWLJP-NSHDSACASA-N 296.319 2.295 10 20 CECD COc1ccc(CNC(=O)NCCC(C)(C)OC)c(O)c1 868995075 YVZKEOFRABODML-UHFFFAOYSA-N 296.367 2.015 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCN(C2CC2)C1 766030740 WYOLXCACJCDZOF-OAHLLOKOSA-N 273.424 2.387 10 20 CECD O=C1NCCC12CCN(Cc1c(O)cccc1Cl)CC2 877783143 GBFZXQONVAKFBO-UHFFFAOYSA-N 294.782 2.148 10 20 CECD CCCOc1ccc(CNC[C@H]2CNC(=O)C2)cc1C 873131708 XOPIAAWWESFPBD-AWEZNQCLSA-N 276.380 2.010 10 20 CECD COC(=O)c1cnc(SCOC(=O)C2CCC2)s1 882174664 VNVANQDRQIAVHL-UHFFFAOYSA-N 287.362 2.323 10 20 CECD CCOc1ccc([C@@H]2NC(=O)[C@@H]3C[C@H](C)CCN32)c(O)c1 777899200 KGNFTWNYQWFBIC-RIEGTJTDSA-N 290.363 2.020 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CO[C@H](C)C2)c1 784441407 FUXJKQBZSWNRJR-VWYCJHECSA-N 279.336 2.003 10 20 CECD C[C@H]1C[C@H](NCc2ccc(Br)cc2O)CO1 691429781 WZHFSORFJMUUOS-KWQFWETISA-N 286.169 2.422 10 20 CECD COc1ccc(CN[C@H]2CCO[C@H](C)C2)c(O)c1OC 893219444 GYFPUSPFDZIJEW-PWSUYJOCSA-N 281.352 2.067 10 20 CECD CCOC1CCN(Cc2cccc(OC)c2O)CC1 132470429 RITJTYPVGXPLQN-UHFFFAOYSA-N 265.353 2.402 10 20 CECD COC[C@]1(C)CCN(Cc2ccc(OC)c(OC)c2O)C1 894673037 XWBLXUOWBXRQIT-MRXNPFEDSA-N 295.379 2.268 10 20 CECD CO[C@H]1Cc2ccc(NC(=O)c3cccc(O)c3O)cc2C1 790927115 DCHVMKUUVIQWSO-ZDUSSCGKSA-N 299.326 2.464 10 20 CECD Cc1ccc(C(=O)OC[C@@H]2CCC[C@H](O)C2)c(O)c1O 795375067 UBBRIPWTXYBTNV-MNOVXSKESA-N 280.320 2.114 10 20 CECD CCCN(Cc1ccccc1O)[C@@H](C)C(=O)N(C)C 76073961 SVOVDMBZBNUGOV-LBPRGKRZSA-N 264.369 2.081 10 20 CECD C[C@H](N[C@H](C)c1cc(F)ccc1O)C1(CO)CC1 829208207 GYGCUPPLXLMMQJ-ZJUUUORDSA-N 253.317 2.343 10 20 CECD Nc1ccoc1C(=O)NCCCSc1nccs1 1325744271 SMGUXUMNHMKZNC-UHFFFAOYSA-N 283.378 2.231 10 20 CECD C[C@H]1COCCN1Cc1c(O)cccc1Br 707133947 FFBHWKVYWQSGCA-VIFPVBQESA-N 286.169 2.375 10 20 CECD CCCOCC(=O)Nc1c(Cl)ccc2nonc12 1324141901 QCCSWYUSBRTOSN-UHFFFAOYSA-N 269.688 2.241 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](N)CCSC 1341509627 ANTQDSYMBNYEAV-CYBMUJFWSA-N 296.436 2.211 10 20 CECD CN1CCCc2cc(CNC(=O)N3CC(F)(F)C3)ccc21 1347327659 RTDOZDFFSOPOOQ-UHFFFAOYSA-N 295.333 2.230 10 20 CECD Cc1ccc(CN[C@@H](CC2CCOCC2)C(=O)O)c(O)c1 1600419957 SVBDLVNCFWTTSF-AWEZNQCLSA-N 293.363 2.060 10 20 CECD CC[C@@H](NC[C@@H](C)C(=O)O)c1ccc(C)cc1O 1603585367 AOAOOFSKGGHCKP-ZYHUDNBSSA-N 251.326 2.462 10 20 CECD CO[C@@H]1CCN(Cc2cc(C)c(C)cc2O)[C@H](C(=O)O)C1 1610237947 QWMZEHBDPHYWKV-KGLIPLIRSA-N 293.363 2.073 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C)C[C@@H]2C(=O)O)c1 1610042947 MAJWTTFRVPFGSE-BXUZGUMPSA-N 293.363 2.476 10 20 CECD COc1ccc(CN[C@@H]2[C@H](C)CCN[C@@H]2C)cc1C 1579216533 ZBBYDNURADNJRI-AXAPSJFSSA-N 262.397 2.480 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H](C(=O)O)C(C)C)c1O 1589268536 TUGAWUNNADZRPG-LBPRGKRZSA-N 299.754 2.447 10 20 CECD CCN(CCC(=O)O)Cc1cc(OC)c(C)cc1O 1596314748 IVMNIVMUENPLSY-UHFFFAOYSA-N 267.325 2.006 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3C[C@H](C(=O)O)[C@@H](C3)C2)cc1 1777039346 FHUMSMMOVQCFJI-DZKIICNBSA-N 288.391 2.295 10 20 CECD CC(C)CO[C@H](C)C(=O)N(C)Cc1ccccc1O 920805730 NBJCYVUCENRNNC-GFCCVEGCSA-N 265.353 2.412 10 20 CECD CN1CCC[C@@H]2CN(C(=O)Nc3ccc(N)cc3)CC[C@@H]21 166707818 SHQWCRYRQKEMHE-DOMZBBRYSA-N 288.395 2.217 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1 258668337 FIYJMESILUFERO-OAHLLOKOSA-N 262.397 2.345 10 20 CECD COc1ccc(O)c(CN(C)C(C)(C)CC(=O)O)c1 1599598437 MJCFMIRJHDAMFP-UHFFFAOYSA-N 267.325 2.086 10 20 CECD CC(C)N(C)CCCNCc1ccc2c(c1)CCO2 226180762 UJJMWMSLLBNUJO-UHFFFAOYSA-N 262.397 2.441 10 20 CECD CCCNC(=O)CN(CCC)Cc1ccc(N)cc1 35364838 ZYFITJJLJAIONQ-UHFFFAOYSA-N 263.385 2.007 10 20 CECD CCOC(=O)[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 49368145 WDZZJJUFHLWWDS-VHSXEESVSA-N 267.325 2.003 10 20 CECD Cn1nncc1CNCc1cc(Cl)cc(Cl)c1O 288385402 GKQUNZJKCMLBOW-UHFFFAOYSA-N 287.150 2.117 10 20 CECD OCCCSCCN[C@H]1CCc2cccc(O)c21 297719271 NCOJFRLBEXSRTC-LBPRGKRZSA-N 267.394 2.085 10 20 CECD CN(Cc1ccccc1O)C(=O)CC(C)(C)CC(=O)O 61827079 CFJQFBWITIGPLB-UHFFFAOYSA-N 279.336 2.242 10 20 CECD COCCn1cc(NCc2cc(F)cc(F)c2O)cn1 708479978 CGESXCRLUCVZOG-UHFFFAOYSA-N 283.278 2.125 10 20 CECD CCc1cccc(CN[C@H](C)CN2CCCC2=O)c1O 691446971 OLCBIUHYUUZEGJ-GFCCVEGCSA-N 276.380 2.055 10 20 CECD CS[C@@H]1CC[C@@H](NC(=O)Cc2ccc(N)cc2)C1 226374482 XWTPMLYYTZAMBB-CHWSQXEVSA-N 264.394 2.212 10 20 CECD COc1ccc(O)c(CNC(=O)c2n[nH]c3ccccc23)c1 114540596 BIPWJCZGUZTWKI-UHFFFAOYSA-N 297.314 2.207 10 20 CECD CCOc1cccc(CN[C@@H](CC)CCO)c1O 134986450 BFVOURQGHWAGOF-LBPRGKRZSA-N 253.342 2.042 10 20 CECD Cc1ccc(C(=O)N(C)C[C@H]2CCCC[C@@H]2O)c(O)c1O 183004937 XCZYSHINIRNKFF-YPMHNXCESA-N 293.363 2.029 10 20 CECD Oc1cc2c(cc1CNC[C@@H]1CCCS1)OCO2 122016047 YLVBXSGXKZYACH-JTQLQIEISA-N 267.350 2.106 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccc(F)nc2)c1 124976209 GQEDLEHTVXXNBV-UHFFFAOYSA-N 291.282 2.257 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H]3OCCC[C@@H]3C1)OCO2 129050712 UIPHSDPSGPAAGP-RISCZKNCSA-N 291.347 2.122 10 20 CECD COC(=O)[C@@H](NCc1cccc(OC)c1O)C(C)(C)C 136868873 BBVDAQOBBPDOJI-CYBMUJFWSA-N 281.352 2.078 10 20 CECD CC[C@@]1(CO)CCCN1Cc1cc(F)ccc1O 191010058 KMLRZAUGXSIUTL-AWEZNQCLSA-N 253.317 2.268 10 20 CECD O=C(O)[C@H]1CCCCN1Cc1cc(Cl)ccc1O 86729177 FGVFVOJQJVJJSZ-LLVKDONJSA-N 269.728 2.485 10 20 CECD Oc1c(Br)cccc1CNCCn1ccnc1 42412613 JYMUOQRZWHQQCD-UHFFFAOYSA-N 296.168 2.141 10 20 CECD CN(C)c1ccc(CN2CCC[C@@](C)(CO)C2)cc1 93340394 OJQIMRIUAHHEGL-MRXNPFEDSA-N 262.397 2.347 10 20 CECD OC[C@H]1CCCN1Cc1cccc(Br)c1O 92470927 LWIMATAGOTXNBD-SNVBAGLBSA-N 286.169 2.111 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H](N(C)C)C2)c1 92938768 UMLDEABKXWGIAP-CQSZACIVSA-N 278.396 2.317 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1C[C@H]2CC[C@H]1NC2 530245823 FMNHHHQROAYWIK-WQAKAFBOSA-N 266.772 2.276 10 20 CECD C[C@@H]1Oc2ccccc2[C@H]1NC(=O)c1cccc(O)c1O 365677455 OMSCJFPKLBGOAP-XPTSAGLGSA-N 285.299 2.350 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1CCCCS1 274934293 OGICWSMSORNFQF-YGRLFVJLSA-N 295.404 2.431 10 20 CECD COC(=O)[C@]1(F)CCN(Cc2c(O)cccc2Cl)C1 271195886 HKPXJEPOXSWXMA-ZDUSSCGKSA-N 287.718 2.133 10 20 CECD CCOc1cccc(CN(C)C[C@H]2CCC[C@H]2O)c1O 271265886 LWXZFXDKTSYYTR-TZMCWYRMSA-N 279.380 2.384 10 20 CECD COc1ccc(O)c(CN(CC2CCC2)[C@@H](C)CO)c1 289537140 QFEMIWNYVAKSSL-LBPRGKRZSA-N 279.380 2.384 10 20 CECD Cc1cccc(CN2C[C@@H](C)O[C@@]3(CCOC3)C2)c1O 280137709 CTLVFXDTCDKNQV-CJNGLKHVSA-N 277.364 2.080 10 20 CECD Cc1ccc([C@H](C)NCC(=O)NCC(F)F)c(O)c1C 280427598 BOJHVLDBPJKCGK-JTQLQIEISA-N 286.322 2.041 10 20 CECD CC[C@H](N[C@H](C)c1nncn1C)c1ccc(F)cc1O 286375912 ZUMJPFQEUZUFHG-SKDRFNHKSA-N 278.331 2.462 10 20 CECD C[C@@H](CC(C)(C)O)NCc1ccc(N2CCOCC2)cc1 385222368 RUIUDOSRHWSCGL-AWEZNQCLSA-N 292.423 2.162 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2ccc(N(C)C)c(C)c2)C1 292718423 FRRIWLKMRPFLQU-KRWDZBQOSA-N 290.407 2.446 10 20 CECD CN(Cc1ccccc1O)c1nnc(C2CCC2)n1C 809838590 DCHZHVRXFNYBHV-UHFFFAOYSA-N 272.352 2.425 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCC[C@@H](C(=O)O)C1 386498829 PUKSGFDTCIFEJK-VXGBXAGGSA-N 291.347 2.242 10 20 CECD CC[C@H](N[C@@H](C)CC(N)=O)c1cccc(Cl)c1O 806143753 OSPOTDMEKGAECI-KWQFWETISA-N 270.760 2.350 10 20 CECD Cc1cc(C(=O)N(C)CCO)c(C)n1-c1ccc(F)cc1 298418947 FWPHHOYIGLCRNH-UHFFFAOYSA-N 290.338 2.298 10 20 CECD COCCN(CCN(C)C)Cc1cc(Cl)ccc1O 809740850 KJRFFLSHNVATBF-UHFFFAOYSA-N 286.803 2.056 10 20 CECD CCN1C[C@H](NCc2ccc(N(CC)CC)cc2)CC1=O 391475148 OAYJOYJAGWTNIC-OAHLLOKOSA-N 289.423 2.243 10 20 CECD CC[C@H](N)CN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 817980723 WQAGZPJWMHTIJS-JSGCOSHPSA-N 295.402 2.050 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2C[C@H](F)CN2)c(O)c1C 817976341 KEHHSEADPURNJG-AGIUHOORSA-N 266.360 2.360 10 20 CECD C[C@H](N[C@@H]1CCNC1)c1cc(Br)ccc1O 817945027 RPVJAUBGMIGLKJ-WCBMZHEXSA-N 285.185 2.167 10 20 CECD Nc1ccc(CCNC(=O)[C@H](N)CC2CCCCC2)cc1 818545132 KIWUTUGGTRYBOQ-MRXNPFEDSA-N 289.423 2.225 10 20 CECD COc1ccc(CNCc2ccc(CC(N)=O)cc2)cc1C 727470400 AIHIRZIITNEVNW-UHFFFAOYSA-N 298.386 2.321 10 20 CECD CN(C[C@](C)(O)c1ccccc1)C(=O)c1cc(O)cs1 822438883 YJWFEZSMLPXVIK-HNNXBMFYSA-N 291.372 2.433 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@](F)(C(=O)O)C1 901513723 BRZALSBZOSMZOC-HNNXBMFYSA-N 280.343 2.060 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)C(C)(C)C 830541059 GTHKDJWQPDBRIG-UHFFFAOYSA-N 291.439 2.441 10 20 CECD COc1ccc(CNC(=O)c2cc(O)cs2)cc1 731863813 DPQJYVRGWUHDQA-UHFFFAOYSA-N 263.318 2.392 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NC1CC1 840237295 FAYPNTMIZUQIBD-LBPRGKRZSA-N 275.396 2.454 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H](N)[C@H](C)C2)cc1 843120510 NWTVLVFXDWKUGD-CZUORRHYSA-N 261.413 2.312 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3[C@H](C2)C3(F)F)c1 846113544 YMNGKXXDSVGFOS-TXEJJXNPSA-N 269.291 2.488 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)N1CCCC1 914460141 UJKNLHYHEKYMQG-UHFFFAOYSA-N 261.369 2.400 10 20 CECD C[C@@H]1C[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](C)O1 840514061 CVRMMAIQCXPMNX-ZAXHWZIBSA-N 291.347 2.041 10 20 CECD CC1(C)CNCC[C@@H]1NCc1cccc(F)c1O 841073428 TXFMYUQBZYBTEG-LBPRGKRZSA-N 252.333 2.009 10 20 CECD COc1cccc(CNC[C@@H]2NCCc3ccccc32)c1O 841069043 LNUUFCMFJCZPGY-INIZCTEOSA-N 298.386 2.377 10 20 CECD COC/C(C)=C/C(=O)N[C@@H](C)c1cc(OC)ccc1O 845834630 VLFAUNXNIRUWED-HUYFXPKMSA-N 279.336 2.171 10 20 CECD CCCCOCCOCCNC(=O)Nc1ccc(N)cc1 841298748 DCCMLFAXVMZQRV-UHFFFAOYSA-N 295.383 2.224 10 20 CECD C[C@H](NC[C@H](C1CC1)N(C)C)c1cc([N+](=O)[O-])ccc1O 756433059 MPFCBLQYSDOFAQ-IINYFYTJSA-N 293.367 2.291 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1nccs1 683623967 VNWAZIHTZPWNTG-UHFFFAOYSA-N 289.360 2.248 10 20 CECD CN(C)c1cc(F)c(CNC[C@@H](C2CC2)N(C)C)cc1F 858101071 YDBXLVXQPLAKGW-INIZCTEOSA-N 297.393 2.461 10 20 CECD O=C(NCc1cccc(Br)c1O)c1cnco1 765731287 ZSSCPVHGZQTVLH-UHFFFAOYSA-N 297.108 2.073 10 20 CECD O=C(CCCCO)NCc1ccc(N2CCCCC2)cc1 865031942 WHDMMJBWPSNVSN-UHFFFAOYSA-N 290.407 2.456 10 20 CECD Cc1ccc(CN[C@H]2C[C@@H](C)N(C3CC3)C2)c(O)c1 877095510 ZXBOYBBPAKJSCX-OCCSQVGLSA-N 260.381 2.415 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CN(C2CC2)C[C@H]1C 877094189 IAGQRVDSDZSGDE-IUODEOHRSA-N 260.381 2.273 10 20 CECD Cc1cc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)ncn1 775407395 UBMYYSBBJQVGCS-LBPRGKRZSA-N 284.363 2.342 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2C[C@@H](C)[C@@H](C)C2)c1O 774904283 GBWMWDRGOFEXPN-AOOOYVTPSA-N 280.324 2.397 10 20 CECD CC(C)[C@](C)(O)C(=O)NCc1c(O)ccc2c1CCCC2 771418909 TVTYJCZSKWANSD-KRWDZBQOSA-N 291.391 2.294 10 20 CECD CCCOCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773015446 OKCAQZQAOSWEFH-GFCCVEGCSA-N 264.369 2.356 10 20 CECD Cc1[nH]nc(NC(=O)/C=C\c2ccc(O)c(O)c2)c1C 779514689 QAHFOOAATCHUGG-XQRVVYSFSA-N 273.292 2.090 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1Cc2ccccc21 778926651 WIWHQJLVIIMDRY-ZDUSSCGKSA-N 269.300 2.054 10 20 CECD CNC(=O)c1cccc(NCc2c(O)cccc2OC)c1 770409351 BAKOVTRRQQUNPW-UHFFFAOYSA-N 286.331 2.373 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1CC(F)(F)C1 1123505961 UDTGHVPQDRFYDT-UHFFFAOYSA-N 283.322 2.222 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCC(C)(C)O)c1 787445296 KRPIHVQMFWKLKD-SNVBAGLBSA-N 281.352 2.129 10 20 CECD Cc1coc(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)c1 884011167 VQPUCIVEDQUYAY-AWEZNQCLSA-N 287.363 2.084 10 20 CECD CC[C@H](N[C@H](C)C(=O)N(C)C)c1ccc(F)cc1O 796827157 QDSDKYYMXKHBQV-SKDRFNHKSA-N 268.332 2.049 10 20 CECD COc1ccc(CNCCNC(=O)C2(C)CCC2)cc1C 1132455084 RFECTRDMPAHMEI-UHFFFAOYSA-N 290.407 2.400 10 20 CECD COc1ccc(CNC(=O)c2cc(Cl)ccn2)c(O)c1 794381106 JGQDPMFJYQYUOP-UHFFFAOYSA-N 292.722 2.379 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CO)C(C)C)c1 92392624 KAHIZZJDQHESCO-GXFFZTMASA-N 253.342 2.068 10 20 CECD C[C@H](O)CCCNCc1ccc(Br)cc1O 701013147 BJDCYMRJWSUCDA-VIFPVBQESA-N 288.185 2.405 10 20 CECD C[C@H](N[C@@H](C)c1cc(F)ccc1O)c1ncn(C)n1 275774203 VFFSEGNROMTZHP-IUCAKERBSA-N 264.304 2.072 10 20 CECD C[C@H](CO)CCCNCc1cc(F)cc(F)c1O 708455528 WEHIPSNNTXDYSL-VIFPVBQESA-N 259.296 2.169 10 20 CECD CO[C@@H]1CC[C@H](NC(=O)NCc2cc(Cl)ccc2O)C1 1329778308 FNKRJZPOJVJRPY-NWDGAFQWSA-N 298.770 2.412 10 20 CECD O=C(O)CC1CC(NCCCSc2nccs2)C1 1601946135 CGVOYLBSVYOHKL-UHFFFAOYSA-N 286.422 2.468 10 20 CECD C[C@H](NCc1cccnc1F)c1cc(C(=O)O)ccc1O 1593304392 MIFIAYFQZBVXRO-VIFPVBQESA-N 290.294 2.475 10 20 CECD CN(Cc1cc(C(=O)O)n(C)c1)Cc1ccccc1O 1598506503 DBAMASMCCQFGAO-UHFFFAOYSA-N 274.320 2.061 10 20 CECD COc1ccc(N2CCN(CC3(O)CCCC3)CC2)cc1 19727565 PFTXEOOUTTWHCD-UHFFFAOYSA-N 290.407 2.122 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(F)cc(F)c1 159005162 VSDGMPVPHVHCTL-UHFFFAOYSA-N 279.242 2.306 10 20 CECD COc1ccc(CN[C@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(O)c1 159469486 WYIZEZQXRSZDFZ-BPUTZDHNSA-N 289.375 2.448 10 20 CECD CN(C)c1ccc(CN2CCSC[C@H](C(=O)O)C2)cc1 901890385 IDTINYVLPNWNQD-CYBMUJFWSA-N 294.420 2.002 10 20 CECD CC1(C)C[C@@H](CNC(=O)c2cccc(O)c2O)CCO1 837221081 ODQDYZBSNVVLBY-JTQLQIEISA-N 279.336 2.033 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](CCO)C(C)C)c1 230664184 NLTIHQNIFIVZBM-FZMZJTMJSA-N 267.369 2.458 10 20 CECD O=S(=O)(NCc1ccccc1O)c1cc(F)ccc1F 158582752 BLPHFYDIUVISAR-UHFFFAOYSA-N 299.298 2.149 10 20 CECD CN(Cc1cc(F)cc(F)c1O)C[C@@H]1CCOC1 708423325 RYIORTGUDJSZLG-VIFPVBQESA-N 257.280 2.139 10 20 CECD COc1ccc(O)c(CNCc2nn(C)cc2Cl)c1 393324313 VHHRMMFRNPYOGW-UHFFFAOYSA-N 281.743 2.078 10 20 CECD OC[C@H]1C[C@H](NCc2c(O)cccc2Br)C1 923005146 JUQOPXLZBQUTPO-KYZUINATSA-N 286.169 2.015 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1ccc(N(C)C)cc1 179886912 SYGFQBHQVINKRO-OAHLLOKOSA-N 276.380 2.280 10 20 CECD Cc1cc(C(=O)N(C)CCO)c(C)n1-c1ccc(C#N)cc1 305724997 XLKBRRBMRBSLLT-UHFFFAOYSA-N 297.358 2.030 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccoc1 183446162 RVYALEZQNWQHEH-VIFPVBQESA-N 261.277 2.052 10 20 CECD COCCC1(C(=O)NCc2ccc(N(C)C)cc2)CC1 122739176 LNXLNYZRCGAUTD-UHFFFAOYSA-N 276.380 2.186 10 20 CECD COc1ccc(N(C)Cc2nnc(C)o2)cc1F 121842921 SAZQLOKFLNEEBE-UHFFFAOYSA-N 251.261 2.162 10 20 CECD CS[C@@H](C)CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186381980 MDSXCULLDNMOSP-UWVGGRQHSA-N 283.393 2.287 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCC[C@H](N(C)C)C2)c(O)c1O 182563134 RAFQAVPHDPFSKE-NEPJUHHUSA-N 292.379 2.009 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](CN(C)C)C2)c1O 79435158 LUIZXYUNMCOJOV-GFCCVEGCSA-N 294.370 2.117 10 20 CECD CC(C)C[C@H](CN)CC(=O)NCc1ccc(N(C)C)cc1 88277971 XEOCHZNODDEIDH-HNNXBMFYSA-N 291.439 2.380 10 20 CECD C[C@H](NCc1ccccc1O)C(=O)OC(C)(C)C 134614041 QYPDZHJONLEPPN-JTQLQIEISA-N 251.326 2.212 10 20 CECD CCCOc1ccc(CNC[C@@H](C)OC)c(O)c1 191138995 PEBWLGQHBHFZGO-LLVKDONJSA-N 253.342 2.306 10 20 CECD CN(C)c1ccc(CNC(=O)NC2CCSCC2)cc1 195152045 ZKBPBHSCEFJOQF-UHFFFAOYSA-N 293.436 2.447 10 20 CECD CC[C@H](C(=O)NCCc1ccc(N)cc1)N(CC)CC 269154470 ZWJJLWWAJRASJW-OAHLLOKOSA-N 277.412 2.048 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]2C[C@@H](C)O)c1 271782149 HVFRBLXQJKIEGN-YPMHNXCESA-N 265.353 2.136 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC(C)(C)N(C)C)c1 273362374 DCYBGGDNTSYQGR-NSHDSACASA-N 294.395 2.170 10 20 CECD COC(=O)[C@@H]1CN(Cc2cc(C)c(C)cc2O)C[C@H]1C 280281391 NKURAHOGBBGBRY-TZMCWYRMSA-N 277.364 2.250 10 20 CECD CC[C@@H](N[C@@H](C)CN1CCOCC1)c1ccc(F)cc1O 285683217 OAVBIOCDYLPFAX-SWLSCSKDSA-N 296.386 2.293 10 20 CECD Cc1cc(C(=O)NCCF)c(C)n1-c1ccccn1 281711858 IWKONYQXJMJRIZ-UHFFFAOYSA-N 261.300 2.188 10 20 CECD C[C@H](NC[C@H](CO)[C@H]1CCOC1)c1ccc(N(C)C)cc1 280912523 QMTOJYQPHBVYFE-CWRNSKLLSA-N 292.423 2.048 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@]2(CCOC2)O1 280254016 LIZAENSJEZJFJV-WMLDXEAASA-N 290.407 2.132 10 20 CECD CC(=O)C(=O)COC(=O)/C=C\c1nc2ccccc2s1 808489778 DMJJCSRXRGEZOA-SREVYHEPSA-N 289.312 2.011 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@H](O)C1CC1 809739595 PCKVETCTYDDRMK-LLVKDONJSA-N 259.708 2.045 10 20 CECD CN(C)C(=O)C1(NCc2ccccc2O)CCCCC1 294976374 JLBATEXHJFRJFO-UHFFFAOYSA-N 276.380 2.273 10 20 CECD COC[C@H](N[C@@H]1CCc2cccc(O)c21)[C@H]1CCCO1 296591188 WVTQBFHEPPNXDO-VNHYZAJKSA-N 277.364 2.163 10 20 CECD Oc1cccc(Cl)c1CN1CCn2cncc2C1 291702647 ZEGUNRQEEPGIDR-UHFFFAOYSA-N 263.728 2.258 10 20 CECD Cc1nc([C@H](C)OC(=O)c2cc(O)cs2)no1 811120374 NTVUNZXYVKOKSO-YFKPBYRVSA-N 254.267 2.063 10 20 CECD CC[C@@H](NCc1c(O)ccc(Cl)c1F)[C@H](C)O 824921447 LYIQJHCCTGADPP-OIBJUYFYSA-N 261.724 2.434 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CC1(O)CCC1 822809374 UCIHJDBUOAHSGN-UHFFFAOYSA-N 290.407 2.406 10 20 CECD CCOCc1nnc(NCc2cc(F)cc(F)c2O)o1 905411341 JCQIXDQTSNAPND-UHFFFAOYSA-N 285.250 2.202 10 20 CECD O=C(O)Nc1ccccc1C(=O)NCc1ccccc1O 833287724 NNVNDVJIKXIFEC-UHFFFAOYSA-N 286.287 2.412 10 20 CECD C[C@@H]1SCCN(C(=O)c2cc(O)cs2)[C@H]1C 735703793 LCPMQBCVHTZGOD-YUMQZZPRSA-N 257.380 2.420 10 20 CECD C[C@@H]1CCCN1CCN[C@H]1CCc2cccc(O)c21 834607292 SOAICJUTTUJCBC-OCCSQVGLSA-N 260.381 2.453 10 20 CECD COc1cc(Cl)cc(CN2CC(O)(C(C)C)C2)c1O 839132766 FMQBWJDZFIZSRK-UHFFFAOYSA-N 285.771 2.257 10 20 CECD CC(C)COCCN(C)c1ccc(OCC(=O)O)cc1 846279837 NFXKZFBQDMWAQX-UHFFFAOYSA-N 281.352 2.259 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC[C@H](CN)C1 841083274 AKSYMQHCLAWDBS-DZGCQCFKSA-N 261.413 2.278 10 20 CECD CCCC[C@H](CN)NCc1cc(OC)c(OC)cc1O 841029758 RTSPUPXGBSBOLF-GFCCVEGCSA-N 282.384 2.017 10 20 CECD COc1cccc(O)c1CNCc1cc(C2CC2)nn1C 922947430 JEWGMUYIOWVLKQ-UHFFFAOYSA-N 287.363 2.302 10 20 CECD Cc1cccc2ncc(/C=C3/SC(=S)NC3=O)n12 748994662 QKDASJURPKESIX-WEVVVXLNSA-N 275.358 2.132 10 20 CECD CN[C@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 923284864 WDFSKVXVIJYJRJ-HNNXBMFYSA-N 261.413 2.245 10 20 CECD CC[C@@H](NCc1cc(OC)c(OC)cc1O)[C@H](O)C(C)C 840967402 MNXRKSHVFJWBCE-MLGOLLRUSA-N 297.395 2.295 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)N1CC(F)C1 753105481 SRZYOPDMRKGBJH-UHFFFAOYSA-N 277.343 2.150 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CCO[C@H](C)C2)c1 858340806 OGBUEFGGQIQKHV-YPMHNXCESA-N 278.352 2.067 10 20 CECD CCc1cccc(CNCCCOCCOC)c1O 691442726 CRHSUZSDZUDQPC-UHFFFAOYSA-N 267.369 2.097 10 20 CECD C[C@@H](NCc1cnccn1)c1ccc(N2CCOCC2)cc1 856767373 LXYPAUAVUZLRMS-CQSZACIVSA-N 298.390 2.164 10 20 CECD CO[C@@]1(C)C[C@H]1N[C@H](C)c1cc(F)cc(F)c1O 850572015 XZEXPJWUVHOJRC-QUUYKZCZSA-N 257.280 2.498 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1cc(OC)ccc1O 1116483909 WXODCEIRIFFFEC-UHFFFAOYSA-N 281.352 2.174 10 20 CECD CN1CCC[C@H]2CN(C(=O)c3cc(O)cs3)CC[C@H]21 768265633 VKWYNLKSQNWGLC-CMPLNLGQSA-N 280.393 2.010 10 20 CECD CCCN(Cc1ccccc1O)C[C@]1(OC)CCOC1 876654766 OTGMZTOGULIZSF-MRXNPFEDSA-N 279.380 2.410 10 20 CECD C[C@H](NC1COC(C)(C)OC1)c1c(O)cccc1F 886589687 BOMYCBMRNUVMEI-VIFPVBQESA-N 269.316 2.333 10 20 CECD C[C@H](NC[C@H]1CN2CCC[C@@H]2CO1)c1c(O)cccc1F 886524702 PCMFUYREQSVEHT-XQQFMLRXSA-N 294.370 2.045 10 20 CECD CSCCCN(C)C(=O)NCc1ccc(N)cc1 1120676903 GDBQGHMDRNURAU-UHFFFAOYSA-N 267.398 2.163 10 20 CECD C[C@H](O)[C@H]1CCN(Cc2c(O)cccc2Cl)C1 780786877 OOMABHGYTBRZJW-UWVGGRQHSA-N 255.745 2.248 10 20 CECD CCn1ccc(CNCc2cc(C)cc(OC)c2O)n1 894990417 GSALAJCXTOJGFC-UHFFFAOYSA-N 275.352 2.215 10 20 CECD COc1ccc(CNC(=O)Nc2ccc(C)nc2)c(O)c1 794761956 MRKNSLIBPOCTRC-UHFFFAOYSA-N 287.319 2.426 10 20 CECD OC[C@H](CNCc1cc(F)ccc1O)CC1CCOCC1 1321296078 HQUOYGVRMMXGCE-ZDUSSCGKSA-N 297.370 2.046 10 20 CECD Cc1ccc(C(=O)N(C)CCC(F)(F)F)c(O)c1O 1341604609 VEAWWMGDGIAYGZ-UHFFFAOYSA-N 277.242 2.431 10 20 CECD O=C(/C=C\[C@@H]1CCCNC1)N1CCc2cc(F)ccc21 1580491951 WNKSFTJNBNGZHX-RYBZSIHZSA-N 274.339 2.271 10 20 CECD O=C(O)C1(CNCc2ccc(F)c(F)c2O)CCC1 1594879923 GDVHRYNDTOSMNJ-UHFFFAOYSA-N 271.263 2.015 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(C)(C)OC)c1 168823615 BJFLWLVMAINITG-SNVBAGLBSA-N 253.342 2.476 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1c(F)cccc1F 159072700 MKLWVKKZIQLRID-UHFFFAOYSA-N 279.242 2.306 10 20 CECD COc1cccc(O)c1CNCC(C)(C)C(C)(C)O 825201080 IQNXMLVETAOYDC-UHFFFAOYSA-N 267.369 2.288 10 20 CECD COc1ccc(N2CCN(C(=O)OC(C)C)CC2)cc1 160310692 WEHZYVWHHVIKDT-UHFFFAOYSA-N 278.352 2.362 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2ccc(C)cc2O)CC1 37138306 KWCMVNIZXIZGDJ-GFCCVEGCSA-N 276.380 2.362 10 20 CECD COc1cccc(CN[C@@H]2CSC[C@@H]2C)c1O 285375249 CMKCZLQYFQKBHU-GXSJLCMTSA-N 253.367 2.242 10 20 CECD Oc1c(CN[C@@H]2CCCC[C@H]2O)ccc(F)c1F 700765687 QYLNNRFWDYMEEK-GHMZBOCLSA-N 257.280 2.064 10 20 CECD CCOC[C@@H]1CN(Cc2cc(Cl)ccc2O)CCO1 529664264 CBJQHTZVNMZAEE-ZDUSSCGKSA-N 285.771 2.283 10 20 CECD CO[C@@]1(C)C[C@@H](NCc2cc3c(cc2O)OCO3)C1(C)C 174137496 ZUGLWJSAXKVUPF-ZBFHGGJFSA-N 293.363 2.414 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2ncnc3c2cnn3C)c1 171607917 ZPESQTAJTFZLMY-SECBINFHSA-N 299.334 2.251 10 20 CECD CCOC(=O)N1CC[C@@H](N[C@@H](C)c2cc(F)ccc2O)C1 186456409 NRAYLTUKMVDDST-CMPLNLGQSA-N 296.342 2.413 10 20 CECD CCS(=O)(=O)CCN[C@H](C)c1cc(Cl)ccc1O 185330732 OMQAUYKWUZEKOY-SECBINFHSA-N 291.800 2.131 10 20 CECD COc1ccc(N(C)C[C@@H](O)COCC(C)C)cc1 33637683 NUCNNCKUHNVHJM-CQSZACIVSA-N 267.369 2.165 10 20 CECD CN(CCC1CC1)C(=O)/C=C/c1ccc(O)c(O)c1 181239320 SQCZPXSACNQFRE-FNORWQNLSA-N 261.321 2.370 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2ccc(N(C)C)cc2)C1 193502057 BBFIBVNONZGHFR-UONOGXRCSA-N 276.380 2.184 10 20 CECD CCOC(=O)CN(Cc1ccc(N(C)C)c(F)c1)C1CC1 130344169 JPRFEPGYHRICMS-UHFFFAOYSA-N 294.370 2.419 10 20 CECD COCCOCCN[C@H](C)c1ccc(C)cc1O 44693901 KHAMMFMCMIBZDF-GFCCVEGCSA-N 253.342 2.014 10 20 CECD C[C@@H]1Oc2ccccc2O[C@@H]1C(=O)Nc1ccc(N)cc1 195308652 HWOMRRDLJNBZMO-BONVTDFDSA-N 284.315 2.436 10 20 CECD CC(C)(C)[C@@H](CCO)NCc1cc(F)ccc1O 231075716 WJLLNCHNZPILGL-CYBMUJFWSA-N 255.333 2.418 10 20 CECD O=C1CN(Cc2cc(Cl)ccc2O)[C@H]2CCCC[C@@H]2N1 92703189 NLLGOJXZPDVVPD-STQMWFEESA-N 294.782 2.289 10 20 CECD C[C@H](NCCC1(C)OCCO1)c1cc(F)ccc1O 183904760 PNWHOXFZADLMOY-JTQLQIEISA-N 269.316 2.335 10 20 CECD Cc1cccc(CN[C@@H]2CCO[C@@]3(CCOC3)C2)c1O 378459981 UZWFNWGBVYKCEK-ZBFHGGJFSA-N 277.364 2.128 10 20 CECD CN(C[C@H](O)COc1ccc(N2CCCC2)cc1)C1CC1 290851474 XLFGJYHMCCELID-INIZCTEOSA-N 290.407 2.121 10 20 CECD CNC(=O)OC[C@H]1CCCCN1Cc1cc(C)ccc1O 290279681 YXPCJNUOKJQLGW-CQSZACIVSA-N 292.379 2.411 10 20 CECD CC(=O)C(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1 808011971 HDXBSTIWTLLYKB-UHFFFAOYSA-N 296.329 2.455 10 20 CECD CC1=CCCN(C(=O)c2c(F)ccc(O)c2O)C1 295213481 WXRLDOAQQAHCFJ-UHFFFAOYSA-N 251.257 2.029 10 20 CECD CNC(=O)[C@H](CCSC)N[C@@H](C)c1ccc(C)cc1O 806663107 MPUFQTLKXDVQIP-AAEUAGOBSA-N 296.436 2.219 10 20 CECD O=C(OCCCN1CCCC1)c1cc(O)cs1 800165142 GNQKAMNHFBWDMC-UHFFFAOYSA-N 255.339 2.096 10 20 CECD Cc1n[nH]cc1[C@H](C)NC[C@@H](N)c1ccc(N(C)C)cc1 817941400 JQKHDWZPNKNUTB-MEDUHNTESA-N 287.411 2.135 10 20 CECD C[C@@H](N)CN[C@H](C)c1ccc(Br)cc1O 817974162 ZUIYUXLDBOVXGS-HTQZYQBOSA-N 273.174 2.153 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(C)c1O)C(=O)O 820418775 GHVCUYONPPWWCH-SNVBAGLBSA-N 257.717 2.307 10 20 CECD O=C(CNCc1ccccc1O)N1CCc2ccccc21 729685112 SXMVZJKFOQZGAA-UHFFFAOYSA-N 282.343 2.071 10 20 CECD CC(C)ONC(=O)NCCCSc1nccs1 838512892 ATNPTNSJSLHFID-UHFFFAOYSA-N 275.399 2.265 10 20 CECD COC(=O)c1cnc(SCC2(O)CCCC2)s1 834382357 LNSNMMRLIGTIID-UHFFFAOYSA-N 273.379 2.327 10 20 CECD COc1cccc(CNC(=O)OC2CCC2)c1O 830623486 UDNQXGWHYPLZKW-UHFFFAOYSA-N 251.282 2.180 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 841066172 WXEZTJMBXKJHHS-KWQFWETISA-N 299.758 2.184 10 20 CECD CC[C@@]1(O)CCN(Cc2ccc(N(C)C)cc2C)C1 840939490 NZNFYMAWSUIIOF-MRXNPFEDSA-N 262.397 2.408 10 20 CECD CCOc1cccc(CN[C@H](C)CCCCN)c1O 841081583 YGPSPTXTPFWVHO-GFCCVEGCSA-N 266.385 2.398 10 20 CECD COc1cccc(CN2CCC[C@@H]([C@H]3CCNC3)C2)c1O 843124845 JCJJIAVCWCKWFX-UONOGXRCSA-N 290.407 2.222 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@@H]2CN2CCCC2)cc1 841300858 XLAIYGULXGXXGT-OAHLLOKOSA-N 288.395 2.361 10 20 CECD C[C@@H](N[C@H]1CC[C@H](O)CC1)c1cc([N+](=O)[O-])ccc1O 756769534 FVFVDAZEIDEJMG-CKYFFXLPSA-N 280.324 2.255 10 20 CECD CN(C)c1ccc(/C=C\CNCC23CC(CN2)C3)cc1 853245931 CYVSZSMNVRBABA-ARJAWSKDSA-N 271.408 2.107 10 20 CECD O=C(CSc1ncc(Cl)s1)[C@@H]1CCOC1 850000344 RAALJNOBLPZWQP-ZCFIWIBFSA-N 263.771 2.494 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCC=CO2)c1 858375456 BAOQWGKILHLQMF-ZDUSSCGKSA-N 276.336 2.193 10 20 CECD C[C@H](NCc1cc(F)c(N(C)C)cc1F)C1(CO)CC1 858188618 HIDKEYBZVPOYSI-JTQLQIEISA-N 284.350 2.281 10 20 CECD Cc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)ncn1 756777414 XLGAMRJOGIXRFU-JTQLQIEISA-N 288.307 2.250 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCOC2CCCC2)c1 858193254 VVJFGWMIFVBHHA-UHFFFAOYSA-N 292.379 2.459 10 20 CECD C[C@H](NCCOC[C@H]1CCOC1)c1ccc(F)cc1O 756563006 KXAGTDVJUXSZQR-RYUDHWBXSA-N 283.343 2.235 10 20 CECD O=C(OCc1cnoc1C1CC1)c1cccc(O)c1O 758556015 BZJNPABEPRNZSQ-UHFFFAOYSA-N 275.260 2.320 10 20 CECD CO[C@H](C)CCNC(=O)N[C@H](C)c1ccccc1O 868219151 PLSKDBBQOUUCGZ-GHMZBOCLSA-N 266.341 2.177 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@@H](C)c1cc(OC)ccc1O 760890382 XDDAFZINNRVPCD-HZUKXOBISA-N 295.379 2.245 10 20 CECD COCCC[C@H](C)C(=O)NCc1cc(C)ccc1O 862757463 VDXMIRRHVXJINX-LBPRGKRZSA-N 265.353 2.380 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](C)Oc2ccccn2)c1 862755301 QHBDTKXMKCWSAZ-LBPRGKRZSA-N 286.331 2.179 10 20 CECD O=C1N[C@H](c2ccc(O)c(O)c2)Nc2cc(F)c(F)cc21 877858633 JTOYZWMPCBEBON-CYBMUJFWSA-N 292.241 2.230 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@@H](C(=O)NCCc2ccc(N)cc2)C1 884028606 LOQFIPRNRODDAE-ABAIWWIYSA-N 298.390 2.017 10 20 CECD CN(C)c1ccc(OCC(=O)NC(C2CC2)C2CC2)cc1 786877661 SMYWKHOHFGNYAU-UHFFFAOYSA-N 288.391 2.436 10 20 CECD C[C@H](N[C@H](CO)CC(F)F)c1c(O)cccc1F 886600911 FFJIXTNWKGKSBH-YUMQZZPRSA-N 263.259 2.198 10 20 CECD C[C@H](O)CCCNCc1c(O)ccc(Cl)c1F 788524904 YNQBAAZLLAEVFH-QMMMGPOBSA-N 261.724 2.435 10 20 CECD Cc1ccc2nc(/C=C3/SC(=S)NC3=O)cn2c1 789127231 MALDKFBHQGDQDA-RUDMXATFSA-N 275.358 2.132 10 20 CECD CCOc1ccc(N2CCN(C[C@@H]3CCCO3)CC2)cc1 1207894406 KTPJTVVCECORKZ-KRWDZBQOSA-N 290.407 2.386 10 20 CECD COc1cc(C)cc(CN(C)C[C@H](C)OC)c1O 795750233 SIPMPOZJJCXIDN-NSHDSACASA-N 253.342 2.176 10 20 CECD CC[C@@H](NCCN1CCO[C@H](C)C1)c1ccc(F)cc1O 796747604 TUHYWMSQFZITAS-IUODEOHRSA-N 296.386 2.293 10 20 CECD CCC(=O)N(C)C1CC(NCc2ccc(OC)c(C)c2)C1 998327386 PLVVQLHHAFNVOG-UHFFFAOYSA-N 290.407 2.493 10 20 CECD CC(C)(CCO)NCc1ccc(Br)cc1O 691456909 XEDGJMRWGJDDCY-UHFFFAOYSA-N 288.185 2.405 10 20 CECD COc1ccc(O)c(CNCC2SCCS2)c1 692904360 KPBABBJGNWQVQT-UHFFFAOYSA-N 271.407 2.297 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2OC)C[C@H](C)O1 769104680 JFXRILSZGVRNPA-NWDGAFQWSA-N 265.353 2.400 10 20 CECD CCOCc1cc(CN[C@H](CC)C(=O)O)ccc1OC 1603842249 PHHKKWKQNKBSTP-CYBMUJFWSA-N 281.352 2.185 10 20 CECD O=C(O)/C=C/c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1 1601882630 LCWAFBHQQWMALY-XXIYDDFUSA-N 298.245 2.189 10 20 CECD C[C@@](CC(=O)O)(NCc1ccc(N)cc1)c1ccncc1 1604090431 MUTRTBGSZUMDGL-INIZCTEOSA-N 285.347 2.144 10 20 CECD COc1ccc(C)c2c1N(C(=O)C1=CC[C@@H](N)C1)CCC2 1579198445 UPGPWMKPUIWPRW-CYBMUJFWSA-N 286.375 2.330 10 20 CECD Cc1cc(CC(=O)NCc2c(O)ccc3c2CCCC3)n[nH]1 150966784 BWXRHEQMWORCJC-UHFFFAOYSA-N 299.374 2.161 10 20 CECD COCC[C@@H](C)CNCc1cccc(OC)c1O 840955850 YLBVBVSPRUOAQB-LLVKDONJSA-N 253.342 2.163 10 20 CECD C[C@@H](NC[C@H]1CCCN1C)c1ccc(N(C)C)cc1 154543781 YIEXUBCFTFDDTM-CZUORRHYSA-N 261.413 2.497 10 20 CECD CCOc1cccc(CNCC2=CCN(C)CC2)c1O 271831136 OVNVHXBWJPIXBY-UHFFFAOYSA-N 276.380 2.142 10 20 CECD Cc1nc(CCN[C@H](C)c2ccc(N(C)C)cc2)n[nH]1 272564347 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CO[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)C12CCC2 834555495 YKJLSXXWQVJXNT-KBPBESRZSA-N 292.335 2.348 10 20 CECD COc1cccc([C@H](C)NC[C@@H](O)COCC(C)C)c1O 846142125 CADSAINHINDQOW-QWHCGFSZSA-N 297.395 2.085 10 20 CECD O=C(N[C@H](CO)CC1CCCCC1)c1cccc(O)c1O 841471249 XSOUVZKJLDKCGD-LBPRGKRZSA-N 293.363 2.159 10 20 CECD COc1ccc2c(c1)CCCN2Cc1noc(C)n1 917077814 STNYYYNHBLXGIY-UHFFFAOYSA-N 259.309 2.339 10 20 CECD C[C@H](N[C@@H](CO)CCF)c1cc(F)cc(F)c1O 846208281 HMNPJLREAHKUCR-IONNQARKSA-N 263.259 2.042 10 20 CECD CCN(CC)c1ccc(CNC[C@@](C)(O)COC)cc1F 740007028 RFQMMBVLJSLFTI-MRXNPFEDSA-N 298.402 2.159 10 20 CECD NC[C@H]1CCCC[C@H]1NCc1cccc(F)c1O 841028991 DCDGIVANLNZUNY-ZWNOBZJWSA-N 252.333 2.138 10 20 CECD CCc1cccc(CN[C@@H]2CCO[C@]3(CCOC3)C2)c1O 848899161 DFGQZXPASVDGRH-NVXWUHKLSA-N 291.391 2.382 10 20 CECD C[C@@H]1C[C@H](NC(=O)NCc2cc(Cl)ccc2O)CO1 845282545 PKYWWLUKVOCUAE-KCJUWKMLSA-N 284.743 2.022 10 20 CECD CN1CC(=O)N[C@H]1c1cc(-c2ccccc2)ccc1O 749702888 VPZJVGZETSPKMW-MRXNPFEDSA-N 268.316 2.119 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@H]1CCCNC1 841043577 UHLMKCNKMQCXDY-JTQLQIEISA-N 258.724 2.026 10 20 CECD CCOc1ccc(CN2CCC(CCN)CC2)c(O)c1 844911104 KKAIUTYQRYXABT-UHFFFAOYSA-N 278.396 2.352 10 20 CECD N[C@]12CCC[C@H]1CN(Cc1c(O)cccc1Cl)C2 857226778 ZDCRWAFHPONXSD-HZMBPMFUSA-N 266.772 2.359 10 20 CECD CCOC(C)(C)C(=O)NCc1cc(Cl)ccc1O 869146461 ITQOAVQEBYGAJO-UHFFFAOYSA-N 271.744 2.477 10 20 CECD CN(Cc1cnc[nH]1)Cc1cc(F)c(N(C)C)cc1F 862409036 REKJFUPPPCJXNT-UHFFFAOYSA-N 280.322 2.386 10 20 CECD COC(=O)[C@@H](NCc1cccc(C)c1O)C(C)(C)C 768524743 PQOBLNYNEUNOFH-CYBMUJFWSA-N 265.353 2.378 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](O)[C@H]2CCCC[C@@H]21 871199664 ZHGBISWSDRNDGV-SRVKXCTJSA-N 281.377 2.219 10 20 CECD C[C@@H](N[C@H](C)c1ccccc1O)c1nccc(N)n1 879648813 APWUODGKYVEQEU-NXEZZACHSA-N 258.325 2.176 10 20 CECD CCCN(c1ccc(CN)cc1)[C@H]1CCCNC(=O)C1 877479702 WHNKCMRRUBRRBH-HNNXBMFYSA-N 275.396 2.030 10 20 CECD CCC[C@@H]1NC(=O)N(Cc2ccc(N(C)C)c(F)c2)C1=O 777628210 RJOUZOMFRWZRFM-LBPRGKRZSA-N 293.342 2.112 10 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2.206 10 20 CECD COc1ccc(O)c(CN[C@@H]2Cc3ccccc3[C@H]2O)c1 898391345 BDQKJBYHNLOWLP-NVXWUHKLSA-N 285.343 2.149 10 20 CECD COc1ccc(CN2CC[C@@H]3OCC[C@@H]3C2)c(O)c1OC 895101789 NDJIFTWSDCDZSB-YPMHNXCESA-N 293.363 2.020 10 20 CECD CC/C=C/CNCc1ccc(OC)c(OC)c1O 894704338 RWQOEYLFHNJHNY-AATRIKPKSA-N 251.326 2.465 10 20 CECD CCN1CCN(Cc2cc(F)cc(F)c2O)[C@@H](C)C1 894745193 BPRWVPGEUAHWJZ-JTQLQIEISA-N 270.323 2.196 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1CCN(C2CC2)C1 708481125 OKUMAVNSHDOCOH-SNVBAGLBSA-N 282.334 2.244 10 20 CECD CCCNC(=O)[C@@H]1CCCN(Cc2ccc(N)cc2)C1 1336117629 PQBFGQWLKRTATQ-CQSZACIVSA-N 275.396 2.007 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC1(CC(N)=O)CC1 1331556580 JFBLQRPLLMIQSV-NWDGAFQWSA-N 288.391 2.494 10 20 CECD Nc1ccc(Cc2nc([C@H]3CCCOC3)no2)cc1 87813545 SZXNVKJIJDLETM-NSHDSACASA-N 259.309 2.137 10 20 CECD COc1ccc(O)c(CN[C@H]2CC[C@@H](CO)CC2)c1 776250392 IMKREGTXEMXGPB-BJHJDKERSA-N 265.353 2.042 10 20 CECD COc1cccc(O)c1CN1CCO[C@H](C(C)C)C1 779149228 CITHFFBHAUCQJF-HNNXBMFYSA-N 265.353 2.258 10 20 CECD COCC1(CN[C@H](C)c2cc(C(=O)O)ccc2O)CC1 1606841182 UHWMVGKHGSOBDY-SNVBAGLBSA-N 279.336 2.168 10 20 CECD CCCCO[C@H](C)C(=O)NCCc1ccc(N)cc1 152571660 QDMDJHBXVMSZEA-GFCCVEGCSA-N 264.369 2.133 10 20 CECD OCC1(NCc2cccc(Br)c2O)CCC1 157491636 BFVBJJWNMUAFFZ-UHFFFAOYSA-N 286.169 2.159 10 20 CECD CCc1cccc(CNCc2cc(C)ncn2)c1O 848900576 OAALWSUDWHHNQC-UHFFFAOYSA-N 257.337 2.343 10 20 CECD CC(C)(C)C[C@@H](O)CNCc1cc2c(cc1O)OCO2 227373741 ZGPUJDQKBLIVAJ-LLVKDONJSA-N 281.352 2.008 10 20 CECD C[C@H]1CCC[C@]1(O)CNCc1cc(F)ccc1O 293951509 IUQOZPNDBNFQRZ-HZMBPMFUSA-N 253.317 2.172 10 20 CECD CCOc1cccc(CNCC[C@H](C)CCO)c1O 295145635 QLGGEMPLJCOODD-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CC[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccccc1O 704340974 OBJGAYDPIOWPRV-CHWSQXEVSA-N 262.353 2.054 10 20 CECD Cc1ccc(O)c(CN2CCN(C(=O)C(C)(C)C)CC2)c1 128339288 CDHVISRJZWGICP-UHFFFAOYSA-N 290.407 2.391 10 20 CECD C[C@@H](N[C@@H]1C=C[C@H](CO)C1)c1ccc(F)c(F)c1O 187764184 YMDIALMQJHKFSC-KXUCPTDWSA-N 269.291 2.258 10 20 CECD C[C@H](NCCSCCCO)c1ccc(F)c(F)c1O 187703863 ILGSJOKZFVAVGL-VIFPVBQESA-N 291.363 2.437 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](C)CN2CCOCC2)c(O)c1 185505292 CFFYKTKPCBHKPE-CABCVRRESA-N 292.423 2.320 10 20 CECD CN(C(=O)/C=C/c1ccc(O)c(O)c1)c1cccnc1 181074666 UMPVLXQCWHBIQU-FNORWQNLSA-N 270.288 2.169 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1CCNC1 89744435 OLLRKTNEXLLQGM-HNNXBMFYSA-N 289.423 2.101 10 20 CECD C[C@@H](CCO)CN[C@H](C)c1ccc(N(C)C)cc1 97436156 NZZXUXNTTYJURT-QWHCGFSZSA-N 250.386 2.422 10 20 CECD CN1CCCc2cc(CNc3ncc([N+](=O)[O-])cn3)ccc21 273619124 OBANNGAUQPYTFH-UHFFFAOYSA-N 299.334 2.379 10 20 CECD CC[C@@H]1NC(=O)N(c2cc(Cl)c(N)c(Cl)c2)C1=O 278273980 YRHLGFDZWSGZJS-QMMMGPOBSA-N 288.134 2.410 10 20 CECD COc1ccc(O)c(CNc2cccc(-c3nn[nH]n3)c2)c1 378896332 NLPISULHVYDKRD-UHFFFAOYSA-N 297.318 2.193 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@]12CCCC[C@H]1CNC2 285691368 ONJFRECEDUBPQM-WMLDXEAASA-N 288.391 2.130 10 20 CECD COC[C@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@@H](C)O1 294699749 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904457738 UKQCBEWYJPWISS-UHFFFAOYSA-N 263.385 2.047 10 20 CECD Cc1cn(C)nc1C(=O)NCc1ccc2c(c1)CCCN2C 839606193 OTVLYCLJKXWNNX-UHFFFAOYSA-N 298.390 2.041 10 20 CECD CN(C)[C@@H]1CCC[C@@H](NC(=O)c2cc(O)cs2)C1 749544847 QBUGMXGGHXGXOT-NXEZZACHSA-N 268.382 2.056 10 20 CECD COc1cccc([C@@H](C)NCCCCN(C)C)c1O 846141724 NAEGLFBEUPKLNF-GFCCVEGCSA-N 266.385 2.393 10 20 CECD CN(C/C=C\Cl)c1ccc(OCC(=O)O)cc1 846279933 QPGLIVVUZZRCMW-UQCOIBPSSA-N 255.701 2.339 10 20 CECD Cc1ccc(O)c([C@H](C)NCC[C@]2(O)CCCOC2)c1 846212484 LRVXAEVZOJZKJJ-XJKSGUPXSA-N 279.380 2.283 10 20 CECD Nc1ccc(CCNC(=O)N2CC[C@@H](C3CC3)C2)cc1 841956456 BDMOZHHKQPFYIX-CQSZACIVSA-N 273.380 2.253 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@H]2CCCNC2=O)cc1 840827274 GMTTUONEVDIXRV-UKRRQHHQSA-N 289.423 2.320 10 20 CECD CN(C)c1ccc(CN2CCNC[C@H]2c2ccncc2)cc1 843120342 GIOWRRRTGUFMLN-SFHVURJKSA-N 296.418 2.294 10 20 CECD CN(C)c1ccc(CN2CC[C@@](C)(CN)C2)cc1F 843115595 HFHGQBLPVIBGRA-HNNXBMFYSA-N 265.376 2.062 10 20 CECD Nc1ccc(CCNC(=O)N2CCC=C(F)C2)cc1 841960467 RLLSEIJPGUFVBW-UHFFFAOYSA-N 263.316 2.080 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1ccc(N(C)C)cc1C 840909979 NYWBCIXQMNGCDH-HNNXBMFYSA-N 276.380 2.198 10 20 CECD Cc1cc(O)c(CNC[C@@]2(C)CCCNC2)cc1C 841057339 MEJJCZXKAHCMED-INIZCTEOSA-N 262.397 2.488 10 20 CECD CCN(C)c1ccc(CNC2(COC)CCOCC2)cc1 852089218 DIGXVYWTPSNJEQ-UHFFFAOYSA-N 292.423 2.428 10 20 CECD Clc1cnc(SC[C@H]2COCCO2)s1 850000096 JGDILIBTFVLXEU-ZCFIWIBFSA-N 251.760 2.304 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H]2c2ncon2)c1O 754729712 FDFNSEQHNRLVHV-GFCCVEGCSA-N 289.335 2.429 10 20 CECD COC[C@](C)(CC(=O)OC)NCc1ccc(OC)c(C)c1 757926798 OTCRPUFEVXPALZ-INIZCTEOSA-N 295.379 2.061 10 20 CECD Cc1cc(=NCc2ccc(N3CCC(O)CC3)cc2)cc[nH]1 853955836 YCKIKCUVCAFVPY-UHFFFAOYSA-N 297.402 2.385 10 20 CECD COC(=O)[C@@](C)(NCc1ccc(OC)c(C)c1)C1CC1 930155933 PZUNBJUVEPPWIY-INIZCTEOSA-N 277.364 2.435 10 20 CECD C[C@H](N[C@@H]1COC[C@@H]1O)c1cc(Cl)c(Cl)cc1O 866421028 UYTKFSKIBQWVCK-QDWQASTRSA-N 292.162 2.109 10 20 CECD COC[C@H](NC(=O)N[C@H](C)c1ccccc1O)C(C)C 868307560 GFQIQNIEAAXFGB-YPMHNXCESA-N 280.368 2.423 10 20 CECD CN(Cc1cc(F)c(N(C)C)cc1F)C[C@H](O)C1CC1 862367651 QBQZWOHBKGNLSB-HNNXBMFYSA-N 284.350 2.234 10 20 CECD CCC[C@](C)(O)C(=O)C(=O)CC(C)(C)CC(=O)OCC 935949427 ZXBJDLYBFJSNHX-HNNXBMFYSA-N 286.368 2.045 10 20 CECD Cc1cccc(O)c1CN1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 877565885 ALGKOVHWLGQQDP-OCVGTWLNSA-N 257.333 2.086 10 20 CECD COc1cncc(NCc2cc(OC)c(OC)cc2O)c1 877663979 JCHAHMLRUVIDCB-UHFFFAOYSA-N 290.319 2.425 10 20 CECD COC(=O)c1occc1CNCc1ccc2c(c1)CCO2 776154032 LVCKYTCCUMUSOC-UHFFFAOYSA-N 287.315 2.291 10 20 CECD CN(CC1CC1)S(=O)(=O)Nc1ccc(O)c(Cl)c1 776750345 AVVWJUBUCNSASB-UHFFFAOYSA-N 290.772 2.044 10 20 CECD Cc1ccc(CNCCCN2CCCCC2=O)c(O)c1 877022736 RCLSMMYMWQNVLF-UHFFFAOYSA-N 276.380 2.193 10 20 CECD O=C(NCc1ccccc1O)Nc1ccc(C2CC2)nn1 773287395 XSJCTLLICBWGFU-UHFFFAOYSA-N 284.319 2.381 10 20 CECD CC[C@@H](C)C[C@H](N)C(=O)NCc1ccc(N(C)C)cc1C 1122003726 GBTDTSCCOGKYKE-WBMJQRKESA-N 291.439 2.441 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC2(CC1)OCCO2 893921936 UZIQRPXXTJQGPO-UHFFFAOYSA-N 285.290 2.009 10 20 CECD C[C@@H](CC[S@](C)=O)NCc1cccc(Cl)c1O 164758961 DXRRTDYVHJKGJT-HUTHGQBESA-N 275.801 2.292 10 20 CECD COc1nc(Cl)c(CN(C)Cc2ccccc2O)n1C 1341539023 CSNPFFVSYBDIGJ-UHFFFAOYSA-N 295.770 2.420 10 20 CECD Cc1ncsc1CCC(=O)NCc1cccc(O)c1O 1352673103 ZSMKVNAXZNFDJT-UHFFFAOYSA-N 292.360 2.112 10 20 CECD Cc1cc(CN[C@H]2CCC[C@H]2C(=O)O)ccc1N(C)C 1607647689 GXEZTYJKFXEAGQ-KGLIPLIRSA-N 276.380 2.404 10 20 CECD C[C@@H](NCc1ccn(C)c1)c1cc(C(=O)O)ccc1O 1609780424 JDQQLTLBZBHDMY-SNVBAGLBSA-N 274.320 2.280 10 20 CECD C[C@H](NC[C@]1(C)CCCNC1)c1cc(C(=O)O)ccc1O 1593250127 REBABYHSQKSAFI-MEDUHNTESA-N 292.379 2.131 10 20 CECD C[C@@H](C[S@](C)=O)N[C@@H](C)c1ccc(N(C)C)cc1 168515644 IRNMNHHTHYJJGL-OAVHHTNSSA-N 268.426 2.170 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCO[C@H](C3CC3)C2)c(O)c1O 157083247 ZBDCVCQVWUDBSW-YPMHNXCESA-N 291.347 2.094 10 20 CECD Cc1cc(C(=O)NCc2ccc(N)cc2)cc([N+](=O)[O-])c1 159393421 KYJASQHCYSKRMC-UHFFFAOYSA-N 285.303 2.415 10 20 CECD CCc1nocc1CNCc1ccc2c(c1)CCO2 815122894 RBPACGDBYOLJDF-UHFFFAOYSA-N 258.321 2.462 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@H]1COCCO1 38060500 ZEAXJRXYVSOXSG-UPJWGTAASA-N 277.364 2.254 10 20 CECD CCOc1cccc(CNC[C@H]2CCCC[C@@H]2O)c1O 77204934 LRXBJMYFWRBPJQ-OCCSQVGLSA-N 279.380 2.432 10 20 CECD CC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@H](C)O 395246912 ARFWSYLZKTVYAV-KWBADKCTSA-N 253.342 2.211 10 20 CECD COC[C@@H]1CCCCN1Cc1cccc(OC)c1O 307785871 SCBWOGWTNKARAW-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD C[C@@H](NCCCN1CCC(O)CC1)c1cc(F)ccc1O 185116543 JNCSEHMUZLCEKX-GFCCVEGCSA-N 296.386 2.029 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CC=CCC2)c1O 68488740 LREMEZSQEAFXJM-LLVKDONJSA-N 261.321 2.373 10 20 CECD Cc1ccc(C(=O)Nc2ccnn2C(C)C)c(O)c1O 177667726 KHLDEEXHPWBCQB-UHFFFAOYSA-N 275.308 2.436 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CC1CCC1 183461482 JLRFOYBZWRTAET-SNVBAGLBSA-N 263.337 2.335 10 20 CECD CCCNC(=O)[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 180021054 JEXAYTBMUXLWHD-GFCCVEGCSA-N 294.370 2.270 10 20 CECD C[C@H](NCc1cc(Cl)cc(Cl)c1O)C(=O)O 49354248 CQXBXAMAHWNZSB-YFKPBYRVSA-N 264.108 2.262 10 20 CECD Oc1cc2c(cc1CNCCCN1CCCCC1)OCO2 42879459 ZHIGUUQBOCVIKW-UHFFFAOYSA-N 292.379 2.087 10 20 CECD CO[C@@]1(C)C[C@H](NC(=O)Cc2ccc(N)cc2)C1(C)C 237160389 QPEAZPVFBJYTRP-BBRMVZONSA-N 276.380 2.131 10 20 CECD C[C@](O)(CN[C@@H]1CCc2cccc(O)c21)C(F)(F)F 296964113 RFYNVYBQGPFQQR-SKDRFNHKSA-N 275.270 2.282 10 20 CECD COc1cc(Cl)cc(CN2CCO[C@H](C)C2)c1O 184676723 BXVAPMYPBKIWHZ-SECBINFHSA-N 271.744 2.275 10 20 CECD Cc1ncc2c(n1)CC[C@@H](NCc1ccc3c(c1)CCO3)C2 363917957 MYCJXVNOCDNWJX-MRXNPFEDSA-N 295.386 2.367 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cccc(Cl)c2O)[C@H]1OC 274934354 PCDRQVPXHKPIER-YRGRVCCFSA-N 285.771 2.328 10 20 CECD Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ccn1 279666909 GEXCFNOJFYTGJC-NSHDSACASA-N 286.331 2.162 10 20 CECD Cc1noc(C(C)(C)NCc2ccc(N(C)C)cc2)n1 283897726 HTKGDFOQIDVSAN-UHFFFAOYSA-N 274.368 2.469 10 20 CECD Cc1cccc(CN2CCC(F)(F)[C@@H](CO)C2)c1O 291305049 QZSNOUMAVOTZNC-GFCCVEGCSA-N 271.307 2.150 10 20 CECD Cc1ccc(O)c(CN2CCC3(CC2)OCCCO3)c1 293637189 LVYRKZPSEXYXFU-UHFFFAOYSA-N 277.364 2.430 10 20 CECD CNCCN[C@@H](C)c1cccc(C(F)(F)F)c1O 817952546 RPXAAVHWOBEGBG-QMMMGPOBSA-N 262.275 2.281 10 20 CECD COc1cccc(O)c1CN1CC[C@]2(CCCN(C)C2)C1 816643142 WJYXEJAUCMKYEC-KRWDZBQOSA-N 290.407 2.319 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cc(C=O)c[nH]2)c1 815835015 IBNDTYWODBBZBW-SECBINFHSA-N 288.303 2.032 10 20 CECD COc1cccc(O)c1CN(C)CC1=CCCOC1 827184727 GLUKVFKSFJWIBQ-UHFFFAOYSA-N 263.337 2.179 10 20 CECD CC(C)CC(=O)NCCC(=O)N[C@H](C)c1ccccc1O 827937092 KDHREVDKERMDIY-GFCCVEGCSA-N 292.379 2.122 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H]2C[C@H]3CC[C@H]2O3)cc1 836240477 VJWARTPFXWVREC-NUEKZKHPSA-N 288.391 2.326 10 20 CECD C[C@H](C[C@@H](O)c1ccco1)NC(=O)c1cc(O)cs1 830118774 FPIITVMXIMAOPY-PSASIEDQSA-N 281.333 2.289 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)CC2CCC2)cc1 832267092 MVOVYFHYFBFSQN-HNNXBMFYSA-N 275.396 2.059 10 20 CECD Nc1ccc(C(=O)NCc2c(O)ccc3c2CCCC3)nc1 830597468 JZEMAHILKYMMAL-UHFFFAOYSA-N 297.358 2.178 10 20 CECD Cc1cc(O)c(CN2CCN[C@H](C)C2)c(Cl)c1 840908971 ZRGVKZNETNYLCC-SNVBAGLBSA-N 254.761 2.148 10 20 CECD NCC(F)(F)CNCc1cc(Cl)cc(Cl)c1O 841059626 IRTMPWARCPQZNG-UHFFFAOYSA-N 285.121 2.383 10 20 CECD CO[C@@](C)(C1CC1)[C@@H](C)NC(=O)c1ccc(C)c(O)c1O 840510728 QBRHEOCWILUZMS-QLJPJBMISA-N 293.363 2.340 10 20 CECD CCc1cccc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c1O 848887719 CKPQMATXDSPTBS-CRTZDJKQSA-N 281.421 2.296 10 20 CECD CC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)[C@@H](O)C(C)C 840525348 NGEPOQHAPCOULO-SSAGHTQJSA-N 293.363 2.023 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](CN)C2)cc1 843048521 FDSFQFMWAZUSNG-OAHLLOKOSA-N 261.413 2.313 10 20 CECD COc1cccc([C@@H](C)NCCN(C)CC(F)F)c1O 858596435 HDMBFHJOHFTJCS-SNVBAGLBSA-N 288.338 2.248 10 20 CECD C[C@H]1C[C@@H](NC[C@H]2C[C@@H](O)C2)c2c(O)ccc(F)c21 858545812 VHCGOZYDJTZSCO-UXCLJVHYSA-N 265.328 2.440 10 20 CECD C[C@@H](NCCC(C)(C)N)c1cc(F)cc(F)c1O 925736508 AWIDBGBDCSZXHU-MRVPVSSYSA-N 258.312 2.448 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)C1(CO)CC1 850361177 OEOLGOLMUXLNNK-LLVKDONJSA-N 266.360 2.142 10 20 CECD C[C@H](NC[C@H]1CCC(=O)O1)c1ccc(N(C)C)cc1 851950334 NRAHCZRURIDFLW-SMDDNHRTSA-N 262.353 2.109 10 20 CECD COc1cccc(CNC(=O)C2(c3ccccn3)CC2)c1O 866764723 XBENHAKMFGBGDI-UHFFFAOYSA-N 298.342 2.144 10 20 CECD CN(C)CCN(C)Cc1cc(F)c(N(C)C)cc1F 862367122 WSNQNMZHNKSYRR-UHFFFAOYSA-N 271.355 2.024 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1cn[nH]c1 863852554 MRIVHFGPCZGOET-UHFFFAOYSA-N 286.379 2.067 10 20 CECD CC[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768440120 SQUNGPIHHUTTGV-XHDPSFHLSA-N 277.364 2.440 10 20 CECD C[C@H](NC[C@H]1C[C@@H](N)C1)c1cc(F)cc(F)c1O 873252084 PCNGKUVGLHUOET-OYNCUSHFSA-N 256.296 2.058 10 20 CECD CC(=O)c1ccc(C(=O)N(C)Cc2ccccc2O)o1 772378481 QPOTZMGNORPBIS-UHFFFAOYSA-N 273.288 2.460 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1cc(Cl)cc(F)c1O 775656676 YPWSCXZCLGWVAU-MRVPVSSYSA-N 289.734 2.426 10 20 CECD CCN(CC)c1ccc(CNC(=O)NC2(C)COC2)cc1 875121094 NNYOKSCNZAKQDV-UHFFFAOYSA-N 291.395 2.121 10 20 CECD CCOC(=O)N[C@@H]1CCCN(Cc2ccc(C)cc2O)C1 876582433 ZDZLGWGIJSIXQH-CQSZACIVSA-N 292.379 2.411 10 20 CECD OC[C@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 775634046 NZKFMDLVPZTAMB-VIFPVBQESA-N 273.735 2.389 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCn2ccnc2C1 877429142 CDUUZGKYSHIYJF-GFCCVEGCSA-N 257.337 2.002 10 20 CECD C[C@H](O)CCCN[C@H](C)c1cc(F)cc(F)c1O 788606333 XOFITZHPJKYWDZ-DTWKUNHWSA-N 259.296 2.482 10 20 CECD CN(CCCF)C(=O)NCc1ccc(N(C)C)c(F)c1 888003140 GQXTZOSVUJYCSA-UHFFFAOYSA-N 285.338 2.393 10 20 CECD CO[C@H](C)[C@@H](C)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898448421 RVOSLMKLBUMJJZ-CKEIUWERSA-N 293.455 2.368 10 20 CECD OC[C@@H](CC1CC1)NCc1c(O)ccc(Cl)c1F 790983649 SEIJXWNOMPTFFQ-SECBINFHSA-N 273.735 2.435 10 20 CECD O=C(NCc1ccccc1O)c1c[nH]c(Br)c1 1318503571 IZWKOPXPLTZZHJ-UHFFFAOYSA-N 295.136 2.413 10 20 CECD CO[C@@H]1CCN(Cc2c(O)cccc2Br)C1 707129482 AFORGOOKHAQVNE-SECBINFHSA-N 286.169 2.375 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)c1cn(C)cn1 709956130 YLJODDSDTZCARJ-LBPRGKRZSA-N 258.369 2.337 10 20 CECD COc1cc(C)cc(CNc2ccc(CO)cn2)c1O 1332004153 JJWSXLLIPHEHEX-UHFFFAOYSA-N 274.320 2.209 10 20 CECD C[C@@H](Cn1ccnc1)N[C@@H](C)c1cc(F)ccc1O 94617557 GNYIBNMUYZJYDL-QWRGUYRKSA-N 263.316 2.467 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)C1=CCOCC1 1261140487 USLHIUNWRDBYQX-UHFFFAOYSA-N 279.683 2.161 10 20 CECD CN(C)c1ccc(OC[C@@H]2CCCOC2)cc1C(=O)O 1598328354 JDGDVTLDFHPNEK-LLVKDONJSA-N 279.336 2.256 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(C(=O)O)CCCCC2)c1 1594373142 DFPFOTRSRLDAML-UHFFFAOYSA-N 291.347 2.352 10 20 CECD CCOc1ccc(CN2C[C@@H](C)[C@H](CC(=O)O)C2)c(O)c1 1597102318 VFYSHQPJXSNPBA-DGCLKSJQSA-N 293.363 2.334 10 20 CECD CC[C@H](NCCNC(=O)C(C)C)c1ccccc1O 20125319 SYSHTRFRKCDWCK-ZDUSSCGKSA-N 264.369 2.205 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@](C)(C(=O)O)C2)cc1 1777039946 HBHOLAPMQGKNNI-XJKSGUPXSA-N 276.380 2.486 10 20 CECD CN(CC1(CC(=O)O)CC1)c1ccc2c(c1)OCCO2 1777050641 BXPNGFKERPHHGM-UHFFFAOYSA-N 277.320 2.149 10 20 CECD CS[C@@H](C)CNC(=O)NCc1ccc(N(C)C)c(F)c1 163832845 NYFLFXWKBCEACY-JTQLQIEISA-N 299.415 2.442 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)CN(C)C)c1 168599521 NYTHQVRSKGVLDB-WDEREUQCSA-N 252.358 2.002 10 20 CECD C[C@@H](CNC(=O)Nc1ccc(N)cc1)CC1(C)OCCO1 841300085 MVPJFCAJDOIQET-LLVKDONJSA-N 293.367 2.180 10 20 CECD CCN1CCC(NCc2cc(F)ccc2O)CC1 226582404 DYEFCPGGDZCIKN-UHFFFAOYSA-N 252.333 2.105 10 20 CECD C[C@H](CCCO)CNCc1ccc(N(C)C)cc1 294668621 APZIWTISOBFKPO-CYBMUJFWSA-N 250.386 2.251 10 20 CECD C[C@@H]1N(C(=O)Nc2ccc(N)cc2)CCOC1(C)C 707264653 NXPNAPJFGOFSNV-JTQLQIEISA-N 263.341 2.300 10 20 CECD C[C@H](CCNCc1cccc(Cl)c1O)N(C)C 697836564 JJWARDFLPGKVHS-SNVBAGLBSA-N 256.777 2.475 10 20 CECD CN(C)c1ccc(CN[C@H](C(=O)O)C2CCC2)cc1 399247014 GOOSDIKHBMVLOH-AWEZNQCLSA-N 262.353 2.096 10 20 CECD CC(=O)NCC1CCN(Cc2cc(C)c(C)cc2O)CC1 54517151 LFDGOFKCEYTKGR-UHFFFAOYSA-N 290.407 2.357 10 20 CECD C[C@H]1CN(Cc2c(O)ccc3ccncc23)CCO1 22005050 XSDYIVHJWQYXQH-NSHDSACASA-N 258.321 2.161 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cccc(Cl)c2O)C1 180567715 LLANJHYOBNIKDU-AWEZNQCLSA-N 283.755 2.431 10 20 CECD CS[C@H](CO)[C@H](C)N[C@@H](C)c1ccc(F)c(F)c1O 187729642 ZMQKZBJDJIYUDF-DKCNOQQISA-N 291.363 2.433 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCC[C@H](N)C1 70575985 QXJMDWHQBLJTAJ-CABCVRRESA-N 289.423 2.229 10 20 CECD Cc1cc(O)c(CN(C)[C@@H]2CCCCNC2=O)cc1C 123883700 YJTHOYKWNHHCPF-CQSZACIVSA-N 276.380 2.110 10 20 CECD CCN(CC1CC1)C(=O)/C=C/c1ccc(O)c(O)c1 181072789 HMBDTOAKONUTDX-SOFGYWHQSA-N 261.321 2.370 10 20 CECD CCCNC(=O)CN[C@H](C)c1cc(Cl)ccc1O 184881672 MHRJSXQQZCAINT-SECBINFHSA-N 270.760 2.222 10 20 CECD COc1cc(CC(=O)NCCc2ccc(N)cc2)ccc1C 237311579 BYUFCOMUYKBCDV-UHFFFAOYSA-N 298.386 2.487 10 20 CECD O=C(CNCc1ccccc1O)N1CCCc2ccccc21 238096082 QUPJWUJAZMKNCA-UHFFFAOYSA-N 296.370 2.461 10 20 CECD CCN(CC)c1ccc(CN2CCC[C@@H]2CO)cc1 92471072 GFPBKJGKHQRQTN-MRXNPFEDSA-N 262.397 2.490 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)C1Cc2ccccc2C1 277595146 HBLIKDMLCTVHHW-UHFFFAOYSA-N 297.354 2.172 10 20 CECD CC(C)COCCCNC(=O)c1c(F)ccc(O)c1O 276691488 QCMVRYXZCWEOLZ-UHFFFAOYSA-N 285.315 2.029 10 20 CECD C[C@@H]1CCN(Cc2c(O)cccc2Cl)CC[S@]1=O 277766784 VVHSPLFDWUCVNX-MLCYQJTMSA-N 287.812 2.389 10 20 CECD COc1cccc(CNC[C@H]2CCOC[C@@H]2C)c1O 285655827 YRKHMGYFWPYWDV-NWDGAFQWSA-N 265.353 2.163 10 20 CECD CC(=O)C(=O)CSc1nc2cc(Cl)ccc2n1C 289535041 FCNUJGADQZPBNH-UHFFFAOYSA-N 282.752 2.477 10 20 CECD CCSCCCNC(=O)c1ccc(C)c(O)c1O 281944316 CJJONXNCEHLXAQ-UHFFFAOYSA-N 269.366 2.279 10 20 CECD COC[C@H](CCO)N[C@@H](C)c1c(C)cc(C)cc1O 293653572 ISOPEZIACHNJDO-STQMWFEESA-N 267.369 2.057 10 20 CECD C[C@@H]1CSC[C@@H]1NC(=O)N(C)Cc1ccccc1O 807476294 CQUJUCGIDWQIIA-PWSUYJOCSA-N 280.393 2.285 10 20 CECD COc1cc(O)c(CNC[C@@]2(O)CCC[C@H]2C)cc1OC 293828749 AMQGYGXFXQGBIQ-BZNIZROVSA-N 295.379 2.050 10 20 CECD CCn1cc([C@@H](C)NCc2cccc(OC)c2O)cn1 294760127 DYSNMKVGDWRGPL-LLVKDONJSA-N 275.352 2.468 10 20 CECD CCOC1(C(=O)NCc2ccc(N)cc2)CCCC1 297127426 HCDYSZKYZYIYNC-UHFFFAOYSA-N 262.353 2.234 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)CC(C)C 819694992 RSQHYDKTCZVHHP-UHFFFAOYSA-N 293.363 2.330 10 20 CECD C[C@@H](Oc1ccccn1)C(=O)N(C)Cc1ccccc1O 825481699 RGWWJVJYDMVRBP-GFCCVEGCSA-N 286.331 2.213 10 20 CECD Cc1cc(O)c(CN(C)CC(=O)N2CCCC2)cc1Cl 824542173 PONDRFGIJIJKOR-UHFFFAOYSA-N 296.798 2.408 10 20 CECD C[C@@H](NC(=O)C1SCCS1)c1ccccc1O 827941407 RIJNGKMRMUOHNL-MRVPVSSYSA-N 269.391 2.376 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCN(C)[C@@H]3C2)cc1F 824893663 YATVIAASEBJBSD-XJKSGUPXSA-N 277.387 2.028 10 20 CECD CC(C)CCNC(=O)[C@@H](C)OC(=O)c1cc(O)cs1 732355474 NYXOXFWSNOZTGF-SECBINFHSA-N 285.365 2.161 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NOCC2CC2)c1 838607793 ZMTPADGYZCZCLC-VIFPVBQESA-N 280.324 2.103 10 20 CECD CCOc1ccc(CN[C@H](C)c2ccn(C)n2)c(O)c1 839192944 XWWPFEJDTWRFBO-LLVKDONJSA-N 275.352 2.375 10 20 CECD Cc1cc(N(C)C)ccc1CNCCc1cnccn1 840936229 HCLRIPFXDIBHKX-UHFFFAOYSA-N 270.380 2.183 10 20 CECD CC[C@](C)(O)CN[C@@H](C)c1cccc(OC)c1O 846148218 YDSRANTUMRSIPH-HZMBPMFUSA-N 253.342 2.212 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CCN(C)C2)cc1F 740004442 NDZBNFYQFBLQQF-CQSZACIVSA-N 279.403 2.466 10 20 CECD CC(C)(C)CC[C@H](NC(=O)Cc1ccc(N)cc1)C(=O)O 841844885 ADOOSLIEEUQNJP-ZDUSSCGKSA-N 292.379 2.207 10 20 CECD CSCC1(CC(=O)NCCc2ccc(N)cc2)CC1 846665069 FOCQJSCUMLGQOK-UHFFFAOYSA-N 278.421 2.461 10 20 CECD Oc1cccc(Cl)c1CNC[C@@H]1CCCNC1 841033405 SZLYSKDTCDOBFN-SNVBAGLBSA-N 254.761 2.135 10 20 CECD CCNC(=O)NC(=O)[C@H](C)Sc1ncc(Cl)s1 849998655 QYENVEXLWGBFFO-YFKPBYRVSA-N 293.801 2.123 10 20 CECD CCN(Cc1cc(F)cc(C(C)=O)c1O)c1cnn(C)c1 847074092 HLZGCPMVRHSMNG-UHFFFAOYSA-N 291.326 2.494 10 20 CECD Cc1ccc(O)c(CN[C@H]2CCN(CC(F)F)C2)c1 841893678 HVLGJXCOMRNFQP-LBPRGKRZSA-N 270.323 2.130 10 20 CECD CCc1cccc(CNCCOC[C@H]2CCOC2)c1O 848896152 TXAONCJMKZDDBB-ZDUSSCGKSA-N 279.380 2.097 10 20 CECD CCOc1ccc(CN[C@@H]2CCc3c[nH]nc3C2)c(O)c1 758504008 GVBZAWKFURDFKP-CYBMUJFWSA-N 287.363 2.161 10 20 CECD CSC(C)(C)C(=O)NCCc1ccc(N)cc1 851631477 DBUQDNDROYODBN-UHFFFAOYSA-N 252.383 2.069 10 20 CECD c1cc(N2CCCC2)ccc1CN[C@@H]1[C@@H]2C[C@@H]3[C@@H]1NC[C@@H]3C2 925542005 FOJXWRICAVDVLP-JAQSECSASA-N 297.446 2.373 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCCS2)c1 858292166 CVLDNSDCMNUOMS-LBPRGKRZSA-N 280.393 2.395 10 20 CECD C[C@@H](NC[C@H]1CCOC1)c1cc(F)cc(F)c1O 756461840 WGJDNMUFGHIZAG-RKDXNWHRSA-N 257.280 2.358 10 20 CECD C[C@@H](NC[C@@H](O)c1ccco1)c1cc([N+](=O)[O-])ccc1O 756382683 SNHWIFFVUGEALP-NOZJJQNGSA-N 292.291 2.278 10 20 CECD CCOC(C)(C)C(=O)NCc1ccc(N(C)C)c(F)c1 865051565 OALUNDOGHNQWFM-UHFFFAOYSA-N 282.359 2.323 10 20 CECD Cc1cc(N[C@@H](C)Cc2ccc(O)c(O)c2)ncn1 762799865 DBAIHDANMJJBII-JTQLQIEISA-N 259.309 2.239 10 20 CECD CCCOc1ccc(CN[C@H](C)CC(=O)NC)cc1C 873129293 KIYHZAKLNVBJLF-CYBMUJFWSA-N 278.396 2.398 10 20 CECD C[C@@H]1C[C@@H](C)N(C(=O)/C=C/c2ccc(O)c(O)c2)C1 779521828 UZWPBZHNUJUPHH-JYBZGJHDSA-N 261.321 2.368 10 20 CECD C[C@@H](C[C@@H]1CCCC(=O)N1)N[C@H](C)c1ccccc1O 877755644 JNEJWZZLYUNATF-XQQFMLRXSA-N 276.380 2.490 10 20 CECD CCOc1ccc(CN2C[C@H](C)O[C@@H](COC)C2)c(O)c1 784666887 CASHMWALOQFWDR-SWLSCSKDSA-N 295.379 2.027 10 20 CECD Cc1c[nH]cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)c1=O 781417674 KWLRAGQLEIZYJU-UHFFFAOYSA-N 299.374 2.022 10 20 CECD CCc1cccc(CN2CC[C@@H](C3OCCO3)C2)c1O 896379408 YJGMWUORQWBEJC-CQSZACIVSA-N 277.364 2.149 10 20 CECD COc1ccc(CNC(=O)NCCC2CC2)c(O)c1 792965603 NKFRXEICRTZCSY-UHFFFAOYSA-N 264.325 2.000 10 20 CECD CN(C)c1ccc(CN(C(=O)COC(F)F)C2CC2)cc1 795054839 CCBVTQYMWHTUCA-UHFFFAOYSA-N 298.333 2.483 10 20 CECD COC(=O)c1ccc([N+](=O)[O-])c(Sc2nccs2)n1 166890506 YKOSWZVLJHAMGJ-UHFFFAOYSA-N 297.317 2.384 10 20 CECD Cc1ccc(O)c(CN[C@@H](CO)Cc2ccccc2)c1 71409400 LGCZSHHMSIGJMM-MRXNPFEDSA-N 271.360 2.394 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCCC[C@H]2O)c1O 187675505 PGSBXIFBABFXDX-VXGBXAGGSA-N 285.771 2.447 10 20 CECD CCN1CCN(Cc2c(O)cccc2Br)CC1 707154080 DCPWOVUFJOBUGO-UHFFFAOYSA-N 299.212 2.292 10 20 CECD CC(C)O[C@@H]1CCCN(C(=O)NCc2ccc(N)cc2)C1 1335736501 BGYJWCYWWVZLLN-OAHLLOKOSA-N 291.395 2.368 10 20 CECD CN(CCCS(=O)(=O)C(C)(C)C)c1ccc(N)cc1 718748496 WZDZXAISNWPHHO-UHFFFAOYSA-N 284.425 2.308 10 20 CECD CC[C@H](C)[C@H](CNC(=O)NCc1ccc(N)cc1)OC 1336974641 CABXBJXJAWQAIX-FZMZJTMJSA-N 279.384 2.129 10 20 CECD COC(=O)[C@H](C)N(Cc1ccc(N)cc1)C1CCC1 1335287818 BWWBWTMAPBYNKN-NSHDSACASA-N 262.353 2.185 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCC(C)(C)C(=O)O 1606060045 UMLFLHKPLOYCRY-UHFFFAOYSA-N 292.379 2.452 10 20 CECD C[C@H]1CCC[C@]1(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776636389 LNRQZWGRQVDBNC-LKFCYVNXSA-N 294.307 2.033 10 20 CECD CN(Cc1nc(C(=O)O)cs1)c1ccc2c(c1)OCO2 1777080943 VLXQKOACJVICGL-UHFFFAOYSA-N 292.316 2.206 10 20 CECD Cn1cccc1CNCc1ccc(N2CCOCC2)cc1 161763490 DDBNDISVFVYVLN-UHFFFAOYSA-N 285.391 2.152 10 20 CECD Cc1c(C(=O)NCc2c(O)ccc3c2CCCC3)cnn1C 163022256 IJKZIBCPKOZZBF-UHFFFAOYSA-N 299.374 2.243 10 20 CECD CC(C)n1nccc1C(=O)NCc1ccc(N(C)C)cc1 156819126 LWOJURMGGVCLOA-UHFFFAOYSA-N 286.379 2.460 10 20 CECD CCc1cccc(CN2C[C@@H](C)N(C)C[C@@H]2C)c1O 848904455 UKNUPKZUYFBHRO-OLZOCXBDSA-N 262.397 2.479 10 20 CECD COc1ccc(CNCc2ccc(CO)cc2)c(O)c1 227464684 BZDJQNJLNYICBR-UHFFFAOYSA-N 273.332 2.183 10 20 CECD C[C@@H](CCc1ccco1)NC(=O)c1cccc(O)c1O 126321397 HGUTYGCQOHXKCA-JTQLQIEISA-N 275.304 2.442 10 20 CECD COc1ccc(O)c([C@@H](C)NCCn2ccnc2C)c1 271810272 LWSHNMHZIGSTLQ-LLVKDONJSA-N 275.352 2.257 10 20 CECD CN[C@@H](CC(C)(C)C)C(=O)NCc1ccccc1O 387604829 WYUFSJSCPFWUFR-LBPRGKRZSA-N 264.369 2.033 10 20 CECD Cc1cnn(C)c1CNCc1cc(Cl)ccc1O 394054425 AFKGMOQTIATYOL-UHFFFAOYSA-N 265.744 2.377 10 20 CECD Cc1ccc(O)c(CNCc2ccc(C(N)=O)cc2)c1 113313316 IZYRVZSDFNLPAP-UHFFFAOYSA-N 270.332 2.089 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@H](C)OC)c1 170900518 GKLHAIYMHOEHEY-UWVGGRQHSA-N 267.325 2.003 10 20 CECD NC(=O)c1cnccc1NCCCSc1nccs1 302040200 RFALPXFPBVUDAA-UHFFFAOYSA-N 294.405 2.231 10 20 CECD CCOc1ccc(O)c(CNC[C@H]2CC[C@H](O)C2)c1 188828718 NUQQIBWYSALXNZ-AAEUAGOBSA-N 265.353 2.042 10 20 CECD CCCOC(=O)N1CCN(c2ccc(OC)cc2)CC1 312437654 VHJXRNOPMUCNDQ-UHFFFAOYSA-N 278.352 2.364 10 20 CECD C[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CC(C)(C)O1 180982125 USFSCVUQKCFTML-ZRQQLDRUSA-N 291.347 2.137 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)NC(C)C)c1 228945992 ILJWXMDBLOGXHB-NEPJUHHUSA-N 264.369 2.264 10 20 CECD CCCN(Cc1cccc(C)c1O)[C@H]1CCS(=O)(=O)C1 179574037 ZTXHSCATOAMXOO-AWEZNQCLSA-N 297.420 2.100 10 20 CECD COc1ccc(N(C)C[C@@H]2CCOC2)cc1OC 140336278 NNMUARXFTCJXID-NSHDSACASA-N 251.326 2.177 10 20 CECD COc1cccnc1N(C)C(=O)/C=C\c1cccnc1 255903389 AQSSOBFORWENJM-FPLPWBNLSA-N 269.304 2.161 10 20 CECD CCN(CCCC(=O)OC)c1ccc(OC)cc1 265290645 CYHSXJMJAMQHAR-UHFFFAOYSA-N 251.326 2.475 10 20 CECD Oc1cccc(Br)c1CNC1CSC1 706854217 WIOOLUSHTPPITG-UHFFFAOYSA-N 274.183 2.360 10 20 CECD COCC[C@H](CO)N[C@@H](C)c1ccc(C)c(C)c1O 281726202 UVMRRJBNWIPSIL-QWHCGFSZSA-N 267.369 2.057 10 20 CECD Oc1ccc(F)cc1CN1CC[C@H](n2cccn2)C1 291166879 DCNYKDJAUBWRFZ-ZDUSSCGKSA-N 261.300 2.175 10 20 CECD Cc1cc(CN2CC[S@](=O)[C@H](C)[C@@H]2C)ccc1N(C)C 293040906 JRPQLCPZFWPHTH-MNVSYLFESA-N 294.464 2.402 10 20 CECD CN1CCC[C@]2(CCN(Cc3ccccc3O)C2)C1 293617485 KMHMZXZMJLCGBO-INIZCTEOSA-N 260.381 2.310 10 20 CECD CCCOc1ccc(CNc2nc(C)n(C)n2)c(O)c1 291968933 SQMXPXNHJIEXDK-UHFFFAOYSA-N 276.340 2.230 10 20 CECD CN1CCCc2cc(CNC(=O)Nc3ccnnc3)ccc21 297432689 OSLYASWKSRNHGH-UHFFFAOYSA-N 297.362 2.181 10 20 CECD C[C@@H]1C[C@@H](N[C@@H](CN)C2CC2)c2c(O)ccc(F)c21 817961313 XCSPGXHTZJNTHN-FXAINCCUSA-N 264.344 2.407 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1ccc(N(C)C)c(C)c1 815102167 MJSNFNOUTZPBOO-HUUCEWRRSA-N 289.423 2.065 10 20 CECD CC[C@](C)(CC(=O)O)NCc1cc(F)cc(C(C)=O)c1O 828664624 DCGHVWMBOFNOOL-OAHLLOKOSA-N 297.326 2.467 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H](C)C[C@@H](C)N 831211267 FEDHDSYDIJNCIB-OLZOCXBDSA-N 293.411 2.440 10 20 CECD O=C(COC(=O)c1ccccc1F)c1ccc(O)c(O)c1 916589852 AGZXADNCQZPXOA-UHFFFAOYSA-N 290.246 2.277 10 20 CECD COC[C@@H]1CCCCN1C(=O)/C=C/c1ccc(O)c(O)c1 837145184 IKGIKEBMVRDXIV-CFNZNRNTSA-N 291.347 2.139 10 20 CECD CN(CCNC(=O)NCc1ccccc1O)c1ccccc1 748463173 LOPJXPUZEPWTMM-UHFFFAOYSA-N 299.374 2.328 10 20 CECD C[C@H](CC(=O)N(C)Cc1ccccc1O)n1ccnc1 845790834 DMPORNSHBIRJLB-GFCCVEGCSA-N 273.336 2.198 10 20 CECD COc1cccc([C@@H](C)NCCc2nccnc2C)c1O 846168613 BKYXQKUKLUVHKX-LLVKDONJSA-N 287.363 2.393 10 20 CECD CC(C)c1nnc(C(=O)NCc2ccc(O)cc2O)s1 910947017 ZHNBZKZMFAEYEZ-UHFFFAOYSA-N 293.348 2.003 10 20 CECD Cc1ccc(C(=O)C(=O)NCc2ccccc2O)cc1 749267375 MKKCUIZAWRCZMX-UHFFFAOYSA-N 269.300 2.200 10 20 CECD C[C@H]1CC2(CCOCC2)CN1C(=O)c1cccc(O)c1O 844092662 CONIOCJAMHPAHH-NSHDSACASA-N 291.347 2.129 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Cl)ccc2O)CCN1 841061854 OARFNGNAQRTRJH-SKDRFNHKSA-N 254.761 2.276 10 20 CECD CC[C@H](CCO)CN[C@@H](C)c1cccc(OC)c1O 846148876 IBQFUFIOKLUXBP-NWDGAFQWSA-N 267.369 2.460 10 20 CECD COc1cc(O)c(CN[C@H]2CCS[C@@H]2C)cc1OC 843435094 QFIRXEZOUVVNTI-KOLCDFICSA-N 283.393 2.393 10 20 CECD CC[C@@H](CN1CCOCC1)NCc1cc(Cl)ccc1O 922589028 FYQBEDRUZAROSF-AWEZNQCLSA-N 298.814 2.246 10 20 CECD COc1ccc(N2CCCN(CCOC3CC3)CC2)cc1 929314967 HFPUCQZZIIAUKB-UHFFFAOYSA-N 290.407 2.386 10 20 CECD Cc1ccc(O)c(CN[C@H](C)[C@@H](O)C(F)(F)F)c1 865711142 JAAGJNLRVDRPNT-LDYMZIIASA-N 263.259 2.102 10 20 CECD CC(C)C[C@@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756497630 RHDZYVWVOCMHBC-ZYHUDNBSSA-N 282.340 2.358 10 20 CECD C[C@H](N[C@@H](C)C1(CO)CC1)c1cc([N+](=O)[O-])ccc1O 850515993 JKRXNPVNYCGOFI-UWVGGRQHSA-N 280.324 2.112 10 20 CECD CO[C@@H](CNC(=O)c1c(F)ccc(O)c1O)C1CCCC1 857332565 XJUFJOXCRDKWTB-LBPRGKRZSA-N 297.326 2.172 10 20 CECD CCOc1ccc(CN2C[C@H]3CCC[C@]3(N)C2)c(O)c1 857226740 YJHPMFGYWLOCHZ-CJNGLKHVSA-N 276.380 2.104 10 20 CECD CN1CCC[C@H]2CN(C(=O)c3cc(O)cs3)CC[C@@H]21 768265634 VKWYNLKSQNWGLC-JQWIXIFHSA-N 280.393 2.010 10 20 CECD CCOC(=O)/C=C\CN1CCOc2cc(N(C)C)ccc21 930128094 YZSLCNCONJDXDH-WAYWQWQTSA-N 290.363 2.071 10 20 CECD CCCOc1ccc(CNCCN2CCCC2=O)cc1C 873132988 LWONBSLSBVWTFG-UHFFFAOYSA-N 290.407 2.496 10 20 CECD COc1cccc(CN(C)[C@@H](C)C(=O)NC(C)(C)C)c1O 777220440 RHZDNWAZVOJXAU-NSHDSACASA-N 294.395 2.136 10 20 CECD CC(C)n1nccc1C(=O)N(C)c1ccc(N)cc1 877074356 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294.358 2.322 10 20 CECD C[C@H](CC(F)(F)F)NC(=O)c1c(F)ccc(O)c1O 828625044 VMVLREMYDUKDRZ-RXMQYKEDSA-N 281.205 2.308 10 20 CECD C[C@@H](Oc1cccnc1)C(=O)N[C@H](C)c1ccccc1O 827937123 LNLDDAHSTHQIHD-VXGBXAGGSA-N 286.331 2.432 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@@H](O)C1CCC1 825244997 CLVYYGXFILCUGR-CYBMUJFWSA-N 273.735 2.435 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](n3ccnn3)C2)cc1 822498150 VHOTZPUKIGESJI-INIZCTEOSA-N 285.395 2.181 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)c2ccc(C)c(O)c2O)C12CCC2 838118394 UUFDITMBOCTKAE-VXGBXAGGSA-N 291.347 2.094 10 20 CECD COC1CCN(CCN[C@H]2CCc3cccc(O)c32)CC1 834616752 QPEAZFXAEGUZHH-HNNXBMFYSA-N 290.407 2.080 10 20 CECD FC1(F)CCNC[C@H]1CNCc1ccc2c(c1)CCCO2 904386023 NANWYOZZGLKGKP-AWEZNQCLSA-N 296.361 2.346 10 20 CECD O=C(NCC[C@@H]1C[C@H]2CC[C@H]1O2)c1cc(O)cs1 839798261 FRZWRQVBSLKZHO-FBIMIBRVSA-N 267.350 2.141 10 20 CECD O=C(CC(F)(F)C(F)(F)F)NCc1ccc(O)cc1O 910955997 IRAAZXZGKWYHJO-UHFFFAOYSA-N 299.195 2.302 10 20 CECD FC(F)CN1CC[C@H](NCc2ccc3c(c2)CCO3)C1 841894649 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C[C@H](CSc1ncc(Cl)s1)S(C)(=O)=O 850001563 JQZKMPQJRWWDNW-RXMQYKEDSA-N 271.816 2.322 10 20 CECD Cc1ccc2c(c1)N(C(=O)/C=C/c1cn(C)cn1)CC2 931152810 JYHYFZMSIHVOLL-AATRIKPKSA-N 267.332 2.331 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H](C)c1cc(F)cc(F)c1O 756773961 DFKBRZZIAZYPML-PLMOITTCSA-N 298.333 2.236 10 20 CECD COC[C@H](O)CCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756780236 XSJQCOYRFFDSGM-HOSYDEDBSA-N 283.343 2.067 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H]2CCCN(C)C2=O)cc1 766437533 PAZXPFKBNLCGHK-CJNGLKHVSA-N 289.423 2.414 10 20 CECD COc1cccc(O)c1CN1CC[C@H]2[C@@H](CCCN2C)C1 770352407 NLDIEIVAAZUKMW-ZFWWWQNUSA-N 290.407 2.317 10 20 CECD CC[C@]1(O)CCCN(Cc2cc(F)ccc2O)C1 877691721 UMHBSZAHRJJEAG-AWEZNQCLSA-N 253.317 2.268 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1c[nH]cc1C1CC1 879207849 MXQHYRRSKVVGND-UHFFFAOYSA-N 286.331 2.276 10 20 CECD Cc1ccc(C(=O)OC[C@H]2CCCCO2)c(O)c1O 778112056 BCOQDCGFKMPUEG-SNVBAGLBSA-N 266.293 2.132 10 20 CECD Cc1nocc1CNC(=O)N(C)Cc1ccccc1O 875953237 NTMNBTPHAINKIO-UHFFFAOYSA-N 275.308 2.030 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC(F)(F)C2)cc1 776301932 ODXOTNMWICHBQD-UHFFFAOYSA-N 283.322 2.303 10 20 CECD CC[C@@H](NCc1ccc(Br)cc1O)[C@H](C)O 691486628 AYITYVZVHNWVKC-GZMMTYOYSA-N 288.185 2.404 10 20 CECD CC[C@H](F)C(=O)NCc1ccc(N(C)C)cc1C 1120950411 XNHIQXYPWRFYQY-ZDUSSCGKSA-N 252.333 2.425 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1cc(C)cc(OC)c1O 894195018 TXLXDMPZNFKQSG-GFCCVEGCSA-N 294.395 2.104 10 20 CECD COc1ccc(CN[C@H]2CCO[C@@H](C)C2)c(O)c1OC 893219443 GYFPUSPFDZIJEW-JQWIXIFHSA-N 281.352 2.067 10 20 CECD COc1cc(C)cc(CNC[C@H](C)C[C@@H](C)O)c1O 894291822 FLPJJUQKRJTDMK-VXGBXAGGSA-N 267.369 2.206 10 20 CECD Cc1nc([C@@H]2CCN(Cc3ccc(N(C)C)cc3C)C2)n[nH]1 895012961 QEIOIPLNPOHANV-OAHLLOKOSA-N 299.422 2.477 10 20 CECD COc1ccc(CNC/C=C\Cl)c(O)c1OC 898424079 BNYZASRZXMONOC-UTCJRWHESA-N 257.717 2.252 10 20 CECD CN1CCN(c2ccc(CNC(=O)C=C3CCC3)cc2)CC1 893608228 SXHKDZWOVPUSBD-UHFFFAOYSA-N 299.418 2.165 10 20 CECD Cc1coc(C)c1C(=O)OCC(=O)c1ccc(O)c(O)c1 792758075 QSZCRHXOAHBOQM-UHFFFAOYSA-N 290.271 2.347 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](CCC(=O)O)C2)cc1 134704563 WKJCZTPHRUTZDB-CQSZACIVSA-N 276.380 2.439 10 20 CECD CCOc1ncccc1NC(=O)c1cccc(O)c1O 188177677 QZLQHSPISYSHOQ-UHFFFAOYSA-N 274.276 2.144 10 20 CECD COc1cccc(O)c1CN(C)CC(C)(C)OC 770316166 CHCIYQDUTLYFJA-UHFFFAOYSA-N 253.342 2.258 10 20 CECD CCOc1ccc(N2CCN(CCC[C@@H](C)O)CC2)cc1 1347839254 DTNVWZZZXLPEBR-OAHLLOKOSA-N 292.423 2.368 10 20 CECD CCCN(Cc1ccccc1O)c1nnnn1C1(C)CC1 1262216498 DDKPGIVBMLOCNU-UHFFFAOYSA-N 287.367 2.304 10 20 CECD Cc1cc(O)c(CN2CC[C@@](F)(C(=O)O)C2)c(Cl)c1 1600286841 XIAYLKAUPHIIIU-ZDUSSCGKSA-N 287.718 2.353 10 20 CECD CC[C@@H]1CN(Cc2cc(F)c(F)cc2O)CC[C@H]1N 1577279211 ALMWYTBGQOCWCD-NOZJJQNGSA-N 270.323 2.230 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H]1CCNC1 1579674167 NTCRWNOCYGAESV-GFCCVEGCSA-N 289.404 2.247 10 20 CECD C[C@H]1CCC[C@]1(NCc1ccc(N(C)C)cc1)C(=O)O 1776639605 MOGZYFGAQIYOQR-BLLLJJGKSA-N 276.380 2.486 10 20 CECD COc1cc(CN2CCO[C@@H](C)[C@@H]2C)c(O)cc1C 160433092 WVGSFMPIPJROTK-RYUDHWBXSA-N 265.353 2.318 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CC2(Cl)Cl)c1 155974067 BQANKPIYSGSDSS-VIFPVBQESA-N 290.146 2.211 10 20 CECD C[C@H](c1ccncc1)N(C)C(=O)Cc1ccc(N)cc1 37823902 CLMZBWWVZOXRTM-GFCCVEGCSA-N 269.348 2.426 10 20 CECD COc1ccc(CNCC2([S@@](C)=O)CC2)cc1C 282485603 VRMKDUSEJWBORI-GOSISDBHSA-N 267.394 2.004 10 20 CECD COC1(CCNC(=O)Nc2ccc(N)cc2)CCC1 312039872 QOVSJIZEMZNSAL-UHFFFAOYSA-N 263.341 2.350 10 20 CECD Cc1cc(CNCc2cc3c(cc2O)OCO3)ccn1 391154217 DORWKDQWEYJAMV-UHFFFAOYSA-N 272.304 2.114 10 20 CECD O=C(COc1ccc(N2CCCC2)cc1)N1CCCC1 178197101 LGSVTWNSANYWJS-UHFFFAOYSA-N 274.364 2.288 10 20 CECD C[C@@H](N[C@@H]1CCCCNC1=O)c1cc(Cl)ccc1O 184982083 MCLWOCXWDZAYEF-BXKDBHETSA-N 282.771 2.365 10 20 CECD CN(C)c1ccc(CN2CC[C@](C)(C(=O)O)C2)cc1 86778921 CGAYVXVRDMYMFV-HNNXBMFYSA-N 262.353 2.049 10 20 CECD COc1cccc(CNS(=O)(=O)C2CCCCC2)c1O 266168046 MOMIOBUIWXSRHF-UHFFFAOYSA-N 299.392 2.153 10 20 CECD Cc1c(CN=c2ncnc3[nH][nH]cc2-3)n(C)c2ccccc12 358821944 GDYAFYTZUZNGJI-UHFFFAOYSA-N 292.346 2.139 10 20 CECD Cc1ccc(C(=O)N(C)C[C@H]2CCCCO2)c(O)c1O 267599857 PBQAJADFWFDVFO-LLVKDONJSA-N 279.336 2.047 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2ccc(N(C)C)c(F)c2)C1 271191267 QGRXHTGBSAACTI-MRXNPFEDSA-N 294.370 2.277 10 20 CECD C[C@H](N[C@@H](C)c1nncn1C)c1ccc(F)c(F)c1O 276896663 INBQECQIBGRBQX-YUMQZZPRSA-N 282.294 2.211 10 20 CECD CC[C@@H](NC[C@@H](COC)OC)c1ccc(C)cc1O 280269070 XSTPRBNEUPVDIO-GXTWGEPZSA-N 267.369 2.403 10 20 CECD CCN(CC)c1ccc(CNc2nnc(CO)o2)cc1F 283989023 PQMAYIIJYCMLFQ-UHFFFAOYSA-N 294.330 2.159 10 20 CECD Cc1nn(C)c(C)c1NC(=O)NCc1ccccc1O 299529917 SDAUXWPDYSGVPH-UHFFFAOYSA-N 274.324 2.064 10 20 CECD CC(C)(C)n1cc(C(=O)NCc2ccccc2O)cn1 299537029 IBQJVUZEBODPAT-UHFFFAOYSA-N 273.336 2.274 10 20 CECD C[C@H]1CSC[C@@H]1NC(=O)N(C)Cc1ccccc1O 807476293 CQUJUCGIDWQIIA-JQWIXIFHSA-N 280.393 2.285 10 20 CECD COC(=O)[C@@H](CNCc1cc(F)ccc1O)CC(C)C 813332183 QOMNHCJOFGKYEA-GFCCVEGCSA-N 283.343 2.456 10 20 CECD CCn1cc(NC(=S)NCc2ccccc2O)cn1 726130441 PPKUSGAEBBDPPO-UHFFFAOYSA-N 276.365 2.095 10 20 CECD Cc1cc(CN(C)CCC(N)=O)ccc1N1CCCCC1 829764164 XAEZGRAHLWFPCS-UHFFFAOYSA-N 289.423 2.293 10 20 CECD CCOc1ccc(CNc2ccnc(COC)n2)c(O)c1 902134589 KIVWQALHEVAMKW-UHFFFAOYSA-N 289.335 2.339 10 20 CECD O=C(NC[C@@H]1OCCc2ccccc21)c1cc(O)cs1 733363770 GOEQEBFITBSIIX-ZDUSSCGKSA-N 289.356 2.498 10 20 CECD CCCN(CC(=O)O)Cc1ccc(N(C)C)cc1C 901605104 HHJHGUQAKOAJAI-UHFFFAOYSA-N 264.369 2.358 10 20 CECD C[C@@H]1C[C@@H](NC[C@@H]2CCN2C)c2c(O)ccc(F)c21 903317403 KGGHHEVWHDIFNG-JFGNBEQYSA-N 264.344 2.373 10 20 CECD CCn1ccnc1CN(C)c1ccc(OCC(=O)O)cc1 833683360 NPSVYQTWSSGNEZ-UHFFFAOYSA-N 289.335 2.003 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C(=O)O)C2CC2)cc1 901475265 OCMMYFFBAYMYSP-OAHLLOKOSA-N 276.380 2.486 10 20 CECD CC[C@H](N[C@@H]1COCC[C@H]1OC)c1ccc(F)cc1O 903296570 JLUFZHPHTQSJDY-GZBFAFLISA-N 283.343 2.376 10 20 CECD O=C(OCCOCC(F)(F)F)c1cc(O)cs1 733496975 OKSRIXBFZFNEDG-UHFFFAOYSA-N 270.228 2.189 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cc(OC)ccc2O)[C@@H]1SC 838948545 UDVCEJSMYQOADF-YUELXQCFSA-N 297.420 2.399 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2CCN)c1O 843384952 LQJFMLCVWIXFAD-AWEZNQCLSA-N 294.370 2.437 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@H](N)[C@H]3C2)cc1F 843059939 VQTPVOWWXPWHGM-DZKIICNBSA-N 291.414 2.451 10 20 CECD CCOC1CCN(C(=O)NCCc2ccc(N)cc2)CC1 841963370 ZYQNSLKBEMRBBN-UHFFFAOYSA-N 291.395 2.022 10 20 CECD CCN1CC[C@@H](N(C)C(=O)Cc2ccc(N)cc2)C[C@@H]1C 844184973 BAFKKNMDHLRLBX-XJKSGUPXSA-N 289.423 2.143 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)N[C@@H](C)CCN 841968306 VZEQJJRKRLCKGP-ZDUSSCGKSA-N 293.411 2.441 10 20 CECD Cc1ccc(CNC(=O)NCCc2ccc(N)cc2)nc1C 841915198 NRKFGJGNIOJEOJ-UHFFFAOYSA-N 298.390 2.323 10 20 CECD CO[C@@H](C)CNCc1ccc(Br)cc1O 691398923 CAGUYPGAFGLNDE-QMMMGPOBSA-N 274.158 2.279 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](C)CCO)c1O 846149129 VZZVNLFLUAZHNG-WDEREUQCSA-N 253.342 2.070 10 20 CECD Cn1c(=O)oc2c(NC(=O)c3cc(O)cs3)cccc21 753843936 ZBEOHNGSEQYQDO-UHFFFAOYSA-N 290.300 2.151 10 20 CECD C[C@H](CO)N(Cc1ccccc1)C(=O)c1cc(O)cs1 921479325 HENNNSKKOGWABF-LLVKDONJSA-N 291.372 2.477 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1cncc(O)c1 857548327 JFYJVYQCLCWWKB-UHFFFAOYSA-N 278.695 2.076 10 20 CECD C[C@H]1C[C@H](C(=O)N(C)Cc2ccccc2O)CCC1=O 763911994 ZYAYRMKTSXLKSG-NWDGAFQWSA-N 275.348 2.356 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@](C)(O)C(C)C)c1 185433883 FUOUVSUCZGVEPM-NHYWBVRUSA-N 267.369 2.458 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CC3(CC3)C(=O)O2)c1 763728024 CSJPBDWZCJZSBX-JQWIXIFHSA-N 291.347 2.147 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1nncn1C 766269543 LJOGXMMXBPVSJW-UHFFFAOYSA-N 272.352 2.167 10 20 CECD CC1(C)CN(Cc2cccc(Cl)c2O)CCN1 775665421 ANBJTDRRQZFPAT-UHFFFAOYSA-N 254.761 2.229 10 20 CECD Cc1cccc(O)c1CN1CCO[C@@H]([C@H]2CCCO2)C1 876805658 DSHRYPBTZZAKPL-HZPDHXFCSA-N 277.364 2.080 10 20 CECD Cc1ccc(CNCc2ccc(N(C)C)nc2)c(O)c1 876926813 GZVHYRGLRPARJC-UHFFFAOYSA-N 271.364 2.451 10 20 CECD C[C@@H](NC(=O)c1ccc(O)nc1)c1ccc(N(C)C)cc1 773013059 ZLRHMJRSYZRXEH-LLVKDONJSA-N 285.347 2.344 10 20 CECD Cc1ccc(CNCCNC(=O)c2cccs2)c(O)c1 876942290 WRGZGLCPVMXXRC-UHFFFAOYSA-N 290.388 2.282 10 20 CECD CCCN1CCC[C@@H]1C(=O)N(C)c1ccc(N)cc1 877077330 DGCGCEKYPXTSLH-CQSZACIVSA-N 261.369 2.106 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@]12CCC[C@@H]1C2 887036009 GISKPSWZFGHTQT-ZMVHBIPDSA-N 259.305 2.170 10 20 CECD C[C@H](CN[C@H](C)c1c(O)cccc1F)CN1CCOCC1 886530360 ISQFJEWTSVUYEC-CHWSQXEVSA-N 296.386 2.150 10 20 CECD CCC[C@](C)(NCc1cc(F)cc(F)c1O)C(=O)OC 894137139 MHMOZKISOBBORA-AWEZNQCLSA-N 287.306 2.492 10 20 CECD CN(Cc1cc(F)cc(F)c1O)C[C@@H]1CCC[C@@H]1O 894090004 YUWOIXQRYGQAGZ-ZANVPECISA-N 271.307 2.263 10 20 CECD COc1ccc(CNc2ccc([N+](=O)[O-])cn2)c(O)c1 795283581 CLSLYKLLLITFFF-UHFFFAOYSA-N 275.264 2.316 10 20 CECD COC(=O)CN(Cc1cc(F)cc(F)c1O)C(C)C 893959031 RDHYEZZCWWXVGE-UHFFFAOYSA-N 273.279 2.054 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C[C@H]2CCOC2)c1O 79498187 DFGMJIDHWSBKDL-LLVKDONJSA-N 281.327 2.202 10 20 CECD CC(C)CN(C)c1nnc(-c2sccc2O)n1C 1350469602 LOTREXQBAUQCAO-UHFFFAOYSA-N 266.370 2.341 10 20 CECD C[C@@H](NCCC(=O)O)c1cc2c(cc1O)CCCC2 1603248036 SPMSQAQKQRDTNI-SNVBAGLBSA-N 263.337 2.396 10 20 CECD CCOc1ccc(CNc2ccc(C(=O)O)nc2)c(O)c1 1605690974 WQOIVFKUELJCMS-UHFFFAOYSA-N 288.303 2.496 10 20 CECD CN(CCCNCc1ccc(N)cc1)CC(F)(F)F 1578469107 AHKBKVPCSVKYOE-UHFFFAOYSA-N 275.318 2.243 10 20 CECD COc1cc(C)c(CNC[C@]23CCC[C@H]2NCC3)c(O)c1 1579145248 XTUYFRJWWYNHPN-IAGOWNOFSA-N 290.407 2.331 10 20 CECD CC(C)COC[C@@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 151421482 CCKZNNJCKSZGOT-PBHICJAKSA-N 294.439 2.437 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cc2occc2[nH]1 159826553 ICVURCSUCDXKKC-UHFFFAOYSA-N 286.287 2.145 10 20 CECD CCCN(Cc1cc(F)ccc1O)[C@H]1CCNC1 219894128 AVRVBEKSYWONPX-ZDUSSCGKSA-N 252.333 2.105 10 20 CECD Cc1ccc(CNC(=O)c2cccc(O)c2O)cc1 126230932 KLAKVPRVJNSZSE-UHFFFAOYSA-N 257.289 2.336 10 20 CECD CO[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)CC1 378628097 CFNBYYPGXZNZAI-LBPRGKRZSA-N 279.336 2.122 10 20 CECD COc1ccc(O)c(CNC[C@H]2CC[C@H](C)O2)c1 398118637 ADXOPCLWVNDLCV-GXFFZTMASA-N 251.326 2.058 10 20 CECD C[C@@H](NC(=O)C12CCCN1CCC2)c1ccccc1O 1348988156 YBMVVDFDAIGSHC-GFCCVEGCSA-N 274.364 2.198 10 20 CECD COc1ccc(O)c(CNc2ncnc3ncccc23)c1 119482783 MIDLKGALTKMHGS-UHFFFAOYSA-N 282.303 2.351 10 20 CECD C[C@H](Oc1cccnc1)C(=O)NCc1ccc(N(C)C)cc1 117581553 BHLIPPJCZTWAMQ-ZDUSSCGKSA-N 299.374 2.231 10 20 CECD CCC[C@H](C)C(=O)NCc1cccc(OC)c1O 113423301 AFCZRAHARLWDHB-JTQLQIEISA-N 251.326 2.453 10 20 CECD CC[C@H](C)[C@@](C)(O)CNCc1cc(OC)ccc1O 305756999 APSCCYZAHNFYCM-NHYWBVRUSA-N 267.369 2.288 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(N3CCOCC3)cc2)CCO1 219887646 QVRPSKLSRLVJNF-HOCLYGCPSA-N 290.407 2.180 10 20 CECD CCN1CCC(N(C)Cc2cc(OC)ccc2O)CC1 131570254 MZWQZRVBYMAKNT-UHFFFAOYSA-N 278.396 2.317 10 20 CECD O=C(CSc1nccs1)NCCOc1ccccc1 44983381 ZNYPMCPFNWZEJQ-UHFFFAOYSA-N 294.401 2.430 10 20 CECD CC[C@]1(CO)CCCN1Cc1cccc(OC)c1O 191958389 PAPSZABDVYYNNC-OAHLLOKOSA-N 265.353 2.138 10 20 CECD COCCOCCCN[C@@H](C)c1cc(F)ccc1O 94616979 HRSTZAINQGUQRK-NSHDSACASA-N 271.332 2.235 10 20 CECD CCOc1ccc(N(CC)C[C@@H]2CCS(=O)(=O)C2)cc1 279914072 FLWIVNCVHQAVBM-ZDUSSCGKSA-N 297.420 2.346 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CCCCNC2=O)c(O)c1C 273411832 PVMRHEGWJAZVOF-JSGCOSHPSA-N 276.380 2.328 10 20 CECD CC[C@@H](NCCc1n[nH]c(C)n1)c1ccc(C)cc1O 280251942 WSFDTZQFXVAIQU-CYBMUJFWSA-N 274.368 2.411 10 20 CECD Cc1cccc(CN2CCOC[C@H]2[C@@H]2CCCO2)c1O 377706849 ZHRJAIVLNYIQDY-GJZGRUSLSA-N 277.364 2.080 10 20 CECD CC(C)N(C)S(=O)(=O)Nc1cc(Cl)c(O)cc1F 288236993 NVQSEXMQFKHEBK-UHFFFAOYSA-N 296.751 2.182 10 20 CECD COc1ccc(O)c(CNC(=O)c2ocnc2C2CC2)c1 809679589 DSVMQXJVCPPJOU-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CCN(Cc1cc(Br)ccc1O)[C@H](C)CO 292767396 KCFKJZWRBYZAKF-SECBINFHSA-N 288.185 2.357 10 20 CECD COc1ccncc1COC(=O)c1ccc(C)c(O)c1O 805433602 TXBGMSGNPNTWES-UHFFFAOYSA-N 289.287 2.167 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1c(C)cc(C)cc1O 294657402 HDTMNAWOOVPSDG-OLZOCXBDSA-N 299.436 2.483 10 20 CECD O=C(NCc1cnn2ccccc12)c1cc(O)cs1 807689939 MSYPSXPQRNLVHG-UHFFFAOYSA-N 273.317 2.031 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)C[C@@H](CO)C2)c1 817412920 QZCRPWYOCPIYDS-CHWSQXEVSA-N 279.380 2.241 10 20 CECD CCOc1cccc(CN2C[C@H](C)C[C@@H](CO)C2)c1O 817413143 USJZTTXQUZTGMT-CHWSQXEVSA-N 279.380 2.241 10 20 CECD COC[C@H](C)[C@@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 812487534 BVLMZNAENMYYCC-NWDGAFQWSA-N 296.386 2.427 10 20 CECD O=C(CSc1nc2c([nH]1)CCC2)c1ccc(O)c(O)c1 813582946 CGTDSOHMIHPYMP-UHFFFAOYSA-N 290.344 2.285 10 20 CECD Cn1c(-c2ccccc2)cnc1SCC(C)(CO)CO 821069350 KCTMTYDMYZBOKI-UHFFFAOYSA-N 292.404 2.170 10 20 CECD OC[C@H](C1CC1)[C@H](NCc1ccccc1O)C1CC1 824845091 HOMWBWCCNVISTP-GDBMZVCRSA-N 261.365 2.279 10 20 CECD Cc1ncsc1CNC(=O)c1cc(O)cs1 732287011 LUVUGKRVSBUDTR-UHFFFAOYSA-N 254.336 2.149 10 20 CECD CN(Cc1ccn(C)c1)c1ccc(OCC(=O)O)cc1 902016816 QBFJZETXNILCAJ-UHFFFAOYSA-N 274.320 2.125 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCO[C@]3(CCOC3)C1)CC2 834697448 LHVOACUKANUMHX-CKEIUWERSA-N 289.375 2.307 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 837137450 GHHRZFORDYCMPR-DERGHVRDSA-N 291.347 2.185 10 20 CECD CC[C@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(F)cc1O 834907512 URYQNCGXTOFGIG-NDMJEZRESA-N 280.343 2.226 10 20 CECD Cc1cc(O)c(CNC[C@@H]2CC(=O)N(C3CC3)C2)cc1C 846076161 ZYXFPOCCAZEVOC-ZDUSSCGKSA-N 288.391 2.110 10 20 CECD COCCCCN[C@H](C)c1cccc(OC)c1O 846140431 RNXIKUYQFAWFGU-LLVKDONJSA-N 253.342 2.478 10 20 CECD C[C@@H](O)CN(Cc1c(O)cccc1Cl)C1CC1 848928607 IQNMGCRICRLGHH-SECBINFHSA-N 255.745 2.391 10 20 CECD CCOC(=O)CN(C)Cc1ccc(N(C)C)cc1C 840909739 HEZPBDXCKYXBII-UHFFFAOYSA-N 264.369 2.056 10 20 CECD CCc1cccc(CN2CCC(CC(N)=O)CC2)c1O 848881964 VDHLJISUBCENRN-UHFFFAOYSA-N 276.380 2.042 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 843058675 VSJXVTDCYSQTPM-YPMHNXCESA-N 265.376 2.061 10 20 CECD CC[C@H](C)C[C@H](CO)NCc1cc2c(cc1O)OCO2 842754599 QSWDLJPRPYGNJB-CMPLNLGQSA-N 281.352 2.008 10 20 CECD C[C@@H](N[C@@H](CO)CCF)c1cc(Cl)ccc1O 846209840 VUJDFTVEQAMKDZ-PSASIEDQSA-N 261.724 2.417 10 20 CECD CCOc1cccc(CN[C@@H]2CCN[C@@H](C)C2)c1O 841062939 ZNDKBKOEUSIGMF-WCQYABFASA-N 264.369 2.021 10 20 CECD C[C@H](NC[C@]1(O)CCO[C@@H]1C)c1ccc(Cl)cc1O 841753367 SKXUPLFQKOWSHO-IMSIIYSGSA-N 285.771 2.236 10 20 CECD CN(C[C@@H]1CC=CCC1)C(=O)C(=O)Nc1ccc(N)cc1 841087731 VKOIMRAVKWIIAH-GFCCVEGCSA-N 287.363 2.022 10 20 CECD CCc1cccc(CNC2CCN(C(=O)OC)CC2)c1O 848895821 ZAJGRQITNJISDY-UHFFFAOYSA-N 292.379 2.275 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1cnn(CCF)c1 857548101 CZMUXDPLMDGGJG-UHFFFAOYSA-N 297.717 2.142 10 20 CECD C/C=C\C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920879852 VTYUYHHIASUDEW-SCOBNMCVSA-N 274.364 2.277 10 20 CECD CCN(CCN)Cc1cc(Cl)cc(C(C)=O)c1O 863550609 BNKQJBIFEMRLLV-UHFFFAOYSA-N 270.760 2.029 10 20 CECD CCN(CCOC)Cc1cc(F)c(N(C)C)cc1F 862216970 UPNDZSXKQCPCKV-UHFFFAOYSA-N 272.339 2.499 10 20 CECD CC[C@H](N[C@@H]1COCC[C@H]1O)c1cc(Cl)ccc1O 866497512 HRBIUEPAWDDJJR-OUCADQQQSA-N 285.771 2.236 10 20 CECD CC1(C)CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768465627 JNUHLGVUQQMBGD-CYBMUJFWSA-N 263.337 2.050 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC/C=C\C2CC2)c1O 1117762105 LLBCADXFSZTYTK-IHWYPQMZSA-N 278.308 2.365 10 20 CECD N[C@@H](CC1CC1)C(=O)NCc1ccc(N2CCCC2)cc1 884193391 FEMHDBBKMRLGOW-INIZCTEOSA-N 287.407 2.030 10 20 CECD Nc1ccc(CC(=O)N[C@@H]2CCCc3cccnc32)cc1 1122227449 OMSKFRPZMGTJPH-OAHLLOKOSA-N 281.359 2.400 10 20 CECD COc1ccc(CN2C[C@H]3[C@H](C2)C3(F)F)c(O)c1OC 895185430 MGHPJZUIFLNQPG-UWVGGRQHSA-N 285.290 2.106 10 20 CECD COCCCCCNCc1ccc(OC)c(OC)c1O 892748109 GCUOMJSNWNENNZ-UHFFFAOYSA-N 283.368 2.316 10 20 CECD C[C@H]1C[C@H](NCCCCO)c2c(O)ccc(F)c21 786939685 DZEFLXKQHLYTJX-ONGXEEELSA-N 253.317 2.442 10 20 CECD CCOC(=O)CN(Cc1cc(F)cc(F)c1O)C(C)C 893968131 YOENKLQQPORTLN-UHFFFAOYSA-N 287.306 2.444 10 20 CECD O=C(NCCF)NCc1ccc(N2CCSCC2)cc1 798057453 NNNSJOKGHCHZPM-UHFFFAOYSA-N 297.399 2.009 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)[C@H]1CCCNC1 699664736 JUGKGWGWIPXFFV-HIFRSBDPSA-N 261.413 2.230 10 20 CECD CCOc1cccc(CN2CC[C@]3(CCOC3)C2)c1O 93820259 ICUCMPZTLRZMMC-INIZCTEOSA-N 277.364 2.403 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1C[C@@H]1F 1346494406 GBCHHECGLOCZOL-YUMQZZPRSA-N 260.359 2.100 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@](C)(O)CC)cc1 1351363191 MYEQWKQNBCQKKG-INIZCTEOSA-N 278.396 2.310 10 20 CECD CN(C)c1ccc(CNC(=O)NCCC(F)F)cc1 1518741938 ODJVAQZDQICRDL-UHFFFAOYSA-N 271.311 2.207 10 20 CECD CCOc1cc(Sc2ncc(C(=O)O)s2)nc(C)n1 1605676540 ZMHIBFWFMMKXCG-UHFFFAOYSA-N 297.361 2.490 10 20 CECD C[C@@H](NC[C@H]1CCSC1)c1cc(C(=O)O)ccc1O 1604336744 AZTILGZYQZQRKF-NXEZZACHSA-N 281.377 2.494 10 20 CECD CC(=O)CCC(C)(C)C(=O)NCCc1ccc(N)cc1 1574980923 INQQJBZXMWNZAE-UHFFFAOYSA-N 276.380 2.323 10 20 CECD CN(C)c1cc(F)c(CN2CC[C@H]3CC[C@@]32CN)cc1F 1578423086 PGYHIPSEOCTYHU-MLGOLLRUSA-N 295.377 2.344 10 20 CECD CC(C)c1ccc(O)c(CN[C@H]2C[C@H](C(=O)O)C2)c1 1588968561 LIYLKOQROBABBX-AULYBMBSSA-N 263.337 2.468 10 20 CECD CCc1nc(CNCc2cc(OC)ccc2O)co1 825058226 UXLGWEFPGSYSDB-UHFFFAOYSA-N 262.309 2.241 10 20 CECD Oc1ccc(F)cc1CN1CCC([C@H]2CCCN2)CC1 219569749 MPPRCNLWYSHTGZ-OAHLLOKOSA-N 278.371 2.495 10 20 CECD c1cc(N2CCOCC2)ccc1CN[C@@H]1CCSC1 230704051 DQSDAXRIMGOEPG-CQSZACIVSA-N 278.421 2.118 10 20 CECD CN(C)c1ccc(CN2CCCC[C@H]2CCN)cc1 70148696 HMQXFSNGQPIELB-INIZCTEOSA-N 261.413 2.456 10 20 CECD CN(CC(=O)N(C)C)Cc1ccc(N2CCCCC2)cc1 52686775 RFDCCVMFJAIZSP-UHFFFAOYSA-N 289.423 2.197 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2C[C@H]2C2CC2)cc1 176564125 CNNRQLBCBPYNHS-GJZGRUSLSA-N 258.365 2.415 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CCN(C2CC2)C1 124806592 JEPWHSMMPZHSPY-NSHDSACASA-N 266.772 2.372 10 20 CECD C[C@](CO)(NCc1ccc2c(c1)CCCO2)C1CC1 921828745 VASKBXUTUBLROX-MRXNPFEDSA-N 261.365 2.262 10 20 CECD COc1ccc(O)c(CNC(=O)CCCOC(C)C)c1 183653091 UGGDWXYLBLAYRU-UHFFFAOYSA-N 281.352 2.222 10 20 CECD C[C@H](CNC(=O)c1cccc(O)c1O)Oc1ccccc1 185654855 JKAJYFIWZVEREI-LLVKDONJSA-N 287.315 2.295 10 20 CECD Cn1cc(CCCNCc2ccc3c(c2)CCO3)cn1 237900168 DZKNSJNBXANDGL-UHFFFAOYSA-N 271.364 2.077 10 20 CECD CC(C)COC[C@@H](O)CN[C@@H](C)c1ccc(F)cc1O 185116974 OTZQTMLLTLWDGV-AAEUAGOBSA-N 285.359 2.215 10 20 CECD CC[C@H](C(=O)O)N1CCCN(c2ccc(OC)cc2)CC1 191429950 VEDPZVMZVRWRHT-OAHLLOKOSA-N 292.379 2.071 10 20 CECD CCN(CC)c1ccc(CNCC[S@@](C)=O)cc1 134742592 XTXBWMGLCKSYQI-SFHVURJKSA-N 268.426 2.001 10 20 CECD Cc1cc(O)c(CN2CC(=O)N[C@H]3CCCC[C@H]32)cc1C 245568676 VJRDOOSNBPPNLX-LSDHHAIUSA-N 288.391 2.252 10 20 CECD C[C@H]1CC[C@H](CCC(=O)NCc2ccccc2O)O1 266641175 YIIOQHRUXGCTLH-WCQYABFASA-N 263.337 2.356 10 20 CECD CCCS(=O)(=O)CCN(CC)c1ccc(OC)cc1 269651013 VHPMLZVQDZAEEO-UHFFFAOYSA-N 285.409 2.346 10 20 CECD COc1cccc(CNC(=O)Nc2c(C)noc2C)c1O 264209311 GTNSCOBZIOEWCA-UHFFFAOYSA-N 291.307 2.327 10 20 CECD CCN1C(=O)/C(=C\c2ccn(C)c2)SC1=S 270637239 WZNXDFFLSWDTTM-RMKNXTFCSA-N 252.364 2.246 10 20 CECD C[C@H]1OCC[C@]12CN(Cc1cc(Cl)ccc1O)CCO2 377274180 WNSLEDALAUGYPI-ABAIWWIYSA-N 297.782 2.425 10 20 CECD C[C@@H](O)c1ncc(CNCc2ccccc2O)s1 289046689 BBIHYPORPDZPKE-SECBINFHSA-N 264.350 2.192 10 20 CECD Cc1cccc(CCNC(=O)NCc2ccccc2O)n1 280758155 IKXWAOYSTHTHRT-UHFFFAOYSA-N 285.347 2.138 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H]1c1ncc[nH]1)OCO2 375356415 ZOEVSDIXFYHCIB-LLVKDONJSA-N 287.319 2.181 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N(C)CCO)c1C 298423367 GXDJZBMTNWROLF-UHFFFAOYSA-N 286.375 2.467 10 20 CECD CCN[C@H](C)CN[C@H](C)c1cc(OC)ccc1O 817973994 XGVHWUDWQPNBNU-GHMZBOCLSA-N 252.358 2.049 10 20 CECD Cc1nc([C@H](C)OC(=O)/C=C/c2ccc(O)c(O)c2)no1 811156222 JANFJLLJGFWWLV-JQTRYQTASA-N 290.275 2.107 10 20 CECD CCNCCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 817952084 MVESDTPSQWGSNJ-ONGXEEELSA-N 252.333 2.279 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H]3C[C@@H]3C2)c1O 827506219 FBZNURCJDIIOON-MWLCHTKSSA-N 278.308 2.151 10 20 CECD CCN(CC[C@@H](C)O)c1ccc(OC)c(OC)c1 828162513 IBVQIDPDANBBQV-LLVKDONJSA-N 253.342 2.301 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C(=O)O)C(C)(C)C)c1O 825946519 CFEBSLWJEFRGSA-CYBMUJFWSA-N 297.326 2.323 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2C[C@@H](O)C2)c2c(O)ccc(F)c21 834904633 ANMUZPOEPFPZJQ-SDNRWEOFSA-N 251.301 2.193 10 20 CECD CCOc1ccc(CN[C@H]2CO[C@@H](C)C2)c(O)c1 842776761 ZRIBUOZRXZLGSO-CMPLNLGQSA-N 251.326 2.058 10 20 CECD C[C@H](CNCc1ccc(N2CCCCC2)cc1)C(=O)O 848638401 RQKOVQHAUIYCAL-CYBMUJFWSA-N 276.380 2.487 10 20 CECD COc1ccc(N2CCC(NCC3(N)CCC3)CC2)cc1 841049857 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Cc1ccc(O)c([C@@H](C)NCC(=O)NC2CCCC2)c1 756703958 CXPFPMWPLYHTKI-GFCCVEGCSA-N 276.380 2.410 10 20 CECD CO[C@H](C)CN(C)Cc1cc(F)c(N(C)C)cc1F 862366524 RTMCLWQJMSTRDK-SNVBAGLBSA-N 272.339 2.498 10 20 CECD C[C@@H](NC(=O)N[C@H]1CCC[C@H]1CCO)c1ccccc1O 875516385 VUQSRZCKHTWHSX-DYEKYZERSA-N 292.379 2.304 10 20 CECD O=C(O)[C@@H](CC1CCC1)NCc1cc(F)cc(F)c1O 1119612214 XFQVEEHTJYOFFG-GFCCVEGCSA-N 285.290 2.403 10 20 CECD O=C(OCc1cn2ccccc2n1)c1cccc(O)c1O 776282144 POGQPTQREVZSRA-UHFFFAOYSA-N 284.271 2.103 10 20 CECD Nc1ccc(CCNCc2cc3c(s2)CCNC3)cc1 873210381 DOLVXTYFYMODTO-UHFFFAOYSA-N 287.432 2.308 10 20 CECD C[C@H]1OCC[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 770618447 OXTRHWZZZQBTJP-DOMZBBRYSA-N 276.380 2.136 10 20 CECD COC[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 784668556 QLZGUCKJTKYALC-GXTWGEPZSA-N 296.386 2.127 10 20 CECD COc1cc(O)c(CN2CCC[C@H]([C@H](C)O)C2)cc1OC 780891855 AOAOKUABIYAURT-RYUDHWBXSA-N 295.379 2.002 10 20 CECD COCc1nccc(NCc2ccc(N(C)C)c(F)c2)n1 892130972 AICSUYUKSXIOGN-UHFFFAOYSA-N 290.342 2.440 10 20 CECD C[C@H]1CCN(CCNCc2cc(F)cc(F)c2O)C1 883026656 AWSZGQVBZUWWGK-JTQLQIEISA-N 270.323 2.102 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1C1CCOCC1 790919833 TVZSXUAHHXYGDE-ZDUSSCGKSA-N 291.347 2.129 10 20 CECD COCCOC[C@@H](C)NCc1c(O)ccc(Cl)c1F 790974869 YHFLPVWAKOKRFG-SECBINFHSA-N 291.750 2.326 10 20 CECD O=[N+]([O-])c1ncccc1NCCc1ccc(O)c(O)c1 754487935 FEIKDDZKOVFUCQ-UHFFFAOYSA-N 275.264 2.056 10 20 CECD CC(C)CNC(=O)CN[C@H](C)c1cc(Cl)ccc1O 1323831267 WRHSRSMAUOXODJ-SNVBAGLBSA-N 284.787 2.468 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@]2(C)CC(C)=NO2)c1 1338905071 OLDVTRXLLKTVKJ-BMIGLBTASA-N 292.335 2.133 10 20 CECD CC(C)[C@@]1(C)C[C@H]1C(=O)NCc1cccc(O)c1O 1520508492 CSSWIXNVNPRGPE-XHDPSFHLSA-N 263.337 2.396 10 20 CECD O=C(O)c1ccc(CNCc2c(O)cccc2F)o1 1602348185 TZSHOPIYGZCACT-UHFFFAOYSA-N 265.240 2.112 10 20 CECD CC[C@H]1CN(Cc2cc(F)c(F)cc2O)CC[C@H]1N 1577279213 ALMWYTBGQOCWCD-TVQRCGJNSA-N 270.323 2.230 10 20 CECD CCC[C@@H](O)CCN[C@@H](C)c1cc(C(=O)O)ccc1O 1595607515 LPEYXKRXACFNTJ-CMPLNLGQSA-N 281.352 2.292 10 20 CECD CCOCc1cc(CNC[C@@H](C)CC(=O)O)ccc1OC 1776909042 AOIYDOOKXCOYCW-LBPRGKRZSA-N 295.379 2.432 10 20 CECD CCOc1ccc(O)c(CNC[C@@]2(C)CCCO2)c1 152936470 JNJDJVQGFRWSBH-OAHLLOKOSA-N 265.353 2.450 10 20 CECD CC(C)(C)OC(=O)N1CC(NCc2ccccc2O)C1 122948296 CPYILNAHOAVKST-UHFFFAOYSA-N 278.352 2.101 10 20 CECD Cc1ncc(CN(C)C(=O)Cc2ccc(N)cc2)s1 37816148 FWDZZWYJECUBAQ-UHFFFAOYSA-N 275.377 2.235 10 20 CECD COC[C@H](CN[C@H]1C[C@H](C)c2c(C)ccc(O)c21)OC 300419250 UGLXOUKGIBTTCV-AVGNSLFASA-N 279.380 2.500 10 20 CECD Cc1ncccc1/C=C1\SC(=S)N(C)C1=O 170903551 SDJWBKCZLDWEPT-TWGQIWQCSA-N 250.348 2.221 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)N2CCSCC2)o1 1537962434 IVWUZFLZBKGNJR-UHFFFAOYSA-N 252.299 2.279 10 20 CECD COc1ccc(O)c(CN[C@@]2(CO)CCc3ccccc32)c1 305807298 ZQDXXONDMIUUGS-GOSISDBHSA-N 299.370 2.324 10 20 CECD CCOC(C)(C)CNCc1cc([N+](=O)[O-])ccc1O 186533768 FOKZXCRRRAPJRD-UHFFFAOYSA-N 268.313 2.205 10 20 CECD COc1ccc(O)c(CNc2ccc(CC(N)=O)cc2)c1 37074693 QAQNPOVBRAWINQ-UHFFFAOYSA-N 286.331 2.041 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cncc(F)c2)c1 133081877 TWOYXVGQZVHMGX-VIFPVBQESA-N 290.294 2.426 10 20 CECD Cc1ccc(O)c(CN2CCC[C@@H](N3CCCC3=O)C2)c1 93278669 WMRJQEHEGXYKON-OAHLLOKOSA-N 288.391 2.287 10 20 CECD C[C@@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)CCO1 271206694 KKMDBDRXSILWOZ-TZMCWYRMSA-N 291.395 2.119 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](C)[C@@H]2CCOC2)c1 273554511 GQSONMICQHKBRR-NTZNESFSSA-N 293.363 2.254 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H]3CCN(C)C[C@H]32)c1 272609196 KDYYAKKCWJXRPJ-XJKSGUPXSA-N 290.407 2.317 10 20 CECD CCCOc1ccc(CN2CCC[C@@H](O)C2)c(O)c1 271017658 RTVGCUNTPKMNOT-CYBMUJFWSA-N 265.353 2.138 10 20 CECD COCCn1cc(CN[C@H](C)c2ccc(F)cc2O)cn1 282848851 TZHUBANRNPDTER-LLVKDONJSA-N 293.342 2.225 10 20 CECD C[C@@H](N[C@H]1C[C@@H](O)C1)c1ccc(Br)cc1O 295906782 IVBQDXXDKDEVHR-QNSHHTMESA-N 286.169 2.329 10 20 CECD CN(Cc1ccccc1O)c1nnc(C(C)(C)C)n1C 290781070 PKCIEYXQPGAIHB-UHFFFAOYSA-N 274.368 2.455 10 20 CECD COC(=O)c1cc(CN(C)Cc2ccccc2O)cn1C 809548411 CKAYSXPYAYNHHJ-UHFFFAOYSA-N 288.347 2.149 10 20 CECD C[C@@H]1C[C@H](NCC(C)(C)OCCO)c2c(O)ccc(F)c21 806664426 PZZWUMKNMZRMRQ-PWSUYJOCSA-N 297.370 2.457 10 20 CECD CCn1nnc(C)c1CNCc1ccc(N(C)C)cc1C 823851548 OPKVNEXGWUFQOX-UHFFFAOYSA-N 287.411 2.271 10 20 CECD Cc1c(CNC(=O)c2cncn2C)n(C)c2ccccc12 582778219 LOFZEYDTGDMNPW-UHFFFAOYSA-N 282.347 2.150 10 20 CECD CCN(C(=O)/C=C/c1cnn(C)c1)c1ccccc1C(=O)O 737053721 WLYGKNNQLPEOJL-CMDGGOBGSA-N 299.330 2.185 10 20 CECD CCn1nccc1CN(C)c1ccc(OCC(=O)O)cc1 902016421 LCYDUPXXWKZDDW-UHFFFAOYSA-N 289.335 2.003 10 20 CECD C[C@H](NC(=O)c1cnc2n1CCC2)c1ccc(N(C)C)cc1 832436913 SVHXCKIEAZOFFS-LBPRGKRZSA-N 298.390 2.386 10 20 CECD CC[C@@H]1C[C@H]1CNC(=O)NCCc1ccc(N)cc1 841911428 VKLFJLPHDXITDU-OLZOCXBDSA-N 261.369 2.157 10 20 CECD CCN(C)c1ccc(CN(CCOC)CCOC)cc1 741752936 JOFGHDFROSEXOI-UHFFFAOYSA-N 280.412 2.238 10 20 CECD C[C@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1cc(F)ccc1O 846205641 IRHPOXZVEQWXBF-QWRGUYRKSA-N 292.354 2.193 10 20 CECD COCC[C@](C)(O)CN[C@@H](C)c1ccc(Cl)cc1O 841763235 LMLHXGIXEALYMC-HZMBPMFUSA-N 287.787 2.484 10 20 CECD C[C@@H]1CC[C@H](C(=O)O)N1Cc1cccc(Cl)c1O 844937175 YQGOTJBPYRQWIS-LDYMZIIASA-N 269.728 2.483 10 20 CECD C/C=C\C[C@H](CO)N[C@H](C)c1cccc(OC)c1O 846165843 ZQWJIEMVDVGCEG-XLMCQVRKSA-N 265.353 2.379 10 20 CECD Cc1c[nH]cc1C(=O)NCc1ccc(N(C)C)cc1 916731394 LVEYJWIUDVRBLS-UHFFFAOYSA-N 257.337 2.319 10 20 CECD COc1cc(O)c(CNC[C@@H]2C[C@H](C)O[C@H]2C)cc1OC 840963973 PSINRNLSTQPAPH-SRVKXCTJSA-N 295.379 2.313 10 20 CECD COc1ccc(O)c([C@@H](C)NCCN(C)CC(F)F)c1 858597808 XMQHSXTWFJECIT-SNVBAGLBSA-N 288.338 2.248 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CSCCS2)c1 862758173 RJORRXXRQWEMDU-LBPRGKRZSA-N 283.418 2.165 10 20 CECD CC(C)(C)OC(=O)[C@H]1CCCN1C(=O)c1cc(O)cs1 760166207 GQNFMCVILXMCTI-SNVBAGLBSA-N 297.376 2.400 10 20 CECD CCOc1ccc(CN2CCCOCC2)c(O)c1 768888778 MLGBZBHSNTWPJS-UHFFFAOYSA-N 251.326 2.013 10 20 CECD CCC(=O)N1CCCN(Cc2c(C)cccc2O)CC1 876625144 VYQNHTKBHWXXEE-UHFFFAOYSA-N 276.380 2.145 10 20 CECD Cc1ccc(O)c(CN[C@H](C)C[C@@H]2CCCC(=O)N2)c1 877652494 INBRISMUZNGBOH-OCCSQVGLSA-N 276.380 2.238 10 20 CECD Cc1ccc(CN2CCC3(CC2)CCN(C)C3=O)c(O)c1 877481392 GFBKGYSZOPFMSR-UHFFFAOYSA-N 288.391 2.145 10 20 CECD Cc1cc(C)c(O)c(CN(C)CCc2cnccn2)c1 770662354 SGDSSUVSMLXJGK-UHFFFAOYSA-N 271.364 2.474 10 20 CECD CC[C@H](C[C@H](C)CO)NCc1cc(OC)ccc1O 776220677 YRKSZVMFPVQDSZ-WCQYABFASA-N 267.369 2.288 10 20 CECD CC[C@@H](CCO)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776146162 GNROOBRYRIPKGR-OCCSQVGLSA-N 293.411 2.274 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1CCC(F)(F)C1 779533325 JGIVWWVGHQHAKV-WUWIAWFRSA-N 283.274 2.415 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC(C)(C)C2)cc1F 788924585 AUTJRKSLSUDRRJ-UHFFFAOYSA-N 279.359 2.443 10 20 CECD CCN(CC)CC[C@H](C)NC(=O)Cc1ccc(N)cc1 1122513435 QMJRDNIZLFYTFO-ZDUSSCGKSA-N 277.412 2.048 10 20 CECD CS[C@@H](C)CCC(=O)OCC(=O)c1ccc(O)c(O)c1 784530139 JIVWBQOHQGHSOJ-VIFPVBQESA-N 298.360 2.355 10 20 CECD Oc1cccc(Cl)c1CN1C[C@H]2CC[C@@H](O)[C@H]2C1 895785631 YGVHCRZXQLRGKQ-ISTVAULSSA-N 267.756 2.248 10 20 CECD COc1cc(C)cc(CNCC2=CCCOC2)c1O 894780464 DWGDSGPDGOPOFP-UHFFFAOYSA-N 263.337 2.146 10 20 CECD COc1ccc(CN2C[C@H](C)O[C@H](C)C2)c(O)c1OC 891401695 IEPMWBBDHDJSHD-PHIMTYICSA-N 281.352 2.019 10 20 CECD CN(Cc1ccccc1O)c1ncccc1[N+](=O)[O-] 89635418 SAWOFVGKCWTMNA-UHFFFAOYSA-N 259.265 2.332 10 20 CECD CN1CC[C@@H]2CN(Cc3ccc(N4CCCC4)cc3)C[C@@H]21 1324662078 KUGLPWXGQBJTJM-AEFFLSMTSA-N 285.435 2.423 10 20 CECD CN1CCC(CCNCc2cc(F)cc(F)c2O)CC1 708558969 OADVVSXJIQALAO-UHFFFAOYSA-N 284.350 2.492 10 20 CECD CN(C)c1nc(NCc2ccc(N3CCCC3)cc2)n[nH]1 1326485605 CWNLZADSGLUYJD-UHFFFAOYSA-N 286.383 2.083 10 20 CECD C[C@H](NC(=O)[C@@H](C)n1ccnc1)c1ccc(N(C)C)cc1 1324138658 IZVNQTPYFVOMFA-QWHCGFSZSA-N 286.379 2.388 10 20 CECD COc1ccc(CNCc2c(Cl)cnn2C)c(O)c1 793388686 RKCIGRRORHLYOL-UHFFFAOYSA-N 281.743 2.078 10 20 CECD O=C1CC[C@@H]2[C@H]1[C@H]2C(=O)Nc1c(Cl)ccc2nonc12 1262488349 ZCPLSMJGYCVSBM-PDFZIDOMSA-N 291.694 2.040 10 20 CECD CC(C)(F)CCNC(=O)NCc1ccc(N)cc1 1346513111 IEFAWMDJAJFNMC-UHFFFAOYSA-N 253.321 2.206 10 20 CECD CCN(CC(=O)N[C@@H](C)c1cc(OC)ccc1O)C1CC1 153873208 AZGBDCXBPGLEPQ-NSHDSACASA-N 292.379 2.062 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCc1cscn1 159400728 XZIYVUMJUMEZHU-UHFFFAOYSA-N 291.376 2.233 10 20 CECD CCC[C@H](CCO)CNC(=O)Nc1ccc(N)cc1 841300889 VTYOBAMPIFSJQF-LLVKDONJSA-N 265.357 2.189 10 20 CECD CN1CC[C@@H](NCc2ccc(N3CCCCC3)cc2)C1 49084079 NVVPUYIAXULQBB-MRXNPFEDSA-N 273.424 2.471 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1ccc(N(C)C)cc1 178371529 JTYFOKPCNGQMAY-CJNGLKHVSA-N 280.412 2.191 10 20 CECD Oc1cccc(Cl)c1CNCC[C@@H](O)C1CC1 898202793 NACGFYRRXZCORC-GFCCVEGCSA-N 255.745 2.296 10 20 CECD CN(C)c1ccc(CNc2ncnc3[nH]cnc23)cc1F 58545380 BWFMYKPFTDTQDU-UHFFFAOYSA-N 286.314 2.170 10 20 CECD Cc1cccc(CNC(=O)CN(C)Cc2ccccc2O)c1 111235764 BQQQOKQPSFXQNF-UHFFFAOYSA-N 298.386 2.449 10 20 CECD CCN(CC)c1ccc(CNC(=O)NC)cc1F 66975543 WDHYGWJSKIHNBL-UHFFFAOYSA-N 253.321 2.101 10 20 CECD C[C@H](NCc1ccccc1O)c1ccc2[nH]c(=O)[nH]c2c1 37163199 CNXJONOWSYQJEV-JTQLQIEISA-N 283.331 2.413 10 20 CECD CC[C@@H](C)[C@H](C)C(=O)NCc1ccc(O)c(O)c1 182838058 SWCRKBDFZGXISP-ZJUUUORDSA-N 251.326 2.396 10 20 CECD C[C@H](N[C@H](C)c1nnnn1C1CC1)c1ccccc1O 189132076 OGOPAELGNBJECA-VHSXEESVSA-N 273.340 2.125 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1Cc1cccc(OC)c1O 131504832 CNMVDKRPJPKOBB-WCQYABFASA-N 265.353 2.400 10 20 CECD Cn1c(-c2ccccc2)cnc1SCCC(N)=O 48375992 HZJVYKUGNXILEQ-UHFFFAOYSA-N 261.350 2.055 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C[C@@H]1COC(=O)C1 137070814 ACRIEWINMBGAQG-LBPRGKRZSA-N 291.347 2.084 10 20 CECD C[C@H](N[C@H](C)CCCO)c1cc([N+](=O)[O-])ccc1O 273556395 HAQPFBWMSDMTEO-ZJUUUORDSA-N 268.313 2.112 10 20 CECD COc1cccc(CN2CC[C@H](N3CCCC3)[C@@H]2C)c1O 289727609 HPEIWSOYMUHCJM-ZFWWWQNUSA-N 290.407 2.459 10 20 CECD CN(C)c1ccc(CN[C@H]2CCc3c[nH]nc3C2)cc1F 372738993 HTXQBLCWGSATIT-ZDUSSCGKSA-N 288.370 2.262 10 20 CECD COC[C@@H](CO)N[C@@H](C)c1cc(Cl)c(Cl)cc1O 280843148 AVECLDBKZNXJKE-JGVFFNPUSA-N 294.178 2.357 10 20 CECD CCCCN(CCn1cncn1)Cc1ccccc1O 282573348 ZWBOFYZWNAEYQX-UHFFFAOYSA-N 274.368 2.286 10 20 CECD CN(C)C(=O)O[C@H]1CCN(Cc2ccc(N(C)C)cc2)C1 295181774 VVLRQUAMYFEKKC-HNNXBMFYSA-N 291.395 2.025 10 20 CECD Nc1ccc(CNC(=O)c2noc3c2CCCCC3)cc1 297309826 WCISUDWJXJFMOS-UHFFFAOYSA-N 285.347 2.456 10 20 CECD CCOC1CC(COC(=O)c2cccc(O)c2O)C1 803440738 QRJDVGYCKSBREN-UHFFFAOYSA-N 266.293 2.070 10 20 CECD CN(Cc1ccccc1O)C(=S)NC1CCC1 814193941 FPYJUXMTABPFNU-UHFFFAOYSA-N 250.367 2.251 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2CCNC2)c2c(O)ccc(F)c21 817944428 BSKMDTSUETVQDL-WCABBAIRSA-N 250.317 2.031 10 20 CECD C[C@@H](NC(N)=O)c1noc(-c2ccc(-n3cccc3)cc2)n1 813339551 PPHDESZFGUSYHB-SNVBAGLBSA-N 297.318 2.257 10 20 CECD COCc1nsc(NCc2cc(OC)ccc2O)n1 811806246 NOAVPLXIHXNIOR-UHFFFAOYSA-N 281.337 2.011 10 20 CECD CC[C@H]1CN(CC)CCN1Cc1cccc(OC)c1O 825004924 AGWUGLSLCMXCMC-AWEZNQCLSA-N 278.396 2.317 10 20 CECD COc1ccc(N(CC[S@](C)=O)C(C)C)cc1F 828268307 SWTOUBFOSHYTCE-SFHVURJKSA-N 273.373 2.428 10 20 CECD O=C(NCCCC1CC1)c1c(F)ccc(O)c1O 825940799 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C[C@H]1CCCN([C@@H](C)CNC(=O)c2cc(O)cs2)C1 731869557 LMTLJUPCRFSHMZ-QWRGUYRKSA-N 282.409 2.304 10 20 CECD CC[C@H](NC(=O)NCc1ccccc1O)C(F)F 836511251 HOGSHFNSXYURKH-VIFPVBQESA-N 258.268 2.235 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1CCCO1 839912612 GAABJHJOJBUWPE-BBRMVZONSA-N 290.407 2.287 10 20 CECD Cc1ccc(C(N)=O)cc1OCc1cc(C(=O)O)oc1C 738568599 MCSSVEGIMWLQRP-UHFFFAOYSA-N 289.287 2.273 10 20 CECD O=C(CC1CCSCC1)NCc1ccc(O)cc1O 910951853 WMBPFLIDIZQZNO-UHFFFAOYSA-N 281.377 2.247 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCc2ccon2)c1 830539827 AARJEGQZHOVMRB-JTQLQIEISA-N 290.319 2.199 10 20 CECD C[C@H]1NCCN(Cc2cccc(Cl)c2O)[C@@H]1C 843058252 QKGHBANQQHJBJI-NXEZZACHSA-N 254.761 2.228 10 20 CECD C[C@H]1CCNC[C@H]1NCc1ccc(N2CCCC2)cc1 841059004 IYMWOIFCGALOKD-WMLDXEAASA-N 273.424 2.374 10 20 CECD Cc1cc(N(C)C)ccc1CN(C[C@@H](C)O)C1CC1 848929080 SKSSLNKIMRTJEZ-CYBMUJFWSA-N 262.397 2.406 10 20 CECD NC[C@@H]1CC[C@@H](NCc2cccc(Cl)c2O)C1 841084966 RBBSGUJFYFPKSU-MWLCHTKSSA-N 254.761 2.263 10 20 CECD Nc1ccc(CCNC(=O)NCCCC(F)(F)F)cc1 841960274 ZRVXWDJIJFZWLL-UHFFFAOYSA-N 289.301 2.453 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCO2)c1nnnn1C1CC1 922054096 XYMNJAWMACZBPA-NSHDSACASA-N 299.378 2.184 10 20 CECD CCCOCC(=O)N(C)CCN(C)c1ccc(OC)cc1 844854932 WHRAHQPTSYELFI-UHFFFAOYSA-N 294.395 2.016 10 20 CECD OC[C@@H](CNCc1ccccc1O)c1ccc(F)cc1 840962640 INDNEVQFLYHNTI-CQSZACIVSA-N 275.323 2.397 10 20 CECD N[C@@]12CCC[C@H]1CN(Cc1cc(Cl)cc(F)c1O)C2 857225949 BOTLBDKHQQBFFF-IINYFYTJSA-N 284.762 2.498 10 20 CECD O=C(NCC[C@@H](O)c1ccccc1)c1cc(O)cs1 754907595 NNFPJTFHYCBQES-GFCCVEGCSA-N 277.345 2.307 10 20 CECD CC(C)(C)N1CC[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1 850351663 QWAXYEQDPZLZIS-GFCCVEGCSA-N 293.367 2.263 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CNC(=O)C1 851732317 NWMAGQXUMYGSJD-HNNXBMFYSA-N 289.423 2.099 10 20 CECD CCNC(=S)NCc1cccc(Br)c1O 765991536 BOHCBKJLLXEUNH-UHFFFAOYSA-N 289.198 2.139 10 20 CECD COc1ccc(N2CCC(NCc3ccon3)CC2)cc1 766418656 IBWIZAFFNJQAAN-UHFFFAOYSA-N 287.363 2.442 10 20 CECD COc1ccc(CNC[C@H]2CCC[C@H]2NC(C)=O)cc1C 1036917317 VZYYNDKAPPJAQW-HZPDHXFCSA-N 290.407 2.398 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)CCN(C)C 768691112 PMUSMATVCKSKGK-AWEZNQCLSA-N 263.429 2.491 10 20 CECD COC(=O)CC(C)(C)CC(=O)NCc1cc(C)ccc1O 862757899 HYSSTUQLUDHBFJ-UHFFFAOYSA-N 293.363 2.296 10 20 CECD O=C(N[C@@H]1CCO[C@@H](C2CC2)C1)c1cc(O)cs1 765864423 JJGNTSYXRUGGAE-MWLCHTKSSA-N 267.350 2.141 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCCOCC2)c1 875463585 UZZYYVAKUFBDOI-CYBMUJFWSA-N 278.352 2.069 10 20 CECD COC(=O)[C@H]1CCC[C@@H]1NCc1ccc(N(C)C)cc1 1116771994 XUXCIMFTQQNLNM-GJZGRUSLSA-N 276.380 2.184 10 20 CECD CO[C@@H]1[C@H](C)[C@@H](NC(=O)c2cc(O)cs2)C1(C)C 776249950 AKZGPEWOAFCPLM-AVPPRXQKSA-N 269.366 2.243 10 20 CECD Cc1ccc(CN[C@@H]2CCc3nc(C)ncc3C2)c(O)c1 876925851 FFMWOXKEJNCRLC-OAHLLOKOSA-N 283.375 2.446 10 20 CECD Cc1cc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)ncn1 775407390 UBMYYSBBJQVGCS-GFCCVEGCSA-N 284.363 2.342 10 20 CECD CSC1(CNC(=O)NCc2ccc(N)cc2)CCC1 1120570659 HXVHEIYPAGDIQS-UHFFFAOYSA-N 279.409 2.354 10 20 CECD CC1(C)CN(Cc2cc(F)cc(F)c2O)CC[C@@H]1O 894533890 KHMMHYJNIWAGKI-LBPRGKRZSA-N 271.307 2.263 10 20 CECD Nc1ccc(CCNC(=O)NC[C@@H]2C=CCC2)cc1 892039371 SGJXEYSJSNYBQW-CYBMUJFWSA-N 259.353 2.077 10 20 CECD COc1cccc(CNC[C@@H]2C[C@H](C)O[C@H]2C)c1O 686510845 IESWMSOBPVMVEN-GVXVVHGQSA-N 265.353 2.304 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1C[C@@]12CCOC2 1329520785 XXHHUPFZDUENTC-FUXBKTLASA-N 293.710 2.241 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCS[C@@H]2C)c1 1261457088 XMNAYAGBIRXAKI-BXKDBHETSA-N 296.392 2.094 10 20 CECD COc1ccc(CNC(=O)/C=C\c2nccs2)c(O)c1 1349598047 FEWZARXOHOYDMA-PLNGDYQASA-N 290.344 2.187 10 20 CECD O=C1CC[C@@H]2[C@@H]1[C@@H]2C(=O)Nc1c(Cl)ccc2nonc12 1262488351 ZCPLSMJGYCVSBM-ZVCUKBJDSA-N 291.694 2.040 10 20 CECD CN1CCCc2cc(CNC(=O)CCCCCN)ccc21 155548259 AARWLELERNOQSC-UHFFFAOYSA-N 289.423 2.204 10 20 CECD COc1cccc(O)c1CNCc1ccnc(C)c1 824597839 XSNNXJWCIKLWDF-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Cc1cccc(CNCc2ccc(CO)cc2)c1O 227458760 YZJBUKMUVMGJPU-UHFFFAOYSA-N 257.333 2.483 10 20 CECD COc1cccc(CN[C@H]2CCN3CCCC[C@H]23)c1O 36996876 APYQPDQAFWCJKL-UONOGXRCSA-N 276.380 2.117 10 20 CECD CO[C@@](C)(CNCc1cc2c(cc1O)OCO2)C1CC1 291049011 MSFKIPOCTLLRGW-HNNXBMFYSA-N 279.336 2.026 10 20 CECD NCC[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 723670769 NZNFADBFBJYCEM-JTQLQIEISA-N 254.761 2.216 10 20 CECD COc1cccc(CN2C[C@@H](C(=O)O)CC[C@H]2C)c1O 397031576 LTVWCMNPYKBXLY-PWSUYJOCSA-N 279.336 2.086 10 20 CECD OC[C@@H](C[C@H]1CCCO1)NCc1cc(Cl)ccc1O 886229733 VBCQTNPMWJNZAJ-CHWSQXEVSA-N 285.771 2.065 10 20 CECD CSC[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1 66756717 CYGUWKBSQWLLKT-LLVKDONJSA-N 266.410 2.368 10 20 CECD CC[C@](C)(O)CNCc1cc(Br)ccc1O 111384720 HCFIHTCDJPUHLO-LBPRGKRZSA-N 288.185 2.405 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)CNC)cc1 178712411 DMBRASSNCMUDJA-CYBMUJFWSA-N 277.412 2.005 10 20 CECD Cc1ccc(-n2cnnn2)cc1NCc1ccccc1O 37008823 HDXSHOFLGZMPJW-UHFFFAOYSA-N 281.319 2.288 10 20 CECD CCN(CC)c1ccc(CNCC(F)(F)CO)cc1F 183870177 BFHWHEYCKBVRDZ-UHFFFAOYSA-N 290.329 2.389 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)C(=O)OC(C)(C)C 123320979 RQVFIATVWMXHEY-LLVKDONJSA-N 277.364 2.441 10 20 CECD COC(=O)COc1ccc(N(C)Cc2cc(C)no2)cc1 183798154 MOXOLUNHLNNQOW-UHFFFAOYSA-N 290.319 2.171 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1cc(C)[nH]n1 130309617 DRCYEIBOUDWFTK-UHFFFAOYSA-N 287.363 2.405 10 20 CECD C[C@@H]1CC(=O)CC[C@H]1C(=O)N(C)Cc1ccccc1O 136462837 XFGHHJWPYGOXGT-BXUZGUMPSA-N 275.348 2.356 10 20 CECD CC(C)N(C)C[C@@H](C)NCc1cc(F)ccc1O 291481175 FUCXFRDTLRVTRV-LLVKDONJSA-N 254.349 2.350 10 20 CECD Nc1ccc(NC(=O)c2noc3c2CCCC3)cc1 238041623 KTPODAQPSQHXFJ-UHFFFAOYSA-N 257.293 2.388 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N3CCNCC3)c2C)c1 237820851 XOMAYNXAVTZWLE-UHFFFAOYSA-N 297.402 2.448 10 20 CECD Cc1ccc(O)c(CNC[C@@](C)(O)c2ccco2)c1 266134889 FGHROITZQFPODF-OAHLLOKOSA-N 261.321 2.291 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)C[C@]2(CCCOC2)O1 373634446 FAWQULBBIYKYFV-WBMJQRKESA-N 295.354 2.301 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](OC)C2)c1 271208518 XGDOLRAGCGZXBK-ZDUSSCGKSA-N 251.326 2.012 10 20 CECD CO[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@H](C)C1 281653429 BRJLVMPNPKEBCH-CBHWHFHUSA-N 291.347 2.137 10 20 CECD CC[C@@H](N[C@H](C)c1ncn(C)n1)c1ccc(F)cc1O 287375810 HZGHJHJULFOYJD-BXKDBHETSA-N 278.331 2.462 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccncc1 299227488 CXXGIZVCBKYPJT-UHFFFAOYSA-N 283.375 2.349 10 20 CECD COC[C@H](CCO)N[C@H](C)c1cc(Cl)cc(C)c1O 808697836 WTCKVEBFYYLOHK-PWSUYJOCSA-N 287.787 2.402 10 20 CECD COC(=O)C[C@@H](NCc1ccc(N(C)C)c(C)c1)C1CC1 815089927 SFFZVCBQBOKRBK-OAHLLOKOSA-N 290.407 2.492 10 20 CECD COC(=O)C[C@@H]1CC[C@@H](NCCc2ccc(N)cc2)[C@@H]1C 817956786 CXTNHIRFQWPODR-IVMMDQJWSA-N 290.407 2.379 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)CC3CC3)C2)cc1 819583927 XAEJOOGNCPEXCP-AWEZNQCLSA-N 288.391 2.438 10 20 CECD CC[C@H](NCCc1ccc(N)cc1)c1cnn(C)c1 817955667 DVIUXHMOCBYTEN-HNNXBMFYSA-N 258.369 2.286 10 20 CECD CCC(F)(F)C(=O)NCc1ccc(N2CCOCC2)cc1 823293078 XOPTWORVCGVXDN-UHFFFAOYSA-N 298.333 2.185 10 20 CECD O=C(/C=C\c1cncc(F)c1)N1C[C@H](CO)c2ccccc21 493491161 JCFIZIXDAZIHOU-CFHLNLSMSA-N 298.317 2.357 10 20 CECD CCn1cc(CNCc2ccc3ccccc3c2O)nn1 827087671 RASGBIHBFRVWLM-UHFFFAOYSA-N 282.347 2.447 10 20 CECD COC(=O)c1cnc(SCc2cnc(C)cn2)s1 829681271 SLZUCIWTMMEHFW-UHFFFAOYSA-N 281.362 2.320 10 20 CECD CC(C)(C)CCNC(=O)c1c(F)ccc(O)c1O 825450077 PMJMVDMGRIEXAE-UHFFFAOYSA-N 255.289 2.403 10 20 CECD CO[C@@H]1CCC[C@H]1NCc1cc(F)cc(C(C)=O)c1O 831744402 MMMPWKYTEKTEGJ-ZIAGYGMSSA-N 281.327 2.391 10 20 CECD CC[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)[C@H](C)O 834889451 XYWGMWMYUIBPHW-AUTRQRHGSA-N 268.313 2.110 10 20 CECD Cc1cc(CN2CCCN(C)CC2)ccc1N(C)C 839464325 OTKAGAMLZSFIBG-UHFFFAOYSA-N 261.413 2.199 10 20 CECD O=C(O)N1CCC[C@H](NCc2c(O)cccc2Cl)C1 739930295 ZVWOMAOWYIOTFT-VIFPVBQESA-N 284.743 2.278 10 20 CECD NCc1ccc2c(c1)CCCN2CCOC[C@H]1CCCO1 843350706 SVEIWKLAKBCRRC-MRXNPFEDSA-N 290.407 2.094 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)c2ccoc2)cc1 844851959 BUSDMIQRJZUUJU-UHFFFAOYSA-N 288.347 2.497 10 20 CECD Cc1cc(C)c2c(N)c(C(=O)OCC[C@H](C)O)sc2n1 849658458 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761973168 NCNKWZACOBNXJD-UCUJLANTSA-N 267.350 2.455 10 20 CECD CN(C(=O)[C@@H]1CCCC[C@@]1(C)N)c1ccc(N)cc1 877077717 RYYSTDNWEAJENN-DZGCQCFKSA-N 261.369 2.139 10 20 CECD CC[C@]1(O)CCCN(Cc2c(O)cccc2OC)C1 877692718 PUIVNKDDLVREJH-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CC[C@@H](NCc1ncn(C)n1)c1cc(Cl)ccc1O 775526579 SFVUMUDOPATPNR-LLVKDONJSA-N 280.759 2.415 10 20 CECD O=C(OCCOc1ccccc1)c1cccc(O)c1O 776278696 FCSIQZJAIBJTNM-UHFFFAOYSA-N 274.272 2.334 10 20 CECD CCCN(C)Cc1ccc(N2CCN(C)CC2)cc1 775648252 RJRUJQOSOMIMKI-UHFFFAOYSA-N 261.413 2.280 10 20 CECD Cc1ccc(C(=O)NCc2ccc3c(c2)CCO3)c(O)c1O 780920144 BCJQNBHKZNRBPP-UHFFFAOYSA-N 299.326 2.271 10 20 CECD CN(C)c1ccc(CNC(=O)N2C[C@H]3C=C[C@H]2C3)cc1F 883241237 QLYKEDSZZLWDNP-STQMWFEESA-N 289.354 2.362 10 20 CECD CCCCO[C@H](C)C(=O)OCC(=O)c1ccc(O)c(O)c1 783217326 OKZPVHHZXWSWKX-SNVBAGLBSA-N 296.319 2.029 10 20 CECD C[C@H](NCc1cc(Cl)cc(F)c1O)c1ncn(C)n1 783705839 KBWHQQXOWJMJNV-ZETCQYMHSA-N 284.722 2.164 10 20 CECD CO[C@@H](C)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 785894376 QBYMUAZNDUXZOX-RYUDHWBXSA-N 279.384 2.148 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2COCC[C@H]2OC)cc1 897891789 QVWOHEIPDUPSOQ-IAGOWNOFSA-N 292.423 2.426 10 20 CECD COc1ccc(O)c(CN(C)[C@@H]2CCCC[C@H]2O)c1 895437899 QXMYEZCPNPJFGU-UKRRQHHQSA-N 265.353 2.136 10 20 CECD COc1cc(C)cc(CN[C@H](C)Cn2cccn2)c1O 894173814 REXUJGKSTDLRPQ-GFCCVEGCSA-N 275.352 2.084 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCCCN1)c1ccccc1O 1349621441 QNWYQRABTSUQOY-DGCLKSJQSA-N 262.353 2.102 10 20 CECD C[C@@H]1CC[C@@H](NCc2ccc(Br)cc2O)CN1 1246341640 BLZIIHOGVRATCZ-BXKDBHETSA-N 299.212 2.385 10 20 CECD C[C@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)CS1 397819824 DLXAKJUHAPULHC-WCBMZHEXSA-N 267.350 2.105 10 20 CECD CN(Cc1ccccc1O)c1ncc([N+](=O)[O-])s1 192514480 VMBOQLRKKNPORB-UHFFFAOYSA-N 265.294 2.393 10 20 CECD C[C@H](N[C@H](C)Cn1ccnc1)c1cc(F)ccc1O 94617558 GNYIBNMUYZJYDL-MNOVXSKESA-N 263.316 2.467 10 20 CECD CO[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 1337744235 RNGWBIHFFLQZGY-LSDHHAIUSA-N 276.380 2.184 10 20 CECD O=C(NCc1cccc(O)c1O)c1cccnc1C1CC1 1349079775 QLKWFQDVAPQSHC-UHFFFAOYSA-N 284.315 2.300 10 20 CECD CC[C@@H](CCO)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1605022660 XLYNQWATQOJRMO-QWRGUYRKSA-N 281.352 2.150 10 20 CECD O=C(O)c1cnc(SC[C@@H]2C[C@@]23CCOC3)s1 1602536983 JHDYYUVMBSOMQM-WRWORJQWSA-N 271.363 2.360 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C)C[C@H]2C(=O)O)c1 1610042954 MAJWTTFRVPFGSE-RISCZKNCSA-N 293.363 2.476 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2CCCC[C@H]2N)cc1F 1578423138 QGRVLYNNRTZMMQ-ZIAGYGMSSA-N 283.366 2.390 10 20 CECD C[C@@H](NCC1=CCN(C)CC1)c1cc(F)ccc1O 273474359 KLXITYVCECVMRE-LLVKDONJSA-N 264.344 2.444 10 20 CECD CCOc1cccc(CN(C)C2CCC(N)CC2)c1O 91844413 VYWIOLPXRIFGHN-UHFFFAOYSA-N 278.396 2.493 10 20 CECD COc1cccc(CN2CC(C)(C)[C@@H]3COC[C@@H]32)c1O 384825270 QVHSCJYYCSAWKF-OLZOCXBDSA-N 277.364 2.258 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](CO)CC(F)F)c1 717748055 DASSATKQGZMAIE-ZJUUUORDSA-N 259.296 2.367 10 20 CECD CCCOc1ccc(CNC[C@@]2(O)CCSC2)c(O)c1 176758333 ZFAWXEVXOKLUIR-HNNXBMFYSA-N 297.420 2.139 10 20 CECD O=C(NC1CCN(Cc2cc(F)ccc2O)CC1)C1CC1 179906727 GQTSDFDRIDUNKD-UHFFFAOYSA-N 292.354 2.022 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NC[C@H]2CCCO2)s1 1537962872 HKKQOIQCFZYIDC-MRVPVSSYSA-N 266.326 2.467 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1ccc(N(C)C)c(F)c1 120594914 WGDLZVMRJMJOPJ-LLVKDONJSA-N 282.359 2.133 10 20 CECD COc1ccc(O)c(CN2CC[C@H](CN3CCCC3)C2)c1 180392683 QLMHOYJUGCZKML-CQSZACIVSA-N 290.407 2.319 10 20 CECD CCc1nnc(CN(C)c2ccc(OC)c(F)c2)o1 121747255 XAPYVWYIXPRLFC-UHFFFAOYSA-N 265.288 2.416 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCOc1ccccc1 180596169 BFLIPPPAJGHPRY-VQHVLOKHSA-N 299.326 2.306 10 20 CECD COCCOCCN[C@H](C)c1cc(C)ccc1O 44694088 NZBVENKEQZHFFI-GFCCVEGCSA-N 253.342 2.014 10 20 CECD Cc1ccc([C@@H](C)NCCSCCCO)c(O)c1 185378989 MUAZMMMKOHOBDH-GFCCVEGCSA-N 269.410 2.467 10 20 CECD CO[C@@H](C)CN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 188107062 MTIOLXGPGOMBSG-QWHCGFSZSA-N 296.386 2.348 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cnns2)c1 192348663 WEAUJWSQBSEEOY-ZETCQYMHSA-N 294.336 2.135 10 20 CECD Cn1ccc(CCNCc2cccc(Cl)c2O)n1 230943474 RPHYJICPOGXALC-UHFFFAOYSA-N 265.744 2.111 10 20 CECD O=C(O)CN1CCCc2cc(OC(F)(F)F)ccc21 238158060 BANNHOBXQRDQRH-UHFFFAOYSA-N 275.226 2.422 10 20 CECD COc1ccc(O)c([C@H](C)NCc2snnc2C)c1 293839086 WUQGVFSODGFMDK-QMMMGPOBSA-N 279.365 2.412 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2CCCCO2)c1 273422119 SLVCIJVRSVKYPT-WCQYABFASA-N 293.363 2.399 10 20 CECD Cc1cccc(CNCCc2cn3c(n2)SCC3)c1O 274456174 VMMBOFYRTQJJTO-UHFFFAOYSA-N 289.404 2.335 10 20 CECD COc1ccc(N2CCN(CCOC3CCC3)CC2)cc1 287396330 RPRAGZPGVJTKOE-UHFFFAOYSA-N 290.407 2.386 10 20 CECD Cc1nc2ccc(NCc3ccc(N(C)C)cc3C)nn2n1 804460635 LYNSZTKBVVXUPH-UHFFFAOYSA-N 296.378 2.419 10 20 CECD Cc1cc(C)c([C@H](C)NCCN2CCC(O)CC2)c(O)c1 296092759 YGWPYZQOKCIMNU-AWEZNQCLSA-N 292.423 2.116 10 20 CECD CN(C)c1ccc(CNC2CCC(N)CC2)cc1F 817899912 IOTUCGMVHJNTAF-UHFFFAOYSA-N 265.376 2.251 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCc2c[nH]nc2C1)c1ccccc1O 827937262 QCTGUXMGVVNBNX-GHMZBOCLSA-N 285.347 2.098 10 20 CECD COc1nccc(CNCc2ccc(N(C)C)cc2C)n1 823847428 NCJXIDXHAVNGHS-UHFFFAOYSA-N 286.379 2.149 10 20 CECD CCc1cccc(CN2C[C@@H](C)[C@@](C)(CO)C2)c1O 827692273 HDBRHZKIJXUARZ-MLGOLLRUSA-N 263.381 2.405 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCN[C@H]2C)cc1 827341000 OXNQCOYIZFFXRP-BBRMVZONSA-N 289.423 2.147 10 20 CECD C[C@@H](NC(=O)COCc1ccccn1)c1ccccc1O 827946712 PWSJZOMWSGXABL-GFCCVEGCSA-N 286.331 2.181 10 20 CECD CC(C)c1nccn1CC(=O)NCc1ccccc1O 821054762 BWSZJSNYWCKEIJ-UHFFFAOYSA-N 273.336 2.029 10 20 CECD C[C@@H](CO)N(CC1CCC1)C(=O)c1cc(O)cs1 832557420 FBBWYCUKWFGHLW-VIFPVBQESA-N 269.366 2.077 10 20 CECD C[C@@H]1CCC[C@@H]1CNC(=O)c1c(F)ccc(O)c1O 831190928 LHDKIWNDGMDTOL-RKDXNWHRSA-N 267.300 2.403 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)nn1 839727918 FMKFUWGJRRYXIN-LBPRGKRZSA-N 284.363 2.342 10 20 CECD COC[C@](C)(O)CN[C@H](C)c1ccc(Cl)cc1O 841762692 JSMFFSQWGMNZGK-NOZJJQNGSA-N 273.760 2.094 10 20 CECD Cc1cc(O)c(CN[C@H](CN)C(C)(C)C)cc1C 841087921 UBEQECNJOXHUSU-CQSZACIVSA-N 250.386 2.472 10 20 CECD CCc1cccc(CN2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)c1O 848905805 OKRVOMPNYNQXHA-QEJZJMRPSA-N 288.391 2.040 10 20 CECD Cc1cc(/C=C2\SC(N3CCCCC3)=NC2=O)n(C)n1 841484636 BIVOHKIVAGBERX-XFXZXTDPSA-N 290.392 2.185 10 20 CECD COc1cccc(CNC[C@H](N)c2ccccc2)c1O 841038553 XZEZPZFLJDTAFO-AWEZNQCLSA-N 272.348 2.190 10 20 CECD CCOc1cccc(CN[C@@H]2CCN[C@H](C)C2)c1O 841062938 ZNDKBKOEUSIGMF-DGCLKSJQSA-N 264.369 2.021 10 20 CECD NCC(F)(F)CNCc1ccc(N2CCCCC2)cc1 841059322 AYVQNFPNWCGTCY-UHFFFAOYSA-N 283.366 2.361 10 20 CECD Cc1cnc(CN(C)c2ccc(OCC(=O)O)cc2)o1 846279792 LBISSASFURQRFY-UHFFFAOYSA-N 276.292 2.083 10 20 CECD Oc1c(Cl)cccc1CN1[C@H]2CCNC[C@H]1CC2 843058143 MAAKLFJZKKMXBC-VXGBXAGGSA-N 266.772 2.372 10 20 CECD CCc1cccc(CNC2(COC)CCOCC2)c1O 848913584 BEAFXYJWJKWSGX-UHFFFAOYSA-N 279.380 2.240 10 20 CECD Cc1cc(CN2CCC[C@H](C(=O)O)C2)ccc1N(C)C 846261562 SHFBTJSHEVVQJQ-AWEZNQCLSA-N 276.380 2.358 10 20 CECD COc1cc(Cl)cc(CN(C)[C@H](C)CCO)c1O 846111492 QBBAGLGFPXXFSH-SECBINFHSA-N 273.760 2.257 10 20 CECD COCC[C@@H](C)N(C)CCN(C)c1ccc(OC)cc1 844400656 FOYVIKHIXMMXCF-CQSZACIVSA-N 280.412 2.488 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](N3CCOC3=O)C2)c1 853541103 PAMNAFYTNITEKY-CQSZACIVSA-N 290.363 2.036 10 20 CECD CC(C)n1cc(S(=O)(=O)Nc2ccc(O)cc2F)cn1 758171357 RSLSPGSBVQJCDA-UHFFFAOYSA-N 299.327 2.110 10 20 CECD C[C@H](C(=O)NCc1cc(Cl)ccc1O)n1cccn1 857547738 RNIZKLSNYIZLMJ-SECBINFHSA-N 279.727 2.120 10 20 CECD C[C@H](NCc1cc(F)c(N(C)C)cc1F)c1ncnn1C 858160023 NSOQIOKXNZUOTI-VIFPVBQESA-N 295.337 2.010 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@@H](C)c1cc(F)ccc1O 760886899 OTPJDYHDOLMNGW-VZJVUDMVSA-N 283.343 2.376 10 20 CECD CC[C@@H](N[C@H](C)CC(N)=O)c1ccc(N(C)C)cc1 763396979 GQYVNCFJGOHHBO-BXUZGUMPSA-N 263.385 2.057 10 20 CECD COc1nc(C)cc(NCc2cc(C)ccc2O)n1 1118811216 RGTCAZSRNCIOLK-UHFFFAOYSA-N 259.309 2.420 10 20 CECD Cc1ccnc(NC(=O)CN(C)Cc2ccc(C)cc2O)c1 876659565 AWBSOIHKRTVOLL-UHFFFAOYSA-N 299.374 2.475 10 20 CECD CCOc1cccc(CN2CCC[C@@H]2CCO)c1O 779203147 ZSIJFNOIASWLRP-CYBMUJFWSA-N 265.353 2.138 10 20 CECD C[C@H](NC(=O)CC(C)(C)C(=O)O)c1ccc(N(C)C)cc1 773897927 KKMSWXXTZNCCMJ-NSHDSACASA-N 292.379 2.431 10 20 CECD Cc1nnc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)s1 775432401 CPQLHIDJCVRDDX-SECBINFHSA-N 290.392 2.404 10 20 CECD CC1(C(=O)NCc2ccc(N3CCCCC3)cc2)COC1 782608477 QBXSWWCCQRBGAN-UHFFFAOYSA-N 288.391 2.330 10 20 CECD Cc1cc(CCNC(=O)[C@@H](C)O)c(C)n1-c1ccccc1 786710326 YOWAHTTVZQIILZ-CQSZACIVSA-N 286.375 2.134 10 20 CECD CC[C@@H](O)CCCNCc1ccc(OC)c(OC)c1O 893019497 TWSMJODEXHLDAT-GFCCVEGCSA-N 283.368 2.050 10 20 CECD C[C@H](NCCC(=O)Nc1ccccn1)c1ccccc1O 783499805 BKOKWBNETYBYQV-LBPRGKRZSA-N 285.347 2.467 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCCCS2)c(O)c1 794381282 NZANDZHEUYSYLY-ZDUSSCGKSA-N 281.377 2.303 10 20 CECD CCCCCOC1CN(C(=O)c2cccc(O)c2O)C1 790838812 JFXAJLODCGUNAL-UHFFFAOYSA-N 279.336 2.129 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1ccc(C)cc1O 83482112 NBTFNBQTAZXJFB-ZDUSSCGKSA-N 265.353 2.378 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](OC(C)C)C2)c1 701730112 RXDIRPSZXZIWMQ-CQSZACIVSA-N 265.353 2.400 10 20 CECD Cc1ccc(C(=O)NCCN2CCCC2(C)C)c(O)c1O 1324698434 VFRPSFNABHBFKK-UHFFFAOYSA-N 292.379 2.010 10 20 CECD C[C@@H](CN(C)C)NCc1c(O)cccc1Br 706863302 BTLAXVLDRPFOKZ-VIFPVBQESA-N 287.201 2.194 10 20 CECD Nc1ccc(CN2CCNCc3ccccc32)cc1 1262488002 MTNPDHVFXGOBFP-UHFFFAOYSA-N 253.349 2.379 10 20 CECD CCCN(Cc1ccccc1O)CC1(C(=O)O)CC1 1609977419 AFIWBABTQJNJDE-UHFFFAOYSA-N 263.337 2.469 10 20 CECD O=C(O)c1cnc(Sc2ccc([N+](=O)[O-])nc2)s1 1608979050 GZICELZFWTTZOG-UHFFFAOYSA-N 283.290 2.296 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C(=O)O)[C@H]1C 1600236814 MXUJLJPTOWEZQQ-DOMZBBRYSA-N 276.380 2.356 10 20 CECD CN(C)c1ccc(CNCc2cc(C(=O)O)n(C)c2)cc1 1610105803 XIKRBTUBMIIUCB-UHFFFAOYSA-N 287.363 2.079 10 20 CECD COc1ccc(CNCC2(C(=O)O)CCC2)cc1C 259010842 ORTZJBSXSIQFHU-UHFFFAOYSA-N 263.337 2.348 10 20 CECD Nc1ccc(OC(=O)[C@@H]2CCO[C@H]2c2ccncc2)cc1 1580449960 YLLNUNGZNYGWRH-CABCVRRESA-N 284.315 2.347 10 20 CECD C[C@H](N[C@H](C)c1cc(C(=O)O)ccc1O)c1ccnn1C 1593204707 VNHNVQTTXYFJOJ-ZJUUUORDSA-N 289.335 2.236 10 20 CECD CCOCc1cc(CN[C@H](C(=O)O)C(C)C)ccc1OC 1591987684 RBQSAWBAQDVXOA-HNNXBMFYSA-N 295.379 2.431 10 20 CECD CC1(C)C[C@@H]1C(=O)NCc1ccc(N2CCOCC2)cc1 160359695 QGVFJEHLGFVGSZ-OAHLLOKOSA-N 288.391 2.186 10 20 CECD CCN(C(=O)/C=C/c1cnn(C)c1)c1ccc(C#N)cc1 152145995 SCVJZGSGFZCZDD-RMKNXTFCSA-N 280.331 2.358 10 20 CECD Oc1cccc2c1[C@@H](NCCCn1ccnc1)CC2 295790341 BOBUBWROKSXYKE-ZDUSSCGKSA-N 257.337 2.256 10 20 CECD Cc1nnsc1CN[C@@H]1CCc2cccc(O)c21 297424944 UXJTVGGXRBGMJP-SNVBAGLBSA-N 261.350 2.329 10 20 CECD O=C(O)[C@@H]1CN(Cc2ccccc2O)C[C@H]1C(F)(F)F 720384807 MSILBBDNTUXQFR-NXEZZACHSA-N 289.253 2.087 10 20 CECD COc1cccc(CNCc2cc(C)ccc2O)n1 113336365 BFXJISKBBQXMKZ-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Nc1ccc(NC(=O)N2CCN(C3CCCC3)CC2)cc1 52063964 IDCQFVLHWDKGTE-UHFFFAOYSA-N 288.395 2.361 10 20 CECD COc1cccc(CN2CCC([C@H]3CCCN3)CC2)c1O 63198139 UURWOJMYOKTTDL-OAHLLOKOSA-N 290.407 2.365 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)C(F)F 186441379 BBQPQIVUUFBFKP-LURJTMIESA-N 295.232 2.045 10 20 CECD CCCOc1ccc(CN[C@@H]2CCO[C@@H]2C)c(O)c1 131940020 IHEXXLDHKGTZNS-BXUZGUMPSA-N 265.353 2.448 10 20 CECD CC[C@@H](N[C@H](C)C(=O)NC(C)C)c1ccccc1O 228929467 RNHQNXFXQZONGU-DGCLKSJQSA-N 264.369 2.346 10 20 CECD CCOc1ccc(O)c(CN(C)CCCOC)c1 92537388 ZGJFFUUYRYNRTD-UHFFFAOYSA-N 253.342 2.259 10 20 CECD Cc1nnccc1C(=O)NCc1ccc(N2CCCC2)cc1 269882427 NLVXDOJIWWQOIB-UHFFFAOYSA-N 296.374 2.315 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C[C@@H]2CCC[C@H]2O)c1O 270065997 HLMZMLWBKOOUEJ-XHDPSFHLSA-N 295.354 2.327 10 20 CECD Cc1cc(O)c(CN[C@H]2CCO[C@@]3(CCOC3)C2)cc1C 374268300 FRTYETOKRYBSBP-RDJZCZTQSA-N 291.391 2.437 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1cccc(OC)c1O 281306571 QEBODPFSOOWWMZ-NSHDSACASA-N 281.352 2.174 10 20 CECD COc1cccc(CN2C[C@H](N3CCCC3)C[C@H]2C)c1O 289698712 OLWJJLGCBULLNZ-UKRRQHHQSA-N 290.407 2.459 10 20 CECD O=C(NC[C@H]1CCC(F)(F)C1)c1c(F)ccc(O)c1O 295205718 VXFKEJRVQNPGNZ-ZETCQYMHSA-N 289.253 2.402 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CCCN(CCCO)C2)c(O)c1 297385141 RKLJQYVQGIUJOI-GJZGRUSLSA-N 292.423 2.198 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]2CF)cc1OC 293845358 BGKJUMQRIINEKV-LLVKDONJSA-N 269.316 2.343 10 20 CECD CCN(CCCO)Cc1ccc(N(C)C)c(C)c1 292716024 FNFWWIMXBLSGLO-UHFFFAOYSA-N 250.386 2.265 10 20 CECD Cc1cc(CN2CC[S@](=O)CC2(C)C)ccc1N(C)C 815098627 KPZNPLIPPYAZKM-FQEVSTJZSA-N 294.464 2.404 10 20 CECD CC1(C)C[C@@H]1CN1C(=O)CN(Cc2ccccc2O)C1=O 819168292 ORNSSTJRDNPVBY-GFCCVEGCSA-N 288.347 2.203 10 20 CECD CN(C)c1ccc(CNCc2ccc(CC(N)=O)cc2)cc1 727463960 JAADNBNVJDHZFI-UHFFFAOYSA-N 297.402 2.070 10 20 CECD CN(Cc1ccc2c(c1)NC(=O)CO2)Cc1ccccc1O 816493030 MNBLEXUWFNLJDM-UHFFFAOYSA-N 298.342 2.355 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H](CC(=O)O)C2)c1O 820759464 UDIZIRXPBXWXBJ-LBPRGKRZSA-N 293.363 2.396 10 20 CECD COC(=O)c1cnc(SCC(=O)c2ccn(C)c2)s1 829692861 VOHSXUOCXWHRQJ-UHFFFAOYSA-N 296.373 2.243 10 20 CECD CCO[C@@H](CC)C(=O)N[C@H](C)c1ccccc1O 827930577 LNNMWOIBEYOFOU-MFKMUULPSA-N 251.326 2.385 10 20 CECD 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CC[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H]1O 770380074 LJKHXJOSKWXAJB-RNCFNFMXSA-N 255.745 2.248 10 20 CECD CCn1cccc(CNCc2ccc(N(C)C)cc2)c1=O 788523488 DGIUBDKTRWEKQH-UHFFFAOYSA-N 285.391 2.224 10 20 CECD Oc1ccc(Cl)cc1CN1CCc2ncncc2C1 895722578 JSHQRINXJMXFMR-UHFFFAOYSA-N 275.739 2.394 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@H](C2OCCO2)C1 896384559 MYPKIUMTRWBQST-JTQLQIEISA-N 283.755 2.240 10 20 CECD Oc1cc(F)c(Cl)cc1CNCC[C@@H](O)C1CC1 898197006 BRYYGNAFXONMGK-GFCCVEGCSA-N 273.735 2.435 10 20 CECD COc1ccc(CNC(=O)NC[C@@H](C)C2CC2)c(O)c1 792917970 NOMMHURESHQCGI-SNVBAGLBSA-N 278.352 2.246 10 20 CECD CCN(CC)C(=O)[C@H](C)N(C)Cc1ccccc1O 109769039 RRHBYVIVCJFHBJ-LBPRGKRZSA-N 264.369 2.081 10 20 CECD CCc1cccc(CN[C@H](C)c2n[nH]c(C)n2)c1O 691460809 SJAXWKQHJUOKDQ-SECBINFHSA-N 260.341 2.232 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)CC(C)(C)O 1252356726 IDNQXVYSAUHNDS-UHFFFAOYSA-N 262.397 2.490 10 20 CECD COCCC(C)(C)NCc1ccc(OC)c(OC)c1O 1336735539 MGEKIOFTSPWZFL-UHFFFAOYSA-N 283.368 2.314 10 20 CECD COC(=O)N1CC(N[C@H]2C[C@H](C)c3c(C)ccc(O)c32)C1 1343304510 CRIQHYYJBQMIGM-JQWIXIFHSA-N 290.363 2.289 10 20 CECD Nc1ccc(CNC(=O)NOC2CCCCC2)cc1 1357351201 OLTZNZNYJKQJHM-UHFFFAOYSA-N 263.341 2.332 10 20 CECD Cc1cc(O)nc([C@H](C)Sc2ncc(C(=O)O)s2)n1 1600286500 LDDYRKACDHARKU-LURJTMIESA-N 297.361 2.499 10 20 CECD O=C(O)[C@H](NCc1ccccc1O)c1ccccc1F 1608550788 BUJGVILIPBAPCQ-CQSZACIVSA-N 275.279 2.447 10 20 CECD CN(C)c1ccc(/C=C/CN2CC[C@H]3CNC[C@H]32)cc1 1578425771 LVYRUDABAKCAIR-PIXXYMSQSA-N 271.408 2.060 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)Sc1ncc(C(=O)O)s1 1594988078 WQLKYICXQWGNGK-RNFRBKRXSA-N 288.394 2.237 10 20 CECD CCN(CC(=O)NCc1ccc(N(C)C)cc1)CC1CC1 157919855 IDGKCDKINVDMEL-UHFFFAOYSA-N 289.423 2.101 10 20 CECD CC(C)C(C)(C)C(=O)NCCc1ccc(O)c(O)c1 168327849 ITSDEBIFVGWBAS-UHFFFAOYSA-N 265.353 2.439 10 20 CECD C[C@@H](CCCO)CNCc1ccc(N(C)C)cc1 294668623 APZIWTISOBFKPO-ZDUSSCGKSA-N 250.386 2.251 10 20 CECD Cc1ccc([C@H](C)N[C@H](CO)C[C@H]2CCCO2)c(O)c1 886669901 GNJTVUUTIOELTP-MELADBBJSA-N 279.380 2.281 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)NCc1c(O)cccc1Cl 113330515 GALAUYGHRFCNHK-VHSXEESVSA-N 284.787 2.438 10 20 CECD COC(=O)CN(C)Cc1cc(Cl)cc(Cl)c1O 179395090 GQABDPLPZHHOLF-UHFFFAOYSA-N 278.135 2.304 10 20 CECD CCN(CC)CCCNC(=O)N(C)Cc1ccccc1O 79115052 LXCZRHIOQRPUJY-UHFFFAOYSA-N 293.411 2.266 10 20 CECD CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)C[C@@H](C)O1 182423980 CHMJNRCGAMFDDZ-GHMZBOCLSA-N 279.336 2.046 10 20 CECD C[C@@H](N[C@@H]1CCCC[C@H]1O)c1ccc(F)cc1O 186801589 PAKIPIQDDAGNOZ-OASPWFOLSA-N 253.317 2.485 10 20 CECD CCCOCC(=O)NCc1c(O)ccc2c1CCCC2 75160080 RXBAUSHSOIRZJM-UHFFFAOYSA-N 277.364 2.314 10 20 CECD CSCCCCC(=O)NCCc1ccc(O)c(O)c1 122760708 GWVKNUZLDAYQEU-UHFFFAOYSA-N 283.393 2.290 10 20 CECD CCCN(CC(=O)OCC)Cc1cc(C)ccc1O 92380526 HMEOBJUQYCSXAQ-UHFFFAOYSA-N 265.353 2.476 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCCC[C@H]2OC)c1 278843551 ZYGUXXDUWJUNKA-UKRRQHHQSA-N 265.353 2.448 10 20 CECD COC[C@@H](CN[C@@H](C)c1c(C)cc(C)cc1O)OC 285115161 KVYFNQKFLXAZEB-QWHCGFSZSA-N 267.369 2.321 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@H]1CCCSC1 292268476 KWLCQCLFGQWVAH-FVOPLDGLSA-N 293.388 2.370 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C)CCCCO)c1 296337241 HQMVZVWORSXQMH-NWDGAFQWSA-N 295.379 2.381 10 20 CECD O=C(COC(=O)c1cc(O)cs1)COc1ccccc1 803345428 AJNXXCQYOSXUBF-UHFFFAOYSA-N 292.312 2.259 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccn1C 808094456 PRVMDEJNFJYVIC-UHFFFAOYSA-N 279.336 2.146 10 20 CECD CN1CCCc2cc(CN[C@H]3CCC[C@H]3CN)ccc21 817901868 YWHFYHJHDXSUFA-HOTGVXAUSA-N 273.424 2.286 10 20 CECD C[C@H](NCCN)c1cc(Br)cc(Cl)c1O 817934978 RZJUZTGLYHQTMY-LURJTMIESA-N 293.592 2.417 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)C(C)(F)F 816028427 FUKFFESWRRMZJN-DTWKUNHWSA-N 287.306 2.436 10 20 CECD CN(C)c1ccc(CN(C(=O)[C@H](O)C2CC2)C2CC2)cc1 821033412 SENUMYGBTHZXLE-MRXNPFEDSA-N 288.391 2.015 10 20 CECD C[C@H](CC(=O)O)NCc1ccc2c(c1)CCCN2C 820084570 MRFPQMLZXNQDCN-LLVKDONJSA-N 262.353 2.022 10 20 CECD Cc1cc(N(C)C)ccc1CNC(C)(C)CC(=O)O 901681643 LLCXRNXNCZSORR-UHFFFAOYSA-N 264.369 2.404 10 20 CECD CCOc1ccc(O)c(CNC[C@]2(C)CCOC2)c1 733328071 RSYVCDCDPIOCIX-HNNXBMFYSA-N 265.353 2.307 10 20 CECD O=C(COC(=O)c1cc(O)cs1)NCC1CCCCC1 731911526 KWRKWXUFGHKUDY-UHFFFAOYSA-N 297.376 2.307 10 20 CECD CCN1CCC[C@H](N[C@H](C)c2cc(OC)ccc2O)C1=O 903392758 YKVBDQDVMPIHQC-RISCZKNCSA-N 292.379 2.062 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@H](C)c1cc(F)ccc1O 903343187 NJCZFRCMHLGPMO-OCCSQVGLSA-N 296.386 2.293 10 20 CECD Nc1ccc(CC(=O)NCCC[C@@H]2CCCCO2)cc1 832002498 NITGKLIBZKKENC-HNNXBMFYSA-N 276.380 2.277 10 20 CECD CC1(C)CCC(NC(=O)c2cc(O)cs2)(C(N)=O)CC1 831345771 CALINOQBPJIPQS-UHFFFAOYSA-N 296.392 2.008 10 20 CECD COC(=O)[C@H](C)N(C(=O)c1cc(O)cs1)C1CCC1 834334902 LKKXGHIQRJMNAC-QMMMGPOBSA-N 283.349 2.010 10 20 CECD CN(C)c1ccc(CN[C@@H](CCN)C(F)(F)F)cc1F 841090988 TUBQDWWQIFDLNT-LBPRGKRZSA-N 293.308 2.261 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C)[C@@H](CN)C2)c1 841100811 KPQKJDHVXKXCBT-JSGCOSHPSA-N 278.396 2.208 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@](C)(O)C1 840918339 SKINTDSZRHUZOX-INIZCTEOSA-N 262.397 2.408 10 20 CECD COc1cccc([C@H](C)NC[C@@H](C)N(C)C)c1O 846145146 LTAKUNWAHBWLDQ-MNOVXSKESA-N 252.358 2.002 10 20 CECD Oc1c(Br)cccc1CNCCCNC1CC1 841091826 HEPKZIVPXBHJIB-UHFFFAOYSA-N 299.212 2.386 10 20 CECD COCCOC[C@H](C)NCc1ccc(N(C)C)cc1C 840935434 PIWNQYTZTAGJQC-AWEZNQCLSA-N 280.412 2.202 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NCCF 840485703 WETHBVDYLHKFEL-GFCCVEGCSA-N 281.375 2.261 10 20 CECD COc1cccc([C@@H](C)NCc2nc(C(C)C)n[nH]2)c1O 846170273 NFPANZZHBQDHFW-SNVBAGLBSA-N 290.367 2.493 10 20 CECD CN(C)c1ccc(CNC2C[C@@H]3CC[C@H](C2)N3)cc1F 841030081 JYRHMSYWDJFWBF-PBWFPOADSA-N 277.387 2.264 10 20 CECD C[C@H]1CN(C(=O)NCCc2ccc(N)cc2)CCC1(F)F 841956775 HPJYQNGMMWPWSW-NSHDSACASA-N 297.349 2.498 10 20 CECD CCc1cccc(CNC[C@@H](O)c2ccco2)c1O 848892573 ATYGCXIAKFMKFP-CYBMUJFWSA-N 261.321 2.371 10 20 CECD Cn1nnnc1CSc1ncc(C(C)(C)C)s1 759719286 KHCUHWPYJVEZSG-UHFFFAOYSA-N 269.399 2.256 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCC[C@H]([S@@](C)=O)C2)c1 850355814 LUWVGKPCTXOIEG-BIENJYKASA-N 281.421 2.480 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2CCN(C)C2)c2c(O)ccc(F)c21 756534697 MXCDFYWCEONYFS-JFGNBEQYSA-N 264.344 2.373 10 20 CECD CCCCc1noc(COC(=O)c2cccc(O)c2O)n1 758559271 DBSVZFGGUMLXSJ-UHFFFAOYSA-N 292.291 2.180 10 20 CECD COC1CC(C(=O)NCc2cc(Cl)ccc2O)C1 862130097 BZNPJYDLCBHYQM-UHFFFAOYSA-N 269.728 2.087 10 20 CECD COC[C@H]1CCCCN(C(=O)c2cc(O)cs2)C1 768734642 ZJJFFFCHRJPIBD-JTQLQIEISA-N 269.366 2.342 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@]2(C)CCCCO2)c1 862754932 LMWRRMCNFPMWTQ-OAHLLOKOSA-N 263.337 2.276 10 20 CECD CCN1CC(=O)N([C@H](C)c2ccc(N(C)C)cc2)C1=O 761578043 JQEAUPGYFANOLR-LLVKDONJSA-N 275.352 2.098 10 20 CECD CCOc1ccc(CN(CCO)[C@H](C)CC)c(O)c1 862388033 UVXYNTQOKDNNAL-GFCCVEGCSA-N 267.369 2.384 10 20 CECD OCCN(Cc1ccc(N2CCCC2)cc1)CC1CC1 1117628385 GBXBRUIOJHWAOH-UHFFFAOYSA-N 274.408 2.491 10 20 CECD CN(C(=O)c1cc2c(s1)CCNC2)c1ccc(N)cc1 877074181 BHJNAIKMWGBTAN-UHFFFAOYSA-N 287.388 2.253 10 20 CECD CC[C@@H](N[C@H](C)C(=O)N(C)C)c1ccc(N(C)C)cc1 773046418 LFPGBGPENBMODQ-IUODEOHRSA-N 277.412 2.270 10 20 CECD Cc1ccc(CNC(C)(C)c2cnn(C)c2)c(O)c1 877045285 UUYYHDQGMAQKEH-UHFFFAOYSA-N 259.353 2.459 10 20 CECD CCOC(=O)[C@H](C)[C@@H](C)NCc1ccc(C)cc1O 877323474 PHEITDSTJSQNEF-VXGBXAGGSA-N 265.353 2.378 10 20 CECD CC[C@@]1(O)CCN(Cc2cc(Cl)cc(OC)c2O)C1 779217821 CLIZPNRCCRYBLP-CQSZACIVSA-N 285.771 2.401 10 20 CECD CCn1cnnc1CCN[C@H](C)c1c(O)cccc1F 886547718 QKOQEGDAZYTEIY-SNVBAGLBSA-N 278.331 2.036 10 20 CECD O=C(c1cc(O)cs1)N1CCC([C@H]2CCCO2)CC1 784798563 RLMTXRSNKBGEHV-GFCCVEGCSA-N 281.377 2.485 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CO[C@H](C)C1 784109588 WCXDUEJZHYBSPZ-TZMCWYRMSA-N 276.380 2.102 10 20 CECD COc1ccc(CN[C@H](CO)CC(C)(C)C)c(O)c1OC 893202802 OGSMIGXGXOSCQJ-LBPRGKRZSA-N 297.395 2.296 10 20 CECD Cc1ccc(C(=O)OCCO[C@H]2CCCCO2)c(O)c1O 791813721 HTQUZGJNFGVVNR-LBPRGKRZSA-N 296.319 2.106 10 20 CECD OC[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)CC1 894866018 DCEFQCCURYTUAK-SNVBAGLBSA-N 271.307 2.265 10 20 CECD CC[C@@]1(NC(=O)NCc2ccc(N(C)C)cc2)CCOC1 790119920 FRYQZYAJPXRWOH-MRXNPFEDSA-N 291.395 2.121 10 20 CECD CCOc1cccc(CNC[C@H]2CCCN2CC)c1O 83594690 VDUKZBOFCPNVEY-CQSZACIVSA-N 278.396 2.365 10 20 CECD Cc1cc(CN(C)c2ccc(OCCN(C)C)cc2)n[nH]1 1325435540 SIPBYGOUJBUOTH-UHFFFAOYSA-N 288.395 2.295 10 20 CECD CCOc1ccc(N(CC)C[C@@H]2CN(C)C(=O)O2)cc1 1347641034 FDSBYNZCEVVMGA-AWEZNQCLSA-N 278.352 2.362 10 20 CECD CSCCNCc1ccc(N2CCN(C)CC2)c(F)c1 1261626966 JHTKTIVKAZYBKV-UHFFFAOYSA-N 297.443 2.030 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnc(C3CC3)[nH]2)c1 1351630326 DQIWBDZPILSADI-UHFFFAOYSA-N 271.320 2.231 10 20 CECD Cn1cc(Cl)c(/C=C2/SC(=S)N(C3CC3)C2=O)n1 1353991413 YZEDXRDHCVTLMO-RUDMXATFSA-N 299.808 2.437 10 20 CECD CC[C@H](COC)N[C@@H](C)c1cc(C(=O)O)ccc1O 1605054884 ODCYYYDMHBSFNU-GXSJLCMTSA-N 267.325 2.166 10 20 CECD Cc1cccc(CN(CCC(=O)O)C[C@H]2CCCO2)c1O 1607851378 WQVYMQYRTXNWRD-CQSZACIVSA-N 293.363 2.156 10 20 CECD Oc1ccccc1CNc1cc(F)ccc1-c1nn[nH]n1 1607112056 RZLRHLYRGLCEQW-UHFFFAOYSA-N 285.282 2.324 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCC[C@H]2C(=O)O)c1 1605697537 HFWZCAHWIHXCBH-OLZOCXBDSA-N 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CECD CCN(CC)c1ccc(CN[C@@H]2COC[C@@H]2OC)cc1 839193567 SBPGNTXZLMMKTN-CVEARBPZSA-N 278.396 2.036 10 20 CECD C[C@@H](NC/C=C\CO)c1ccc(Br)cc1O 850507910 IXKQIKFBZNZGSM-PKRMOACSSA-N 286.169 2.354 10 20 CECD CC(C)CC[C@H](CO)NCc1cc(F)ccc1O 862480253 ARVWWZIOMPLQKY-CYBMUJFWSA-N 255.333 2.418 10 20 CECD CCO[C@@H](C(=O)N[C@@H](C)c1cc(OC)ccc1O)C1CC1 860241566 KTMIPWBWUVXIER-ZUZCIYMTSA-N 293.363 2.393 10 20 CECD Cc1cc(N[C@H](C)Cc2ccc(O)c(O)c2)ncn1 762799867 DBAIHDANMJJBII-SNVBAGLBSA-N 259.309 2.239 10 20 CECD CCCNC(=O)CN1CCCCc2cc(OC)ccc21 766270913 WWAKBCQEXAQIBV-UHFFFAOYSA-N 276.380 2.364 10 20 CECD O=C(NCc1ccccc1O)c1cc(C(F)(F)F)n[nH]1 774061540 ANQSVRNQKDLOAY-UHFFFAOYSA-N 285.225 2.064 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](N)CCC(C)C)c1 876878734 JTGSRCXDJOOZKG-FZMZJTMJSA-N 294.395 2.342 10 20 CECD COCC1(C(=O)NCc2c(O)ccc3c2CCCC3)CC1 778929094 DLHMIOYESJYALG-UHFFFAOYSA-N 289.375 2.314 10 20 CECD CCC[C@H](OCC)C(=O)N(C)c1ccc(N)cc1 877074484 LVAKQRMFACFMHJ-ZDUSSCGKSA-N 250.342 2.437 10 20 CECD 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CECD CCOCc1cc(CNC[C@@H]2C[C@H](F)CN2)ccc1OC 841079722 QFFNFVPTYQDLRY-GJZGRUSLSA-N 296.386 2.021 10 20 CECD CCN(CC)c1ccc(CNCCSCC(=O)O)cc1 841814144 QLOVPZHNSYRZMG-UHFFFAOYSA-N 296.436 2.440 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@H]([C@@H]2CCNC2)C1 843125598 YMDTWIUXFBFCSA-OLZOCXBDSA-N 278.371 2.353 10 20 CECD Cc1ccc(O)c(CN(C2CCNCC2)C2CC2)c1 843043751 GBJUZZNRDSHRCS-UHFFFAOYSA-N 260.381 2.417 10 20 CECD NCC[C@@H](NCc1c(O)cccc1Cl)C(F)F 841074161 MQIPKVYYMUMPKN-SECBINFHSA-N 264.703 2.118 10 20 CECD COC[C@H](NC(=O)c1cc(O)cs1)c1ccco1 746697276 PDAYMAICKDWTKH-VIFPVBQESA-N 267.306 2.164 10 20 CECD CCCN(Cc1cc(F)ccc1O)[C@H]1CCN(C)C1 843421354 CENKELKPTNEAGI-AWEZNQCLSA-N 266.360 2.447 10 20 CECD CC(C)OC(=O)CCCNC(=O)Nc1ccc(N)cc1 841296089 OQEBGZAYDMIVTM-UHFFFAOYSA-N 279.340 2.122 10 20 CECD Cc1noc(CCCNCc2ccc3c(c2)CCCO3)n1 921694763 YBKYIWNIPGYOEE-UHFFFAOYSA-N 287.363 2.425 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2C[C@]2(C)OC)c1 850571530 RXRXNFGYZYZDPE-PKPZWWHKSA-N 279.336 2.007 10 20 CECD 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10 20 CECD O=C(O)c1ccc(CNCc2cc(F)ccc2O)o1 1608887649 RJEPYZSUOTZHPQ-UHFFFAOYSA-N 265.240 2.112 10 20 CECD Cc1cc(N(C)C(=O)/C=C/[C@H]2CCCNC2)ccc1O 1579617052 KKQAYECCFVASOF-OQHXTRMZSA-N 274.364 2.219 10 20 CECD CCN1CCC[C@@H]1CN[C@@H](C)c1cc(C(=O)O)ccc1O 1596421402 JVAJWMJZMLFFSJ-WCQYABFASA-N 292.379 2.225 10 20 CECD CCN1C(=O)/C(=C\c2cncc(C(=O)O)c2)SC1=S 1776874496 QHWQQKNIUFVEET-RUDMXATFSA-N 294.357 2.001 10 20 CECD O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1ccc(O)cc1 20212955 WWHXIEGOWAQXBO-UHFFFAOYSA-N 294.288 2.101 10 20 CECD C[C@H](N)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 166470546 RERFLIOPZIZFEJ-ZDUSSCGKSA-N 289.423 2.419 10 20 CECD Nc1ccc([N+](=O)[O-])c(NCc2ccccc2O)c1 800847599 FVRBXABHLSBIDM-UHFFFAOYSA-N 259.265 2.495 10 20 CECD CC[C@H](NCc1ccc(N(C)C)cc1)C(C)(C)O 293031446 PTZHZBYRHUFARL-AWEZNQCLSA-N 250.386 2.392 10 20 CECD C[C@H]1CCCCN1CC(=O)NCc1ccc(N(C)C)cc1 7354335 SHEFDQSGJSGPIE-AWEZNQCLSA-N 289.423 2.243 10 20 CECD CCOCCCNC(=O)N[C@H](C)c1cc(OC)ccc1O 103506777 VAFZXKFZJYGABB-LLVKDONJSA-N 296.367 2.188 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](O)c1ccccc1 179652760 IZKAQGSTJONTJO-QGZVFWFLSA-N 298.386 2.445 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccc(C)cn2)c1 184256008 UPVJEOJBVILIJI-UHFFFAOYSA-N 287.319 2.426 10 20 CECD COc1cccc(CN2CCN(C3CCCC3)CC2)c1O 133882138 CFDSNIGBIVOXPF-UHFFFAOYSA-N 290.407 2.461 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2[C@H](C)O[C@H](C)[C@@H]2C)c1 529835912 NALPEKWOJZGRHL-OXIQGZBJSA-N 277.364 2.376 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CCCN1C 269187682 VZPRXKCZVRCUBS-CQSZACIVSA-N 276.380 2.225 10 20 CECD CC(=O)N1CCC[C@H](CNCc2c(O)cccc2Cl)C1 279781612 LIBAFQJVTSMUCR-GFCCVEGCSA-N 296.798 2.394 10 20 CECD COC(=O)COc1ccc(N(C)CC2CCC2)cc1 273156606 YXOCQZXSGGWCBF-UHFFFAOYSA-N 263.337 2.475 10 20 CECD CC(C)C[C@@H](CCO)CNC(=O)c1c(F)ccc(O)c1O 276563108 JGPKUTHBQQOLID-SNVBAGLBSA-N 299.342 2.011 10 20 CECD COC(=O)[C@]1(C)CN(Cc2cc(C)ccc2O)C[C@H]1C 282724819 LVJKULUNUOHQCD-MLGOLLRUSA-N 277.364 2.332 10 20 CECD Cc1cc(O)c(CNCC2([S@@](C)=O)CC2)cc1C 282344925 MLARUGWDJCKZSK-GOSISDBHSA-N 267.394 2.010 10 20 CECD Cc1conc1C(=O)N1CCOc2cc(N(C)C)ccc21 631560651 BFZBIURXPBKJLD-UHFFFAOYSA-N 287.319 2.088 10 20 CECD CC(C)c1nn(C)cc1C(=O)NCc1ccc(N)cc1 297134124 HONLVQCNTPRLHA-UHFFFAOYSA-N 272.352 2.056 10 20 CECD C[C@@H](N[C@@H]1CCNC1)c1cc(Br)ccc1O 817945025 RPVJAUBGMIGLKJ-PSASIEDQSA-N 285.185 2.167 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCC[C@@H](N)C2)c1 817970045 KFSPTVNMUVBIOO-QJPTWQEYSA-N 264.369 2.321 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CN)CC(C)C)c1 817959148 PTWPTJPZAROCHO-RYUDHWBXSA-N 266.385 2.425 10 20 CECD Cc1cc([C@@H](C)NC[C@@H](N)c2ccc(N(C)C)cc2)no1 817944316 ZCLSPZQGXWHMER-IUODEOHRSA-N 288.395 2.400 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(O)nc(C2CC2)n1 816889138 NLUAESDQABFXFY-UHFFFAOYSA-N 299.330 2.037 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)[C@H]2CCCOC2)cc1Cl 826120462 DPUJLHPNBJNLRD-FZMZJTMJSA-N 299.798 2.231 10 20 CECD CCOCc1cc(CN[C@@H](CC)[C@H](C)O)ccc1OC 824921475 MHLUECNHJJYKNO-WFASDCNBSA-N 281.396 2.481 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)CC(F)F)cc1Cl 825697840 KNEXOCVUPPRURM-SECBINFHSA-N 279.714 2.460 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)C[C@@H]2C(N)=O)cc1Cl 825568205 UCTHENMRIFSCBL-TVQRCGJNSA-N 296.798 2.440 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H]1CCNC(=O)CC1 827377781 FLBJGBAGIHSXMD-CYBMUJFWSA-N 288.391 2.364 10 20 CECD CSC[C@@H](CCO)N[C@H]1CCc2cccc(O)c21 834597489 GGLLTAGXFZHHQO-NEPJUHHUSA-N 267.394 2.083 10 20 CECD CCC[C@@H](NCc1ccc(N(C)C)cc1C)C(=O)O 905786151 HIFYRXMBZRSPLD-CQSZACIVSA-N 264.369 2.404 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(CC)C1)c1ccc(C)cc1O 834892546 WAILKCSOHDAEPZ-GXTWGEPZSA-N 276.380 2.362 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCC[C@@H]1CCCN1 842007273 XTKHETVFMJSJSE-AWEZNQCLSA-N 291.395 2.066 10 20 CECD CCOCc1cc(CN[C@H]2CO[C@@H](C)C2)ccc1OC 842774511 IHCLPKBWTKZUCU-SWLSCSKDSA-N 279.380 2.499 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)[C@H]2CCCNC2)c1 841033735 VEPZQUCIUWJKCM-STQMWFEESA-N 278.396 2.269 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)NC(C)C)c1ccc(F)cc1O 840888803 CRMWUTMKTYSXIX-GXFFZTMASA-N 282.359 2.485 10 20 CECD O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCc1ccc(O)cc1O 910945432 WHCWVKDFHPEXNS-GBIKHYSHSA-N 261.321 2.150 10 20 CECD CC(C)C[C@@H](CNCc1ccc2c(c1)CCO2)C(=O)O 841816282 NVHADJNBOGSXRO-AWEZNQCLSA-N 277.364 2.458 10 20 CECD COc1cc(O)c(CN[C@H](CN)C2CCCC2)cc1OC 841087500 OUPMIHZZCHLJPB-CYBMUJFWSA-N 294.395 2.017 10 20 CECD Cc1cc(N(C)C)ccc1[C@H]1NC(=O)CN1CC(C)C 840799696 FKVCUHKTHLXMTL-INIZCTEOSA-N 275.396 2.147 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)c1cc(O)cs1 743697618 HBNYONMCWYVGEC-QMMMGPOBSA-N 257.355 2.387 10 20 CECD C[C@H]1CCNC[C@@H]1NCc1ccc(N2CCCC2)cc1 841059005 IYMWOIFCGALOKD-YOEHRIQHSA-N 273.424 2.374 10 20 CECD CN1CCC(NCc2ccc(N(C)C)c(F)c2)CC1 742207349 WPUDHHITGLHZAQ-UHFFFAOYSA-N 265.376 2.076 10 20 CECD Cc1cc(CN2CC(=O)N[C@@H](C)C2)c(O)c(C(C)(C)C)c1 840132828 LDSNVLRVWIVFLF-LBPRGKRZSA-N 290.407 2.318 10 20 CECD CC[C@H]1CCCN1C(=O)NCCc1ccc(N)cc1 841955658 JJPGGVLIZQBIFB-AWEZNQCLSA-N 261.369 2.395 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H](O)C[C@@H](C)C1 840953868 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1116737319 OKFTYOKQWFHIOI-UHFFFAOYSA-N 292.722 2.006 10 20 CECD C[C@H]1CCCN1C(=O)CCN[C@H](C)c1ccccc1O 879648371 LRBDUODBTUNGSJ-QWHCGFSZSA-N 276.380 2.444 10 20 CECD O=C(N[C@@H](CO)c1c(F)cccc1F)c1cc(O)cs1 778510681 LVTGCNCTVJRVSS-JTQLQIEISA-N 299.298 2.195 10 20 CECD CC[C@H](N[C@H](C)[C@@H]1CN(C)CCO1)c1ccccc1O 775522021 HMRPHOBZEAUHGV-INWMFGNUSA-N 278.396 2.152 10 20 CECD CC(C)c1n[nH]c(CNCc2cc(F)cc(F)c2O)n1 883133189 RRCNYCYQNXEDKI-UHFFFAOYSA-N 282.294 2.202 10 20 CECD Cc1ccc(CN[C@@H]2Cc3ccccc3[C@H]2O)c(O)c1 898387954 SHIGXXSXLHTEMI-NVXWUHKLSA-N 269.344 2.449 10 20 CECD COc1ccc(CNC(=O)c2cccc3nc[nH]c23)c(O)c1 794377864 LSKOBDKAYNMDTF-UHFFFAOYSA-N 297.314 2.207 10 20 CECD COc1cc(CN(C)C[C@H](C)OC)c(O)cc1C 795748680 DMFKEEOXZSOUSS-NSHDSACASA-N 253.342 2.176 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCC(=O)C[C@H]2C)c(O)c1 794373844 NBNVFWYBEBYVAY-YGRLFVJLSA-N 291.347 2.022 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCN2CCC[C@H]2C1 725845539 CRPLCPVOTZMWTN-OLZOCXBDSA-N 276.380 2.117 10 20 CECD OC[C@@H](CC(F)F)NCc1c(O)cccc1Cl 717713312 LWKFPPQJZHYKHX-SSDOTTSWSA-N 265.687 2.151 10 20 CECD CCC[C@H](O)CN1CCN(c2ccc(OCC)cc2)CC1 1252789863 PICPQFLXMVJTAP-INIZCTEOSA-N 292.423 2.368 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1ccc(C(=O)O)cn1 1608258498 JXZYNCQQPYNBBL-UHFFFAOYSA-N 297.358 2.191 10 20 CECD CN(Cc1ccc2nonc2c1)c1ccc(N)cc1 1578490664 QVDNYZHHWFETCU-UHFFFAOYSA-N 254.293 2.441 10 20 CECD COc1ccc(CN[C@@H]2CCC[C@H]2C(=O)O)cc1C 1599572295 CMXNILLTHTUMEL-CHWSQXEVSA-N 263.337 2.347 10 20 CECD CCCCN[C@@H](CC)c1cccc(-c2nn[nH]n2)c1O 1590604347 HRPKDGAUSXILRN-LBPRGKRZSA-N 275.356 2.413 10 20 CECD COC[C@]1(C)CCN(Cc2c(O)cccc2OC)C1 824577045 YTQJFKSBUCLGJA-OAHLLOKOSA-N 265.353 2.259 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](O)[C@H]2C)c1O 832219216 ATSBHQFTHVERKS-AMIZOPFISA-N 283.755 2.203 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CCn3ccnc3C1)CC2 834773552 GUVVNMXSTVWCBF-QWHCGFSZSA-N 269.348 2.181 10 20 CECD Oc1ccc(F)cc1CNC[C@@H]1CCN(C2CC2)C1 226584536 XKPKCSLBUWOYIG-NSHDSACASA-N 264.344 2.105 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H](CN)C2)c1O 229102564 WJPHNEJAADUVHS-JTQLQIEISA-N 284.787 2.225 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)CN2CCOCC2)c1 36933344 DVJPPXAUASXYHM-KGLIPLIRSA-N 278.396 2.072 10 20 CECD Oc1ccccc1CN1CCS[C@H]2COCC[C@@H]21 179585216 FBLQHAPGKGNXGL-JSGCOSHPSA-N 265.378 2.099 10 20 CECD CCN(CCO)Cc1cc(Cl)cc(C(C)=O)c1O 50134563 SQJVQBHKAFYNPR-UHFFFAOYSA-N 271.744 2.062 10 20 CECD CC(C)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 68512487 DXELXUQQSCPILX-ZDUSSCGKSA-N 276.380 2.356 10 20 CECD CN(Cc1nnc[nH]1)Cc1cc(Cl)cc(Cl)c1O 179794502 OGTCCTYOAUPHKM-UHFFFAOYSA-N 287.150 2.449 10 20 CECD Cc1ccc(C(=O)NC[C@H]2Cc3ccccc32)c(O)c1O 179438864 BSXGSHCEGGIZHQ-GFCCVEGCSA-N 283.327 2.476 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1ccc(N(C)C)c(F)c1 120594774 WGDLZVMRJMJOPJ-NSHDSACASA-N 282.359 2.133 10 20 CECD COCCc1nsc(NCc2cc(OC)ccc2O)n1 302835311 VBLGGHZPLYKTLW-UHFFFAOYSA-N 295.364 2.053 10 20 CECD N[C@@H]1CCCN(Cc2cc(Br)ccc2O)C1 219507980 CVTKGOGMYCOSDH-LLVKDONJSA-N 285.185 2.078 10 20 CECD c1cc(N2CCOCC2)ccc1CNC[C@H]1CCCOC1 38044459 SIJHLOKGYHEZKR-MRXNPFEDSA-N 290.407 2.039 10 20 CECD CC1(CNCCCSc2nccs2)COC1 381365546 DXFKEMTUXAWEEK-UHFFFAOYSA-N 258.412 2.251 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cc(F)ccc1F 96968115 REKHHMNZHUWYJM-UHFFFAOYSA-N 293.269 2.349 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1CCOC2(CCC2)C1 269287831 SZWLSAJVLVTRIS-ZDUSSCGKSA-N 290.363 2.293 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@@H](n2cncn2)C1 364505089 DGDKKIGRJXVADM-LLVKDONJSA-N 278.743 2.084 10 20 CECD Cc1ccc(C(=O)N2CCCOC(C)(C)C2)c(O)c1O 361000500 WHXWFLZRRBBVRH-UHFFFAOYSA-N 279.336 2.047 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)CC[S@]1=O 277647689 OBSLSVISSMSDIC-FKIZINRSSA-N 298.427 2.235 10 20 CECD COc1ccc(N2CCC(NCCC[C@@H](C)O)CC2)cc1 366012247 TWCVRTTWJLHKQO-CQSZACIVSA-N 292.423 2.415 10 20 CECD COC[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 273472173 JWHLCSAXKDIERK-ZANVPECISA-N 280.324 2.376 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)CC[S@](=O)C1 277362010 FHFZDAFSIHIBNN-YPMLDQLKSA-N 287.812 2.246 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C)[S@](=O)CC2)cc1C 277808539 YBHUHZBFPKGCLP-BFUOFWGJSA-N 281.421 2.352 10 20 CECD CCO[C@H]1C[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 298665728 QMJCIQQOHDOAQD-GJZGRUSLSA-N 276.380 2.136 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCOC1CCC1 805508603 LAGDHHUMJYFVGW-FNORWQNLSA-N 278.304 2.223 10 20 CECD COC1(CCNCc2cc([N+](=O)[O-])ccc2O)CCC1 293041720 SIOXWSDZSHBUSM-UHFFFAOYSA-N 280.324 2.349 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnn2ccccc12 394990998 MOQTUWOTBVBANA-UHFFFAOYSA-N 281.315 2.312 10 20 CECD CC(=O)C(=O)COc1ccccc1C(=O)Nc1ccccc1 808012468 LMNYVAUQUWYCDP-UHFFFAOYSA-N 297.310 2.476 10 20 CECD COc1cc(O)c(CN2CCC[C@H]2CF)cc1OC 293845361 BGKJUMQRIINEKV-NSHDSACASA-N 269.316 2.343 10 20 CECD C[C@@H](NCC[C@@H]1CCNC1)c1cc(F)ccc1O 817955520 XXENGAUMTSPKMV-MNOVXSKESA-N 252.333 2.182 10 20 CECD CN(Cc1cc(Br)ccc1O)C1(CO)CC1 827903102 BHEJKZAAWLKDBG-UHFFFAOYSA-N 286.169 2.111 10 20 CECD COCCCNC(=O)c1cc(C)n(-c2ccccn2)c1C 914846071 TWGNHTMGRYGYCG-UHFFFAOYSA-N 287.363 2.255 10 20 CECD CCc1ccccc1NC(=O)C(=O)NCc1ccccc1O 748486880 XUCNSMQPTVHBKV-UHFFFAOYSA-N 298.342 2.210 10 20 CECD COc1cccc(CN[C@@H](C)COCC2CC2)c1O 846073880 SHRNGXRZWHYVOU-NSHDSACASA-N 265.353 2.306 10 20 CECD Nc1ccc(Cc2nc(CC3CCOCC3)no2)cc1 843184605 FZNXMAFMXPUYTR-UHFFFAOYSA-N 273.336 2.212 10 20 CECD COc1cccc(CNC[C@H]2NCCc3ccccc32)c1O 841069044 LNUUFCMFJCZPGY-MRXNPFEDSA-N 298.386 2.377 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H]2CCOC2)cc1 844399894 RSUDAJMUNSWVJW-AWEZNQCLSA-N 278.396 2.100 10 20 CECD Nc1ccc(CCNC(=O)NC[C@H]2CCCSC2)cc1 841906513 RVZQFKVDJFSOAC-CYBMUJFWSA-N 293.436 2.254 10 20 CECD CC[C@@H](NC(=O)NCCc1ccc(N)cc1)[C@@H]1CCCO1 841865395 RJGCSWZIJQNDSY-CABCVRRESA-N 291.395 2.068 10 20 CECD Cc1ccc(CCNC(=O)NCc2ccccc2O)o1 748459920 LBJNNROWSDVAMF-UHFFFAOYSA-N 274.320 2.336 10 20 CECD CCOc1ccc(CN[C@@H]2CCCNCC2)c(O)c1 841057048 HHFXWNBNLHKVNV-CYBMUJFWSA-N 264.369 2.023 10 20 CECD C[C@@H](CCCO)N[C@@H](C)c1cc(F)cc(F)c1O 756648727 YZVBRNKYNGMEKS-IUCAKERBSA-N 259.296 2.482 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@](C)(O)C(C)C)c1 756578032 VLHVNGMOKWALDJ-ZBEGNZNMSA-N 295.379 2.236 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC(C)(O)C2)cc1 765452363 DFCJJDPOJNMFRK-UHFFFAOYSA-N 284.359 2.301 10 20 CECD CCCN(CCN1CCCC1=O)Cc1ccccc1O 68973658 UEXHYPQSGDQMDZ-UHFFFAOYSA-N 276.380 2.227 10 20 CECD CC(C)N(CCO)Cc1cc(F)c(N(C)C)cc1F 862213046 MMVYGFZMVFCMCX-UHFFFAOYSA-N 272.339 2.234 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2ccc(C)nc2)c1 862758537 CFOGWQYCZXLCEZ-UHFFFAOYSA-N 270.332 2.263 10 20 CECD CC[C@H](CO)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 779735107 BEYKKXRTLGYGFX-CQSZACIVSA-N 290.407 2.262 10 20 CECD COc1ccc(CNC[C@@H]2C[C@H](C)O[C@@H]2C)c(O)c1OC 894909239 COLFSYFEVYAPOW-LOWVWBTDSA-N 295.379 2.313 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)NCc1cc(C)cc(OC)c1O 894386649 KPXMEFDLQJBLHA-NEPJUHHUSA-N 294.395 2.102 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](O)C[C@H]2C)cc1 788270935 XHBFETXFRURZQS-CZUORRHYSA-N 262.397 2.488 10 20 CECD COc1cc(C)cc(CNCCCC2(O)CCC2)c1O 895033454 AKPWLRSGLSEPON-UHFFFAOYSA-N 279.380 2.494 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)[C@H]1OC 893593816 PEZUENGGCMLEKV-DJIMGWMZSA-N 291.391 2.294 10 20 CECD COc1ccc(CN[C@H](C)c2nnnn2C2CC2)cc1C 790537460 HIWMJWJOSMWRRS-LLVKDONJSA-N 287.367 2.176 10 20 CECD COc1ccc(CNC(=O)c2cccc3[nH]ncc23)c(O)c1 794369069 AMSCBADICXWHLZ-UHFFFAOYSA-N 297.314 2.207 10 20 CECD CN(Cc1ccccc1O)c1cc(C(=O)O)ccn1 1777076912 OTPBVROGNKAQFP-UHFFFAOYSA-N 258.277 2.122 10 20 CECD C[C@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc(N)cc1 19397050 HXXJGIQENQZWID-FZMZJTMJSA-N 278.352 2.182 10 20 CECD Oc1c(Cl)cc(Cl)cc1CNC[C@@H]1COCCO1 38060442 CYFHUOLOKUALBO-SNVBAGLBSA-N 292.162 2.204 10 20 CECD COC1(CN[C@@H](C)c2cc(F)ccc2O)CCOCC1 186147225 UMMRRVQBMCVCOL-NSHDSACASA-N 283.343 2.378 10 20 CECD CCOC(=O)c1cnc(S[C@H]2CCOC2)s1 703029688 RXNYICNMRLHGJW-ZETCQYMHSA-N 259.352 2.201 10 20 CECD C[C@@H](NC(=O)[C@@H](C)n1ccnc1)c1ccc(N(C)C)cc1 1324138656 IZVNQTPYFVOMFA-CHWSQXEVSA-N 286.379 2.388 10 20 CECD C[C@@H]1COC[C@@H]1NCc1c(O)cccc1Br 706805241 TXSTZJIDCJATPI-KCJUWKMLSA-N 286.169 2.279 10 20 CECD COc1cc(C)cc(CNCc2cnc(C)o2)c1O 1332719215 ZRECAWKJMRLJPU-UHFFFAOYSA-N 262.309 2.295 10 20 CECD CO[C@]12CCC[C@@]1(C(=O)Oc1ccc(N)cc1)CCO2 1579132933 IXGUKQBQMPZOQU-GJZGRUSLSA-N 277.320 2.108 10 20 CECD COc1cccc(CNCc2ccc(N(C)C)cc2)n1 105460649 OCGSLKBPJGGUEO-UHFFFAOYSA-N 271.364 2.446 10 20 CECD CN(C)[C@H](C(=O)NCCc1ccc(N)cc1)c1ccccc1 152529092 DEOWMCNNCCHRJE-KRWDZBQOSA-N 297.402 2.230 10 20 CECD CCCOc1ccc(CN2CCCN(C)CC2)c(O)c1 211488214 VLFYNZPKBCIYIK-UHFFFAOYSA-N 278.396 2.319 10 20 CECD CC[C@@H](N[C@H](C)c1nncn1C)c1ccccc1O 37016937 QNAIQPLCZIJGER-ZYHUDNBSSA-N 260.341 2.323 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCCS1 266475592 BMXFKUPCCQQZSY-GFCCVEGCSA-N 251.351 2.246 10 20 CECD Cc1cccc(CN(C)C[C@H]2CCCN(C)C2)c1O 179733801 MGMQVVOQXHZAIE-AWEZNQCLSA-N 262.397 2.474 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)[C@@H]1CCOC1 708438578 WURUMJUNYLBWJH-DTWKUNHWSA-N 257.280 2.185 10 20 CECD CC1(C)CN(C(=O)Nc2ccc(N)cc2)[C@@H]2COC[C@@H]21 384617431 RAUYUQKMECDIKK-QWHCGFSZSA-N 275.352 2.158 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)C(C)C)c1 172043360 XPHOYTBKATXPGR-JTQLQIEISA-N 251.326 2.309 10 20 CECD CC(C)NC1CCN(Cc2cc3c(cc2O)OCO3)CC1 179837161 JXKTUAANDGZRII-UHFFFAOYSA-N 292.379 2.083 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)CCO)CC2)cc1 305113913 HDOOJCBECIGXLP-ZDUSSCGKSA-N 278.396 2.025 10 20 CECD Cc1cccc(CN2CCN(c3ccccn3)CC2)c1O 183471258 UTVIVUTUOXJKSS-UHFFFAOYSA-N 283.375 2.418 10 20 CECD COC[C@@H](CNCc1ccc(N2CCCCC2)cc1)OC 227704573 AMHNECBFGATFAD-QGZVFWFLSA-N 292.423 2.428 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@H]1CCCCN1 195171562 JTIAQAQFWZPCEJ-INIZCTEOSA-N 287.407 2.045 10 20 CECD COc1cccc(CN2CCC[C@H]2C[C@@H](C)O)c1O 93482922 NTZMHZATWDNPCR-YPMHNXCESA-N 265.353 2.136 10 20 CECD CO[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 271185589 MUQNEAWDIBXCJF-LBPRGKRZSA-N 252.333 2.112 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC(C)C)c1 273428413 VACXWIBZTBJPHY-JTQLQIEISA-N 251.326 2.485 10 20 CECD CO[C@@]1(C)C[C@H](NC(=O)c2c(F)ccc(O)c2O)C1(C)C 276610539 PNLOPYSXZDKXGE-BONVTDFDSA-N 297.326 2.170 10 20 CECD COC[C@H](CO)N[C@@H](C)c1ccc(N2CCCCC2)cc1 280983274 MFIWOEIPVSJMJC-HOCLYGCPSA-N 292.423 2.335 10 20 CECD CO[C@@H]1CCN(C(=O)c2ccc(C)c(O)c2O)[C@@H](C)C1 281842523 SYRPJWNFRKFOSR-WDEREUQCSA-N 279.336 2.046 10 20 CECD CCCc1cc(C(=O)OCC(=O)C(C)=O)sc1C 808486213 KPNIKVPWFOJUHD-UHFFFAOYSA-N 268.334 2.324 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](N)C1CCC1 399192481 QPBJJJGNFGALDJ-INIZCTEOSA-N 289.423 2.229 10 20 CECD C[C@H](NCc1cncn1C)c1cc(F)cc(F)c1O 810244298 ZPEJNTXDLQIDJY-QMMMGPOBSA-N 267.279 2.255 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CC1(CN)CC1 817993467 IIMJYJIEKDCCTO-UHFFFAOYSA-N 289.423 2.230 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CCS[C@H]2C)c(O)c1 827649548 JJBSSMHJZYSWHG-CABZTGNLSA-N 296.392 2.094 10 20 CECD COc1ccc(CN[C@@H](C)[C@H](C)C(=O)O)cc1C 901446264 SOKMWTMWWJQQQL-QWRGUYRKSA-N 251.326 2.202 10 20 CECD CC[C@H](CNC/C=C\c1ccc(N(C)C)cc1)C(=O)O 903709134 CMKUEZDPDFKWPJ-GEXIGZQTSA-N 276.380 2.466 10 20 CECD CNC(=O)c1cccc(COC(=O)c2cc(O)cs2)c1 733826135 LBRRFOUCCZEESV-UHFFFAOYSA-N 291.328 2.170 10 20 CECD Nc1ccc(CC(=O)N2CCC([C@@H]3CCCO3)CC2)cc1 831934139 YLVOPSNEFZTIPO-INIZCTEOSA-N 288.391 2.229 10 20 CECD CN(C)c1ccc(/C=C\CNCC2(C(=O)O)CC2)cc1 901509662 YZYFGHJXLPUHTR-ARJAWSKDSA-N 274.364 2.220 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 834902838 DJXLJJXOXZSQDA-LEJCRSTHSA-N 295.354 2.473 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCCCC(=O)O 848449148 BOQMWCMDFPESLV-UHFFFAOYSA-N 292.379 2.322 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](C)S(=O)[C@@H](C)C1 840941812 MREMCYGPNSLNNA-KBPBESRZSA-N 294.464 2.402 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)CCN(C)C)c1O 846142348 RROJXYKURJRRJR-NWDGAFQWSA-N 266.385 2.392 10 20 CECD COC[C@@H](C)n1ccc(NC(=O)Nc2ccc(N)cc2)n1 841296152 PFJOWRZHBDCECH-SNVBAGLBSA-N 289.339 2.317 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H](C)CCN 841968431 XPYGAJQXWSNIMP-GFCCVEGCSA-N 279.384 2.051 10 20 CECD CCC[C@H](C)S(=O)(=O)NCc1cc(OC)ccc1O 845872949 ALQSVGAZVGQRDE-JTQLQIEISA-N 287.381 2.009 10 20 CECD N[C@H]1CCO[C@@H](C2CCN(Cc3ccccc3O)CC2)C1 841103869 LMWPGFOOTLPAJI-DOTOQJQBSA-N 290.407 2.111 10 20 CECD Oc1cccc(Cl)c1CNC[C@@H]1CCCCN1 841032210 AMSFSGSCTHXMHR-JTQLQIEISA-N 254.761 2.277 10 20 CECD CC(C)CN1CC(=O)N[C@H]1c1cc(Cl)c(F)cc1O 840800302 LOHCSSHEIXVQGW-CYBMUJFWSA-N 286.734 2.271 10 20 CECD CNCCC1CCN(Cc2cccc(F)c2O)CC1 843057355 IYDPVNKYFRKKHM-UHFFFAOYSA-N 266.360 2.353 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](C)CC(=O)O)c1 911343660 SBXLFZGMFOFKRI-NXEZZACHSA-N 295.335 2.079 10 20 CECD C[C@H]1C[C@H](CN)CN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 843058739 XFIHVOZAOZEKNW-DTWKUNHWSA-N 299.758 2.123 10 20 CECD CCS(=O)(=O)CCCN[C@@H](C)c1cc(C)ccc1O 840888223 DCGNZAPWZAJIDG-LBPRGKRZSA-N 285.409 2.176 10 20 CECD CC[C@@H](C[C@@H](C)CO)NCc1cc2c(cc1O)OCO2 743499720 PVTZIAQXPLAPAF-PWSUYJOCSA-N 281.352 2.008 10 20 CECD CCc1cccc(CN[C@H](C)COCCOC)c1O 848898725 XQZRYLQNUJFHRM-GFCCVEGCSA-N 267.369 2.096 10 20 CECD CCOCCNCc1ccc(Br)cc1O 691413600 IEKAOHGYGNONPG-UHFFFAOYSA-N 274.158 2.281 10 20 CECD OC[C@@H](CN[C@H]1CCc2cccc(O)c21)CC1CC1 850546422 ZPSCJIIKKAXUTB-OCCSQVGLSA-N 261.365 2.378 10 20 CECD C[C@@H](Sc1ncc(Cl)s1)c1nnnn1C 850000125 JWSROTZXRXRCSU-SCSAIBSYSA-N 261.763 2.173 10 20 CECD CC(C)[C@H]1C[C@H](C(=O)NCc2ccccc2O)CCO1 934936686 WDINKYMRGTZPAS-IUODEOHRSA-N 277.364 2.460 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@H](C)c1ccc(F)cc1O 760883550 CEIWMARKRCRJHI-RIEGTJTDSA-N 283.343 2.376 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1ccc(OCC)cc1O 779715684 NSYAQGWOJOBEQY-INIZCTEOSA-N 292.379 2.412 10 20 CECD CC(C)[C@@](C)(O)C(=O)NCCCSc1nccs1 771339847 AJNIZSSLIZQLDE-GFCCVEGCSA-N 288.438 2.149 10 20 CECD CN(Cc1cn[nH]c1)Cc1cccc(Cl)c1O 775699153 ABGVXZNSDTWGHB-UHFFFAOYSA-N 251.717 2.401 10 20 CECD Cc1ccc(CN2CCOC3(CCOCC3)CC2)c(O)c1 877398290 CWKXXQATIVYRIO-UHFFFAOYSA-N 291.391 2.472 10 20 CECD CCCN(C[C@H](OC)[C@@H]1CCOC1)c1ccc(CN)cc1 877477387 CEGRBYHTPHHUMF-WBVHZDCISA-N 292.423 2.413 10 20 CECD C[C@H](NCc1cc(=O)c(O)co1)c1ccc(N(C)C)cc1 775832271 XSAFWGSKOBRBOM-NSHDSACASA-N 288.347 2.262 10 20 CECD NC(=O)[C@H]1CC[C@H](CNCc2cc(F)cc(F)c2O)CC1 883147496 XPVUQQQITQZFHW-MGCOHNPYSA-N 298.333 2.052 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2c(O)cccc2F)n1 886628691 ZMSPJHDWVURZFN-JTQLQIEISA-N 278.331 2.302 10 20 CECD CN1CCCc2cc(CNC(=O)N3C[C@H]4C[C@@H]4C3)ccc21 888004891 APLNSUGHHAAMLJ-HUUCEWRRSA-N 285.391 2.230 10 20 CECD C[C@H]1CCCN(CCNCc2cc(F)cc(F)c2O)C1 882891294 SQBIGORQXNSTRC-NSHDSACASA-N 284.350 2.492 10 20 CECD COc1ccc(CNC[C@H]2CCO[C@H](C)C2)c(O)c1OC 893296862 FRPYYYAIHOMXNY-NEPJUHHUSA-N 295.379 2.314 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC[C@@H]1CCCO1 787747502 HRGMUDSHPQDUOC-RNZFLTOJSA-N 278.304 2.223 10 20 CECD Cc1ccc(O)c(CN[C@@H](Cc2ccccc2)C(=O)O)c1 84854118 POOZVCKAJXMXSA-HNNXBMFYSA-N 285.343 2.486 10 20 CECD CCN(C)S(=O)(=O)Nc1cc(Cl)c(O)c(Cl)c1 273406226 LUDJEMRTGWIOSS-UHFFFAOYSA-N 299.179 2.307 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1CCCC12CC2 1350299631 GUNPAWJHOKADCI-LLVKDONJSA-N 261.321 2.294 10 20 CECD C[C@H](NC(=O)[C@@H]1CC[C@H]1C(=O)O)c1ccc(N(C)C)cc1 1603234364 MXUWYDZONPXSHB-ZLKJLUDKSA-N 290.363 2.041 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCC[C@H]1C(=O)O)c1ccccc1O 1607421924 UDSKNBGWFFRQAN-KGYLQXTDSA-N 291.347 2.460 10 20 CECD CNC(=O)c1ccccc1OCc1cc(C(=O)O)oc1C 1610144649 FYBYNTRLVQGTFO-UHFFFAOYSA-N 289.287 2.225 10 20 CECD CC(C)c1ccc(O)c(CN2CCCO[C@@H](CN)C2)c1 1575858794 PGORJOLMRICKQK-HNNXBMFYSA-N 278.396 2.065 10 20 CECD Nc1ccc(CCNC(=O)N[C@@H]2C[C@H]2C2CCC2)cc1 1580443405 CMIRYXWIJPTUDQ-LSDHHAIUSA-N 273.380 2.299 10 20 CECD CCC[C@@](C)(NCc1cccc(C)c1O)C(=O)O 1595560412 XKYPHKSEOOSIHB-CQSZACIVSA-N 251.326 2.434 10 20 CECD CN(C)c1ccc(CN[C@@H](COC(C)(C)C)C(=O)O)cc1 1777040268 YIKBCORJEFZZIV-AWEZNQCLSA-N 294.395 2.111 10 20 CECD CC(=O)c1cc(F)cc(CN2CCOC[C@@H](C)C2)c1O 374351428 CIHHSNJUYBTYFB-JTQLQIEISA-N 281.327 2.202 10 20 CECD CCc1cccc(CNCCCC(=O)NC2CC2)c1O 709404631 BFYWMYFVPYULCG-UHFFFAOYSA-N 276.380 2.103 10 20 CECD COC(=O)[C@H](C)NCc1cc(Cl)cc(Cl)c1O 37074048 PYOFLXGKOHBRRG-LURJTMIESA-N 278.135 2.350 10 20 CECD Cc1cccc(CNCCCCCS(C)(=O)=O)c1O 187693809 FLSQACOMUJLXHA-UHFFFAOYSA-N 285.409 2.005 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCN(C)C 120985304 UYNNAVXSIWQYFR-UHFFFAOYSA-N 291.420 2.447 10 20 CECD CC[C@@](C)(CCO)NCc1cc(OC)c(OC)cc1O 182626609 OJNODSQHACWUPK-HNNXBMFYSA-N 283.368 2.050 10 20 CECD CC[C@@H](N)C(=O)NCc1ccc(N(CC)CC)c(F)c1 130483100 MWRRWUKJODOJHK-CYBMUJFWSA-N 281.375 2.025 10 20 CECD Cc1cc(Br)cc(CNCC[C@H](C)O)c1O 133209345 KDIHXDMQXGBCEC-VIFPVBQESA-N 288.185 2.324 10 20 CECD CC(C)C(=O)NCCN(C)Cc1cc(Cl)ccc1O 92104021 HWVVLHHWSVZVPS-UHFFFAOYSA-N 284.787 2.250 10 20 CECD CCCOc1ccc(CN(C)CCCC(=O)NC)c(O)c1 93717992 UAFURXZCQMLLTO-UHFFFAOYSA-N 294.395 2.139 10 20 CECD CN(C(=O)c1c[nH]nc1-c1cnn(C)c1)c1ccccc1 435830474 GFIFUSHXHUZXCN-UHFFFAOYSA-N 281.319 2.087 10 20 CECD C[C@H](N[C@@H](C)[C@H](C)N1CCOCC1)c1ccccc1O 248384380 DRWMFKZCMWEPPH-IHRRRGAJSA-N 278.396 2.152 10 20 CECD Nc1ccc(CCNC(=O)CCc2nccs2)cc1 269148434 KFYASSNFVOABRW-UHFFFAOYSA-N 275.377 2.017 10 20 CECD CCOC(=O)/C(=C\c1cnn(C(C)C)c1)c1nccn1C 264874566 RZOXCFKMUGZNFP-JYRVWZFOSA-N 288.351 2.301 10 20 CECD Cc1ncc2c(n1)CC[C@@H](NCc1cccc(C)c1O)C2 361991777 PQHASEMUANLNGA-OAHLLOKOSA-N 283.375 2.446 10 20 CECD Cc1cccc(CN[C@H]2CCc3c[nH]nc3C2)c1O 378457135 PXXGYKFDAJKYHL-ZDUSSCGKSA-N 257.337 2.071 10 20 CECD CO[C@H]1CCN(C(=O)c2ccc(C)c(O)c2O)[C@H](C)C1 281842518 SYRPJWNFRKFOSR-MNOVXSKESA-N 279.336 2.046 10 20 CECD CO[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@@H](C)C1 281653431 BRJLVMPNPKEBCH-IKHFIWMDSA-N 291.347 2.137 10 20 CECD Cc1cccc(CNCc2ncnn2C(C)(C)C)c1O 282733475 MNCKOABTDNCYKZ-UHFFFAOYSA-N 274.368 2.337 10 20 CECD CC/C=C/CNC(=O)NCc1cccc(OC)c1O 297632059 BHGORTBEIIALIR-SNAWJCMRSA-N 264.325 2.166 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](N2CCCC2)[C@@H]1C 809724182 GBPSQPZUAYCSQL-DZGCQCFKSA-N 290.407 2.459 10 20 CECD CC[C@@H](N[C@H](CN)C1CC1)c1ccc(F)cc1O 817959607 DIXCFWLTUAJYIB-CHWSQXEVSA-N 252.333 2.309 10 20 CECD CCOc1ccc(CN[C@@H]2CCCC[C@H]2N)c(O)c1 818431369 JXMSTYXRBAOQHN-ZIAGYGMSSA-N 264.369 2.150 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CCC1(F)F 811780533 OKYWLVRPEXVOBP-NOZJJQNGSA-N 299.317 2.295 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCC[C@H]2N)cc1F 818431946 XIGZWOFDGFGETL-ZIAGYGMSSA-N 265.376 2.251 10 20 CECD Cc1nc(CN(C)Cc2ccc(N(C)C)cc2C)no1 827898487 QBCBGDUTWYUWCB-UHFFFAOYSA-N 274.368 2.384 10 20 CECD CC[C@@H](C)OCC(=O)N[C@H](C)c1ccccc1O 827941158 OFEXHXCNHCEAAY-GHMZBOCLSA-N 251.326 2.385 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1cccc(OC)c1O 828665450 SEMRWIBKARWMDS-AWEZNQCLSA-N 267.325 2.134 10 20 CECD CC(C)[C@H](NCc1ccc(N(C)C)c(F)c1)C(=O)O 820053239 IDCKLICVBOPQKQ-ZDUSSCGKSA-N 268.332 2.091 10 20 CECD COc1cc2c(c(OC)c1)N(CC[C@@H](C)O)CCC2 823239777 PKVITTHHGLOAHA-LLVKDONJSA-N 265.353 2.227 10 20 CECD C[C@@H](NC(=O)[C@](C)(O)C1CCC1)c1ccccc1O 827946953 VQGQFWSYJJPFAA-MEBBXXQBSA-N 263.337 2.121 10 20 CECD O=C(/C=C\[C@@H]1CCOC1)NCCCSc1nccs1 823298078 NLTPZFXXHGOKOB-OTDNITJGSA-N 298.433 2.334 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCC[C@H]3C1)[C@H](O)CO2 902654438 MIJNPPHXCUEMKI-JRPNMDOOSA-N 275.348 2.050 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1 824837071 DJEJGNLAOXZXHM-YYIAUSFCSA-N 270.376 2.138 10 20 CECD CC[C@H](O)[C@@H](C)C(=O)NCCCSc1nccs1 900684012 VRCQYPJTPOCHSI-ZJUUUORDSA-N 288.438 2.149 10 20 CECD c1cc(N2CCCCC2)ccc1CN1CCc2nn[nH]c2C1 827885167 SBGHLMYXSSOVSA-UHFFFAOYSA-N 297.406 2.353 10 20 CECD O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cc(O)cs1 732276807 RLGBXIWXFAZESJ-UHFFFAOYSA-N 292.316 2.334 10 20 CECD COc1ccc(N(C)C/C=C(/C)C(=O)O)cc1OC 832378422 MRHAOSNBZRUNLX-YFHOEESVSA-N 265.309 2.171 10 20 CECD CCC[C@H]1CCCCN1C(=O)C(=O)Nc1ccc(N)cc1 841109141 JMQFBRIFDLKBRJ-AWEZNQCLSA-N 289.379 2.389 10 20 CECD COc1cccc(O)c1CNCc1ccc(CN)cc1F 844904231 FJILQFUNAYZTCX-UHFFFAOYSA-N 290.338 2.288 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCCNCC2)c1 841058824 VUCYTCKQFDYZRH-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD COc1cccc(O)c1CN[C@H]1CCNC2(CCC2)C1 841090186 WXCIMRDWDRNOSZ-LBPRGKRZSA-N 276.380 2.165 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCCC[C@H]1O 840937120 HRXVWZORNQCLQK-HZPDHXFCSA-N 262.397 2.454 10 20 CECD CS[C@H]1CC[C@H](NC(=O)NCCc2ccc(N)cc2)C1 841841823 DQTBDBSDJAWGGK-KBPBESRZSA-N 293.436 2.395 10 20 CECD C[C@H]1CCCCN1[C@H](C)CNC(=O)Cc1ccc(N)cc1 844171220 HABVOROWJKVLDT-UONOGXRCSA-N 289.423 2.190 10 20 CECD CC(C)(N)CN(Cc1ccccc1O)C[C@@H]1CCCO1 843117149 VTLYBLOFIAXKSS-AWEZNQCLSA-N 278.396 2.111 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@H]2CCNC2)cc1 843049605 SQDLRASRFNEMBA-MRXNPFEDSA-N 261.413 2.327 10 20 CECD COc1cccc([C@@H](C)NCC(C)(C)OC)c1O 846143952 BJBKHJZRCUSWIP-SNVBAGLBSA-N 253.342 2.476 10 20 CECD CCOc1ccc(N(C)Cc2nc(C(C)(C)N)no2)cc1 843358915 DJEPKBYSHJIXJR-UHFFFAOYSA-N 290.367 2.299 10 20 CECD C[C@H](NCCN1CCCC1)c1cc([N+](=O)[O-])ccc1O 756356122 YRGDAOWPHSLRJL-NSHDSACASA-N 279.340 2.047 10 20 CECD C[C@@H]1COC[C@H]1NCCCSc1nccs1 925101783 JSPHGDNTVKLRTL-NXEZZACHSA-N 258.412 2.250 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)N(C)C 750192715 SXFAUKBDVMULEI-ZDUSSCGKSA-N 277.412 2.051 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C3OCCO3)C2)cc1 932002291 VZPAWVDYISVHBD-OAHLLOKOSA-N 290.407 2.338 10 20 CECD CC(C)OC[C@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 775834085 JYAFTWUEWDHDMV-CZUORRHYSA-N 280.412 2.189 10 20 CECD Cc1n[nH]c(C)c1CCC(=O)N(C)c1ccc(N)cc1 877074979 WYXVCGYWMJKLMO-UHFFFAOYSA-N 272.352 2.204 10 20 CECD Cc1ccc(CNCC[S@@](=O)C(C)(C)C)c(O)c1 877055392 MPZKLRYMHVJMMT-GOSISDBHSA-N 269.410 2.337 10 20 CECD COc1cc(N2CCC(F)(F)C2)c([N+](=O)[O-])cc1OC 776301966 QJMLMFDVWBILTC-UHFFFAOYSA-N 288.250 2.457 10 20 CECD COc1ccc(CN[C@@H]2C[C@H](C(=O)O)[C@H]3C[C@H]32)cc1C 1120001825 OYAHAUZUAOEOMU-RFQIPJPRSA-N 275.348 2.202 10 20 CECD CC1(C)CC[C@@H](CO)N(Cc2cc3c(cc2O)OCO3)C1 895926116 WIPKGIAAGHCFOO-LBPRGKRZSA-N 293.363 2.104 10 20 CECD CCn1cc(CCN(C)c2ccc3c(c2)OCO3)cn1 788486475 XHSGIJLENXVXMK-UHFFFAOYSA-N 273.336 2.311 10 20 CECD CC[C@@H](C)CC(=O)OCC(=O)c1ccc(O)c(O)c1 784927225 ZSLSJOXGUHVESW-SECBINFHSA-N 266.293 2.260 10 20 CECD Oc1cc(F)c(Cl)cc1CNCC[C@H](O)C1CC1 898197008 BRYYGNAFXONMGK-LBPRGKRZSA-N 273.735 2.435 10 20 CECD CN(Cc1ccccc1O)C(=O)NC/C=C/Cl 899054722 DDZBPAMTTVAADQ-QPJJXVBHSA-N 254.717 2.286 10 20 CECD C[C@@H]1C[C@@H](CO)CN(Cc2cc(F)cc(F)c2O)C1 895032767 ALAHIVSCZSCDDA-NXEZZACHSA-N 271.307 2.121 10 20 CECD CN(C)c1ccc(CNCC[C@H]2CCOC2)cc1F 784656199 JCOCWAUICHMQBX-LBPRGKRZSA-N 266.360 2.408 10 20 CECD CN(CC(=O)OC(C)(C)C)Cc1cc(F)cc(F)c1O 893987911 WKMVWMATRXTVEP-UHFFFAOYSA-N 287.306 2.444 10 20 CECD COc1cc(Cl)cc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)c1O 895781114 CIHAEKDBZXKMMV-BIMULSAOSA-N 297.782 2.257 10 20 CECD CC[C@@](C)(CNCc1ccc(OC)c(OC)c1O)OC 894713196 XQLWUXHONCDJTE-HNNXBMFYSA-N 283.368 2.314 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1cc(F)cc(F)c1O 894993268 HUKQCADJRDFGAA-GFCCVEGCSA-N 285.290 2.102 10 20 CECD COc1ccc(CNC(=O)c2cccc(C)c2O)c(O)c1 794380779 CIVSCRZORLBARR-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CO[C@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C1CC1 791720368 NDSBGTPUJONCPS-NHYWBVRUSA-N 276.380 2.355 10 20 CECD O=C(c1cccc(O)c1O)N1CC(Oc2ccccc2)C1 790642213 CAXDRHRSJSXWJT-UHFFFAOYSA-N 285.299 2.001 10 20 CECD CC1CC(NCc2ccc(N3CCOCC3)cc2)C1 135562765 VXTWBIZJDMTQOQ-UHFFFAOYSA-N 260.381 2.411 10 20 CECD CC(C)(C)NC(=O)CCNCc1cc(Cl)ccc1O 134591805 NNVIBLWPZUNCHM-UHFFFAOYSA-N 284.787 2.440 10 20 CECD COc1cc(Cl)cc(CN[C@H]2COC[C@@H]2C)c1O 699846507 IQEGEMYVMBSZSY-KWQFWETISA-N 271.744 2.179 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)c1 1333333620 LXNPBDIPKNVEPW-QEJZJMRPSA-N 261.365 2.354 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@H]2c2ccncc2)c1O 1346449236 FXIJOSYHVXODMB-UONOGXRCSA-N 298.342 2.216 10 20 CECD CCCn1ncc(C(=O)N(C)c2ccc(N)cc2)c1C 1344368614 KZCPDGONGALGNI-UHFFFAOYSA-N 272.352 2.460 10 20 CECD C[S@@](=O)CCN(Cc1ccco1)Cc1ccccc1O 1261455877 FIEWTRKEOZXUGI-HXUWFJFHSA-N 293.388 2.366 10 20 CECD C[C@@H](C(=O)O)N(Cc1cc(F)ccc1O)C1CCC1 1609641984 YURPIISLQZOYDK-VIFPVBQESA-N 267.300 2.359 10 20 CECD CCC(N)(CC)CNC(=O)NCc1cc(C)ccc1O 1577109547 FQTRMDNMYAHJRM-UHFFFAOYSA-N 279.384 2.017 10 20 CECD O=C([C@@H]1CNCc2ccccc21)N1Cc2cccc(O)c2C1 1580486630 GHHTXEBFLTUHLY-OAHLLOKOSA-N 294.354 2.121 10 20 CECD C[C@H](NC(=O)[C@@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 1589088162 IJXVZNMQZBFJNK-HZMBPMFUSA-N 290.363 2.041 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CCC(=O)O 1589650148 BDBPIZWQCKAFEW-UHFFFAOYSA-N 279.336 2.386 10 20 CECD CC[C@@H](CCNCc1ccc2c(c1)CCO2)C(=O)O 1776712190 UJYZXZOWNCZFGD-LBPRGKRZSA-N 263.337 2.212 10 20 CECD CC(C)(O)CNCc1cc(Br)ccc1O 111385809 VQQLDTJGGQUSNQ-UHFFFAOYSA-N 274.158 2.015 10 20 CECD CC(C)(CO)NCc1cc(Br)ccc1O 116341366 AFSBOQRGLMBGIT-UHFFFAOYSA-N 274.158 2.015 10 20 CECD CC1(C)CCN(C(=O)c2cccc(O)c2O)CCS1 228670971 WLZZNOKVRSCKEG-UHFFFAOYSA-N 281.377 2.456 10 20 CECD CC(C)(C)SCCNC(=O)Cc1ccc(N)cc1 236594734 OMQMLPDKWHUPES-UHFFFAOYSA-N 266.410 2.459 10 20 CECD Nc1ccc(NC(=O)NC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)cc1 300649282 ZUNFVSMVQWCRBK-RBJBARPLSA-N 257.337 2.435 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@]1(C)CCCNC1 62856526 YDQKIUOUOKLWPX-KRWDZBQOSA-N 289.423 2.101 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@](C)(CO)C2)c1O 305231343 SGNOXBOOGZTSDN-INIZCTEOSA-N 295.354 2.328 10 20 CECD Oc1ccc(Cl)cc1CN1CCC2(CC1)OCCO2 126091760 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JYGQPJGTUMPPDL-CQSZACIVSA-N 289.423 2.291 10 20 CECD Cc1c(C(=O)NCc2ccc(N)cc2)[nH]c2c1C(=O)CCC2 297326479 XHFOLCMQLKIGBP-UHFFFAOYSA-N 297.358 2.354 10 20 CECD C[C@@H](CCCO)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 296530979 QKVUKDOHZMALHM-QWRGUYRKSA-N 282.340 2.360 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 298792275 ZAMRMPLSTLFVHA-HZPDHXFCSA-N 288.391 2.328 10 20 CECD C[C@@H]1C[C@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2O)CCN1 817972631 YVPDWSDZUXVXDP-GMTAPVOTSA-N 279.340 2.092 10 20 CECD C[C@@H](NC(=O)CSc1nncs1)c1ccccc1O 827930400 JFRDNQHJYQSNAR-MRVPVSSYSA-N 295.389 2.213 10 20 CECD CC[C@@H](C(N)=O)N(C)Cc1ccc(N(CC)CC)cc1 738297801 CXVHXUGEEIKLLL-HNNXBMFYSA-N 277.412 2.229 10 20 CECD CCc1cnc(COC(=O)c2ccc(C)c(O)c2O)o1 744911352 XFBKLGAYRQZPQQ-UHFFFAOYSA-N 277.276 2.314 10 20 CECD CCCN1CC(=O)N[C@H]1c1cc(Cl)cc(F)c1O 840824429 LYDPVDANIXMJKB-GFCCVEGCSA-N 272.707 2.025 10 20 CECD C[C@@H]1CCCC[C@@H]1CNC(=O)C(=O)Nc1ccc(N)cc1 841021275 SXHFYGRTKSTBBE-VXGBXAGGSA-N 289.379 2.150 10 20 CECD CCOc1ccc(O)c(CN[C@H](CN)C(C)(C)C)c1 841087723 RQILOSFIHIFHTH-CQSZACIVSA-N 266.385 2.254 10 20 CECD CC[C@@H](C(=O)NCc1cc(Cl)ccc1O)[C@H](C)O 846660822 IROBOPZOHQPVSV-GZMMTYOYSA-N 271.744 2.069 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CCOC[C@H]2OC)c1O 846170739 ZFANGVDXMVWEAY-YWPYICTPSA-N 295.379 2.103 10 20 CECD COc1cccc([C@@H](C)NCCOCC(F)F)c1O 846163954 CTPSCISEWXSBCZ-SECBINFHSA-N 275.295 2.333 10 20 CECD CCC[C@H](NC(=O)C(=O)Nc1ccc(N)cc1)C1CCC1 841140539 FLFJMYSNIAMFNM-AWEZNQCLSA-N 289.379 2.292 10 20 CECD CC[C@H]1COC[C@H]1NCc1ccc(N2CCOCC2)cc1 850382100 NJHXVVDRCDMCHH-DOTOQJQBSA-N 290.407 2.038 10 20 CECD CC(C)C[C@@H]1CN(C)CCN1C(=O)Nc1ccc(N)cc1 926146532 ZYLPNLDMJRYTGJ-OAHLLOKOSA-N 290.411 2.463 10 20 CECD Cc1cc(CN[C@](C)(CN)C2CC2)ccc1N(C)C 923296696 VUMWMGFAVJDGQM-MRXNPFEDSA-N 261.413 2.278 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@](C)(O)C1CC1 755907299 YCLPBSYAXYVULR-KRWDZBQOSA-N 290.407 2.228 10 20 CECD N[C@@]12CCC[C@H]1CN(Cc1cccc(Cl)c1O)C2 857226325 KSYNLASUUPKLPG-SMDDNHRTSA-N 266.772 2.359 10 20 CECD CCOC(=O)C(C)(C)CC(=O)NCc1cc(C)ccc1O 862755091 CKCUXUGTEGDFJN-UHFFFAOYSA-N 293.363 2.296 10 20 CECD COc1ccc(N(C)Cc2cn(C)nn2)cc1Cl 761670978 CVSWTOVKYBIXPM-UHFFFAOYSA-N 266.732 2.114 10 20 CECD CCOc1ccc(CN2CCC(CCO)CC2)c(O)c1 768236892 LGGSQOFOPBDTND-UHFFFAOYSA-N 279.380 2.385 10 20 CECD CC(C)(C(=O)NCc1ccc(O)c(O)c1)c1cccnc1 778917150 ZHJNPNRSIVVIPP-UHFFFAOYSA-N 286.331 2.087 10 20 CECD CC(C)(C)[S@](=O)CCNCc1cc(F)cc(F)c1O 883007628 BFGFNKRXPUOVMU-LJQANCHMSA-N 291.363 2.307 10 20 CECD CCN(C)c1ccc(Cn2cc([C@@H](O)C3CC3)nn2)cc1 881313242 FOUVOSSCAOVXPF-INIZCTEOSA-N 286.379 2.226 10 20 CECD COCCOC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 885246550 MLXORJBZRGQYDP-ZDUSSCGKSA-N 294.395 2.365 10 20 CECD CC[C@@H](CO)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 783317506 SXLLIYFCAQYRFV-YWVKMMECSA-N 253.317 2.440 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccnc(C2CC2)c1 783587832 IJUMELMFUJFOLG-UHFFFAOYSA-N 284.315 2.300 10 20 CECD CC[C@@H](NCc1nnnn1CC1CC1)c1ccccc1O 784266646 XIUZIJAYOJSMMZ-CYBMUJFWSA-N 287.367 2.030 10 20 CECD COc1cccc(NCc2ccc(OC)c(OC)c2O)n1 895302365 WFPIJSLOFGMZTC-UHFFFAOYSA-N 290.319 2.425 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](OCC)C2)c1 897068324 JLCNEMMNPPJSNV-AWEZNQCLSA-N 265.353 2.402 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)NCc1cc(C)cc(OC)c1O 894386651 KPXMEFDLQJBLHA-RYUDHWBXSA-N 294.395 2.102 10 20 CECD CC(C)(C)[C@H](CC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1321923989 DQSNJNJBJUUEJV-LBPRGKRZSA-N 296.323 2.279 10 20 CECD OC[C@H]1C[C@@H](NCc2cccc(Br)c2O)C1 707546218 NLJQCDWAGCHOMT-WAAGHKOSSA-N 286.169 2.015 10 20 CECD CCOc1cccc(CN[C@H](CO)CC2CC2)c1O 754832743 KFELDZAPOOOZQY-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD O=C(NCc1ccc(F)c(F)c1)c1cccc(O)c1O 72112786 BRTREFOFOMZSTI-UHFFFAOYSA-N 279.242 2.306 10 20 CECD Cc1ccncc1[C@H](C)NC(=O)c1cccc(O)c1O 790912147 NTYIQDVXMZZKAI-JTQLQIEISA-N 272.304 2.292 10 20 CECD NC(=O)[C@@H]1CC[C@H](NCc2ccc(N3CCCC3)cc2)C1 1344075154 LXBJHCKBNTZLFW-CABCVRRESA-N 287.407 2.030 10 20 CECD CN(C)c1ccc(CN[C@H]2C[C@@H]3C[C@]3(C(=O)O)C2)cc1 1606055469 KYIWAJLVHBCFTR-WWGRRREGSA-N 274.364 2.096 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc2ccccn2c1 158958008 YXVXAXOXELGRIU-UHFFFAOYSA-N 282.299 2.281 10 20 CECD CCN(CC)c1ccc(CNCC[C@H](O)COC)cc1 153717975 BMPAASJETNVFEQ-INIZCTEOSA-N 280.412 2.020 10 20 CECD CCCCNC(=O)[C@@H](C)N(C)Cc1ccccc1O 111235241 KIHOXFZNLSFSFP-GFCCVEGCSA-N 264.369 2.129 10 20 CECD COc1cccc(CN(C)C(=O)Cc2ccc(N)cc2)c1 37797884 YHGUIYSOMIWADQ-UHFFFAOYSA-N 284.359 2.479 10 20 CECD CCOc1ccc(O)c(CN2CCO[C@@H](C)C2)c1 179868067 QHQSWXZNWIHZSK-NSHDSACASA-N 251.326 2.012 10 20 CECD O=C1NCCN(Cc2ccccc2O)[C@@H]1c1ccccc1 179565345 MRWGIRNOXRCLPU-MRXNPFEDSA-N 282.343 2.065 10 20 CECD COCCc1nsc(NCc2ccc(N(C)C)cc2)n1 301604225 XLSSMVLKYYXYKR-UHFFFAOYSA-N 292.408 2.405 10 20 CECD CSC[C@](C)(O)CNCc1ccc(N(C)C)c(F)c1 120671222 UYVQKPFRJRYYCI-CQSZACIVSA-N 286.416 2.095 10 20 CECD CCOC(=O)[C@@H](NCc1cccc(OC)c1O)[C@@H](C)CC 187870764 JXCIEGJQKHQGIH-FZMZJTMJSA-N 295.379 2.468 10 20 CECD COc1cccc(CNC(=O)OCC2CC2)c1O 189649347 YNVIPBJFGCAQDH-UHFFFAOYSA-N 251.282 2.037 10 20 CECD CCN(C)C(=O)CNCc1cc(Cl)cc(Cl)c1O 185183960 JWOKNLGHKKNLLM-UHFFFAOYSA-N 291.178 2.267 10 20 CECD CCCC(O)(CCC)CC(=O)NCc1ccc(O)c(O)c1 182528517 XHHHEYJEFMYNMY-UHFFFAOYSA-N 295.379 2.435 10 20 CECD O=C(CNCc1ccccc1O)Nc1cccc(F)c1 134231836 SGDZRHRRCWLRHP-UHFFFAOYSA-N 274.295 2.260 10 20 CECD O=C(NCc1ccccc1O)c1ccc(Cl)nc1 133784883 CWNPPALLQZBCMK-UHFFFAOYSA-N 262.696 2.371 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1CCCO1 46743088 NKVPKYUCKHXEEB-HNNXBMFYSA-N 276.380 2.280 10 20 CECD COc1cccc(CNC2CCSCC2)c1O 134413873 RCWHYLPYGVMYOH-UHFFFAOYSA-N 253.367 2.386 10 20 CECD COc1cc(CN2CCN(C)C[C@H]2C(C)C)c(O)cc1C 245536447 HZZJASZBRDYKRO-HNNXBMFYSA-N 292.423 2.481 10 20 CECD Oc1ccccc1CN1C[C@@H](O)Cc2ccccc21 279426625 NTMYQHUFZZEOOG-AWEZNQCLSA-N 255.317 2.316 10 20 CECD CC[C@@H](NC[C@@H](O)COC)c1cccc(Cl)c1O 287212032 WYYXHHFUTZBPCL-BXKDBHETSA-N 273.760 2.094 10 20 CECD C[C@H](N[C@H]1CCCN(CCCO)C1)c1ccc(F)cc1O 297404041 SRJDWBFDLAATEE-JSGCOSHPSA-N 296.386 2.029 10 20 CECD COc1ccc(O)c(CN2CC[C@H](SC)C2)c1 295098500 SJHMZDAXHLJRRT-LBPRGKRZSA-N 253.367 2.338 10 20 CECD C[C@@H](NC(=O)c1cccc(O)n1)c1ccc(N(C)C)cc1 802600575 VYXACOBVXFPEMN-LLVKDONJSA-N 285.347 2.344 10 20 CECD CCOC1CC(N(C)Cc2cccc(OC)c2O)C1 809774701 XMJAZXXVUWYNDT-UHFFFAOYSA-N 265.353 2.400 10 20 CECD Cc1noc([C@@H]2CCCN2C(=O)c2cc(O)cs2)n1 807767539 MYQXFNJXAJVHOI-VIFPVBQESA-N 279.321 2.122 10 20 CECD CC(C)[C@H](N)CN[C@H](C)c1cc(F)cc(F)c1O 817959893 WKGLEXBEOPAZRZ-PRHODGIISA-N 258.312 2.304 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CCCNC2)c1 817946128 RZMKOSFYZXUJIB-NWDGAFQWSA-N 264.369 2.051 10 20 CECD CN(C)c1ccc(CNCCO[C@H]2CCCCO2)cc1 813333210 KQZMAMHVADILOY-INIZCTEOSA-N 278.396 2.385 10 20 CECD C[C@H](N[C@H]1CCCNCC1)c1cc(F)ccc1O 817968453 JNYDPBIILHZMTD-JQWIXIFHSA-N 252.333 2.324 10 20 CECD CC[C@@H](NCC1(CC(N)=O)CC1)c1ccc(C)cc1O 817584972 BSTNKXQHABSDQR-CYBMUJFWSA-N 276.380 2.397 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H](C)OC 821718777 VNUKWRFBAHOYKA-GFCCVEGCSA-N 280.368 2.349 10 20 CECD C[C@@H](NC(=O)C1(CN(C)C)CC1)c1ccc(N(C)C)cc1 822081373 DKJZNVIMIQMVEK-CYBMUJFWSA-N 289.423 2.272 10 20 CECD CC(C)(C)N1C[C@@H](CNCc2cc(F)ccc2O)CC1=O 827555053 MRZLZUIWZVVDRV-LLVKDONJSA-N 294.370 2.268 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1cc(Cl)ccc1O 824702027 GYBVVYLCPDLZPU-NEPJUHHUSA-N 283.755 2.477 10 20 CECD COc1cccc(O)c1CNCCN1CCCC1(C)C 825327810 VITHDJQLZCGCBF-UHFFFAOYSA-N 278.396 2.365 10 20 CECD COc1ccc2ccc(O)c(CN3CC(OC)C3)c2c1 738234744 SSCQCQARRYSOIV-UHFFFAOYSA-N 273.332 2.385 10 20 CECD COc1ccc(N(C)Cc2cn(C3CC3)nn2)cc1F 906277975 RVIDYQCNKLRWQT-UHFFFAOYSA-N 276.315 2.397 10 20 CECD CCC(CC)CS(=O)(=O)NCc1ccccc1O 739962689 NYPFKGOGQHJISR-UHFFFAOYSA-N 271.382 2.248 10 20 CECD CC[C@H](C)NC(=S)NCc1cc(OC)ccc1O 733907062 SCECBKSSGVGPPW-VIFPVBQESA-N 268.382 2.163 10 20 CECD CN(C)c1ccc(CNC(=O)N2C[C@H]3[C@H](C2)C3(F)F)cc1 844782686 XLUCWKHZRBAWIO-STQMWFEESA-N 295.333 2.159 10 20 CECD COc1cccc(C[C@@H](C)NCCc2ccc(N)cc2)n1 841036868 WPUJMHBNJKPIRO-CYBMUJFWSA-N 285.391 2.436 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@H]1CCCNC1 841033169 OCXFELBSGAJXRS-VIFPVBQESA-N 272.751 2.274 10 20 CECD Cc1cc(C)c([C@@H](C)NCCN2CCCC2=O)c(O)c1 846207071 XXTIRHYQWWDMNU-CYBMUJFWSA-N 276.380 2.282 10 20 CECD COC/C(C)=C/C(=O)N[C@H](C)c1cc(OC)ccc1O 845834631 VLFAUNXNIRUWED-PFEDMVJOSA-N 279.336 2.171 10 20 CECD Oc1cc(OCc2ccccc2)ccc1CN[C@H]1CCNC1 841044791 IEEWDJYGGVXLLJ-INIZCTEOSA-N 298.386 2.423 10 20 CECD COc1cccc([C@H](C)NCC(=O)NC2CCCC2)c1O 846150268 COXFQHXPYCZPTG-NSHDSACASA-N 292.379 2.110 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)CO[C@@H]1CCOC1 840936800 GOZKOPSYGHIFQM-RHSMWYFYSA-N 292.423 2.345 10 20 CECD CN(C)c1ccc(CN(C2CC2)S(=O)(=O)C2CC2)cc1 742278907 NRUNGEBZEMZNRY-UHFFFAOYSA-N 294.420 2.209 10 20 CECD Nc1ccc(NC(=O)C(=O)N[C@H]2CC23CCCCC3)cc1 841080927 RPPRKIVFHOLEJK-ZDUSSCGKSA-N 287.363 2.046 10 20 CECD Cc1nnsc1C(=O)N[C@H](C)c1ccccc1O 827923227 MGBGBTHRYWKLCU-SSDOTTSWSA-N 263.322 2.043 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ccccc2O)cc1 750663288 LRURTQNGBWQAIY-UHFFFAOYSA-N 284.359 2.317 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ncoc1-c1ccon1 857466673 CKUDXOVVVKMDHQ-UHFFFAOYSA-N 299.286 2.307 10 20 CECD COc1ccc(N(C)Cc2nncs2)cc1OC 929349105 ZJIUQYVZQORNJH-UHFFFAOYSA-N 265.338 2.192 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@@H](C)c1cc(Cl)ccc1O 858588179 WQYBOWAAQVFWAV-DTWKUNHWSA-N 286.759 2.105 10 20 CECD C[C@H](O)C1(NCc2cc(F)c(N(C)C)cc2F)CC1 862418799 LSJSPHLQQTWCJR-VIFPVBQESA-N 270.323 2.034 10 20 CECD COc1ccc(N2CCC(NC[C@H](C)N(C)C)CC2)cc1 765776260 VXSQLNFFIGHJBF-AWEZNQCLSA-N 291.439 2.204 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](C)OCC(C)C)c1 862759277 ZZCJOVZELICSFQ-GFCCVEGCSA-N 265.353 2.378 10 20 CECD COC(=O)c1cc(CN[C@H](C)c2ccccc2O)on1 877755872 PSVCULVSBOXVCE-SECBINFHSA-N 276.292 2.018 10 20 CECD C[C@H]1CCCN(C(=O)CN[C@H](C)c2ccccc2O)C1 879648104 YMUBGQLQYIXVEP-QWHCGFSZSA-N 276.380 2.301 10 20 CECD Cc1cccc(O)c1CN1CCCN(C(=O)C2CC2)CC1 877458447 UITYMUZLFFZRHJ-UHFFFAOYSA-N 288.391 2.145 10 20 CECD CCCOc1ccc(CN[C@H]2CC(=O)N(C)C2)cc1C 873036610 UUOQNPJXDLALBO-AWEZNQCLSA-N 276.380 2.104 10 20 CECD O=C(N[C@H](CO)C1CCCCC1)c1cc(O)cs1 778512695 ARMWKKQSDQTHAI-LLVKDONJSA-N 269.366 2.125 10 20 CECD COC(=O)[C@H]1CCC[C@H](C(=O)N(C)c2ccc(N)cc2)C1 877075221 AMOKSFJDBDPIOV-RYUDHWBXSA-N 290.363 2.211 10 20 CECD C[C@@]1(CO)CCCN(Cc2cc(F)cc(F)c2O)C1 1119508287 ZIFBZRCDHCBMMR-CQSZACIVSA-N 271.307 2.265 10 20 CECD Cc1ccc(CNCCOc2cccnc2)c(O)c1 877037946 DNSRJJMSRADDJF-UHFFFAOYSA-N 258.321 2.264 10 20 CECD C[C@H](O)[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 780891979 FQTKSJZEJRFALO-JSGCOSHPSA-N 280.387 2.485 10 20 CECD Cc1ccc(C(=O)Nc2c(C)noc2C)c(O)c1O 780914091 DYYNPCGGAQQXOH-UHFFFAOYSA-N 262.265 2.263 10 20 CECD CC[C@H](NC[C@@H](O)c1cnn(C)c1)c1ccc(F)cc1O 796790157 XPNRFFLKDCCONH-DZGCQCFKSA-N 293.342 2.039 10 20 CECD COc1ccc(CNC(=O)C[C@H](C)SC)c(O)c1 794388302 WAEQGWVPYBQOFU-VIFPVBQESA-N 269.366 2.159 10 20 CECD CCc1ccnc(CNC(=O)/C=C\c2ccc(O)c(O)c2)c1 798064960 JSZRJZBLFBELEM-XQRVVYSFSA-N 298.342 2.385 10 20 CECD CC[C@@H](CO)NCc1cccc(Br)c1O 42411835 NEMOJMLBZBLUID-VIFPVBQESA-N 274.158 2.015 10 20 CECD COCCOCCCN[C@H](C)c1ccc(F)cc1O 62745341 SKOJMCZNDVZAQD-LLVKDONJSA-N 271.332 2.235 10 20 CECD CC1(C)CO[C@@H](CC(=O)NCCc2ccc(N)cc2)C1 717151093 OFSFYHXEDWKWRH-AWEZNQCLSA-N 276.380 2.133 10 20 CECD C[C@H](CCO)CNCc1ccc(N2CCCC2)cc1 97436448 WBBCOVAJULYNLN-CQSZACIVSA-N 262.397 2.395 10 20 CECD Cc1noc(C)c1[C@@H](C)C(=O)NCc1cccc(O)c1O 1263894468 HYYHLYSXUVGLIX-MRVPVSSYSA-N 290.319 2.123 10 20 CECD CN1C[C@@H](CSc2ncc(Cl)s2)OC1=O 1350130704 RBWGFBMTAXFRDN-YFKPBYRVSA-N 264.759 2.339 10 20 CECD COCC1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 1520942459 ZZSFFJSRBQAJNF-GFCCVEGCSA-N 291.395 2.101 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2ccc(Cl)cc2O)C1 1589199257 ZXRTXSUKHKHYJP-ZDUSSCGKSA-N 269.728 2.342 10 20 CECD CCCOc1ccc(CN[C@@](C)(COC)C(=O)O)cc1C 1776818762 VJSWRAPMPKNORM-INIZCTEOSA-N 295.379 2.363 10 20 CECD COC[C@H]1CCCN(Cc2cc(OC)c(OC)cc2O)C1 160193683 WJYXQFIDCUJCPB-LBPRGKRZSA-N 295.379 2.268 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](C(=O)O)C2)c1O 164508864 CTPHBFKUFANPOH-JTQLQIEISA-N 295.310 2.031 10 20 CECD CCC(CC)[C@@H](O)CNCc1cc2c(cc1O)OCO2 111404459 JRBBMWBUUHDRGP-ZDUSSCGKSA-N 281.352 2.008 10 20 CECD COc1ccc(O)c(CNCCc2csc(C)n2)c1 224541102 LJFADLYMOIIBNB-UHFFFAOYSA-N 278.377 2.498 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H]([C@H](C)N)C2)c1O 252848676 HYQBRHYMTUHHRU-UWVGGRQHSA-N 284.787 2.223 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CCCCNC2=O)c(O)c1 36976453 XMCIWYWKZKFTSP-AAEUAGOBSA-N 262.353 2.020 10 20 CECD CN(C)CC(C)(C)CNCc1ccc2c(c1)CCO2 37362478 AMCHPLZKYAXGAK-UHFFFAOYSA-N 262.397 2.299 10 20 CECD C[C@H](NCCCC(=O)N(C)C)c1ccc(F)cc1O 185194022 UHBGSYKUPQMPJP-JTQLQIEISA-N 268.332 2.050 10 20 CECD CCOc1cccc(CN[C@@H]2CO[C@@H](C)C2)c1O 402351356 SHVCXWRNOTZAGT-JQWIXIFHSA-N 251.326 2.058 10 20 CECD COc1ccc(CNCCCn2cccn2)cc1C 73870041 YTDOPEZYERBDAR-UHFFFAOYSA-N 259.353 2.380 10 20 CECD CNC(=O)C[C@H](C)N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 322947867 QXVJMQDCKWVWOI-GRYCIOLGSA-N 276.380 2.363 10 20 CECD O=C(O)[C@H]1CCC[C@@H](NCc2cc(F)cc(F)c2O)C1 708089773 MKNNEPIVVJAXFL-GZMMTYOYSA-N 285.290 2.403 10 20 CECD Oc1c(Br)cccc1CNCCc1cn[nH]c1 379585224 XUOFWLIDBWXNPT-UHFFFAOYSA-N 296.168 2.210 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCCOC2)c1 109543442 SHKJFJVIAQSZNN-GHMZBOCLSA-N 251.326 2.230 10 20 CECD C[C@@H](CO)N[C@H](C)c1cc(Br)ccc1O 134925641 PBUYEHVRCDLXQT-JGVFFNPUSA-N 274.158 2.186 10 20 CECD COc1ccc(O)c(CN(C)Cc2ccncc2)c1 183743945 RYGQYQQQOJKMPM-UHFFFAOYSA-N 258.321 2.428 10 20 CECD C[C@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)N1CCCC1 135674132 FTBZSNZBBPPLSG-KGLIPLIRSA-N 289.423 2.414 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@@H]1C(=O)O 227171075 CJJPRQYSPZVHOL-RISCZKNCSA-N 262.353 2.048 10 20 CECD C[C@@H](NCc1ccc(N2CCCCC2)cc1)C(=O)O 49355082 MKKDQKZJUDJYIJ-GFCCVEGCSA-N 262.353 2.240 10 20 CECD COCCN(Cc1cc(C)ccc1O)CC(F)F 92966300 OPVKSBDOLKNCEF-UHFFFAOYSA-N 259.296 2.414 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2cc(C)ccc2O)C1 93813955 KKXKDNCQMZOAIE-OAHLLOKOSA-N 263.337 2.086 10 20 CECD CCOC(=O)CN(Cc1cc(OCC)ccc1O)C1CC1 91773159 ITPVAIZJIMUDTE-UHFFFAOYSA-N 293.363 2.318 10 20 CECD CCOc1ccc(N(CC)C[C@@H](O)Cn2cccn2)cc1 264510288 ZOXWRFOBIJHDCF-OAHLLOKOSA-N 289.379 2.169 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCCCN2)cc1F 369953376 AEWWXMGRCAIXNA-AWEZNQCLSA-N 293.386 2.040 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCO[C@@H](C(C)C)C2)c(O)c1O 272909358 CVNDAMNVSGZSPF-WCQYABFASA-N 293.363 2.340 10 20 CECD COc1cc(O)c(CN[C@H]2CC[C@H](CO)CC2)cc1OC 271788298 GENFNCITGGZWHE-AULYBMBSSA-N 295.379 2.050 10 20 CECD CC[C@@H](NC[C@H](O)c1cnn(C)c1)c1ccc(C)cc1O 280239243 VWYHDBWPDXSFIW-ZBFHGGJFSA-N 289.379 2.208 10 20 CECD Cc1ccc(O)c(CN(CCCO)Cc2ccccn2)c1 289176455 ABUUPQQOXQNYRS-UHFFFAOYSA-N 286.375 2.480 10 20 CECD Cc1cc(C)c([C@H](C)NCCC(=O)N(C)C)c(O)c1 293785049 QISVKCUDXDOWKX-LBPRGKRZSA-N 264.369 2.138 10 20 CECD CON(CC(C)(C)C)C(=O)c1c(F)ccc(O)c1O 295228129 IEZDWAXRHAJBCG-UHFFFAOYSA-N 271.288 2.287 10 20 CECD COCC1(CNCc2ccc3c(c2)CCO3)CCOCC1 291739089 OSZVHGSUBVHDAJ-UHFFFAOYSA-N 291.391 2.154 10 20 CECD C[C@@H]1C[C@@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2O)CCN1 817972632 YVPDWSDZUXVXDP-MXWKQRLJSA-N 279.340 2.092 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C)C[C@H](CO)C2)cc1C 817413085 SWGOSUCSOFMMOP-FZMZJTMJSA-N 263.381 2.459 10 20 CECD C[C@H](N[C@@H](C)[C@H]1CCCNC1)c1cc([N+](=O)[O-])ccc1O 817948296 WUMKMQKYRGQTAD-SRVKXCTJSA-N 293.367 2.339 10 20 CECD COCCOCCNCc1cc(Cl)c(C)cc1O 825138831 YSHKWAFADKPFGC-UHFFFAOYSA-N 273.760 2.107 10 20 CECD CCOc1ccc(CN2CCCC[C@H]2C(=O)O)c(O)c1 820387661 WGJQDJBNWXHBEL-ZDUSSCGKSA-N 279.336 2.230 10 20 CECD CNC(=O)C[C@H](C)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 834900548 QRZIYUUBQPGPIZ-QXEWZRGKSA-N 280.343 2.194 10 20 CECD CN(C)c1ccc(CN[C@@](C)(CCF)C(=O)O)cc1 901916689 WHEAEMPHUWTCEC-AWEZNQCLSA-N 268.332 2.045 10 20 CECD Cc1cccc(CN[C@@H]2CCN(C(C)(C)C)C2=O)c1O 843414908 FNHVVBVPWXDNGO-CYBMUJFWSA-N 276.380 2.190 10 20 CECD Cc1cc(C)c(CNC(=O)NCCc2ccc(N)cc2)cn1 841913427 NHDKBMUSJVIUQO-UHFFFAOYSA-N 298.390 2.323 10 20 CECD CC(=O)CCC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840558126 XZCRMFPSYRBDHV-CYBMUJFWSA-N 290.407 2.477 10 20 CECD CCCNC(=O)CN(C)Cc1ccc(N(CC)CC)cc1 741677972 GHOZQQVAHDDLOJ-UHFFFAOYSA-N 291.439 2.491 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@H](C)c1cccc(OC)c1O 846163134 KXUAFCWSXCTXGE-OSAQELSMSA-N 295.379 2.245 10 20 CECD Nc1ccc(CCNC(=O)NC[C@H]2Cc3ccccc32)cc1 841726474 KHXWEYCYOJBLNQ-OAHLLOKOSA-N 295.386 2.450 10 20 CECD C[C@H]1[C@@H](C)NCCN1Cc1ccc(N(C)C)c(F)c1 843056961 DHSDGMYJKUTSHS-NEPJUHHUSA-N 265.376 2.074 10 20 CECD CCOc1cccc(CN[C@H](C)[C@H](O)C(F)(F)F)c1O 865711402 NKEZEXMQLFENII-PELKAZGASA-N 293.285 2.192 10 20 CECD Cc1ccc(O)c([C@@H](C)Nc2cnn(CCO)c2)c1 756855820 NNZOJLOYLRARPU-LLVKDONJSA-N 261.325 2.063 10 20 CECD c1cc2c(cc1CNCc1nc(C3CC3)n[nH]1)CCCO2 922154294 MYWDGOVHZFMMPW-UHFFFAOYSA-N 284.363 2.297 10 20 CECD C[C@@H](NC[C@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 850544538 HKIJRRQOEUQIBV-ZYHUDNBSSA-N 294.351 2.360 10 20 CECD CC[C@H](CNC(=O)N[C@H](C)c1ccccc1O)OC 868630108 QNFAWZSPENNMBV-GHMZBOCLSA-N 266.341 2.177 10 20 CECD O=C(NCc1cccc(Br)c1O)C1=COCC1 765751907 UNVCWVYTFRIIDS-UHFFFAOYSA-N 298.136 2.075 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)[S@@](=O)[C@H](C)C1 877473660 PFZGKWBAMKRDJS-FVGIMDHTSA-N 267.394 2.042 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H]1CCCN(C)C1=O 1118797356 HMSVCAJKRZYEDZ-UPJWGTAASA-N 288.391 2.459 10 20 CECD COCc1cc(NCc2ccc(N(C)C)cc2)ncn1 771233565 FUVKIRLRNDJVEO-UHFFFAOYSA-N 272.352 2.301 10 20 CECD C[C@H](NC(=O)NCC1(O)CCC1)c1ccc(N(C)C)cc1 776250906 YHMRMGKOHMENKI-LBPRGKRZSA-N 291.395 2.028 10 20 CECD CO[C@H](C)[C@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 898448424 RVOSLMKLBUMJJZ-VBQJREDUSA-N 293.455 2.368 10 20 CECD COc1ccc(CNC(=O)[C@H]2CC[C@@H](C)C2)c(O)c1 794390971 RZQKCHYGTIAGGX-MNOVXSKESA-N 263.337 2.453 10 20 CECD COC(=O)N1CCCN(Cc2cc(Cl)ccc2O)CC1 1203651803 WILVLRTZVYXFCW-UHFFFAOYSA-N 298.770 2.320 10 20 CECD C[C@@H](CC(N)=O)NCc1ccc(N2CCCCC2)cc1 135725252 KPKUKWMGZHLXAN-ZDUSSCGKSA-N 275.396 2.030 10 20 CECD C[C@H]1COC[C@H]1NCc1ccc(Br)cc1O 691469696 ZPRJTWIFBUVRQY-GZMMTYOYSA-N 286.169 2.279 10 20 CECD NC(=O)c1ccc(NCCCSc2nccs2)nc1 1324035396 PTUODBIUBLRTEF-UHFFFAOYSA-N 294.405 2.231 10 20 CECD CCc1cccc(CN[C@H]2CCCN(CC)C2=O)c1O 722354296 RIWFUGVCLCAUDQ-AWEZNQCLSA-N 276.380 2.055 10 20 CECD CNC(=O)CCCN(C)Cc1ccc(N2CCCC2)cc1 1337042247 IKPDJWPGQWESLN-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COc1ccc(O)c(CN2CC[C@H](C)C[C@@H]2C(=O)O)c1 1607277567 HQAITSFVYPYFAT-GXFFZTMASA-N 279.336 2.086 10 20 CECD Cc1cc(C)n(CCSc2ncc(C(=O)O)s2)n1 1600180407 RMDKKACYQFSFKH-UHFFFAOYSA-N 283.378 2.447 10 20 CECD CN(C)c1ccc(CNCCc2nnc3ccccn23)cc1 17318930 CQYZBYGHFZYSPO-UHFFFAOYSA-N 295.390 2.128 10 20 CECD CCN(Cc1cc(Br)ccc1O)C[C@H](C)N 843359053 FXJOHEVGFXKAQP-VIFPVBQESA-N 287.201 2.324 10 20 CECD C[C@H](C[S@](C)=O)N(C)Cc1cc(Cl)ccc1O 130866434 YWYFCIPVQSZHQT-VVVCHXIZSA-N 275.801 2.244 10 20 CECD C[C@@H](CN1CCCC1=O)NCc1cc(Cl)ccc1O 37782004 HKIZFGBIYRDJIU-JTQLQIEISA-N 282.771 2.146 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)cc1O)c1nncn1C 62746963 XDYBETDOFFFZPI-BDAKNGLRSA-N 264.304 2.072 10 20 CECD CCOC(=O)[C@H](C)N(C)Cc1ccc(N(C)C)cc1 771529056 UGIKIGIYYVAKKP-LBPRGKRZSA-N 264.369 2.136 10 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10 20 CECD CCC[C@@](C)(N)C(=O)NCc1ccc(N2CCCC2)cc1 272399907 ZHRDKJATZQHAGU-QGZVFWFLSA-N 289.423 2.421 10 20 CECD C[C@H](N[C@H]1CCc2c[nH]nc2C1)c1ccccc1O 371684849 HWDKZKIOBPISDL-JQWIXIFHSA-N 257.337 2.323 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)CC[S@@](=O)C1 375950185 ZWZBSUYJWDCDMM-XTZNXHDOSA-N 287.812 2.246 10 20 CECD COc1cccc(CN2CCC[C@@H]3CN(C)CC[C@H]32)c1O 290641806 YMXYPIUKZUZQMM-UKRRQHHQSA-N 290.407 2.317 10 20 CECD COC1(CCNC(=O)N(C)Cc2ccccc2O)CCC1 297184169 BWYKGOYYUDVDHV-UHFFFAOYSA-N 292.379 2.493 10 20 CECD C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(Br)cc1O 817977280 GBZZKCBGNHJJPV-UVRHIYEWSA-N 297.196 2.023 10 20 CECD CO[C@](C)(CNC(=O)N(C)Cc1ccccc1O)C1CC1 813203442 LRGNFKKEUVJAIC-MRXNPFEDSA-N 292.379 2.349 10 20 CECD CC(C)[C@H](O)CNCc1cc(Cl)c(F)cc1O 816550082 HZNLQVOULUIEMU-GFCCVEGCSA-N 261.724 2.291 10 20 CECD Cn1c(Cl)nc(Cl)c1/C=C1/SC(=S)NC1=O 726876141 HQTTZUYVQRLIBS-DUXPYHPUSA-N 294.188 2.216 10 20 CECD C[S@](=O)[C@H]1CCC[C@H](NCc2cc(F)ccc2O)C1 826910298 DWOUTBXIHRIADO-JMERFSKESA-N 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273.691 2.234 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1cccc(OC)c1O 842754352 NWJAWHQBIGVKRI-YPMHNXCESA-N 267.369 2.288 10 20 CECD C[C@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)CO1 842674396 ZYNOVGDNSLDXIS-JQWIXIFHSA-N 252.333 2.159 10 20 CECD CN[C@@H]1CCN(Cc2cc(Br)cc(C)c2O)C1 843045542 UUHNJYGFVRKRAD-GFCCVEGCSA-N 299.212 2.257 10 20 CECD CCOc1nc(C(=O)NCc2ccc(N(C)C)cc2)co1 753781256 LIYLGLNDEFBCCE-UHFFFAOYSA-N 289.335 2.069 10 20 CECD COc1cccc([C@@H](C)NCC2CC3(C2)OCCO3)c1O 926998577 DNTXQDDRYCOGLB-LLVKDONJSA-N 293.363 2.205 10 20 CECD OC[C@@H](CC(F)F)NCc1c(O)ccc(Cl)c1F 758617011 TUCBNDJJBQDZKZ-ZCFIWIBFSA-N 283.677 2.290 10 20 CECD CC(C)N1C[C@H](N[C@H](C)c2cc(F)ccc2O)CC1=O 756739804 ZCFMOKQKCSATAM-ZYHUDNBSSA-N 280.343 2.191 10 20 CECD COC[C@H](C)CC(=O)NCc1ccc(N(C)C)c(F)c1 755250993 PVNASXYZNLHHGX-LLVKDONJSA-N 282.359 2.181 10 20 CECD C[C@@H]1C[C@H](NCC(F)(F)CO)c2c(O)ccc(F)c21 768285116 DVKWCTYIDNOBGG-APPZFPTMSA-N 275.270 2.297 10 20 CECD CCOc1ccc(CN2CCC[C@@H](N(C)C)C2)c(O)c1 769301678 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CC1([C@H](NCc2cc(F)cc(F)c2O)C(=O)O)CC1 1776514301 ZXYUHVRHMCPMNB-LLVKDONJSA-N 271.263 2.013 10 20 CECD C[C@@H](CC(=O)O)CC(=O)Nc1c(Cl)ccc2nonc12 1592392075 XBPCTMMLTXTTHJ-ZCFIWIBFSA-N 297.698 2.316 10 20 CECD C[C@H](NC[C@H]1CCC=CO1)c1cc(C(=O)O)ccc1O 1593251361 DJKVTMPXKJOUKC-CMPLNLGQSA-N 277.320 2.434 10 20 CECD CN(C)c1ccc(CNC(=O)CCc2cccnc2)cc1 18215290 BXGHYHKKGFSWOT-UHFFFAOYSA-N 283.375 2.397 10 20 CECD CCCNC(=O)CN(C)c1ccc(OCC)cc1 150731726 FJMZNYAGUZHMPE-UHFFFAOYSA-N 250.342 2.048 10 20 CECD COc1cc(O)c(CN2C[C@H](C)OC(C)(C)C2)cc1OC 159941761 HADYJGIXBJWAIA-NSHDSACASA-N 295.379 2.409 10 20 CECD CCn1ccc(CNCc2ccc3c(c2)CCO3)n1 840956508 UYBRMRLOMSNMOY-UHFFFAOYSA-N 257.337 2.128 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCCc1ccc(O)c(O)c1 827085522 UQSGXPIISGAOMA-RWMBFGLXSA-N 275.348 2.193 10 20 CECD C[C@@H](NC(=O)C[C@@H](N)C(C)(C)C)c1ccccc1O 1263175715 KCBYXADTFDEYQN-ZWNOBZJWSA-N 264.369 2.333 10 20 CECD Cc1ccc(S(=O)(=O)NCc2ccccc2O)cc1C 158586340 QTWNIZBBBYFOIZ-UHFFFAOYSA-N 291.372 2.488 10 20 CECD Cc1c([C@H](C)NCc2cccc(F)c2O)cnn1C 158718342 ZTRMTWYSTOHRAX-VIFPVBQESA-N 263.316 2.424 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H]2CCCCNC2=O)c1 36977563 HJHIIHJGSTVFPU-YPMHNXCESA-N 262.353 2.020 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2([S@](C)=O)CC2)c1 282342611 OWMNLPZJLSXVMZ-ZMZPIMSZSA-N 267.394 2.262 10 20 CECD COc1ccc(O)c(CN[C@H](C)CN(C)C(C)C)c1 291712566 ZZIBNNOENVBKHF-GFCCVEGCSA-N 266.385 2.219 10 20 CECD C[C@@H]1NCCN(Cc2cc(Cl)ccc2O)[C@H]1C 379501894 WWQPNGIJJIBBJI-UWVGGRQHSA-N 254.761 2.228 10 20 CECD CCOc1cccc(CNC[C@@H](OC)C2CC2)c1O 381217291 MZVNLTHXEBJMQC-CQSZACIVSA-N 265.353 2.306 10 20 CECD Cc1cccnc1CNC(=O)NCc1ccc(N(C)C)cc1 104772754 BYTBQXFLQYIOJX-UHFFFAOYSA-N 298.390 2.455 10 20 CECD CCc1cc(NC(=O)N(C)Cc2ccccc2O)n(C)n1 116509694 JZYPWEBFCFIIAG-UHFFFAOYSA-N 288.351 2.352 10 20 CECD CCN(CC)c1ccc(CN(C)Cc2nnc[nH]2)cc1F 179793131 FAQUYLCURZEURJ-UHFFFAOYSA-N 291.374 2.422 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2cccnc2)c1 114541708 GJUCOOHLKQUDEB-UHFFFAOYSA-N 286.331 2.045 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@@H]1CCCO1 115780470 KFAXGTDCQLBKHZ-HNNXBMFYSA-N 291.395 2.039 10 20 CECD CCOc1cccc(CNCC[C@@H](O)CC)c1O 127403148 CAUXUSUHIGOZKK-LBPRGKRZSA-N 253.342 2.042 10 20 CECD COc1ccc(=NCc2c(C)c3ccccc3n2C)[nH]n1 352546023 OJRCORMTTDBVNF-UHFFFAOYSA-N 282.347 2.319 10 20 CECD O=[N+]([O-])c1ccc(O)c(CN[C@@H]2CCCc3cn[nH]c32)c1 268838971 MTBSYKMQTRBGFK-GFCCVEGCSA-N 288.307 2.191 10 20 CECD C[C@@H](N[C@@H](CO)c1cnn(C)c1)c1cc(Cl)ccc1O 273536954 XOEKHWIGISUDCH-RNCFNFMXSA-N 295.770 2.163 10 20 CECD Cc1ccc(C(=O)N2[C@H]3C=CC[C@H]2CC3)c(O)c1O 364707621 QKWQACGYHVDEAH-QWRGUYRKSA-N 259.305 2.339 10 20 CECD COc1ccc(CNC(=O)[C@H]2Cc3ccccc3O2)c(O)c1 373662120 YSOOSZJBNOESEA-MRXNPFEDSA-N 299.326 2.021 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC=C(C)C2)c1O 281685164 BAQHYHMSQOVWHE-UHFFFAOYSA-N 278.308 2.461 10 20 CECD COc1ccc(N(C)C(=O)C2=CC[C@H](N)C2)cc1Cl 638027441 WLMQUOVJSUDOIR-JTQLQIEISA-N 280.755 2.359 10 20 CECD COCCn1cc(CNCc2c(O)cccc2Cl)cn1 282187903 ZZYVTMGDTHAZDI-UHFFFAOYSA-N 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GDJIDPOVOIOWGO-UHFFFAOYSA-N 264.369 2.438 10 20 CECD COC1(C(=O)NCc2cc(Cl)ccc2O)CCC1 846472602 BJPWLZDFWYDZCI-UHFFFAOYSA-N 269.728 2.231 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@H](F)C1 846630133 IVMHLWAZZCLKEU-MALLOTDXSA-N 265.284 2.072 10 20 CECD OC[C@H](NCc1ccc2c(c1)CCO2)c1ccccc1 63000423 VYPSAZJXRICJMR-INIZCTEOSA-N 269.344 2.445 10 20 CECD CN(C)c1ccc(CNCC2(N(C)C)CC2)cc1F 841890006 KFLPVBBWNUJTKO-UHFFFAOYSA-N 265.376 2.076 10 20 CECD C[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@@H](C)S1 743728758 WJLWLTNRXXZISF-HTQZYQBOSA-N 257.380 2.420 10 20 CECD CC[C@H](NCCN(C)C(=O)OC)c1ccc(C)cc1O 850547168 BOIJZUZRUYEBKG-ZDUSSCGKSA-N 280.368 2.440 10 20 CECD CC(C)(C)N1CC[C@@H](CNC(=O)c2cc(O)cs2)C1 855162522 XVZHZJGLCGAHLS-JTQLQIEISA-N 282.409 2.304 10 20 CECD CCOC(=O)c1cnc(SCC(=O)OC(C)C)s1 853376601 PUNICUIMZPMSQB-UHFFFAOYSA-N 289.378 2.364 10 20 CECD CN(C)c1cc(F)c(CNCc2ccon2)cc1F 858148353 UGPMQSBQDATSDE-UHFFFAOYSA-N 267.279 2.309 10 20 CECD Cc1ccc(CN(C)CC(=O)OC(C)(C)C)c(O)c1 876659301 SQFZCSDHQZCSAC-UHFFFAOYSA-N 265.353 2.474 10 20 CECD CCN(Cc1cc2c(cc1O)OC[C@H]2O)C1CCC1 768448779 WNDDHWWHAZKSFR-CQSZACIVSA-N 263.337 2.192 10 20 CECD CN(C)c1cc(F)c(CN2C[C@@H]3C[C@H]3C2)cc1F 862442192 BEJLXCVUPJNENU-UWVGGRQHSA-N 252.308 2.483 10 20 CECD COc1cccc(O)c1CN(CCCCO)C1CC1 769404006 HFWYVXPNFIMBAY-UHFFFAOYSA-N 265.353 2.138 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](N)CCC(C)C)c1 876878732 JTGSRCXDJOOZKG-BXUZGUMPSA-N 294.395 2.342 10 20 CECD COc1cccc(O)c1CN(C)Cc1ncc(Cl)n1C 779162579 WHNIMDNEPFREIZ-UHFFFAOYSA-N 295.770 2.420 10 20 CECD CC[C@@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(N(C)C)cc1 773101149 ANZKKUGLAARCRC-IUODEOHRSA-N 298.452 2.226 10 20 CECD CCOc1ccc(N(CC)CC(=O)N=S(C)(C)=O)cc1 878220870 UFZNFUKAARZRBL-UHFFFAOYSA-N 298.408 2.166 10 20 CECD CCN(CC)C(=O)CCCNCc1c(C)cccc1O 876932216 HHOLTLUWGYZCED-UHFFFAOYSA-N 278.396 2.439 10 20 CECD C[C@@H](NC(=O)c1cnccn1)c1ccc(N(C)C)cc1 773012155 GDNKCTDSLBTVHS-LLVKDONJSA-N 270.336 2.034 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@H](C(=O)NCCc2ccc(N)cc2)C1 884028609 LOQFIPRNRODDAE-XHDPSFHLSA-N 298.390 2.017 10 20 CECD Cc1ccc(CN[C@@H](C)c2ccc(F)cc2O)c(=O)n1C 786928207 BNVKLVYCCZZRGE-NSHDSACASA-N 290.338 2.389 10 20 CECD COc1ccc(CN[C@@H]2CCS[C@H]2C)c(O)c1OC 895126113 SHIUKNHIKIFECM-GXSJLCMTSA-N 283.393 2.393 10 20 CECD C[C@@H](O)[C@H]1CCN(Cc2c(O)cccc2Cl)C1 780786879 OOMABHGYTBRZJW-ZJUUUORDSA-N 255.745 2.248 10 20 CECD CCOC(=O)[C@H](CC1CC1)NCc1cc(F)cc(F)c1O 894442455 RWDUNUZFMWZJNC-ZDUSSCGKSA-N 299.317 2.492 10 20 CECD COC(=O)[C@H](Cc1ccccc1)NCc1ccccc1O 789573017 UADBAOVSUAGFCA-HNNXBMFYSA-N 285.343 2.266 10 20 CECD CN1CCc2cc([C@H](CN)N3CCCCC3)ccc21 34936243 GSYGCKALSIRLQO-INIZCTEOSA-N 259.397 2.165 10 20 CECD CC1=NO[C@@H](CNCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 895309968 DMCZFGAUALJUCI-SNVBAGLBSA-N 299.714 2.208 10 20 CECD COc1ccc(CNC(=O)C[C@H]2CCC(=O)[C@H]2C)c(O)c1 794374433 SYOKSGAZXHCHII-WDEREUQCSA-N 291.347 2.022 10 20 CECD O=C(Nc1cccc(N2CCC2=O)c1)c1cc(O)cs1 791092177 ISZGMCWYMCIMQN-UHFFFAOYSA-N 288.328 2.443 10 20 CECD COc1ccc(O)c(CN(C)CC[C@@H](N)C(C)C)c1 133389822 LVDYHQLETMMSCG-CQSZACIVSA-N 266.385 2.206 10 20 CECD COC[C@@H](NCc1cc(F)cc(F)c1O)C(C)C 708442585 NITOHCMCTCZAPW-GFCCVEGCSA-N 259.296 2.431 10 20 CECD CCN(CC)CCCNCc1cc(F)cc(F)c1O 708516326 HBFIGIIEFFXXMP-UHFFFAOYSA-N 272.339 2.492 10 20 CECD C[C@@H](CN)N(C)Cc1cc(Br)cc(F)c1O 715788793 LUXHKGRMBXXRGF-ZETCQYMHSA-N 291.164 2.073 10 20 CECD CC(C)[C@@H](CNCc1cc(F)cc(F)c1O)C(=O)O 1353945562 LXNIUDKLLBKVIU-SNVBAGLBSA-N 273.279 2.117 10 20 CECD Cc1cccc(CN2CCSC[C@@H]2CC(=O)O)c1O 1600533776 XBZHBUSPEKAOSH-LBPRGKRZSA-N 281.377 2.093 10 20 CECD CCn1ccnc1CN[C@@H](C)c1cc(C(=O)O)ccc1O 1605932317 HLUARGKFYWAKIL-JTQLQIEISA-N 289.335 2.158 10 20 CECD O=C(O)C[C@@H]1CCCN1Cc1ccc(Cl)cc1O 1601953942 RKPGVHWHUZZJJE-NSHDSACASA-N 269.728 2.485 10 20 CECD N[C@@H]1CC=C(C(=O)N2CCC=Cc3ccccc32)C1 1580171331 MBLTYJWVQWGAGX-CQSZACIVSA-N 254.333 2.484 10 20 CECD CCOC(=O)C[C@@H]1CCCN1Cc1cc(F)ccc1O 156270277 KBEOROIPHAIAMM-ZDUSSCGKSA-N 281.327 2.449 10 20 CECD CC1(C(=O)NCCc2ccc(O)c(O)c2)CC(F)(F)C1 821061125 PQXKCUAECOFNMS-UHFFFAOYSA-N 285.290 2.192 10 20 CECD Cc1ccc(O)c([C@H](C)NCCNC(=O)C(C)C)c1 35628802 SDSCJOSJQOPRQU-LBPRGKRZSA-N 264.369 2.123 10 20 CECD CCN1CC[C@H]2CC[C@@H](C1)N2Cc1ccccc1O 179585543 OYYXGZIGBVBSKV-CABCVRRESA-N 260.381 2.451 10 20 CECD CC[C@@H](C)C[C@@H](N)C(=O)NCc1ccc(N(C)C)cc1 401001281 KMAWTVBIMPIKCE-IUODEOHRSA-N 277.412 2.132 10 20 CECD CN1CCCN(C(=O)c2ccc(CN=[N+]=[N-])s2)CC1 1537962688 AGWLJBKZWUOARP-UHFFFAOYSA-N 279.369 2.336 10 20 CECD CN(Cc1ccc(C#N)cc1)C(=O)c1cccc(O)c1O 186891453 CDFOZYKUSGIIGH-UHFFFAOYSA-N 282.299 2.242 10 20 CECD CCCOc1ccc(CNCC2(C(=O)OC)CC2)c(O)c1 188670818 LHOOSVZPIVSXFI-UHFFFAOYSA-N 293.363 2.224 10 20 CECD C[C@H](CN1CCCC1=O)N[C@H](C)c1ccc(F)c(F)c1O 191215220 QDYJKTWPJSHELR-NXEZZACHSA-N 298.333 2.332 10 20 CECD COc1ccc(N(C)CC(=O)OC(C)(C)C)c(OC)c1 131872974 ITLSNUBRICVTGE-UHFFFAOYSA-N 281.352 2.482 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(F)cc1F 98074474 WGLVEHDDZCSPIV-UHFFFAOYSA-N 293.269 2.349 10 20 CECD CCOc1ccc(O)c(CNCCCn2ccnc2C)c1 263733659 YNMWQVRYHVXHKT-UHFFFAOYSA-N 289.379 2.476 10 20 CECD COc1cccc(CN=c2[nH]cnc3c2CCCC3)c1O 360438331 WYKSPQGEQJYUHT-UHFFFAOYSA-N 285.347 2.104 10 20 CECD CC[C@@H](CCO)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273609128 VFCYUCXGCACWPT-NEPJUHHUSA-N 295.379 2.238 10 20 CECD CC[C@H](NC[C@@H](O)CN1CCCC1)c1ccc(F)cc1O 286334440 YBETXTIWWOIRLE-HIFRSBDPSA-N 296.386 2.029 10 20 CECD Cc1nc(C(=O)NCc2c(O)ccc3c2CCCC3)co1 801625590 KKDLUVMDVLICCV-UHFFFAOYSA-N 286.331 2.497 10 20 CECD CN(C)c1ccc(CNC(=O)[C@](C)(O)C2CCC2)cc1F 813429632 ILRHPEQGYJCUQD-MRXNPFEDSA-N 294.370 2.059 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@H](C(=O)N(C)Cc2ccccc2O)C1 816889028 JPFOODOODBKNFJ-SMDDNHRTSA-N 299.374 2.440 10 20 CECD Cc1cc(CN(C)[C@H]2CCCCNC2=O)ccc1N(C)C 815037577 OZUWSGKICJILKN-INIZCTEOSA-N 289.423 2.162 10 20 CECD COC[C@H]1CN(Cc2ccc3ccccc3c2O)CCO1 816513196 JMLBPGGUWXMUPL-OAHLLOKOSA-N 287.359 2.393 10 20 CECD CCn1nc(C)c(C(=O)NCCc2ccc(N)cc2)c1C 818546105 PFXSBABGBIPKON-UHFFFAOYSA-N 286.379 2.075 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cccc(CN)c1 825943135 YPMBCBNAMLABKI-UHFFFAOYSA-N 297.402 2.484 10 20 CECD Cc1noc(C)c1NC(=O)NCc1ccccc1O 728739061 FXIKLTZMFIFWCK-UHFFFAOYSA-N 261.281 2.319 10 20 CECD CCCN(Cc1ccccc1O)C[C@H](C)S(C)(=O)=O 827938792 SGAURFSWYZLYDZ-LBPRGKRZSA-N 285.409 2.037 10 20 CECD COc1cccc(O)c1CNCc1cccc(C(=O)O)c1 820871023 LLGZONCMPAUETP-UHFFFAOYSA-N 287.315 2.389 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)C1(CO)CC1 827903600 LLEOCHDPOAKCBO-UHFFFAOYSA-N 259.708 2.141 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCOCC12CC2 840943474 ZMLYXOCUXFESAK-UHFFFAOYSA-N 260.381 2.426 10 20 CECD CC[C@H](N[C@H]1CCc2c(nnn2C)C1)c1ccccc1O 848562232 BNUWSBBYQJDHMQ-AAEUAGOBSA-N 286.379 2.119 10 20 CECD Oc1ccc(Cl)cc1CNC[C@H]1CCCNC1 841033379 SJSJLAYRHSZWBT-JTQLQIEISA-N 254.761 2.135 10 20 CECD C[C@H](COCC1CC1)NCc1cc([N+](=O)[O-])ccc1O 846073778 ROVOGEPJOHCOCZ-SNVBAGLBSA-N 280.324 2.205 10 20 CECD C[C@H](CC(=O)O)CC(=O)NCc1ccc(N(C)C)c(F)c1 911301191 YPGAVEMFOUDDPY-JTQLQIEISA-N 296.342 2.009 10 20 CECD COc1ccc(CN[C@@H](CCN)C(F)F)cc1C 841071675 IGCVGCQWSUIKQK-NSHDSACASA-N 258.312 2.076 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1N 843052260 RGCUOZWOCKUNFT-BXUZGUMPSA-N 265.376 2.061 10 20 CECD C[C@H](N[C@H](C)CN1CCCC1=O)c1cc(F)cc(F)c1O 756450965 WWRLDNHOQXPOOA-ZJUUUORDSA-N 298.333 2.332 10 20 CECD Cn1cc([C@H]2N(C(=O)c3cc(O)cs3)CC2(C)C)cn1 852972999 YITDLDOLNUPDNA-GFCCVEGCSA-N 291.376 2.411 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccn(C)c2)c1 764322157 LUUXDRLOCLARMS-JTQLQIEISA-N 274.320 2.230 10 20 CECD CCN(CC)c1ccc(CN(C)Cc2cn(C)nn2)cc1 761639642 AQMJYSIAVGBIBD-UHFFFAOYSA-N 287.411 2.293 10 20 CECD OCC[C@@H](NCc1cccc(Cl)c1O)C1CCOCC1 764677111 FRSKBYBLMLLMAB-CQSZACIVSA-N 299.798 2.313 10 20 CECD Cc1nccc(NC(=O)N(C)Cc2ccccc2O)n1 763267377 JKFMFSMQDFKYCB-UHFFFAOYSA-N 272.308 2.155 10 20 CECD COc1ccc(O)c(CN[C@@H]2Cc3cccc(O)c3C2)c1 763481071 QMSPZPJNNFBWQD-CYBMUJFWSA-N 285.343 2.363 10 20 CECD Cc1cccc(O)c1CN1CCC2(CC1)OCCO2 876562523 YYWNRDTVPHEICO-UHFFFAOYSA-N 263.337 2.040 10 20 CECD Cc1ccc(CNCc2cccc(N(C)C)n2)c(O)c1 877117737 SKADSVLZLMKXGG-UHFFFAOYSA-N 271.364 2.451 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)CC2CCCC2)c1 1118821494 GZRGBXPFZFFHLN-UHFFFAOYSA-N 283.393 2.310 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)CC)cc2)C[C@H]1O 773827161 VYKAUAKKVHZSNY-GOEBONIOSA-N 262.397 2.345 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)cc1 887039249 FYOAQTIDISFKCT-BPUTZDHNSA-N 260.381 2.098 10 20 CECD Cc1ccc(O)c(CNCCO[C@@H]2CCCCO2)c1 894798750 HWCYIJXKUNLVMK-OAHLLOKOSA-N 265.353 2.333 10 20 CECD CN[C@H](C)CCN[C@@H](C)c1cc(F)cc(F)c1O 1325742088 BFWWOKSRZWLQHT-BDAKNGLRSA-N 258.312 2.319 10 20 CECD CN(CCn1cccn1)Cc1ccc(N(C)C)cc1 194536891 PXSWJIWZCBBXSO-UHFFFAOYSA-N 258.369 2.081 10 20 CECD CCN1CCC[C@@H](NCc2cccc(Cl)c2O)C1=O 722351546 CUXFFBUXPCXHBM-GFCCVEGCSA-N 282.771 2.146 10 20 CECD COc1cccc(O)c1CN1C[C@H](C)OC(C)(C)C1 769101695 UJDYSRWCKMZKDV-NSHDSACASA-N 265.353 2.400 10 20 CECD C[C@H](N[C@H](C(N)=O)c1ccccc1)c1ccccc1O 775135861 GZUKVHLEEZHBKT-NHYWBVRUSA-N 270.332 2.269 10 20 CECD CC[C@]1(O)CCN(Cc2cc(F)cc(C(C)=O)c2O)C1 778398686 NGIORSXQVFLUCU-HNNXBMFYSA-N 281.327 2.081 10 20 CECD CN(Cc1ccc(N(C)C)cc1)CC1CCNCC1 94011047 QWRMHWFIEKOCGW-UHFFFAOYSA-N 261.413 2.184 10 20 CECD Nc1ccc(CN2CCC[C@H]([C@@H]3CCNC3)C2)cc1 1352791070 TYLNBWOHFOCITE-CABCVRRESA-N 259.397 2.090 10 20 CECD CC(C)[C@H](C(=O)NCc1ccc(N)cc1)N1CCCCC1 1356226963 DNENDOGFIZXMHK-MRXNPFEDSA-N 289.423 2.396 10 20 CECD O=C(O)c1cnc(S[C@@H]2CCCCC2=O)s1 1602537440 UPOQBLMMWXPPJB-SSDOTTSWSA-N 257.336 2.445 10 20 CECD O=C(O)c1cc(NCc2cc(Cl)ccc2O)ncn1 1602287088 DIFSCXFVVHDMQE-UHFFFAOYSA-N 279.683 2.146 10 20 CECD COc1ccc(CN[C@@](C)(C(=O)O)C2CC2)cc1C 1607258204 CPLCTSNPFFGFPI-OAHLLOKOSA-N 263.337 2.347 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C(=O)O)C2)c(Cl)c1 1600286090 KHUCGWBKBGFHKJ-VIFPVBQESA-N 269.728 2.261 10 20 CECD COc1ncc(CSc2ncc(C(=O)O)s2)c(C)n1 1599734128 OJVGQNUTKAMZAH-UHFFFAOYSA-N 297.361 2.241 10 20 CECD Cc1occc1CN[C@@H](C)c1cccc(-c2nn[nH]n2)c1O 1592512304 KAUWDOPSYDYESV-VIFPVBQESA-N 299.334 2.325 10 20 CECD CCCNC(=O)CN[C@@H](CC)c1ccc(N(C)C)cc1 158329130 FGVJEZUQCZJKQS-HNNXBMFYSA-N 277.412 2.320 10 20 CECD Oc1ccc(F)cc1CN[C@H]1CCN2CCC[C@@H]2C1 226585184 DNUTZQRRQBOVKY-UONOGXRCSA-N 264.344 2.248 10 20 CECD CCN1CCC[C@H]1CNCc1ccc2c(c1)CCO2 37362683 QGICMMRQJHPZSM-HNNXBMFYSA-N 260.381 2.195 10 20 CECD CCN(CC)c1ccc(CNCCCS(C)(=O)=O)cc1 38047423 MYGKQXKZQHDQSZ-UHFFFAOYSA-N 298.452 2.057 10 20 CECD Nc1ccc(CC(=O)N(CC(F)(F)F)C2CC2)cc1 42736661 QJAOWKPWJRWERG-UHFFFAOYSA-N 272.270 2.365 10 20 CECD C[C@@H](N[C@H](C)c1ncn(C)n1)c1ccc(N(C)C)cc1 275700228 KPQWOARCLNKIKC-VXGBXAGGSA-N 273.384 2.293 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@H]3CNC[C@@H]3C2)cc1 401022544 RSGJKRMLGVWNQH-OWCLPIDISA-N 273.424 2.230 10 20 CECD CCn1ccc(NCc2cc(F)cc(F)c2O)n1 708534947 HFLNIYKSWUHBKV-UHFFFAOYSA-N 253.252 2.499 10 20 CECD CO[C@H](C1CC1)[C@H](C)NCc1cc2c(cc1O)OCO2 388208346 FCWAJWYMPQJABG-VFZGTOFNSA-N 279.336 2.024 10 20 CECD Cn1cc(Cl)c(CNCc2ccccc2O)n1 393335831 XPSSLUHFUFVNTI-UHFFFAOYSA-N 251.717 2.069 10 20 CECD CCN(CC)c1ccc(CNCc2cn(CC)nn2)cc1 404435531 CGWLIGZBYIWJCN-UHFFFAOYSA-N 287.411 2.434 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H]1CCOC1 179169792 PYTNNGFRCQQIPE-CYBMUJFWSA-N 278.352 2.103 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCCO2)cc1F 121341059 YOMNGCZJKFAYKW-AWEZNQCLSA-N 280.343 2.077 10 20 CECD C[C@@]1(O)CCN(Cc2cc(Br)ccc2O)C1 180183263 CXUNEILEADBXNA-GFCCVEGCSA-N 286.169 2.111 10 20 CECD C[C@@H]1SCCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@H]1C 180795153 CLNPJDARGOSYSJ-LJRGRFNSSA-N 293.388 2.463 10 20 CECD CNc1snc(C)c1C(=O)N(C)Cc1ccccc1O 77258358 FKGCAFKECTWLQS-UHFFFAOYSA-N 291.376 2.471 10 20 CECD CCN(CC[C@H]1CCOC1=O)c1ccc(OC)cc1 267921776 FKMFXFHJJXWFCV-LBPRGKRZSA-N 263.337 2.475 10 20 CECD CCOc1cccc(CNCCCn2ccnc2C)c1O 263711891 UQEIMAMINRROKQ-UHFFFAOYSA-N 289.379 2.476 10 20 CECD Oc1c(Cl)cccc1CN1C[C@@H]2CCCN[C@@H]2C1 271897717 YLZXWDJZPHPIFK-GXFFZTMASA-N 266.772 2.229 10 20 CECD CCCOc1ccc(CN2CCC[C@H](O)C2)c(O)c1 271017660 RTVGCUNTPKMNOT-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD C[C@@H](N[C@@H]1CCN(c2cnn(C)c2)C1)c1ccccc1O 367785881 XEPVDVDTWKCWMC-CHWSQXEVSA-N 286.379 2.055 10 20 CECD Cc1cc(C(=O)NC2=NO[C@H](C)C2)c(C)n1-c1ccccn1 270634509 WHPRMAZWAXDJFG-LLVKDONJSA-N 298.346 2.341 10 20 CECD Cc1cccc(CNC[C@H](O)Cc2ccccc2)c1O 289894637 TWXCHVZZUIVEHA-MRXNPFEDSA-N 271.360 2.394 10 20 CECD CNC(=O)CCCN[C@H](C)c1c(C)cc(C)cc1O 293720358 MLIQPFNMQRRBGC-GFCCVEGCSA-N 264.369 2.186 10 20 CECD CO[C@@](C)(C(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 292368054 PELGTGNXIIJHPB-MRXNPFEDSA-N 294.370 2.323 10 20 CECD CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)C[C@@H](CC)O1 817640666 RHOWOHFMVKCUGV-VXGBXAGGSA-N 293.363 2.436 10 20 CECD Cc1n[nH]cc1[C@H](C)NC[C@H](N)c1ccc(N(C)C)cc1 817941401 JQKHDWZPNKNUTB-ZBEGNZNMSA-N 287.411 2.135 10 20 CECD C[C@@H](NCCN)c1cc(Br)cc(Cl)c1O 817934984 RZJUZTGLYHQTMY-ZCFIWIBFSA-N 293.592 2.417 10 20 CECD Cc1cc(C)c([C@H](C)NCc2ccc(C(N)=O)nc2)c(O)c1 815587362 HZBUVWVJHZVHQP-LBPRGKRZSA-N 299.374 2.354 10 20 CECD CC(C)NC(=O)NCCN[C@H](C)c1ccc(N(C)C)cc1 828312971 LSZHGEXCLOVERL-CYBMUJFWSA-N 292.427 2.111 10 20 CECD O=C(CC[C@@H]1CCCN1)NCCCSc1nccs1 829528248 NIPMGINAXRHBNN-NSHDSACASA-N 299.465 2.274 10 20 CECD O=C(NCCc1nc2ccccc2[nH]1)c1cc(O)cs1 732258323 SDMPSZCWNOETJA-UHFFFAOYSA-N 287.344 2.303 10 20 CECD CC[C@](C)(CNC(=O)NCc1cc(OC)ccc1O)OC 838474502 LDFGQOHXMBIVHF-OAHLLOKOSA-N 296.367 2.015 10 20 CECD CN(C[C@H]1CCCCO1)C(=O)c1cc(O)cs1 732276978 YZFTWWNEEFJDLI-SNVBAGLBSA-N 255.339 2.095 10 20 CECD C[C@@H]1C[C@@H](C)N(CC(=O)NCc2ccc(N(C)C)cc2)C1 839495665 UALSJOLRPLHLDJ-ZIAGYGMSSA-N 289.423 2.099 10 20 CECD CCC(C)(C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832281972 WNEBHPCCMSTDAA-CQSZACIVSA-N 277.412 2.305 10 20 CECD CC[C@@H](C)CC(=O)N(CC(=O)O)Cc1ccccc1O 911494717 XHTCMXPMPZHSRS-LLVKDONJSA-N 279.336 2.242 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H]3CNC[C@@H]32)c1O 842473355 YSQJOHFJTJBGTO-YGRLFVJLSA-N 294.782 2.042 10 20 CECD COc1cc(O)c(CN[C@@H]2CS[C@@H](C)C2)cc1OC 840958832 OLZJOGMFWYKJHO-ONGXEEELSA-N 283.393 2.393 10 20 CECD CCN1C[C@H](CNCc2cccc(Cl)c2O)CC1=O 846097242 OHVYPAZWDRYYDA-JTQLQIEISA-N 282.771 2.004 10 20 CECD CC(C)Cn1ncnc1CN1CCCc2cc(CN)ccc21 843352268 WWDNETATGQLWIL-UHFFFAOYSA-N 299.422 2.346 10 20 CECD CN(C)C(=O)C1CCC(C(=O)Nc2ccc(N)cc2)CC1 851633387 IQZVGWYDCAIOLA-UHFFFAOYSA-N 289.379 2.102 10 20 CECD CCc1cccc(CN2CC[C@H](C)[C@H](CO)C2)c1O 857061067 JESXYKHCMCMLIH-WFASDCNBSA-N 263.381 2.405 10 20 CECD COc1cc(C)cc(CN2CCC[C@H]2c2ncon2)c1O 754729714 FDFNSEQHNRLVHV-LBPRGKRZSA-N 289.335 2.429 10 20 CECD CC(=O)c1cc(F)cc(CN[C@]2(C)CCO[C@@H]2C)c1O 755155661 CNMGZAOMDRAXLP-MEBBXXQBSA-N 281.327 2.391 10 20 CECD COc1cc(C)cnc1C(=O)NCc1cc(C)ccc1O 862757062 GCVGLGWJAXAPJA-UHFFFAOYSA-N 286.331 2.343 10 20 CECD COc1cccc(O)c1CNCC[C@H](O)C1CCCC1 865874475 DSNFLKIDWYJKOT-AWEZNQCLSA-N 279.380 2.432 10 20 CECD CCOc1nc(C(=O)NCc2cc(C)ccc2O)co1 862757471 VNICLJAVOSRAQH-UHFFFAOYSA-N 276.292 2.017 10 20 CECD CCN(C)c1ccc(CN(C)C[C@H](C)C(=O)OC)cc1 773728552 DAUNONBCOULGRR-ZDUSSCGKSA-N 278.396 2.384 10 20 CECD C[C@H](NC(=O)C1(N(C)C)CCC1)c1ccc(N(C)C)cc1 775412596 ZPYCVNFLFBGJSI-ZDUSSCGKSA-N 289.423 2.414 10 20 CECD O=C(N[C@@H](CO)C1CCCCC1)c1cc(O)cs1 778512697 ARMWKKQSDQTHAI-NSHDSACASA-N 269.366 2.125 10 20 CECD C/C=C\C[C@@H](CO)NCc1cc(F)cc(F)c1O 883090225 FIIXJAWEGHPJLJ-QUCGXOGASA-N 257.280 2.087 10 20 CECD Cc1cc(O)c(CN2C[C@@H](O)[C@H](C)C2)cc1Cl 897680650 UTVIYQJQEWXDMK-NOZJJQNGSA-N 255.745 2.167 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@@H](OC)C2)cc1F 895968079 GNIXWFVCMMFVTB-MRXNPFEDSA-N 296.386 2.477 10 20 CECD Cn1cnnc1[C@@H]1CCCN1Cc1cc(F)cc(F)c1O 894077178 YPAJOJLQFDUDTL-LBPRGKRZSA-N 294.305 2.136 10 20 CECD COc1ccc(CN[C@@H](C)CSC)c(O)c1OC 893004456 HXCQFMMVMJUDOP-VIFPVBQESA-N 271.382 2.251 10 20 CECD COc1ccc(CN2CC[C@H](OC)C[C@@H]2C)c(O)c1OC 894254760 UWGSYEBTOWEWKG-AAEUAGOBSA-N 295.379 2.409 10 20 CECD Cc1ccc(C(=O)NCc2ccn(C(C)C)n2)c(O)c1O 780946434 AENZQNJRTXGSFI-UHFFFAOYSA-N 289.335 2.114 10 20 CECD C[C@H](NCc1c(O)ccc(Cl)c1F)c1ncnn1C 790991131 KYRMMKPTEKFEQY-ZETCQYMHSA-N 284.722 2.164 10 20 CECD Cc1ccc(O)c(CNC(C)(C)C(=O)N2CCCC2)c1 793393903 DRUYRYZVGVJQPU-UHFFFAOYSA-N 276.380 2.191 10 20 CECD COc1ccc(CNC(=O)c2scnc2C)c(O)c1 794378153 DBBQOAWSFLXIAN-UHFFFAOYSA-N 278.333 2.096 10 20 CECD COC(=O)CC1(CN[C@H](C)c2cc(OC)ccc2O)CC1 799315104 YOXNTDOGYCKDQC-LLVKDONJSA-N 293.363 2.395 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@@H]1CCn2ccnc2C1 790987651 FFCCJTFKCPCYJY-SECBINFHSA-N 295.745 2.486 10 20 CECD Nc1ccc(CN2CCC[C@H]([C@@H]3CCCNC3)C2)cc1 1235426940 MAISPCTYJKDBEU-CVEARBPZSA-N 273.424 2.480 10 20 CECD Oc1cccc(Br)c1CNC[C@H]1CCOC1 706863885 XIYZKCSZCXCYTC-SECBINFHSA-N 286.169 2.281 10 20 CECD C[C@@H]1OCCN(Cc2cc(F)cc(F)c2O)[C@@H]1C 708399234 KIZUTVOZORYKIP-BDAKNGLRSA-N 257.280 2.280 10 20 CECD CO[C@@H](C(=O)N(C)Cc1ccccc1O)C(C)C 771409564 YNBYVKRVSRXBGE-CYBMUJFWSA-N 251.326 2.022 10 20 CECD Cc1ccc(O)c(CNC(=O)NCC(C)(C)C[C@H](C)O)c1 1331346310 UXLRMCVXUPUMHH-LBPRGKRZSA-N 294.395 2.297 10 20 CECD C[C@@H](NC[C@@H]1CCCCO1)c1cc(C(=O)O)ccc1O 1609779127 OUSFDPXJOKJHNR-PWSUYJOCSA-N 279.336 2.310 10 20 CECD CC1(C)[C@@H](N)C[C@H]1NCc1c(O)ccc(Cl)c1F 1576380011 FPNCTUUOBVFBOZ-WDEREUQCSA-N 272.751 2.400 10 20 CECD C[C@H]1CN(Cc2cc(F)c(F)cc2O)C[C@]1(C)C(=O)O 1599929684 HOHQEODLTQNHAB-RTHLEPHNSA-N 285.290 2.213 10 20 CECD CCONC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 166417721 NFCZFAVSHGTZMT-ZDUSSCGKSA-N 294.351 2.034 10 20 CECD CC[C@@H]1C[C@@H](NCc2cccc(OC)c2O)CCO1 824383926 WMCRKCJNSVSJNL-QWHCGFSZSA-N 265.353 2.448 10 20 CECD CC[C@@H](NC[C@]1(OC)CCOC1)c1ccccc1O 160140991 GFXSMNUTQTYWTF-UKRRQHHQSA-N 265.353 2.238 10 20 CECD CN(Cc1ccccc1O)C(=O)CC[C@H]1CCCNC1 43589399 RPCJOPFNNVRATQ-CYBMUJFWSA-N 276.380 2.130 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](CO)C(C)C)c1 394028013 IFBNLBJBWGTOMR-RYUDHWBXSA-N 267.369 2.316 10 20 CECD COc1ccc(O)c(CNCc2cc(OC)ns2)c1 399102671 FXWZEHLIKJWKCD-UHFFFAOYSA-N 280.349 2.156 10 20 CECD O=C(C[C@@H]1CCCN1)NCc1ccc(N2CCCC2)cc1 178711085 UOVRIRVFOBYDJQ-HNNXBMFYSA-N 287.407 2.045 10 20 CECD COc1ccc(O)c(CNC(=O)NCc2cccs2)c1 172064128 LDZGQJWUEOURNK-UHFFFAOYSA-N 292.360 2.462 10 20 CECD CC[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCS1 173504107 IFCRBOPDGFGSKJ-LLVKDONJSA-N 281.377 2.448 10 20 CECD CCCOc1ccc(CNC(C)(C)CCO)c(O)c1 174578989 AYFQGUNQIQMRNS-UHFFFAOYSA-N 267.369 2.432 10 20 CECD CCOCc1cc(CN[C@H]2C[C@@H](O)C2(C)C)ccc1OC 189328180 NCCGSAJJAKZNGH-JKSUJKDBSA-N 293.407 2.481 10 20 CECD CCCC[C@H](NCc1ccccc1O)C(=O)OC 154564468 SQVRWILOESUVHA-LBPRGKRZSA-N 251.326 2.214 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1cccc(OC)c1O 182325481 FQLNXDLHVWKWRW-HNNXBMFYSA-N 278.352 2.021 10 20 CECD CCCOc1ccc(CN2CC[C@@](C)(O)C2)c(O)c1 180195643 UOHHTYXRPGCUIU-OAHLLOKOSA-N 265.353 2.138 10 20 CECD CC(C)N(CC(N)=O)Cc1cc(Cl)cc(Cl)c1O 133008152 GOZBUEJOLKXWGI-UHFFFAOYSA-N 291.178 2.395 10 20 CECD CCOCCN(C)Cc1cc(OC)c(C)cc1O 92885354 UAACBKFKDNHOIK-UHFFFAOYSA-N 253.342 2.178 10 20 CECD OCCNCc1ccc2c(c1)CCN2Cc1ccccc1 368510107 CKMOGROWGHJYKP-UHFFFAOYSA-N 282.387 2.331 10 20 CECD CC[C@H](C)[C@H](O)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273599573 RPDPJSXIZMSEPF-ZIBATOQPSA-N 295.379 2.236 10 20 CECD Cc1cc(C(=O)NC2=NO[C@@H](C)C2)c(C)n1-c1ccccn1 270634512 WHPRMAZWAXDJFG-NSHDSACASA-N 298.346 2.341 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)C[C@@H](C)[S@@]1=O 289699214 ONRKAKPFMRWWQT-YZRASEIHSA-N 297.420 2.132 10 20 CECD CN(Cc1ccccc1O)C(=O)CCC(C)(C)[N+](=O)[O-] 294886207 QMQOKIIWWWBNOI-UHFFFAOYSA-N 280.324 2.186 10 20 CECD COCCOCCN(C)Cc1cc(C)cc(C)c1O 808237133 DJIZYYGUOZMKLZ-UHFFFAOYSA-N 267.369 2.104 10 20 CECD CC(=O)C(=O)COC(=O)CSc1ccc(C)cc1C 808485372 OEZOGFSVFYQISI-UHFFFAOYSA-N 280.345 2.097 10 20 CECD O=C(/C=C/c1ccc(O)cc1)NCc1ccccc1O 706233250 MHXYSXSKZZLTMI-JXMROGBWSA-N 269.300 2.427 10 20 CECD Cc1cc(CN(C)C2(CO)CCC2)ccc1N(C)C 815121776 XEVYHFCXTLMECA-UHFFFAOYSA-N 262.397 2.408 10 20 CECD CC[C@H](N[C@@H]1CCNC1)c1cc(Cl)ccc1O 817944640 ITGPZNDRANZWLK-PWSUYJOCSA-N 254.761 2.448 10 20 CECD Cc1cc(CNC(=O)c2ccc(C)c(O)c2O)cc(C)n1 817619199 NXQKHHKWLSUHJQ-UHFFFAOYSA-N 286.331 2.348 10 20 CECD CC[C@]1(O)CCN(Cc2ccc(N(C)C)c(C)c2)C1 815096990 YCMUJGJOYCDKON-INIZCTEOSA-N 262.397 2.408 10 20 CECD CCC(N)(CC)CN[C@H](C)c1cc(C(=O)OC)ccc1O 817960930 UPNMRDLHAVKRBC-LLVKDONJSA-N 294.395 2.347 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)CCCCF 829864337 NAYHGSJPCQRNBE-UHFFFAOYSA-N 261.318 2.192 10 20 CECD COc1cc(O)c(CNCc2cnccc2C)cc1OC 824910771 ZQEHDQXDGAWYGH-UHFFFAOYSA-N 288.347 2.403 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1CC[C@H](F)C1 838480733 ZTRKKMLZMWXYNV-ZDUSSCGKSA-N 279.359 2.314 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1[C@@H]2CCC(=O)[C@H]21 906995238 XXSMMVPMLLPBHL-UHOFOFEASA-N 287.359 2.356 10 20 CECD O=C1NCC[C@H]1CCOc1ccc(N2CCCC2)cc1 902283291 IIJOEJHSZYBRHB-ZDUSSCGKSA-N 274.364 2.192 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)NC)cc1 848407790 UJHTXUZFQDJUTQ-ZDUSSCGKSA-N 277.412 2.099 10 20 CECD Cc1cc(N(C)C)ccc1CNCC[C@]1(O)CCCOC1 846106566 CLLCNNMTHOFEMY-QGZVFWFLSA-N 292.423 2.082 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1cc(F)ccc1O 843427334 LIZNHIJEWXSQEK-MFKMUULPSA-N 255.333 2.418 10 20 CECD CCC1CCN(S(=O)(=O)Nc2ccc(O)cc2)CC1 849305853 QNOHTFVVWBXSBJ-UHFFFAOYSA-N 284.381 2.171 10 20 CECD CCc1cccc(CN2CCC[C@H](CC(N)=O)C2)c1O 848889026 GAWKMVMEQVPWLD-GFCCVEGCSA-N 276.380 2.042 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H](N)CC 842003429 BOWVBTSUTYRYGU-CYBMUJFWSA-N 279.384 2.051 10 20 CECD Cc1cc(C)c(O)c(CN2CCC(S(C)(=O)=O)CC2)c1 754739801 PILQDCLSCHTJEP-UHFFFAOYSA-N 297.420 2.018 10 20 CECD Cc1ccc(O)c([C@@H](C)NCc2nc(C(N)=O)cs2)c1 850540712 NPKAYZTXPFNSIK-SECBINFHSA-N 291.376 2.107 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C)C1)c1cc2c(cc1O)CCCC2 756528724 VYZDYAIGRWPABG-FZMZJTMJSA-N 288.391 2.152 10 20 CECD C[C@]1(CNC(=O)c2cc(O)cs2)CCO[C@@H]1C1CC1 768737523 QTOHSJDQSMVROJ-TZMCWYRMSA-N 281.377 2.389 10 20 CECD Cc1ccc(CNCCC(=O)N2CCCCC2)c(O)c1 876942718 CIPLFQYMDBYINP-UHFFFAOYSA-N 276.380 2.193 10 20 CECD CC1(C)CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768465628 JNUHLGVUQQMBGD-ZDUSSCGKSA-N 263.337 2.050 10 20 CECD CC(C)Nc1ccccc1NCc1nnc2n1CCOC2 871845932 NWGLYEKJLWVIRR-UHFFFAOYSA-N 287.367 2.241 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@@H](c1cc3c(cc1O)OCO3)N2 877862125 SOERTEHUQBMTNP-HNNXBMFYSA-N 298.298 2.283 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCn1cccc1 773750768 WPINHXWRHJDDRX-GFCCVEGCSA-N 288.347 2.037 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCC[C@@H](O)C1 775638526 JNVRLOSADIINSY-SNVBAGLBSA-N 259.708 2.141 10 20 CECD CCOc1ccc(CN2CCN(C)[C@@H](C)[C@H]2C)c(O)c1 775987885 WVMPTMHZJYPARV-QWHCGFSZSA-N 278.396 2.315 10 20 CECD C[C@@H]1CC[C@H](CNC(=O)N[C@H](C)c2ccccc2O)O1 875656929 NIYQOWJLJDYQEM-IJLUTSLNSA-N 278.352 2.320 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 773021985 AGWQRLIAAAIVKG-KGLIPLIRSA-N 280.412 2.455 10 20 CECD CC[C@H](N[C@@H]1CCC[C@@H]1C(=O)NC)c1ccccc1O 775523917 BAWQNVOWYZOJAP-MELADBBJSA-N 276.380 2.348 10 20 CECD C[C@H](C[C@@H]1CCOC1)NC(=O)/C=C/c1ccc(O)c(O)c1 779527993 FGGKZOKDLNFGLR-QIPCVNDGSA-N 291.347 2.042 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CC=CCC2)c(O)c1 793028691 RHJJUOKTDNWWKF-GFCCVEGCSA-N 276.336 2.309 10 20 CECD C[C@H](Nc1ccc(C(=O)O)nn1)c1ccccc1O 1599902445 FTHAWTZNNQHGKO-QMMMGPOBSA-N 259.265 2.054 10 20 CECD O=C(O)CCCNCc1c(O)cccc1Br 706673924 MVZZYKQLROOJCR-UHFFFAOYSA-N 288.141 2.109 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@H]1CCCNC1=O 1325575037 SXNVKONDHZPLPR-UPJWGTAASA-N 288.391 2.365 10 20 CECD COC(=O)CC1CCN(Cc2ccc(N)cc2)CC1 1335284589 DYIDFLRBLZMZHF-UHFFFAOYSA-N 262.353 2.044 10 20 CECD Nc1ccc(NC(=O)NCC[C@@H]2CCCC[C@@H]2O)cc1 904499486 FIZDMBUAIAWNOX-FZMZJTMJSA-N 277.368 2.332 10 20 CECD COCC1(C)CCN(C(=O)NCc2ccc(N)cc2)CC1 1346737889 BHCTYXPJRIIGKH-UHFFFAOYSA-N 291.395 2.227 10 20 CECD Cc1ccc(O)c(CN[C@H]2CCCC[C@H]2C(=O)O)c1 1600467277 OEGVAPTWJRSJMY-OLZOCXBDSA-N 263.337 2.434 10 20 CECD Cc1cc(CCNC(=O)C2(N)CC2)c(C)n1-c1ccccc1 1574134352 KHDQHMCUMBWPMX-UHFFFAOYSA-N 297.402 2.244 10 20 CECD CCCOc1ccc(CNC[C@H](CC(=O)O)OC)cc1C 1776820672 BLIIPCCGHKMZMJ-AWEZNQCLSA-N 295.379 2.363 10 20 CECD COc1cccc(CNCc2c(C)nn(C)c2C)c1O 112018060 DXHJBJKJASHHFQ-UHFFFAOYSA-N 275.352 2.041 10 20 CECD Cc1cnc(CNCc2cc3c(cc2O)OCO3)s1 230686361 XLHZXAAVEIDPSJ-UHFFFAOYSA-N 278.333 2.176 10 20 CECD C[C@@H](NCC12CC(CO1)C2)c1cc(F)ccc1O 527984123 WNCNBIHQOATKBZ-NAUIOFCNSA-N 251.301 2.361 10 20 CECD C[C@@H](N[C@H]1CCN(C2CC2)C1)c1cc(F)ccc1O 94617980 NDHDVKSIXIUGRN-PWSUYJOCSA-N 264.344 2.419 10 20 CECD C[C@H](NCC1CC2(C1)OCCO2)c1ccc(F)cc1O 927004268 QYUQDTIMWSGPJP-JTQLQIEISA-N 281.327 2.335 10 20 CECD CCCNC(=O)N1CCCN(c2ccc(OC)cc2)CC1 56371780 YWLOMMUICYOTAO-UHFFFAOYSA-N 291.395 2.327 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)N[C@@H](C)c1cc(OC)ccc1O 170900683 HWVMGNRBQSWZHA-MRCXROJRSA-N 279.336 2.003 10 20 CECD c1csc(Cn2nnnc2Sc2nccs2)c1 60216616 DGQZPCUNBVMCDU-UHFFFAOYSA-N 281.391 2.391 10 20 CECD CCN(CC)C(=O)CN(C)Cc1cc(C)c(C)cc1O 120412919 JWTANUXQNLILII-UHFFFAOYSA-N 278.396 2.309 10 20 CECD CCOc1ccc(O)c(CNC[C@@](C)(O)C(C)C)c1 304081453 YQFQZTDLSYEBTD-OAHLLOKOSA-N 267.369 2.288 10 20 CECD C[C@@H](NC[C@]1(O)CCOC1)c1cc2c(cc1O)CCCC2 186178158 HLFHLRHZPOLXED-SJKOYZFVSA-N 291.391 2.073 10 20 CECD CCOc1ccccc1CNC(=O)c1cccc(O)c1O 186999124 FAWGKPGJQXNGNS-UHFFFAOYSA-N 287.315 2.427 10 20 CECD Cc1cccc(CN2CCNC(=O)[C@H]2CC(C)C)c1O 188922725 OEFRNZJXVUTMSC-CQSZACIVSA-N 276.380 2.047 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1cccc(Cl)c1O 180552497 KPRFIRKEEWAAHX-LBPRGKRZSA-N 282.771 2.146 10 20 CECD CN(C)c1ccc(CN(C)c2cc(Cl)nc(N)n2)cc1 45025057 ZKMLYTVZLCXATA-UHFFFAOYSA-N 291.786 2.415 10 20 CECD CCCNC(=O)CCNCc1c(O)cccc1Cl 83552093 UNNKYPXGYZMOHE-UHFFFAOYSA-N 270.760 2.052 10 20 CECD Cc1c([C@@H](C)NCc2cc3c(cc2O)OCO3)cnn1C 42880115 WSHVRWHJSIVIDC-SECBINFHSA-N 289.335 2.014 10 20 CECD COc1ccccc1CNCc1cc2c(cc1O)OCO2 42879117 WTSBMJNONDWMSV-UHFFFAOYSA-N 287.315 2.419 10 20 CECD O=C(CCc1c[nH]cn1)NCc1ccc(N2CCCC2)cc1 193373709 XBWJXCSUTXSQJD-UHFFFAOYSA-N 298.390 2.259 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cncs1 266359220 RITFTEJGZLZRKL-UHFFFAOYSA-N 289.360 2.248 10 20 CECD CCOc1cccc(CN[C@@H]2C[C@H](OCC)[C@H]2OC)c1O 274965488 VFQNHEVUTMQPNM-INWMFGNUSA-N 295.379 2.073 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](O)C2CCOCC2)c(O)c1C 273530776 WEKUWDGFIOACTD-CJNGLKHVSA-N 293.407 2.447 10 20 CECD CC[C@H](NCCOCCOC)c1ccc(C)cc1O 279954602 BYWHVLDKRSAGFK-AWEZNQCLSA-N 267.369 2.404 10 20 CECD CCOc1cccc(CN2CC[C@H](C)[S@](=O)CC2)c1O 277725605 SSPXCNRSHWQRSV-FKIZINRSSA-N 297.420 2.134 10 20 CECD CCOC1CC(O)(CNCc2c(O)cccc2Cl)C1 277817923 ZOVBGAQFOZAUFT-UHFFFAOYSA-N 285.771 2.065 10 20 CECD Cc1ccc([C@H](C)NCCCS(C)(=O)=O)c(O)c1C 273601728 SBAKNRRZLAFCTM-LBPRGKRZSA-N 285.409 2.094 10 20 CECD C[C@@H](NCC1(S(C)(=O)=O)CCCC1)c1ccccc1O 285859256 ZNQMWWXGZGIOPA-GFCCVEGCSA-N 297.420 2.400 10 20 CECD CN(Cc1c(O)cccc1Cl)[C@@H]1CCC[C@H]1O 289806217 SPSWUJVOUBUPIZ-DGCLKSJQSA-N 255.745 2.391 10 20 CECD Cc1ccc([C@@H](C)NC[C@H]2CC[C@@H](CO)O2)c(O)c1C 293708273 MPGWQZJPEGYWMK-MCIONIFRSA-N 279.380 2.200 10 20 CECD COc1ccc(N(C)C[C@H](O)c2cccnc2)cc1F 296810577 QCJSIANZYIMQRP-AWEZNQCLSA-N 276.311 2.399 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H](O)CC2)c1O 294132917 UPNHAGDTXXOAHJ-GFCCVEGCSA-N 285.771 2.401 10 20 CECD COCCNC(=O)NCc1cc(Cl)cc(Cl)c1O 806273520 CBYLMOLKMRFYTR-UHFFFAOYSA-N 293.150 2.145 10 20 CECD CC1(CCNC(=O)c2c(F)ccc(O)c2O)CC1 296262980 LYYABXGCYIGXOK-UHFFFAOYSA-N 253.273 2.157 10 20 CECD O=C(NC[C@@H]1CCCSC1)c1cc(O)cs1 807850596 PQWJDXFGZOAFFB-QMMMGPOBSA-N 257.380 2.327 10 20 CECD COC[C@@]1(CN[C@@H](C)c2ccc(C)cc2O)CCCN1 817974196 JIBZNEXUEWTQQY-BBRMVZONSA-N 278.396 2.120 10 20 CECD C[C@@H]1C[C@H](NC[C@H](N)C2CC2)c2c(O)ccc(F)c21 817964678 DBTBCYLXXNJQFR-ZHAHWJHGSA-N 264.344 2.407 10 20 CECD COCCOC[C@H](C)NCc1cc(Cl)c(C)cc1O 825320281 HPOCFRBZFIBQRU-NSHDSACASA-N 287.787 2.495 10 20 CECD FCC(CF)NCc1ccc(N2CCOCC2)c(F)c1 824555571 VEKRQYFKURKFLL-UHFFFAOYSA-N 288.313 2.060 10 20 CECD COc1ccc(N(C)C[C@H]2CCNC(=O)CC2)cc1OC 827492738 YOMXYERFMIBCSU-GFCCVEGCSA-N 292.379 2.056 10 20 CECD O=C(O)[C@H]1CC12CCN(Cc1cccc(F)c1O)CC2 833771434 FLVNTWXUPMHESW-LLVKDONJSA-N 279.311 2.218 10 20 CECD CCCCCNC(=O)CN[C@@H](C)c1cc(OC)ccc1O 839540338 SZAFYBNYFDDQDD-LBPRGKRZSA-N 294.395 2.358 10 20 CECD Cc1cn2nc(NCCc3ccc(O)c(O)c3)sc2n1 749286828 BKSFSWOXKUKLDF-UHFFFAOYSA-N 290.348 2.165 10 20 CECD CC(=O)NCCN(C)Cc1ccc2ccccc2c1O 843428199 SEGZSJQYAGECBT-UHFFFAOYSA-N 272.348 2.113 10 20 CECD C[C@H]1CC2(CCOCC2)CN1C(=O)c1cc(O)cs1 844152942 CUBAGMWLHAUPTK-JTQLQIEISA-N 281.377 2.485 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCC[C@H]2CN)cc1F 841030953 PYTWKAJEYPIBEK-ZFWWWQNUSA-N 279.403 2.499 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)CC[S@@](C)=O 840939043 RPWBJCWPEKASRZ-BFUOFWGJSA-N 282.453 2.308 10 20 CECD CCC(CC)(CO)C(=O)NCc1ccc(N(C)C)cc1C 847500916 RGZZXBZXSWFZQJ-UHFFFAOYSA-N 292.423 2.476 10 20 CECD CNCCCC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 843486630 XWTVAEZKRKZPQL-UHFFFAOYSA-N 291.439 2.489 10 20 CECD CN[C@@H](C)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 848414425 MTVKJHQTWGNOHP-AWEZNQCLSA-N 289.423 2.147 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)C[C@H](C)O)c1O 846163032 KGXWMBKHWIZUAI-DCAQKATOSA-N 253.342 2.211 10 20 CECD COc1cccc([C@@H](C)NC[C@H]2CCCN2C)c1O 846142208 DFQJEPNWQLGGAU-VXGBXAGGSA-N 264.369 2.146 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1ccncn1 755367941 IBUYKUJIEGNGRO-UHFFFAOYSA-N 298.390 2.100 10 20 CECD N[C@]12CCC[C@H]1CN(Cc1cc(Cl)ccc1O)C2 857226166 GSDKSPAWYWWTLU-FZMZJTMJSA-N 266.772 2.359 10 20 CECD CON(C)C(=O)[C@H](C)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 858580195 XNBBJGTUWVJCSB-YWVKMMECSA-N 296.342 2.078 10 20 CECD Cc1ccc(O)c(CNC(=O)c2c[nH]nc2C2CC2)c1 862757506 WRPFXHSBUUXKKC-UHFFFAOYSA-N 271.320 2.231 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H](n2ccnc2)C1 769310586 IVOAOOJAUIEOJZ-CYBMUJFWSA-N 287.363 2.434 10 20 CECD N[C@H]1CC[C@H](C(=O)NCCCSc2nccs2)CC1 870886317 DDCOKISHTNGJQM-XYPYZODXSA-N 299.465 2.259 10 20 CECD Cc1cccc(O)c1CN1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 877565886 ALGKOVHWLGQQDP-RRCSTGOVSA-N 257.333 2.086 10 20 CECD CC[C@@]1(CO)CCCN(C(=O)c2cc(O)cs2)C1 779478886 FBPIEDUSQQVYLT-CYBMUJFWSA-N 269.366 2.078 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H]1c1ncc[nH]1 779548632 WMACOUXBJVULNG-RNZFLTOJSA-N 299.330 2.198 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](OC)C(C)C)c1 771416037 CEQSXDHCUOUVOJ-YGRLFVJLSA-N 281.352 2.249 10 20 CECD O=C(c1cc(O)cs1)N1CCC(NC2CCC2)CC1 889824203 BDEADBCFRIVBAN-UHFFFAOYSA-N 280.393 2.200 10 20 CECD CN[C@@H](CC(C)C)C(=O)N(C)Cc1ccc(N(C)C)cc1 884306005 POKJONRPJCQDJK-INIZCTEOSA-N 291.439 2.345 10 20 CECD CC(C)c1oncc1C(=O)NCc1ccccc1O 1123770953 XRUXMLXIOGFXBP-UHFFFAOYSA-N 260.293 2.434 10 20 CECD O=C1CC[C@H](C(=O)NCc2ccccc2O)n2cccc21 789996441 RSWRARRJKHVRFU-CYBMUJFWSA-N 284.315 2.028 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H]([C@@H](C)O)C2)c1O 894423535 TWGDOJXZDNZBFF-CHWSQXEVSA-N 279.380 2.302 10 20 CECD CC[C@H](NCC(=O)NCC1CC1)c1ccc(C)cc1O 794819362 VJFYTMLNFYLPDN-AWEZNQCLSA-N 276.380 2.268 10 20 CECD C[C@H](CC[S@](C)=O)NCc1c(O)ccc(Cl)c1F 790976681 LAXOSGXQYXKYGR-CVJBHZAOSA-N 293.791 2.431 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(C)=O)[C@@H]2C)cc1C 985871083 NQKAQSJAVKYXJJ-IUODEOHRSA-N 276.380 2.103 10 20 CECD COCCOC[C@H]1CCN(Cc2cc(C)ccc2O)C1 93755431 HZZINMXYKMZDNB-AWEZNQCLSA-N 279.380 2.186 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C)c2noc(C)n2)c1O 1323795836 BDUWOGTZDOKSPZ-ZETCQYMHSA-N 293.298 2.276 10 20 CECD COc1cccc(O)c1CNCC1(CO)CCCC1 769934357 BEMRRJFOXPSILJ-UHFFFAOYSA-N 265.353 2.043 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CCS[C@@H]2C)c1 1261457091 XMNAYAGBIRXAKI-SKDRFNHKSA-N 296.392 2.094 10 20 CECD C[C@@H](CC(=O)NCc1cccc(O)c1O)c1ccncc1 1349079209 MBRROQHZZJJFEH-NSHDSACASA-N 286.331 2.303 10 20 CECD O=C(/C=C\c1nccs1)NCc1ccccc1O 1519726023 OHYWLGRGNZFVCL-WAYWQWQTSA-N 260.318 2.178 10 20 CECD COc1nc(N(C)Cc2ccccc2O)ccc1C(=O)O 1610368794 INOZLXSILLKNJK-UHFFFAOYSA-N 288.303 2.130 10 20 CECD CNC[C@H]1CCCN(Cc2c(C)cc(OC)cc2O)C1 1578656080 DSDKEKYIWMNEBO-CYBMUJFWSA-N 278.396 2.141 10 20 CECD COc1ccc(CNC[C@@]2(C(=O)O)C[C@H]2C)cc1C 1777364074 KKOXZVZWGXNZDP-ABAIWWIYSA-N 263.337 2.204 10 20 CECD Cc1nn(C)cc1CNCc1cc(Cl)ccc1O 168693571 ZXSWKVCHUJEFHB-UHFFFAOYSA-N 265.744 2.377 10 20 CECD CC[C@H](C)CS(=O)(=O)N(C)Cc1ccccc1O 151260525 LSVUCDXKARQSLL-NSHDSACASA-N 271.382 2.200 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 156689378 KHHFQEYNAPNFDA-FZMZJTMJSA-N 274.364 2.196 10 20 CECD CC[C@H](OC1CCCC1)C(=O)NCc1ccc(O)c(O)c1 159065082 BDTDTXVVWRMLNE-HNNXBMFYSA-N 293.363 2.452 10 20 CECD CO[C@@H]1CCC[C@H](C(=O)NCc2ccccc2O)C1 815833403 LRGYXCXVOLKKAQ-WCQYABFASA-N 263.337 2.214 10 20 CECD COc1ccc(CNCCc2ccn(C)n2)cc1C 230882524 SQCQXOBSIFYREM-UHFFFAOYSA-N 259.353 2.069 10 20 CECD CC(C)COCCCNC(=O)Nc1ccc(N)cc1 232645247 VMJQHXNBTLYHAE-UHFFFAOYSA-N 265.357 2.453 10 20 CECD COc1ccc(CNC[C@](C)(O)C(F)(F)F)cc1C 270459330 FKYZMERGWQYBOQ-LBPRGKRZSA-N 277.286 2.407 10 20 CECD CC[C@]1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CCNC1 62894667 PQNLPUNIHHDIKH-KRWDZBQOSA-N 289.423 2.101 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1ccccc1F 20212953 IAPWMIZRWBKISH-UHFFFAOYSA-N 267.281 2.332 10 20 CECD Cc1ccc(C(=O)Nc2cccnc2N(C)C)c(O)c1O 182164601 GYINKGQZCZMIRM-UHFFFAOYSA-N 287.319 2.120 10 20 CECD CN(CCN1CCCC1=O)Cc1c(O)cccc1Cl 124199490 IMHKMLUZRUYBDS-UHFFFAOYSA-N 282.771 2.100 10 20 CECD CC1(C)CN(C(=O)Cc2ccc(N)cc2)CCS1 157101435 PTSQLKIYKDYKLQ-UHFFFAOYSA-N 264.394 2.165 10 20 CECD CN1CCC2(CCCN2Cc2ccccc2O)CC1 375510568 YMLPNHJEEYBWCB-UHFFFAOYSA-N 260.381 2.452 10 20 CECD Cn1nccc1NC(=O)NCc1ccc(N2CCCC2)cc1 185452486 HBWOHNOIHKBVKG-UHFFFAOYSA-N 299.378 2.342 10 20 CECD C[C@H](NCC1(C)OCCO1)c1cc(Cl)ccc1O 186211550 ADLFEIGXJJWJCP-VIFPVBQESA-N 271.744 2.459 10 20 CECD Cc1cccc(OC[C@H](O)CNCc2ccccc2O)c1 134227821 ULHQEXISGQXJJU-OAHLLOKOSA-N 287.359 2.230 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cnns1 195124156 RHNSAYHOCZMYFT-UHFFFAOYSA-N 277.349 2.296 10 20 CECD CN1CC[C@H]2[C@@H](CCCN2Cc2ccccc2O)C1 290565331 SQNQZWXDSZRNDV-ZFWWWQNUSA-N 260.381 2.308 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c(O)c1 529228376 NHZKEKPGQARFRF-OZWUEAAUSA-N 293.363 2.077 10 20 CECD COc1ccc(O)c(CNC[C@@H]2COC3(CCCC3)O2)c1 271874065 YSSXWWJJDLESEH-CQSZACIVSA-N 293.363 2.176 10 20 CECD CCN(CC)c1ccc(CNC(=O)NCCF)cc1 281924330 WHNYISQXRKHPEG-UHFFFAOYSA-N 267.348 2.302 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)CCCO1 281561714 KYLLAIAABVILOD-NSHDSACASA-N 279.336 2.047 10 20 CECD CC[C@@H]1C[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 280519715 AZCVRRYNFPMNKD-TZMCWYRMSA-N 261.369 2.350 10 20 CECD CC(C)(C)SCCNC(=O)c1c(F)ccc(O)c1O 295332850 UDZGWSDZESHHEF-UHFFFAOYSA-N 287.356 2.498 10 20 CECD COC[C@H](C)[C@@H](C)C(=O)N(C)Cc1ccccc1O 812475676 WRJGKEVRGWQAMH-NWDGAFQWSA-N 265.353 2.269 10 20 CECD C[C@H](N[C@@H]1CC12CCNCC2)c1ccc(F)cc1O 817976850 VMJRDQGTOOGJOC-IINYFYTJSA-N 264.344 2.324 10 20 CECD COCC1(CNCc2cc3c(cc2O)OCO3)CCCC1 825245429 JZMIKDFISUGZNB-UHFFFAOYSA-N 293.363 2.417 10 20 CECD COc1cccc(O)c1CN(C)Cc1nnc(C)s1 827800373 UGKYWYJPUVWPST-UHFFFAOYSA-N 279.365 2.193 10 20 CECD CN(Cc1cccc(Br)c1O)C1(CO)CC1 827904285 ZAHDICZLRHEGLS-UHFFFAOYSA-N 286.169 2.111 10 20 CECD CN(Cc1cc(Cl)ccc1O)CC(C)(C)CO 824629949 GTUACEKOFHLHCN-UHFFFAOYSA-N 257.761 2.496 10 20 CECD CCCCOCCCNC(=O)c1cc(O)cs1 731865257 MMUADHZNDQPEKK-UHFFFAOYSA-N 257.355 2.390 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H](F)C2)cc1 836223641 DEEJFZYEVAYUPB-LBPRGKRZSA-N 265.332 2.006 10 20 CECD CN(Cc1cccc(O)c1)C(=O)c1cc(O)cs1 732274554 VMQWRLKVIRSKRD-UHFFFAOYSA-N 263.318 2.432 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCCNC(=O)O 737021621 ZEORXXCOTLPQET-UHFFFAOYSA-N 294.351 2.179 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H]([C@H](C)N)C2)c1O 843353953 RUQGEWPQYLFFLR-JQWIXIFHSA-N 294.370 2.293 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@@]2(CCNC2)C1 843120487 NFUPXUPRHYIERC-CQSZACIVSA-N 284.762 2.370 10 20 CECD Cc1ccc(O)c([C@@H](C)NCc2nnn(C(C)(C)C)n2)c1 848560816 KVCKQDSYADWPKU-LLVKDONJSA-N 289.383 2.293 10 20 CECD CC[C@@H](O)CCN[C@H](C)c1cccc(OC)c1O 846151508 ZFYBBUYDDBJJDX-GHMZBOCLSA-N 253.342 2.212 10 20 CECD COCCC(=O)CSc1ncc(Cl)s1 850000113 JQHGLMXKDGYSHA-UHFFFAOYSA-N 251.760 2.494 10 20 CECD Cc1ccc(O)c(CNC(=O)NOC2CCCC2)c1 858347043 QXWJQNBUZPMYJO-UHFFFAOYSA-N 264.325 2.374 10 20 CECD CC[C@H](NCc1nc(C(N)=O)cs1)c1ccccc1O 850539595 DVXPRMBMRXCCHA-JTQLQIEISA-N 291.376 2.189 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCc1cn[nH]c1 863863047 FURVAZLBTFWVQC-UHFFFAOYSA-N 287.363 2.487 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2nnc(C)s2)c1 860284038 NMKAKCNUBBHRTG-UHFFFAOYSA-N 278.337 2.182 10 20 CECD COCCOC1CCN(Cc2c(C)cccc2O)CC1 876725751 PDHDSYRIOJEAEM-UHFFFAOYSA-N 279.380 2.328 10 20 CECD Cc1cccc(O)c1CN1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 877565887 ALGKOVHWLGQQDP-WMHQRMGPSA-N 257.333 2.086 10 20 CECD CCCOc1ccc(CN[C@@H]2CCN(C(C)=O)C2)cc1C 873140313 MGPLYCIZHJDUGB-MRXNPFEDSA-N 290.407 2.494 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)N[C@H](C)c1ccccc1O 879649032 JURGEQLKMRCNIW-IJLUTSLNSA-N 264.369 2.346 10 20 CECD Cn1ncc2c1CN(Cc1cc(Cl)cc(F)c1O)C2 877632906 QZSNOMPJLHWFBP-UHFFFAOYSA-N 281.718 2.434 10 20 CECD Cc1cc(C)c(O)c(CN(C)CC(=O)N2CCCC2)c1 874040459 BQTGTVIBPRNWKW-UHFFFAOYSA-N 276.380 2.063 10 20 CECD CO[C@@H](C(=O)NCCCSc1nccs1)C(C)C 771340683 GSGUVKZJNNCDIS-SNVBAGLBSA-N 288.438 2.413 10 20 CECD Cc1cc(Cn2cc(CCN)nn2)ccc1N1CCCCC1 881379783 ZBAXZVLVCNCYIJ-UHFFFAOYSA-N 299.422 2.126 10 20 CECD CCCCNC(=O)[C@H]1CCCN(Cc2ccc(N)cc2)C1 1120262827 FEIVSFVYAFOGGO-HNNXBMFYSA-N 289.423 2.397 10 20 CECD C[C@@H](Cn1ccnc1)N[C@@H](C)c1c(O)cccc1F 886503036 ZHSRCODBOIORME-QWRGUYRKSA-N 263.316 2.467 10 20 CECD COC[C@H](NCc1cc(C)c(C)cc1O)[C@H]1CCCO1 788534684 IEMHULIANNNXDB-GOEBONIOSA-N 279.380 2.293 10 20 CECD NC(=O)[C@@H]1[C@@H]2CCC[C@H]2CN1Cc1c(O)cccc1Cl 787423983 OPKQROCPRMGDAK-RBZYPMLTSA-N 294.782 2.131 10 20 CECD COc1ccc(CN2CCC[C@@H](OC)CC2)c(O)c1OC 893512731 WYOAKJBTSRGZEP-CYBMUJFWSA-N 295.379 2.410 10 20 CECD CCOCCOCCN(C)Cc1cc(F)cc(F)c1O 894537481 JKHCQJZOFSFFFI-UHFFFAOYSA-N 289.322 2.155 10 20 CECD CCOc1ccc(N2CCN(CC3(C)COC3)CC2)cc1 1207799626 GSZTYIRWINILII-UHFFFAOYSA-N 290.407 2.244 10 20 CECD CCN(CCCO)Cc1ccc(N2CCCC2)cc1 1319948734 RJDAAXHOOAYTHQ-UHFFFAOYSA-N 262.397 2.491 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H]2CCN(C(C)C)C2=O)c1 186047826 UQZWSFFMYJVVNK-JSGCOSHPSA-N 276.380 2.361 10 20 CECD C[C@@H](NCCOC[C@@H]1CCCO1)c1cc(F)ccc1O 756583063 MMTCXSJRCZIZRC-YPMHNXCESA-N 283.343 2.378 10 20 CECD C[C@H]1CN(C)[C@H](C)CN1Cc1cc(F)ccc1O 775988535 YRJYZZSSQILFQT-MNOVXSKESA-N 252.333 2.056 10 20 CECD CO[C@H](CNC(=O)NCc1ccc(N)cc1)C1CCCC1 1346513240 KYBHIQRYANCJHX-OAHLLOKOSA-N 291.395 2.273 10 20 CECD CN1CCN(c2ccc(CNC3CC=CC3)cc2F)CC1 1346156968 RVHZIOHOIHXELT-UHFFFAOYSA-N 289.398 2.386 10 20 CECD CC[C@@H](C(=O)O)N1CCCc2ccc(N(C)C)cc2C1 1776682273 ASBKUTZFYLRCAK-HNNXBMFYSA-N 276.380 2.364 10 20 CECD C[C@H]1CC[C@](NCc2cc(F)cc(F)c2O)(C(=O)O)C1 1776628573 JIIGSWXUFHLPGY-RMLUDKJBSA-N 285.290 2.403 10 20 CECD COc1ccccc1CNC(=O)/C=C\c1ccc(O)c(O)c1 206517705 MBFUFMRRDBQDEW-CLFYSBASSA-N 299.326 2.436 10 20 CECD COc1cc(CN2CCC[C@@H](OC)C2)c(O)cc1C 160126238 LVYYKLYJKCGMLI-CYBMUJFWSA-N 265.353 2.320 10 20 CECD CC(C)[C@H](C)CC(=O)NCCc1ccc(O)c(O)c1 156645116 BXLSNFAJGQGGPY-LLVKDONJSA-N 265.353 2.439 10 20 CECD COC(=O)C1(CNCc2ccc(OC)c(C)c2)CC1 258994223 NGWIFROBIQOESX-UHFFFAOYSA-N 263.337 2.046 10 20 CECD O=[N+]([O-])c1ccc(NCCc2ccc(O)c(O)c2)cn1 811810753 AGEAOWOGOHVLDF-UHFFFAOYSA-N 275.264 2.056 10 20 CECD CN1CC=C(CNCc2cccc(Cl)c2O)CC1 271765109 AGEJTFQPCFRLOO-UHFFFAOYSA-N 266.772 2.397 10 20 CECD C[C@@H]1O[C@H](C)C[C@H]1CNCc1cc(F)ccc1O 686507314 SDHNFHQCXZGETN-VWYCJHECSA-N 253.317 2.434 10 20 CECD CC(C)[C@H](CO)CN[C@H](C)c1ccc(F)cc1O 394044442 HXLJACSHLFCPRM-MNOVXSKESA-N 255.333 2.446 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](C)C(N)=O)c2C)c1 53394535 YHWTZILCNPXDEP-LBPRGKRZSA-N 299.374 2.006 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 115280839 KVYOBTARKGBLHD-OAGGEKHMSA-N 288.391 2.245 10 20 CECD COc1ccc(N(C)CC[C@H]2CCOC2=O)cc1F 121686177 BUFDQQOCVGNHIH-JTQLQIEISA-N 267.300 2.224 10 20 CECD Cc1cc(S(=O)(=O)Nc2ccc(O)cc2)c(C)o1 182419238 WUJPHLJPNFAIPI-UHFFFAOYSA-N 267.306 2.403 10 20 CECD COc1cc(O)c(CNCCc2ccco2)cc1OC 123565486 VBNAJWQSVIKOHV-UHFFFAOYSA-N 277.320 2.335 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](C)COC 79116194 LDGGMCDSNYMQKX-CYBMUJFWSA-N 293.411 2.319 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 181125510 RRRZHLZDBLXXKV-LXSSAFMLSA-N 293.363 2.431 10 20 CECD Cc1nnc2ccc(NCc3ccc(N(C)C)cc3)nn12 77292737 LGLNMMZHVVIIRV-UHFFFAOYSA-N 282.351 2.111 10 20 CECD Cc1cc(C(=O)NCCC(=O)O)c(C)n1-c1ccccc1 237582239 WNZDEOQNQMPHLJ-UHFFFAOYSA-N 286.331 2.299 10 20 CECD C[C@H](NCC1(C(N)=O)CCCC1)c1ccc(F)cc1O 273607405 UQHMDLWHUWDKNM-JTQLQIEISA-N 280.343 2.228 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CCCCO2)c(O)c1O 272890638 ARECRYSGVTWLHF-JQWIXIFHSA-N 279.336 2.094 10 20 CECD CC[C@H](NC[C@@H](CO)[C@H]1CCOC1)c1ccc(C)cc1O 280888531 OVYRROWTAUOJKB-DZKIICNBSA-N 293.407 2.386 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@@H](C2CC2)O1 280502512 GGJYRRRXMVHYFK-HWPZZCPQSA-N 291.347 2.120 10 20 CECD CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@H](C)[S@]1=O 289831912 UGWDDIDKMGUPBM-BBEJJTJUSA-N 281.421 2.432 10 20 CECD COc1ccc(O)c(CNS(=O)(=O)CCC2CCC2)c1 809820475 YZAUALIWYYVWDZ-UHFFFAOYSA-N 299.392 2.010 10 20 CECD CN(C)c1ccc(CNCc2nc(C3CC3)n[nH]2)cc1 294803749 NCNBWJJCWLGSQP-UHFFFAOYSA-N 271.368 2.038 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2ccc(C)cc2O)n1 818344230 AJLPJFGPDNWEEM-LLVKDONJSA-N 274.368 2.471 10 20 CECD NC[C@@H](N[C@H]1CCc2cccc(O)c21)C1CCCC1 817981689 MPTMIPQYBZEZLJ-UONOGXRCSA-N 260.381 2.487 10 20 CECD CCn1nc(C)c(CNCc2cc(Cl)c(F)cc2O)n1 822494888 XFJZKWMEQSXADG-UHFFFAOYSA-N 298.749 2.394 10 20 CECD Cc1ncsc1/C=C\C(=O)N1CCCc2n[nH]cc21 493607756 AXDCZEOPNZNMDM-PLNGDYQASA-N 274.349 2.167 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]2CC(=O)O)c1O 833401448 UKBMUNMSFBGIFR-GFCCVEGCSA-N 295.310 2.173 10 20 CECD Cc1ccc(O)c(CNCc2ccc(-c3nn[nH]n3)cc2)c1 737363937 HCWQXGOENWGQAI-UHFFFAOYSA-N 295.346 2.171 10 20 CECD Cc1cccc2c1C(=O)N[C@H](c1cc(C(=O)O)ccc1O)N2 738747002 CDWDGTGKFFNGRM-CQSZACIVSA-N 298.298 2.253 10 20 CECD CCN(C)C(=O)CN(C)Cc1ccc(N(CC)CC)cc1 746650780 JFVUBBNJQZCZDE-UHFFFAOYSA-N 291.439 2.443 10 20 CECD CCn1cc(CN[C@H](C)c2cccc(OC)c2O)cn1 846152219 QMRUDENGCGUSAI-LLVKDONJSA-N 275.352 2.468 10 20 CECD CCCNCCNCc1cc(Cl)cc(F)c1O 841046686 LNCMKJPXUPTVLP-UHFFFAOYSA-N 260.740 2.274 10 20 CECD O=C(Nc1cnn(CC(F)F)c1)c1cc(O)cs1 741287184 OWGSUJUPOMBTRS-UHFFFAOYSA-N 273.264 2.168 10 20 CECD Cc1cc(C(=O)N[C@H]2CO[C@@H](C)C2)c(C)n1-c1ccccn1 844108326 VCDNPVAYJMPQLL-GXTWGEPZSA-N 299.374 2.396 10 20 CECD CC[C@@H](CO)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840554343 GGRMJLVLWDKRJG-KGLIPLIRSA-N 292.423 2.127 10 20 CECD C[C@H](NC[C@@H]1CNC(=O)C1)c1cc2c(cc1O)CCCC2 840834649 YZEVLBDOJIMMES-NWDGAFQWSA-N 288.391 2.058 10 20 CECD CCOc1ccc(CN[C@H]2CCOC[C@H]2OCC)c(O)c1 759172289 HLMKIUAHHDRULP-GOEBONIOSA-N 295.379 2.075 10 20 CECD C[C@H](NC(=O)c1ccc[nH]1)c1ccc(N2CCOCC2)cc1 920888545 PJGPOBQNUAKLRL-ZDUSSCGKSA-N 299.374 2.342 10 20 CECD CON(C)C(=O)[C@H](C)N[C@H](C)c1ccc(Cl)cc1O 858580601 SDQPENXAWJJVPT-BDAKNGLRSA-N 286.759 2.105 10 20 CECD Cc1ccn(C[C@@H](C)C(=O)Nc2ccc(N)cc2)n1 867965982 KRXLWDPORMQWDJ-SNVBAGLBSA-N 258.325 2.049 10 20 CECD C[C@@H]1C[C@H](C(=O)N(C)Cc2ccccc2O)CCC1=O 763911996 ZYAYRMKTSXLKSG-VXGBXAGGSA-N 275.348 2.356 10 20 CECD CCCN(Cc1cc2c(cc1O)OC[C@H]2O)CC(F)F 768443079 AGIYMZRWLQIPON-GFCCVEGCSA-N 287.306 2.295 10 20 CECD CCO[C@H](CC)C(=O)N(C)Cc1ccccc1O 769281470 DZIWQFDVGJFNOX-CYBMUJFWSA-N 251.326 2.166 10 20 CECD O=C(NCc1ccccc1O)c1coc(C2CC2)n1 777273293 ANQHMNLZNWVBLN-UHFFFAOYSA-N 258.277 2.188 10 20 CECD CC[C@]1(CO)CCCN(C(=O)c2cc(O)cs2)C1 779478887 FBPIEDUSQQVYLT-ZDUSSCGKSA-N 269.366 2.078 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@H]1O 770380095 LJKHXJOSKWXAJB-TVQRCGJNSA-N 255.745 2.248 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(C)C1)c1cc(Cl)ccc1O 775500937 MJLMXDUCKIMGIT-ZYHUDNBSSA-N 282.771 2.317 10 20 CECD CN(C)c1ccc(CN[C@@H](CCO)C(F)(F)F)cc1F 886371250 HUXYADAGPGGXAX-LBPRGKRZSA-N 294.292 2.295 10 20 CECD COC[C@H](N[C@@H](C)c1ccc(F)cc1O)[C@H]1CCCO1 788619616 QKBVQESWRIQOOK-VZJVUDMVSA-N 283.343 2.376 10 20 CECD CN(C)c1ccc(CNC(=O)NC/C=C\Cl)cc1F 892488600 QWGLGDQHAZCENR-UTCJRWHESA-N 285.750 2.443 10 20 CECD CCC[C@H](CCO)NCc1ccc(N(C)C)cc1 716889115 XSWDKRCVGKSNJX-CQSZACIVSA-N 250.386 2.393 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CO)CC(F)F)c1 717811249 LUIFUIKSSPRGJT-BDAKNGLRSA-N 275.295 2.068 10 20 CECD CCN(Cc1c(O)cccc1OC)C[C@H]1CCCO1 769030965 ZBRQSRWLOSLRPU-GFCCVEGCSA-N 265.353 2.402 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](C)C[C@H]2C(=O)O)c1 1607811156 LYVOZWUDRHDVRS-AAEUAGOBSA-N 263.337 2.386 10 20 CECD CS[C@H](C)CN[C@H](C)c1cc(C(=O)O)ccc1O 1610380022 CZTQOGYQAUKIDU-RKDXNWHRSA-N 269.366 2.493 10 20 CECD Nc1ccc(CCNC(=O)NC2(C3CC3)CCC2)cc1 1580443383 AGLVHRLBTBNHER-UHFFFAOYSA-N 273.380 2.443 10 20 CECD C[C@@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(O)c(O)c1 159140522 NLJMGVVJAIRXDI-ABAIWWIYSA-N 293.363 2.309 10 20 CECD Cn1ncc2c1CCC[C@H]2NCc1cc(F)ccc1O 226584568 WBXJWQVMYOROTK-CYBMUJFWSA-N 275.327 2.432 10 20 CECD Cc1cc(C(=O)NCc2ccccc2O)ccc1O 227041134 SNFIHQDTLYQFEK-UHFFFAOYSA-N 257.289 2.336 10 20 CECD CC[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)OC 311569657 QPULSWHFCBJIAK-SMDDNHRTSA-N 264.369 2.355 10 20 CECD CN(C)c1ccc(CN(CCC(=O)O)CC2CC2)cc1 717215863 ADUPYGUFTIHMFX-UHFFFAOYSA-N 276.380 2.439 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NCc1cc(F)ccc1O 388278592 KNCIOTGZYAIBOL-OTYXRUKQSA-N 253.317 2.434 10 20 CECD Cc1n[nH]c(C)c1CC(=O)N[C@H](C)c1ccccc1O 827922938 DYBQUYYUJVWWJZ-SECBINFHSA-N 273.336 2.152 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CC(=O)OC(C)(C)C 175031042 FLWXPOIRXGBXDW-UHFFFAOYSA-N 292.379 2.293 10 20 CECD COc1cccc(CNC(=O)Cc2ccsc2)c1O 105652925 CGFHWQCFTRXBMH-UHFFFAOYSA-N 277.345 2.321 10 20 CECD COc1ccc(CNCc2ccc(OC)c(O)c2)c(O)c1 171134463 BIFPHFHXOUHATG-UHFFFAOYSA-N 289.331 2.405 10 20 CECD CO[C@H](C)CN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 188107084 MTIOLXGPGOMBSG-CHWSQXEVSA-N 296.386 2.348 10 20 CECD CC[C@@H](N[C@@H](C)CCS(C)(=O)=O)c1ccccc1O 156382689 RAMRENSWCTXHIL-WCQYABFASA-N 285.409 2.256 10 20 CECD COc1cccc(CNC(=O)Nc2ccc(F)cn2)c1O 181858284 SGOLAJGLIIRPTP-UHFFFAOYSA-N 291.282 2.257 10 20 CECD COc1cccc(CNCc2ncc(Cl)n2C)c1O 263773282 DBTJLGTYJLSPEP-UHFFFAOYSA-N 281.743 2.078 10 20 CECD COC[C@H](CNCc1cc(Cl)cc(Cl)c1O)OC 227705630 CDRBQPASLUWAAE-JTQLQIEISA-N 294.178 2.450 10 20 CECD C[C@H](N)[C@H]1CCCN(Cc2cc(F)ccc2O)C1 220210955 PQRUVNYRNFZSGE-QWRGUYRKSA-N 252.333 2.091 10 20 CECD Oc1ccc(F)cc1CNc1ccc(-n2cnnn2)cc1 226561163 VSAOIBSPNHWJMV-UHFFFAOYSA-N 285.282 2.119 10 20 CECD Nc1ccc(NC(=O)[C@@H]2CC(=O)Nc3cc(F)ccc32)cc1 237988611 MAGOBFPVHVQGBA-CYBMUJFWSA-N 299.305 2.472 10 20 CECD CCn1ccnc(NCc2ccc(N(C)C)cc2C)c1=O 91011779 SFPBGQBFHHBLGJ-UHFFFAOYSA-N 286.379 2.250 10 20 CECD CN(C)c1ccc(CNC[C@](C)(O)c2ccco2)cc1F 266127249 BXXYIJGJLBZAHP-INIZCTEOSA-N 292.354 2.482 10 20 CECD CCCOc1ccc(CN(CC)CC(=O)OC)c(O)c1 271144084 GPRHRNLXQYKVOK-UHFFFAOYSA-N 281.352 2.176 10 20 CECD CN(C)c1ccc(CN2CCC[C@@]23CCOC3=O)cc1F 275137977 MXLSJSRCOCFOCZ-INIZCTEOSA-N 292.354 2.173 10 20 CECD CCC(CC)(CCO)NCc1cccc(OC)c1O 283082624 VTGNEOTXWBNAQJ-UHFFFAOYSA-N 267.369 2.432 10 20 CECD C[C@@H]1CN(Cc2ccccc2O)C[C@@]2(CCCOC2)O1 370712503 VUIRGGHNDLHSPW-CZUORRHYSA-N 277.364 2.162 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)C[C@@H](C(=O)O)C2)c1 817881988 SXBWLSFAVAUUHI-DGCLKSJQSA-N 293.363 2.334 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@@H]2CCNC2)c1O 817945231 XOXIXDMJNCOJSJ-MWLCHTKSSA-N 254.761 2.367 10 20 CECD COc1c(C)cnc(CNC(=O)Cc2ccc(N)cc2)c1C 827976966 XMMOMAMPMOVGIK-UHFFFAOYSA-N 299.374 2.148 10 20 CECD O=C(O[C@@H]1C[C@H]2CCCC[C@H]2NC1=O)c1cc(O)cs1 837516503 YOBUZSQZYYDSIC-FBIMIBRVSA-N 295.360 2.058 10 20 CECD Cc1cnc(CCNCc2cccc(C)c2O)cn1 835062468 VKXYKPIDOSRLFZ-UHFFFAOYSA-N 257.337 2.131 10 20 CECD Cc1ccc2c(c1)N(C(=O)/C=C\c1cnn(C)c1)CC2 746819280 RZKXXFULQAAXFI-XQRVVYSFSA-N 267.332 2.331 10 20 CECD Cc1cccc(N(C)C(=O)c2cnn3c2[C@@H](CN)CCC3)c1 592484111 KCHLGEVUWNBPQV-CYBMUJFWSA-N 298.390 2.304 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)cc2C)CC1 840908523 SFPPKPVSXTYLQR-UHFFFAOYSA-N 261.413 2.199 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CS[C@@H](C)C2)c1O 840958576 MVFZRZVMPHVVHY-WPRPVWTQSA-N 298.364 2.293 10 20 CECD CC[C@H]1CN(C(=O)c2cc(O)cs2)CCS1 743801425 OKFVFTRSMBHDAT-VIFPVBQESA-N 257.380 2.421 10 20 CECD C[C@H]1CN(Cc2c(O)ccc(Cl)c2F)[C@@H](C)CN1 843119704 CSLOZJINESPPBT-IUCAKERBSA-N 272.751 2.367 10 20 CECD c1csc(Sc2nnnn2C2CCCC2)n1 743356054 QSXZXTXVJGIZQF-UHFFFAOYSA-N 253.356 2.396 10 20 CECD CCc1cccc(CN[C@@H](CCO)C2CCOCC2)c1O 848902907 JMLXHHWNEZRVHI-INIZCTEOSA-N 293.407 2.222 10 20 CECD CC(C)n1ccc(NC(=O)NCCc2ccc(N)cc2)n1 841228145 FPNVZJNAEIYAFU-UHFFFAOYSA-N 287.367 2.410 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2C[C@@H]2C)cc1 754150438 RVTJYGZMRAUFHD-RYUDHWBXSA-N 263.337 2.331 10 20 CECD CCn1nccc1CNC(=O)N[C@H](C)c1ccccc1O 868792554 OESJEGPYLAVKQC-LLVKDONJSA-N 288.351 2.169 10 20 CECD Cc1ccc(O)c(CNC(=O)c2nnc(C(C)(C)C)o2)c1 866025401 IPBVWXNKMWVUBG-UHFFFAOYSA-N 289.335 2.311 10 20 CECD CCc1nncn1CCN[C@H](C)c1ccc(N(C)C)cc1 766312957 HULXMAOMVMCOBX-CYBMUJFWSA-N 287.411 2.257 10 20 CECD COc1ccc2c(c1)CCCN2CN1C[C@H](C)CC1=O 766342628 YFAGESXNXMEYPZ-GFCCVEGCSA-N 274.364 2.274 10 20 CECD COc1cc(Cl)cc(CN2CCc3c[nH]nc3C2)c1O 761203978 ZVMXHCUSDIYYLB-UHFFFAOYSA-N 293.754 2.336 10 20 CECD CCc1nnsc1C(=O)NCc1cc(C)ccc1O 862759732 KECJKHQKSJIVCA-UHFFFAOYSA-N 277.349 2.045 10 20 CECD COC[C@@H](C)NCc1cc(F)c(N(C)C)cc1F 1118909683 XHNNZMCFLZKYPV-SECBINFHSA-N 258.312 2.155 10 20 CECD Cc1csc(CCC(=O)NCc2ccc(O)c(O)c2)n1 768078564 IWGJOKIVLBXJGE-UHFFFAOYSA-N 292.360 2.112 10 20 CECD COC(=O)C[C@@H]1CSCCN1Cc1ccc(C)cc1O 876757366 CKSXTTHFHBDPKL-CYBMUJFWSA-N 295.404 2.181 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC1CC=CC1 875798102 MJYMJXNTJFZXGG-UHFFFAOYSA-N 260.337 2.500 10 20 CECD CC(C)(C)C(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 772773060 AXZUNFNEPVVYJT-ALCCZGGFSA-N 278.304 2.269 10 20 CECD C[C@@H](CCCO)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776159487 QNIALFVJMRNEEZ-STQMWFEESA-N 293.411 2.274 10 20 CECD C[C@@H](CCS(C)(=O)=O)N[C@@H](C)c1c(O)cccc1F 886541183 ROTGVAPVXGNQTF-UWVGGRQHSA-N 289.372 2.005 10 20 CECD CCOc1cccc(CN2CC[C@H](C(=O)OC)[C@@H]2C)c1O 787420296 GFAYYFAZOWNGHQ-AAEUAGOBSA-N 293.363 2.174 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C[C@@H]1C 895331941 CBOSTLQVOZYHQL-JOYOIKCWSA-N 299.317 2.301 10 20 CECD CC[C@H](C)[C@H](OC)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 793794987 AMXAEBRSAQVVRB-RWSFTLGLSA-N 295.379 2.206 10 20 CECD CCOc1cccc(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)c1O 792191864 CZDIVCHJFPWOAH-HRBWSGTNSA-N 297.420 2.132 10 20 CECD Nc1ccc(CN2CCCN(CC(F)(F)F)CC2)cc1 1337834325 POKVFOGQMRGTDC-UHFFFAOYSA-N 287.329 2.339 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)C[C@H](C)O1 92487377 MZLCGXNSFACEQF-WCQYABFASA-N 265.353 2.400 10 20 CECD Cc1cc(O)c(CN2C[C@H]3CC[C@H]2[C@H](O)C3)cc1C 1262056649 VZWLNDWITWZOAO-DUVNUKRYSA-N 261.365 2.354 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1261482824 ZVBQIYCEELBPEB-GDBMZVCRSA-N 273.424 2.456 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCOC3(CCC3)C2)cc1 1262578372 OLGQBEFFIUUVIC-CQSZACIVSA-N 289.379 2.170 10 20 CECD CO[C@@H]1C[C@H](NC(=O)NCc2ccc(N)cc2)C12CCC2 1353412888 CUTRPVAXBCVDDL-UONOGXRCSA-N 289.379 2.026 10 20 CECD Cc1cc(Sc2ncc(C(=O)O)s2)ncn1 1600303477 NNNAXAFVIMVDCS-UHFFFAOYSA-N 253.308 2.091 10 20 CECD O=C(O)c1cnc(SC[C@@H]2CCCOC2)s1 1602536665 DGJRQTWJFZDJJM-SSDOTTSWSA-N 259.352 2.360 10 20 CECD COc1cc(CN(C)[C@@H](C)CN)c(O)c(C(C)(C)C)c1 1579150318 GTQFMBWEXHSUJP-NSHDSACASA-N 280.412 2.477 10 20 CECD C[C@@H](NCCCn1ccnc1)c1cc(C(=O)O)ccc1O 1593268494 VREPLAKLFYBQJB-LLVKDONJSA-N 289.335 2.028 10 20 CECD COc1ccc(O)c(CNCC[C@H]2CCCN(C)C2)c1 839182815 PWFZXDQONMZANR-CYBMUJFWSA-N 278.396 2.222 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)[C@H]1OC 252782677 NMMGHTBSGUQCKX-BZUAXINKSA-N 278.396 2.035 10 20 CECD C[C@H](NCc1cnn(C)c1)c1ccc(N(C)C)cc1 41159269 SBVKDNDLBSFNCU-LBPRGKRZSA-N 258.369 2.337 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2CCCCS2(=O)=O)c(O)c1 694591105 RLFWRPMCWZGMAS-OLZOCXBDSA-N 297.420 2.319 10 20 CECD COc1cccc(CN2C[C@@H](C(=O)O)CC[C@@H]2C)c1O 397031574 LTVWCMNPYKBXLY-JQWIXIFHSA-N 279.336 2.086 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)[C@@H]1C[C@@H]1C(=O)O 1593293718 XHNBQBOTQMZDBA-SWPVVBRQSA-N 269.728 2.244 10 20 CECD COc1cccc(CNC(=O)[C@H]2CC=CCC2)c1O 68488739 LREMEZSQEAFXJM-NSHDSACASA-N 261.321 2.373 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCOC1 66942269 SWMANWQTVMTBHN-CQSZACIVSA-N 276.380 2.138 10 20 CECD Cc1ccc(O)c(CN(C)CC(=O)OC(C)(C)C)c1 126947688 CVFLKBIGPPFDGF-UHFFFAOYSA-N 265.353 2.474 10 20 CECD CS[C@@H](C)CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186381998 MDSXCULLDNMOSP-ZJUUUORDSA-N 283.393 2.287 10 20 CECD CCN(Cc1cccc(C)c1O)C[C@@H](O)C(F)(F)F 189862889 APMQVKMEGKVJPN-LLVKDONJSA-N 277.286 2.446 10 20 CECD CCOCCNC(=O)NCc1ccc(N(CC)CC)cc1 79970965 CYEUJSJNZBIGAB-UHFFFAOYSA-N 293.411 2.369 10 20 CECD CN(CCC(F)(F)F)C(=O)c1cccc(O)c1O 126458230 SQTGAZGSJONZPM-UHFFFAOYSA-N 263.215 2.122 10 20 CECD C[C@H](CC[S@@](C)=O)NCc1c(O)cccc1Cl 125477894 NDDVLVIBHHKFPX-XLFHBGCDSA-N 275.801 2.292 10 20 CECD CC[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 181180038 RXHHRUSWUVVCKP-MALLOTDXSA-N 261.321 2.370 10 20 CECD Cc1ccc(C(=O)N(C)C[C@@H]2CCCC[C@H]2O)c(O)c1O 183004956 XCZYSHINIRNKFF-WCQYABFASA-N 293.363 2.029 10 20 CECD C[C@@H](NC[C@@H]1CCCN1C)c1ccc(F)c(F)c1O 191221960 CIYKXKNFNWCAAV-ZJUUUORDSA-N 270.323 2.415 10 20 CECD C[C@H]1C[C@@H]1c1cc(NC(=O)c2cccc(O)c2O)[nH]n1 192993331 CIUNUGIXUQAUEJ-CBAPKCEASA-N 273.292 2.197 10 20 CECD Oc1cccc(Cl)c1CNCCOCC(F)F 231677218 OUVRYQBCCZRQSC-UHFFFAOYSA-N 265.687 2.417 10 20 CECD C[C@@H]1C(=O)CC[C@H]1CC(=O)N(C)Cc1ccccc1O 279726443 CGFLBMZVFQPNRH-RYUDHWBXSA-N 275.348 2.356 10 20 CECD Cc1ccc(O)c(CN2CCO[C@]3(CCO[C@H]3C)C2)c1 279709360 SHXYKRFMWVMQMO-XJKSGUPXSA-N 277.364 2.080 10 20 CECD Cc1ncc2n1CC[C@H](C(=O)N(C)Cc1ccccc1O)C2 289946893 UQXJSDKDSURSLD-ZDUSSCGKSA-N 299.374 2.118 10 20 CECD Cc1cc(C)c([C@@H](C)NCCS(=O)(=O)C(C)C)c(O)c1 294295166 MZPJSJXNCPPPPY-CYBMUJFWSA-N 299.436 2.483 10 20 CECD CSC[C@@H](O)CNc1ccccc1OCC(F)F 819459991 DBKWRXPKXYMEHM-VIFPVBQESA-N 277.336 2.466 10 20 CECD C[C@H](N)C[C@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 817891451 KLWQLXVBCOAMGD-SOUVJXGZSA-N 291.439 2.300 10 20 CECD CCOC(=O)[C@@H]1CCCCN1C(=O)c1cc(O)cs1 824776009 DNVQJEHNMRNUMX-JTQLQIEISA-N 283.349 2.012 10 20 CECD CCn1cc(CNCc2cc(Cl)c(C)cc2O)nn1 827088042 YYDGNVKFSNWDKM-UHFFFAOYSA-N 280.759 2.255 10 20 CECD Cc1cccc(CN(C)C(=O)c2cc(O)cs2)n1 741286505 VXRIEGXLEKUYSH-UHFFFAOYSA-N 262.334 2.429 10 20 CECD C[C@@]1(C(=O)NCc2cc(Cl)ccc2O)CCCOC1 846473144 JNGUXDNDCKIAPC-CQSZACIVSA-N 283.755 2.479 10 20 CECD COC[C@H](CC(C)C)NC[C@@H](N)c1ccc(N(C)C)cc1 841045917 SQQATQOLHWBISW-DOTOQJQBSA-N 293.455 2.403 10 20 CECD Cc1cc(N(C)C)ccc1CNCCN(C)C(C)C 840932008 BLBHKCPPBBCBLP-UHFFFAOYSA-N 263.429 2.491 10 20 CECD COc1ccc(N(C)CCN(C)CCC[C@H](C)O)cc1 844402979 YPYKBVSWOSJFMQ-AWEZNQCLSA-N 280.412 2.224 10 20 CECD CCOc1ccc(CN2CC[C@H](N)C[C@H]2C)c(O)c1 846699701 VVZUCDTVXGHNJA-YPMHNXCESA-N 264.369 2.103 10 20 CECD CNC[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843044041 ARXMFNYZVWCLFR-CQSZACIVSA-N 279.403 2.323 10 20 CECD C[C@@H]1C[C@H](NCc2c(O)cccc2Cl)CCN1 841061605 LNLHBYBOGBKJGO-NXEZZACHSA-N 254.761 2.276 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC[C@@H]1CCCCO1 844925939 SBRAWVRSNGRBKH-LBPRGKRZSA-N 298.770 2.414 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@H](C)c1cc(C)ccc1O 756775462 QPHDNDCCRQMSAI-YRGRVCCFSA-N 276.380 2.266 10 20 CECD COc1ccc2nc(-c3cc(O)c(O)c(OC)c3)[nH]c2n1 758488322 FZWRVUHFFXBVQD-UHFFFAOYSA-N 287.275 2.053 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCc2n[nH]cc2C1 857878257 VWPYFNASCFHVQA-UHFFFAOYSA-N 281.718 2.466 10 20 CECD COc1ccc(N(C)CCN(C)c2cc(F)ncn2)cc1 853711527 FKLGHZLKWQAOOV-UHFFFAOYSA-N 290.342 2.197 10 20 CECD CCn1cc(CN[C@H](C)c2cc(F)cc(F)c2O)nn1 850522344 OVFJTOGZIVJXMU-MRVPVSSYSA-N 282.294 2.133 10 20 CECD CCn1cnnc1CCN[C@@H](C)c1cc(C)ccc1O 756734734 ZWWDDNDUCQSSKR-LBPRGKRZSA-N 274.368 2.205 10 20 CECD C[C@@H](NCC1(N)CCCC1)c1ccc(F)cc1O 854222687 KHCRNLWBJKECKU-SNVBAGLBSA-N 252.333 2.453 10 20 CECD Nc1ccc(CCNC(=O)OCC(F)(F)F)cc1 850587210 RYKQUYOOMFDZQE-UHFFFAOYSA-N 262.231 2.100 10 20 CECD Cc1ccccc1C(=O)COC(=O)c1cccc(O)c1O 758548404 SGQJKPNDRMVZPO-UHFFFAOYSA-N 286.283 2.446 10 20 CECD CCC[C@@H]1CN(C(=O)c2cc(O)cs2)CCO1 760889985 FDLRPZWOVLLMCW-SNVBAGLBSA-N 255.339 2.095 10 20 CECD CCCn1cc(CNCCCSc2nccs2)nn1 865468351 GRQSSLVDPPJJTE-UHFFFAOYSA-N 297.453 2.417 10 20 CECD O=C(N[C@@H](CCO)c1ccccc1)c1cc(O)cs1 764836277 BNGWTDLBARPFOE-LBPRGKRZSA-N 277.345 2.307 10 20 CECD Cc1cccc(O)c1CNCCCOC1CCOCC1 877054388 HOYWZKACJARVBW-UHFFFAOYSA-N 279.380 2.376 10 20 CECD Cc1ncc([C@@H](C)NC(=O)Cc2ccc(N)cc2)s1 877193443 DFYKLCOOUZPTAC-SECBINFHSA-N 275.377 2.454 10 20 CECD Cc1ccc(CN2CCC[C@@H]2c2nncn2C)c(O)c1 876782685 YXKBDXUEYCUOAL-CYBMUJFWSA-N 272.352 2.166 10 20 CECD Cc1ccc(CNCC(C)(C)[C@@]2(O)CCCOC2)c(O)c1 877637256 GMCLRRGYDVDYMU-QGZVFWFLSA-N 293.407 2.358 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](C)n2cccc2)c1 1118909808 AKRKXEZMESEGDB-GFCCVEGCSA-N 258.321 2.380 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cncc2ncnn12 782952959 QCELHDHDXPNRLN-UHFFFAOYSA-N 282.351 2.111 10 20 CECD COc1cccc(CN2CC[C@H](C)C[C@H]2[C@H](C)O)c1O 785988841 PLKQVJOIMRGUDQ-OBJOEFQTSA-N 279.380 2.382 10 20 CECD COCC[C@@H](CO)NCc1ccc2ccccc2c1O 894656659 UBIHVXHNSRTKIP-AWEZNQCLSA-N 275.348 2.032 10 20 CECD CC[C@H]1CN(Cc2ccc(OC)c(OC)c2O)CCCO1 894242995 BFGSYSHUBGJMGS-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD CCC1(NCc2ccc(OC)c(OC)c2O)CCOCC1 893387548 FSDHNKVBWONFJZ-UHFFFAOYSA-N 295.379 2.458 10 20 CECD CO[C@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C1CC1 791720366 NDSBGTPUJONCPS-ABAIWWIYSA-N 276.380 2.355 10 20 CECD COc1cc(C)cc(CNC(C)(C)c2cnn(C)c2)c1O 894268130 ATCRPMQUZYBHQH-UHFFFAOYSA-N 289.379 2.468 10 20 CECD COc1ccc(CNC(=O)NC[C@H](C)C2CC2)c(O)c1 792917969 NOMMHURESHQCGI-JTQLQIEISA-N 278.352 2.246 10 20 CECD COCCCNCc1cc(Cl)cc(OC)c1O 76274277 FVPCHUICOCFACF-UHFFFAOYSA-N 259.733 2.180 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCN2CCCC[C@@H]12 708481627 RWSXYHXSFWCBFA-KBPBESRZSA-N 282.334 2.387 10 20 CECD CCc1cccc(CN(C)C[C@@H]2CCCN2C)c1O 692129051 HZNBUIFSGUJAIR-HNNXBMFYSA-N 262.397 2.481 10 20 CECD O=C(O)[C@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 1606016037 QTNFRAVZCRAXBF-ZETCQYMHSA-N 273.691 2.091 10 20 CECD Cc1cc(CN[C@@](C)(CCF)C(=O)O)ccc1N(C)C 1600205077 NCOOYTQDHNFOKM-HNNXBMFYSA-N 282.359 2.354 10 20 CECD CN1C(=O)c2ccccc2[C@@H]1CNCc1ccc(N)cc1 1578516145 YTCVNLBHWNDCIG-INIZCTEOSA-N 281.359 2.185 10 20 CECD COc1cc(C)c(CN2CCC[C@@H]2CC(=O)O)c(O)c1 1599391163 IXOBSPXUTCLFKV-LLVKDONJSA-N 279.336 2.148 10 20 CECD CC[C@@H](NCC1CC1)c1cccc(-c2nn[nH]n2)c1O 1590466685 LTKWJNZGGDURAW-GFCCVEGCSA-N 273.340 2.023 10 20 CECD COc1cc(CN2CC[C@](C)(C(=O)O)C2)c(O)cc1C 1594056197 GWQXIJSOFSCGKA-HNNXBMFYSA-N 279.336 2.006 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCCN1C)c1ccccc1O 827936937 HHXXRBLQNPCBOT-YPMHNXCESA-N 262.353 2.054 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCC[C@@H](O)C2)c1 224866279 AVSDOPVGTILFLW-DGCLKSJQSA-N 265.353 2.042 10 20 CECD Oc1ccc(F)cc1CNC1CCN(C2CC2)CC1 226583690 GZDJXCLOEXSFDA-UHFFFAOYSA-N 264.344 2.248 10 20 CECD CCOc1cccc(CNCCC(C)(C)CO)c1O 294915874 YJWSFZMUGXBIJJ-UHFFFAOYSA-N 267.369 2.289 10 20 CECD CC1(C)CN(Cc2cc3c(cc2O)OCO3)CCCO1 313237953 UVJUPPWAIHFSNW-UHFFFAOYSA-N 279.336 2.122 10 20 CECD OC[C@@H](C[C@H]1CCCO1)NCc1cccc(Cl)c1O 895747916 JIYRVDLMPJOPAD-VXGBXAGGSA-N 285.771 2.065 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](C(=O)O)C2)cc1 3749776 DNHUHXWLFCLYDZ-ZDUSSCGKSA-N 262.353 2.049 10 20 CECD O=C(NCCCSc1nccs1)c1ccc(O)nc1 114376002 IRFYTZMEVQBGMX-UHFFFAOYSA-N 295.389 2.156 10 20 CECD CCC(O)(CC)CNCc1ccc(N2CCOCC2)cc1 69160705 KRMNYLGTVSGECU-UHFFFAOYSA-N 292.423 2.164 10 20 CECD CCCc1cc(C(=O)NCc2ccc(N(C)C)cc2)[nH]n1 29963945 QNGSVIIUAHPHLO-UHFFFAOYSA-N 286.379 2.358 10 20 CECD CC(C)CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183481186 YBLHBJBOLMDQSH-JTQLQIEISA-N 251.326 2.191 10 20 CECD CC(C)COC[C@H](O)CN[C@H](C)c1ccc(F)cc1O 185116989 OTZQTMLLTLWDGV-DGCLKSJQSA-N 285.359 2.215 10 20 CECD CCCN(CC(=O)NC)Cc1cccc(Cl)c1O 124564064 VFMRGIRZDBJWKV-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CCC[C@](C)(O)C(=O)NCc1ccc(N(C)C)c(F)c1 124527259 BQMKMWWMQIRFBJ-HNNXBMFYSA-N 282.359 2.059 10 20 CECD CC(C)C[C@H]1C(=O)NCCN1Cc1cccc(Cl)c1O 188918375 WZCVOAPYSPTTCA-ZDUSSCGKSA-N 296.798 2.392 10 20 CECD COC[C@@H](NCc1cc([N+](=O)[O-])ccc1O)c1ccco1 80263249 HFSKRQMGVAMFSB-GFCCVEGCSA-N 292.291 2.371 10 20 CECD C[C@@H]1C[C@H](NCc2cc(F)ccc2O)CCN1C 226612781 WRGSLHMGTXPBLZ-ZWNOBZJWSA-N 252.333 2.104 10 20 CECD CC[C@@]1(C(=O)O)CCCN(Cc2cc(OC)ccc2O)C1 86784860 BWMYWDFEBGNQDA-MRXNPFEDSA-N 293.363 2.478 10 20 CECD COc1cccc(CN(C)[C@H]2CCSC2)c1O 130587982 FKULEOPDTJDUIW-NSHDSACASA-N 253.367 2.338 10 20 CECD Cn1cc(CCCN[C@H]2CCc3cccc(O)c32)cn1 297625531 JBLKIXVNRHNMTB-AWEZNQCLSA-N 271.364 2.335 10 20 CECD COc1ccc(CNC(=O)c2conc2C(C)C)c(O)c1 529230352 VNYNDIOHAXRWAP-UHFFFAOYSA-N 290.319 2.442 10 20 CECD COCC[C@H](C)N1CCN(c2ccc(OC)c(F)c2)CC1 268013105 SBRHIAOHKOAQCM-ZDUSSCGKSA-N 296.386 2.381 10 20 CECD Cc1cccc(CN2C[C@@H](C)O[C@]3(CCCOC3)C2)c1O 366489495 POGFJUPFLHSUOD-RHSMWYFYSA-N 291.391 2.471 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C)[S@@](=O)CC2)c1 277456239 KEZDFROAYHEYNS-YUNKPMOVSA-N 297.420 2.134 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@H](C)c1ccc(F)c(F)c1O 276896451 IIGAOVKVBSVUIF-IXGDSRDXSA-N 291.363 2.478 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1ccc(C)c(C)c1O 273544110 ZANZIHCMVYALFP-LBPRGKRZSA-N 278.396 2.432 10 20 CECD C[C@@H](O)CNCc1ccc(N(C)C)cc1C(F)(F)F 280069957 XNUKIEZREFFCIE-SECBINFHSA-N 276.302 2.242 10 20 CECD CN(Cc1ncnn1C(C)(C)C)c1ccc2c(c1)OCO2 283238859 UQEVVRJKJXJEDK-UHFFFAOYSA-N 288.351 2.398 10 20 CECD CC1(C)CC[C@H](COC(=O)c2cccc(O)c2O)O1 803439645 FSMYAOOKBRYJFZ-SECBINFHSA-N 266.293 2.212 10 20 CECD C[C@H](NCCN1CCC(O)CC1)c1cc(Cl)ccc1O 295813800 BGCRITFDLWGYRF-NSHDSACASA-N 298.814 2.153 10 20 CECD CCC(C)(C)CNC(=O)c1c(F)ccc(O)c1O 296965272 YMPWCNMQOFHZIO-UHFFFAOYSA-N 255.289 2.403 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H](CCO)CC1 817418971 MURNBSJGNDMAEH-CYBMUJFWSA-N 279.380 2.385 10 20 CECD COc1ccc(N2CC[C@@H](CNc3ncccn3)C2)cc1 819936718 VTZAHHBJQPZWFD-ZDUSSCGKSA-N 284.363 2.424 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)[C@H](C)N 818608176 QIBGHBLIPDKBRH-KBPBESRZSA-N 291.439 2.473 10 20 CECD CCN(C)C(=O)CNCc1ccc2ccccc2c1O 816573820 MILKCDUFTBDBSX-UHFFFAOYSA-N 272.348 2.113 10 20 CECD OCC[C@H](NCc1cc(Cl)c(F)cc1O)C1CC1 816553073 HWGDIRXKCKUHAS-LBPRGKRZSA-N 273.735 2.435 10 20 CECD Cc1cc(CN[C@H]2CCCC[C@@H]2C(N)=O)ccc1N(C)C 815089360 DARCBXKLVLQAAC-GJZGRUSLSA-N 289.423 2.195 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)NC(C)C)C2)cc1 818049403 YPCZONOAOKCQQP-ZDUSSCGKSA-N 291.395 2.229 10 20 CECD CC(C)N1CCC(N(C)C(=O)c2cc(O)cs2)CC1 820546794 QZBXQARGZOCMOD-UHFFFAOYSA-N 282.409 2.399 10 20 CECD Oc1c(Cl)cccc1CN(C1CC1)C1COC1 824472231 NRJVRMFYPSLPQX-UHFFFAOYSA-N 253.729 2.409 10 20 CECD CCn1nc(C2CC2)cc1C(=O)NCCc1ccc(N)cc1 911782288 HLPWWKMUIRGTDT-UHFFFAOYSA-N 298.390 2.335 10 20 CECD CC[C@@H]1CCCN1CC(=O)NCc1ccc(N(C)C)cc1 839480264 QDVMMFVFPITVPW-OAHLLOKOSA-N 289.423 2.243 10 20 CECD CO[C@H](C)CCNC(=O)NCc1ccc(N(C)C)cc1C 734526702 IMDRRXSPXQRAHP-CYBMUJFWSA-N 293.411 2.285 10 20 CECD COC1([C@H](C)NCc2ccccc2O)CCOCC1 834555007 JPEAGTYGXRGKFL-LBPRGKRZSA-N 265.353 2.066 10 20 CECD CCOc1ccc(CNC(C)(C)CN(C)C)c(O)c1 835070635 UIUOPMXPVNWPTM-UHFFFAOYSA-N 266.385 2.221 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCNc1ncccn1 840928971 CXGGREXXWASQDO-UHFFFAOYSA-N 299.422 2.443 10 20 CECD CSCCCOC(=O)c1ccc(C)c(O)c1O 744910512 QFYAYRQCQWGYML-UHFFFAOYSA-N 256.323 2.316 10 20 CECD Cc1ccc(C(=O)N2CC[C@H](c3cccnc3)C2)c(O)c1O 843968892 UYTNMCYNRKAMML-ZDUSSCGKSA-N 298.342 2.431 10 20 CECD Cc1cc(Br)cc(CNC[C@H](C)CN)c1O 841048483 JFYVOBJXHZJDCJ-MRVPVSSYSA-N 287.201 2.148 10 20 CECD CC[C@H](NC(=O)NCCc1ccc(N)cc1)[C@H]1CCCO1 841865400 RJGCSWZIJQNDSY-LSDHHAIUSA-N 291.395 2.068 10 20 CECD CC(C)N1CCC(NCCc2ccc(N)cc2)CC1 841036547 UYMPZKYMHXAEMN-UHFFFAOYSA-N 261.413 2.274 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[S@](=O)[C@H](C)[C@H]1C 840917410 JXYRZYAGYHGHSZ-JZKQVHKSSA-N 294.464 2.402 10 20 CECD CC[C@@H](NCCN(C)OC)c1ccc(N(C)C)cc1 850479914 FYLNWRJBZXUGHB-OAHLLOKOSA-N 265.401 2.287 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCOC[C@H]2C)c(O)c1C 756534462 KVQLKUZPKTXBFG-UKRRQHHQSA-N 292.423 2.380 10 20 CECD CC(C)(C)OCCCOC(=O)c1cccc(O)c1O 758547296 JNXJZUJIBMEGDE-UHFFFAOYSA-N 268.309 2.460 10 20 CECD CC(C)N1C[C@H](NCc2ccc3c(c2)CCCO3)CC1=O 921762788 JRAZBFMSCQJXTK-OAHLLOKOSA-N 288.391 2.111 10 20 CECD CN(C)c1ccc(CNC(=O)NCCc2ccoc2)cc1 852560112 OUTUMXIHQGOBJW-UHFFFAOYSA-N 287.363 2.388 10 20 CECD COc1cc(N2CC[C@@H]3C[C@@H]3C2)c([N+](=O)[O-])cc1OC 853901754 JPINZUUHLKRSDL-NXEZZACHSA-N 278.308 2.458 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C[C@@H]1COC(C)(C)O1 851880575 DOORTYZVCBEUOE-CYBMUJFWSA-N 292.379 2.103 10 20 CECD C[C@@H](N[C@@H](CCO)C1CCOCC1)c1ccccc1O 763558442 PNICNWADXJXHPG-DOMZBBRYSA-N 279.380 2.220 10 20 CECD COCCN(C(=O)NCc1ccc(N)cc1)C1CCCC1 1120677873 ZEFAEPCZFICQFC-UHFFFAOYSA-N 291.395 2.369 10 20 CECD COc1cccc(O)c1CN1CC[C@@H]2[C@H](CCCN2C)C1 770352403 NLDIEIVAAZUKMW-UKRRQHHQSA-N 290.407 2.317 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCN3CCC[C@H]3C2)c1O 894188222 SHZFOFNGEQCMEV-CABCVRRESA-N 290.407 2.426 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOC[C@H]1[C@@H]1CCCO1 894747492 LUSQWRDSGHALIU-KBPBESRZSA-N 299.317 2.050 10 20 CECD COc1cc(C)cc(CN[C@H](C)c2cnn(C)c2)c1O 894295466 ZNEDTJPYPOYNOC-LLVKDONJSA-N 275.352 2.294 10 20 CECD CC(C)(C)n1cc(NC(=O)c2c(F)ccc(O)c2O)cn1 790070029 YHZNLWWIFAAGFG-UHFFFAOYSA-N 293.298 2.441 10 20 CECD CSc1cc(CNC(=O)c2cccc(O)c2O)ccn1 790912085 NKPNAPRFTVVPPG-UHFFFAOYSA-N 290.344 2.145 10 20 CECD CC[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)[C@H](C)O 791207423 AKRNABVGPRZSGJ-XJKSGUPXSA-N 290.407 2.310 10 20 CECD COc1ccc(CNCCCNC(=O)[C@@H]2C[C@@H]2C)cc1C 1154309688 RONPOVYYBBHOAY-SWLSCSKDSA-N 290.407 2.256 10 20 CECD CCOc1cccc(CNCC[C@@H](O)C2CC2)c1O 898206065 LGHUAWFQEJFYKX-CYBMUJFWSA-N 265.353 2.042 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1nccc(Cl)c1F 1320623652 YJJGOZMTKWTDGH-UHFFFAOYSA-N 296.685 2.215 10 20 CECD CN(C)c1ccc(CNC(=O)NC(C)(C)CF)cc1 1325691163 FIQYZBMTAPNIRV-UHFFFAOYSA-N 267.348 2.300 10 20 CECD Cn1cc(C(=O)Nc2ccc(N)cc2)c(C(F)(F)F)n1 746480296 VMNVGZLLEJNTDQ-UHFFFAOYSA-N 284.241 2.273 10 20 CECD CCOC(=O)[C@H](NCc1cc(C)cc(OC)c1O)C1CC1 1338266062 YMOIPYKCXOKWKT-CQSZACIVSA-N 293.363 2.141 10 20 CECD O=C(NCc1cccc(O)c1O)c1scnc1C1CC1 1348045049 ADUWHTNXLLJROA-UHFFFAOYSA-N 290.344 2.362 10 20 CECD CC(C)c1nnsc1C(=O)NCc1ccc(O)c(O)c1 1358046976 RPFAOSBFZPFQMR-UHFFFAOYSA-N 293.348 2.003 10 20 CECD CC[C@@](COC)(NCc1ccc(N(C)C)c(C)c1)C(=O)O 1609926433 QZCUEXHEJVKWCO-INIZCTEOSA-N 294.395 2.030 10 20 CECD COc1ccc(O)c(CN[C@@H](C)[C@H]2CCCO2)c1 20208963 ASOCTUIMADJRAU-IINYFYTJSA-N 251.326 2.058 10 20 CECD CC(C)(C)C[C@@H](O)CNCc1cc(F)ccc1O 226609354 MHVVCAMFGAEVOU-GFCCVEGCSA-N 255.333 2.418 10 20 CECD COc1cc(Cl)cc(CNCCCn2ccnc2)c1O 228668892 FYZCCFKFYICCHS-UHFFFAOYSA-N 295.770 2.431 10 20 CECD COc1cc(Cl)cc(CN(CC(=O)O)CC2CC2)c1O 229118188 NWBNQIVDLLYNOL-UHFFFAOYSA-N 299.754 2.351 10 20 CECD Cc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C)c1O 124608442 YXYJEXHUUGDMNQ-CABCVRRESA-N 260.381 2.369 10 20 CECD Cc1c(CN[C@@H]2CCc3cccc(O)c32)cnn1C 296796682 LHDSVNBVDMGRAT-CYBMUJFWSA-N 257.337 2.211 10 20 CECD COc1ccc(O)c([C@H](C)NCCC2(C)OCCO2)c1 183893705 QWBWRLPZPYHCFV-NSHDSACASA-N 281.352 2.205 10 20 CECD C[C@@H]1NC[C@@H](C)N(Cc2ccc(N(C)C)cc2)[C@H]1C 401219581 DZHWHHIREFVQCZ-RDBSUJKOSA-N 261.413 2.323 10 20 CECD C[C@H](NCC12CC(CO1)C2)c1ccc(F)cc1O 527983163 UGPLBSJRZXWKEO-IPWFMCSPSA-N 251.301 2.361 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCOC[C@H]2C)c1O 398896592 BVDCVYWSPIQYKN-SNVBAGLBSA-N 281.327 2.345 10 20 CECD c1ccc(Cn2nnnc2CSc2nccs2)cc1 919676966 KXOHWQFHHSXTJL-UHFFFAOYSA-N 289.389 2.470 10 20 CECD COCC1CCC(NC(=O)c2cccc(O)c2O)CC1 839855119 YYDHUYARNNZDGS-UHFFFAOYSA-N 279.336 2.033 10 20 CECD CCOc1cccc(CN2CC[C@@H](N)C[C@@H]2C)c1O 131432191 LDKVJQVRXNNYJJ-WCQYABFASA-N 264.369 2.103 10 20 CECD CC(C)COC[C@H](O)CN[C@@H](C)c1ccccc1O 179873526 JRLLXVLDAGLQHK-QWHCGFSZSA-N 267.369 2.076 10 20 CECD CCCNC(=O)[C@H]1CCCN(Cc2ccccc2O)C1 179566407 VMRCWFPFDRMMBU-AWEZNQCLSA-N 276.380 2.130 10 20 CECD COC[C@H](C)CNC(=O)N(C)Cc1ccc(N(C)C)cc1 171595718 LOWIVAQDFCPUNN-CYBMUJFWSA-N 293.411 2.177 10 20 CECD Oc1cccc(Cl)c1CN1CCC2(CC1)OCCO2 126111355 XMKJCFDQDXEUSV-UHFFFAOYSA-N 283.755 2.385 10 20 CECD CCOCc1nnc(NCc2cc(C)ccc2O)o1 181848795 LKZJAWZDDUAHBO-UHFFFAOYSA-N 263.297 2.232 10 20 CECD C[C@H](Sc1nccs1)C(=O)NCC(F)(F)F 72016352 XJWGPQCQSJYKBT-YFKPBYRVSA-N 270.301 2.302 10 20 CECD CCOC1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)CC1 180965231 AYEWGIVZSOMQBH-GQCTYLIASA-N 291.347 2.139 10 20 CECD CS[C@H](C)CC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186381944 MDSXCULLDNMOSP-VHSXEESVSA-N 283.393 2.287 10 20 CECD C[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)n1cccn1 45054022 RGDOEVUHXDZUFO-ZDUSSCGKSA-N 286.379 2.169 10 20 CECD CN(C(=O)/C=C/c1ccc(Cl)nc1)c1cnn(C)c1 135589958 SNQNRJDCOAQMHY-GQCTYLIASA-N 276.727 2.145 10 20 CECD CO[C@@](C)(CNCc1cc(F)ccc1O)C1CC1 291051799 NDKSDEDEABERJK-AWEZNQCLSA-N 253.317 2.436 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)NC(C)C)c1ccccc1O 228929440 RNHQNXFXQZONGU-WCQYABFASA-N 264.369 2.346 10 20 CECD COC[C@@H](C)NCc1cc(Cl)cc(OC)c1O 228669685 WUAMIYRBQPJICL-MRVPVSSYSA-N 259.733 2.179 10 20 CECD C[C@@H](N[C@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 86758482 TWAGIAZHJOAPJJ-YGRLFVJLSA-N 262.353 2.266 10 20 CECD COC[C@H](NCc1cccc(Cl)c1O)[C@H]1CCCO1 279440084 PDBDBPLHZGJZPA-QWHCGFSZSA-N 285.771 2.329 10 20 CECD Oc1ccc(F)cc1CN1CCN(Cc2ccco2)CC1 272339486 YHDYQTKQPFOFCN-UHFFFAOYSA-N 290.338 2.442 10 20 CECD C[C@@H](CF)NC(=O)NCc1ccc(N2CC=CC2)cc1 287387280 IGEUARWWMNRZNZ-LBPRGKRZSA-N 277.343 2.220 10 20 CECD CC1CCN(c2ccc(CNC(=O)[C@H](C)CN)cc2)CC1 285809097 RIRRDMBNNOPBES-CQSZACIVSA-N 289.423 2.134 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CC2(F)F)cc1F 294822691 WKJGDECCSZEQFU-SECBINFHSA-N 272.270 2.163 10 20 CECD COCC1(CN[C@H](C)c2ccc(F)cc2O)CCNCC1 817973946 HRRGDWIIIREHIF-GFCCVEGCSA-N 296.386 2.198 10 20 CECD C[C@H]1C[C@H](NCCc2ccc(N)cc2)c2nccn21 817957797 PGFAYDPOPIXJAG-FZMZJTMJSA-N 256.353 2.303 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCCC[C@H]1N 818431384 KJNIQQSUHMYTST-HZPDHXFCSA-N 261.413 2.421 10 20 CECD C[C@@H](CC(=O)N[C@H](C)c1ccccc1O)n1ccnc1 827952374 PWLZQQSKUFKFQT-NWDGAFQWSA-N 273.336 2.417 10 20 CECD CN(C)Cc1ccc(C(=O)NCc2ccccc2O)cc1 725895341 FEFWLYJBBRAZDM-UHFFFAOYSA-N 284.359 2.384 10 20 CECD O=C(NCCC1CCC1)c1c(F)ccc(O)c1O 826818495 PLFCLYOTBTZUOD-UHFFFAOYSA-N 253.273 2.157 10 20 CECD CC[C@H](O)[C@H](C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 907494274 XTENROXURWXWLK-ZOWXZIJZSA-N 278.396 2.337 10 20 CECD Cc1cc(O)c(CN2CC(=O)NCC2(C)C)cc1Cl 825780501 WJKLUALLICFXGY-UHFFFAOYSA-N 282.771 2.064 10 20 CECD C[C@H](NCCC1(CO)CC1)c1cc([N+](=O)[O-])ccc1O 834897890 WTFINTYMSSIJSU-JTQLQIEISA-N 280.324 2.114 10 20 CECD CCOc1ccc(CN2CCC[C@@H]3COC[C@@H]32)c(O)c1 839187761 NQPZXBXFZYUORA-HIFRSBDPSA-N 277.364 2.402 10 20 CECD CN(Cc1ccccc1O)C(=O)COC1(C)CCC1 746219664 MDYQVWHSQUYTIZ-UHFFFAOYSA-N 263.337 2.310 10 20 CECD CC1(C)NCC[C@@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 841086083 LXUCNVPMAXSDPQ-NSHDSACASA-N 299.758 2.184 10 20 CECD C[C@H](N[C@@H]1CCCN(C)C1=O)c1ccc(Cl)cc1O 841755105 NLZMGRSKSJWNDZ-JOYOIKCWSA-N 282.771 2.317 10 20 CECD C[C@H]1CC(C)(C)CN1Cc1cc2c(cc1O)OC[C@@H]2O 840179321 ALEDMKATFAEJNE-HZMBPMFUSA-N 277.364 2.438 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cccc(CC)c2O)[C@H]1OC 848902700 GQBZKOOHNTWVHN-IIAWOOMASA-N 279.380 2.237 10 20 CECD CC(=O)Nc1ccc(CC(=O)NCc2ccccc2O)cc1 748354233 XHDWSGIAKZMRPQ-UHFFFAOYSA-N 298.342 2.210 10 20 CECD CCOc1ccc(O)c(CN(C[C@H](C)O)C2CC2)c1 848928851 PJRZZCOJZCLZFQ-NSHDSACASA-N 265.353 2.136 10 20 CECD COc1cc(O)c(CNCCCCCCN)cc1OC 843128566 XGDHQNJCDINZPY-UHFFFAOYSA-N 282.384 2.018 10 20 CECD CCN(CCSC)C(=O)c1c(F)ccc(O)c1O 844152282 CMHWEDQWCWTXGC-UHFFFAOYSA-N 273.329 2.062 10 20 CECD CCn1cnnc1CCN[C@@H](C)c1cc(F)cc(F)c1O 756731808 DCFKUPKZGCZNJC-VIFPVBQESA-N 296.321 2.175 10 20 CECD COc1cccc(O)c1CNC[C@]1(O)CCc2ccccc21 752124100 IUEMGQHQLZWQSS-GOSISDBHSA-N 299.370 2.324 10 20 CECD C[C@H]1C[C@@H](N[C@H]2C[C@H](CO)C2)c2c(O)ccc(F)c21 927147016 IKSAVTGBIUBVEL-QFOLPQNPSA-N 265.328 2.440 10 20 CECD CO[C@@H]1CCCC[C@H]1NC(=O)Nc1ccc(N)cc1 846310622 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185639576 MEQISNCSZHHUNA-ZANVPECISA-N 271.357 2.050 10 20 CECD CC(C)COC[C@H](O)CN[C@H](C)c1c(O)cccc1F 886511019 GMXYSTMOYSUIHT-VXGBXAGGSA-N 285.359 2.215 10 20 CECD CC(C)OC(=O)[C@@H](C)N(C)Cc1cc(F)cc(F)c1O 894075746 JCHRHDFMYHMOTI-SECBINFHSA-N 287.306 2.442 10 20 CECD CSCCCCC(=O)OCC(=O)c1ccc(O)c(O)c1 783762405 PDQBVVVMVFPLNC-UHFFFAOYSA-N 298.360 2.357 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCCOC2)c1O 894199071 FUNPQHOTJAZZPA-GFCCVEGCSA-N 265.353 2.225 10 20 CECD O=C(N[C@@H]1C[C@@H]1Cc1ccccc1)c1cccc(O)c1O 790785842 YYEGTFPKXNHGOG-GXTWGEPZSA-N 283.327 2.459 10 20 CECD CN(C(=O)c1snnc1C1CC1)c1ccc(N)cc1 1342332016 LBNCBUPNJRTNOA-UHFFFAOYSA-N 274.349 2.274 10 20 CECD CC1(C)CN(Cc2ccc(N3CCCC3)cc2)C[C@H]1O 1339516790 AQAYOJLXALUJIG-MRXNPFEDSA-N 274.408 2.490 10 20 CECD CN(Cc1ccccc1O)C(=O)CCc1cnc(N)s1 721333410 YNOADXRVAAEJLJ-UHFFFAOYSA-N 291.376 2.022 10 20 CECD CO[C@H]1CCC[C@@H]1C(=O)N(C)Cc1ccccc1O 1358032709 HZDBEQAFKSHTIJ-JSGCOSHPSA-N 263.337 2.166 10 20 CECD CON(C)C(=O)[C@H](C)N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 1351353560 RQEZRTWEWXDNLC-GRYCIOLGSA-N 292.379 2.247 10 20 CECD Cn1cc(CNCc2cccc(Cl)c2O)cc1C(=O)O 1600953908 BYEUIDWMNHLHLJ-UHFFFAOYSA-N 294.738 2.372 10 20 CECD C[C@H](NC/C=C/C1CC1)c1cccc(-c2nn[nH]n2)c1O 1589961138 ARMXLHSGBLONTP-FSIBCCDJSA-N 285.351 2.189 10 20 CECD CN(C)c1ccc(CN[C@H](CC2CCC2)C(=O)O)cc1 1777039547 HPUBYSWGRWLSNJ-OAHLLOKOSA-N 276.380 2.486 10 20 CECD O[C@@H]1CC[C@H](CNCc2ccc3c(c2)CCCO3)C1 922043987 IMXBVCSMKWOHOF-DZGCQCFKSA-N 261.365 2.262 10 20 CECD CCOc1cccc(CN2CCN(CC)[C@@H](C)C2)c1O 211402260 KQCHLBVILDWKEN-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)OC[C@H]2C)c1O 37323453 HGGGFZFMYJEXCI-NXEZZACHSA-N 281.327 2.343 10 20 CECD CC[C@@H](N[C@H](C)CN1CCCC1=O)c1ccccc1O 37782115 WGCDHYYFCQWVOX-TZMCWYRMSA-N 276.380 2.444 10 20 CECD C[C@H](CN[C@@H]1CCc2cccc(O)c21)N(C)C1CC1 297776124 PLLHELHKQBBQFV-BXUZGUMPSA-N 260.381 2.452 10 20 CECD O=C1N=C(N2CCOCC2)S/C1=C/c1cccc(F)c1 51491 PWEASAGGEDOKLH-FMIVXFBMSA-N 292.335 2.128 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2ccc[n+]([O-])c2)cc1 57117595 PHWZIIRUJVLIMD-UHFFFAOYSA-N 299.374 2.096 10 20 CECD COc1ccc(O)c(CN(C)C[C@@H]2CCCC[C@H]2O)c1 305845607 SMFKHSYVTNXCFY-SWLSCSKDSA-N 279.380 2.384 10 20 CECD COCCN(C)CCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 61375621 UGLTUSDSRGZVNA-KGLIPLIRSA-N 292.423 2.417 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCOCC2(C)C)c1 185333666 OGMVDMJFXCOGNG-CQSZACIVSA-N 292.423 2.462 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCC[C@H]1CCO 188423602 WMQZGLCQQXMVBI-GXTWGEPZSA-N 292.379 2.085 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1nccs1 184926950 AFIVGBUSNPHTQR-MRVPVSSYSA-N 293.348 2.307 10 20 CECD CC[C@H](SC)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 185389169 IBCXPVHQONUCNF-RNCFNFMXSA-N 283.393 2.287 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H](C)c1ccc(F)c(F)c1O 187729679 ZMQKZBJDJIYUDF-VAOFZXAKSA-N 291.363 2.433 10 20 CECD COc1ncccc1C(=O)NCc1ccc(N(C)C)cc1 46544338 NWUIAAILELJDDN-UHFFFAOYSA-N 285.347 2.086 10 20 CECD CN(C)c1ccc(NCc2cc3c(cc2O)OCO3)cn1 42879898 PCCUYCKRODQPFP-UHFFFAOYSA-N 287.319 2.194 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2CCCCO2)cc1 87004628 PYFMDCWVBPOCPV-OAHLLOKOSA-N 276.380 2.328 10 20 CECD COc1ccc(O)c([C@H](C)NCCCCCO)c1 223738880 KVUQWDAJAAKXGS-NSHDSACASA-N 253.342 2.214 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCN2)cc1F 236911794 VSTRYMPTXTYCQF-AWEZNQCLSA-N 293.386 2.040 10 20 CECD CCC[C@H](O)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 268893819 OOGGHFAPMSDMHX-YOEHRIQHSA-N 292.423 2.335 10 20 CECD CC[C@H](NC[C@@H]1COCCN1)c1cccc(Cl)c1O 530227849 WIABLARZVLYOSI-MFKMUULPSA-N 284.787 2.075 10 20 CECD Oc1c(Cl)cccc1CNCC1(N2CCOCC2)CC1 278295361 DAOJTCQCEGXTDW-UHFFFAOYSA-N 296.798 2.000 10 20 CECD O=C1CN(C(=O)/C=C/c2cccnc2)c2cccc(F)c2N1 360335367 MQSZXFPBKVWDKH-VOTSOKGWSA-N 297.289 2.219 10 20 CECD COc1cc(O)c(CN[C@@H]2CCO[C@@H](C)C2)cc1OC 271794256 HQRSXLQFHNRNSX-CMPLNLGQSA-N 281.352 2.067 10 20 CECD CC[C@@H](N[C@@H](CO)c1cnn(C)c1)c1ccc(F)cc1O 285957141 FIZMGABQIJXNLV-KGLIPLIRSA-N 293.342 2.039 10 20 CECD Cc1cc(O)c(CN2CCOC[C@@H]2[C@@H]2CCCO2)cc1C 377702060 UAMHVTWTYRPWEO-WBVHZDCISA-N 291.391 2.389 10 20 CECD COc1cc(O)c(CN2CCC[C@H](CO)CC2)cc1OC 293993769 LVSVVVDASCXWAV-LBPRGKRZSA-N 295.379 2.004 10 20 CECD COc1ccc(O)c(CNC(=O)c2ncccc2Cl)c1 815835159 LKKPEFTUXQDZGV-UHFFFAOYSA-N 292.722 2.379 10 20 CECD Oc1c(F)cc(Br)cc1CNCCF 715711226 FGWHYSQJPMLCHB-UHFFFAOYSA-N 266.085 2.353 10 20 CECD COC[C@@H]1CN(Cc2ccc3ccccc3c2O)CCO1 816513195 JMLBPGGUWXMUPL-HNNXBMFYSA-N 287.359 2.393 10 20 CECD COC1CCN(c2ccc(CN(C)OC)cc2)CC1 827377918 HSECEDNDRGBDAQ-UHFFFAOYSA-N 264.369 2.295 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)NCc1ccc(N(C)C)cc1C 734405692 WUTNQFKQVNDYTE-LSDHHAIUSA-N 276.380 2.102 10 20 CECD CC1(C)C[C@H]1CNC(=O)NCCc1ccc(N)cc1 841812051 ULGAJCXYYAPYMD-LBPRGKRZSA-N 261.369 2.157 10 20 CECD CC(C)[C@@]1(C)C[C@H]1C(=O)NCc1ccc(O)cc1O 910948295 XGNSVPWNEBARTQ-SWLSCSKDSA-N 263.337 2.396 10 20 CECD CO[C@@H](C(=O)NCc1cc(Cl)ccc1O)C1CC1 846472723 DXRNOHKESRNUBF-GFCCVEGCSA-N 269.728 2.087 10 20 CECD CC(=O)c1cc(F)cc(CN[C@](C)(CN)C(C)C)c1O 843355932 NBNNAHNEGAVLMJ-OAHLLOKOSA-N 282.359 2.197 10 20 CECD Nc1ccc(NC(=O)C(=O)N(C2CCCC2)C2CC2)cc1 841092606 AQRKOJUVGWBPJQ-UHFFFAOYSA-N 287.363 2.141 10 20 CECD CCN(CC(C)(C)C)C(=O)C(=O)Nc1ccc(N)cc1 841134490 QBQNXTOPWDULCE-UHFFFAOYSA-N 277.368 2.102 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)[C@@H]2CN(C)CCO2)c(O)c1 756762283 XEOOAAULNHJHKS-ZENOOKHLSA-N 278.396 2.070 10 20 CECD COc1cc(O)c(CN2CC[C@@H]3C[C@H]3C2)cc1OC 853576795 QVJWWQKMDVOEAU-MNOVXSKESA-N 263.337 2.251 10 20 CECD Cc1ccccc1CS(=O)(=O)NCc1ccccc1O 751151932 YHKMCSPIYRUTIE-UHFFFAOYSA-N 291.372 2.320 10 20 CECD Cc1cc(CNC(=O)[C@H](O)C2CC2)c(C)n1-c1ccccc1 863164150 CMTDLCCDLCQRCX-QGZVFWFLSA-N 298.386 2.481 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C(C)(C)OCC 935944059 LNCLXXHZHDODBY-UHFFFAOYSA-N 286.368 2.309 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)CC[C@H]1C 768466024 VNYTTXSUWUSDTR-UEKVPHQBSA-N 277.364 2.296 10 20 CECD CC(C)OCC[C@H](O)CN[C@H](C)c1ccccc1O 879649325 NESDVBVVCLJNJQ-OLZOCXBDSA-N 267.369 2.219 10 20 CECD Cc1cccc(CN2CCN(CC(C)C)C(=O)[C@@H]2C)c1O 779201865 HKZSHQQOBAJVQG-AWEZNQCLSA-N 290.407 2.389 10 20 CECD CC[C@H]1C[C@@H](C(=O)N(C)c2ccc(N)cc2)CCO1 877076161 MUATVLVLYPCHQU-FZMZJTMJSA-N 262.353 2.437 10 20 CECD CN(C(=O)c1cnn(CC2CC2)c1)c1ccc(N)cc1 877077067 VKNBTZVAINYYAE-UHFFFAOYSA-N 270.336 2.152 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@]2(C)CCCOC2)cc1 771711779 SIMCIPZVRYCUMJ-MRXNPFEDSA-N 291.395 2.121 10 20 CECD C[C@@H](N[C@H](CCO)C(F)(F)F)c1c(O)cccc1F 886803928 PFFUHNHCBTYRRC-GMSGAONNSA-N 281.249 2.495 10 20 CECD C[C@@H]1CC[C@@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)C1 784569031 ZLGJWAKPHCMBJL-MWLCHTKSSA-N 278.304 2.260 10 20 CECD COc1ccc(C)nc1NC(=O)c1ccc(C)c(O)c1O 780957056 VUFGCBKIULZTPD-UHFFFAOYSA-N 288.303 2.371 10 20 CECD COc1cccc(CN(C)[C@@H]2CCCC[C@H]2O)c1O 895438179 ULJRTCUIFDFLMH-CHWSQXEVSA-N 265.353 2.136 10 20 CECD CCn1cc(CNCc2ccc3c(c2)CCO3)c(C)n1 892792983 JUKNKHQYXCTGDQ-UHFFFAOYSA-N 271.364 2.436 10 20 CECD OC[C@]1(F)CCN(Cc2ccc(N3CCCC3)cc2)C1 1204324587 NNNYPNANPGODSI-INIZCTEOSA-N 278.371 2.193 10 20 CECD O=C(CCc1ccccn1)NCc1ccccc1O 133748306 XDXXZMZJZOOCMW-UHFFFAOYSA-N 256.305 2.036 10 20 CECD CC(C)CNC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 135812092 VFFHRZPPWAWOHM-CYBMUJFWSA-N 277.412 2.175 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)CC(C)(C)O)c1O 81747347 OFNMIXOUTHRNKG-UHFFFAOYSA-N 285.771 2.451 10 20 CECD CCCCSCC(=O)NCCc1ccc(N)cc1 701021450 AIOAXRUDLFGZMI-UHFFFAOYSA-N 266.410 2.461 10 20 CECD COc1ccc(CN[C@H]2CCO[C@@H](C)C2)c(O)c1 219899789 UJAROCKDYRFAOD-JQWIXIFHSA-N 251.326 2.058 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCOC1)c1ccc(N(C)C)cc1 1320381948 PUUPSLFQZHCIJH-CHWSQXEVSA-N 291.395 2.149 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCC[C@H]1N)c1ccccc1O 1332992396 GVHDSKBINSCSCE-KGYLQXTDSA-N 262.353 2.087 10 20 CECD CC(C)N1CCC[C@H]1C(=O)N(C)c1ccc(N)cc1 1340848033 NYNMGAKMYUUTGG-AWEZNQCLSA-N 261.369 2.104 10 20 CECD Cc1cc(Cl)cc(CN2CC[C@@](F)(C(=O)O)C2)c1O 1607656493 ZRPFHJAGOVQBRF-ZDUSSCGKSA-N 287.718 2.353 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C(=O)O)[C@H]2C)c1 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CC[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H](C)[S@]1=O 286026160 QCEVGDMSWLNKQK-OWDMVUQNSA-N 294.464 2.484 10 20 CECD CCOc1ccc(CN(C)[C@@H](CO)COC(C)C)c(O)c1 809768448 LGUDDADGIPKZMQ-AWEZNQCLSA-N 297.395 2.009 10 20 CECD CC(=O)C(=O)CSc1ccc2c(c1)OCCCO2 808012385 KIKATBRHPCOYCD-UHFFFAOYSA-N 266.318 2.098 10 20 CECD CCC[C@H](OC)C(=O)NCc1ccc(N(C)C)c(F)c1 294688955 KJVUDLDDYJLPSB-AWEZNQCLSA-N 282.359 2.323 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC2CC(F)(F)C2)c1 291817754 YVXPJKAFELTQCB-UHFFFAOYSA-N 272.251 2.435 10 20 CECD CC[C@H](NC[C@H]1CNCCCO1)c1cccc(Cl)c1O 817982978 XEXHYKCQMOBKFN-RISCZKNCSA-N 298.814 2.465 10 20 CECD C[C@@H](CN)N[C@@H](C)c1cc(Br)cc(F)c1O 817970387 UKCZTBLQOQDLFS-BQBZGAKWSA-N 291.164 2.292 10 20 CECD CC[C@@H](CNC(=O)N[C@H](C)c1cc(OC)ccc1O)OC 811969138 RYVNCAOHDPENEM-MNOVXSKESA-N 296.367 2.186 10 20 CECD O=C(CSc1nccs1)NCC(=O)c1ccccc1 726862675 OWOCSNVLYAPWCF-UHFFFAOYSA-N 292.385 2.234 10 20 CECD CC(C)NC(=O)CCCC(=O)N[C@H](C)c1ccccc1O 827931121 YYERSDFMYGNYNX-GFCCVEGCSA-N 292.379 2.264 10 20 CECD CCN(CC(=O)N(C)C)Cc1cc(Cl)c(C)cc1O 824561530 YCWAQQZGZJTKLY-UHFFFAOYSA-N 284.787 2.264 10 20 CECD O=C(/C=C/c1cccnc1)N1CCc2ccncc21 492435163 FHTOUDXAQDQQCY-ONEGZZNKSA-N 251.289 2.079 10 20 CECD CC[C@@H](NC(=O)NCc1cc(OC)ccc1O)C(F)F 838474955 VCQLNJIJHCOCHU-SNVBAGLBSA-N 288.294 2.244 10 20 CECD Cc1cnc(NCc2ccc(N3CCN(C)CC3)cc2)cn1 902212187 XYKFDHDSANWPSY-UHFFFAOYSA-N 297.406 2.149 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]3COC[C@@H]32)cc1OC 839187948 RSJBJCKAXSJJEU-YPMHNXCESA-N 293.363 2.020 10 20 CECD CNC(=O)C[C@H](C)N[C@@H](C)c1c(C)cc(C)cc1O 834901988 YQWXJJDNTQSMNE-RYUDHWBXSA-N 264.369 2.184 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H]1[C@H]1CCCOC1 844147704 YPJIPTSYJZUWQN-JQWIXIFHSA-N 281.377 2.485 10 20 CECD C[C@@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1cc(F)ccc1O 846205640 IRHPOXZVEQWXBF-MNOVXSKESA-N 292.354 2.193 10 20 CECD CC[C@H](NC(=O)Nc1ccc(N)cc1)[C@H]1CCCO1 841297810 IITXZLLJNFUKHA-QWHCGFSZSA-N 263.341 2.348 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCCC(F)(F)C1 846358930 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CC[C@@H](N[C@@H]1CCN(C(C)C)C1=O)c1ccccc1O 183338856 IXMMHCNEGPJQQW-ZIAGYGMSSA-N 276.380 2.442 10 20 CECD C[C@H](NCc1c(O)cccc1Cl)c1nnc2n1CCC2 83551781 VFDNEJNHKPCRPK-VIFPVBQESA-N 292.770 2.434 10 20 CECD Nc1ccc(CC(=O)NCC(C2CC2)C2CC2)cc1 88454260 ARUACFGCFCHRSJ-UHFFFAOYSA-N 258.365 2.364 10 20 CECD C[C@@H](NCCCCCS(C)(=O)=O)c1ccccc1O 186857686 YWCDXBYJGQBXJI-GFCCVEGCSA-N 285.409 2.258 10 20 CECD CCC[C@@H](O)CNC1CCN(c2ccc(OC)cc2)CC1 305098930 AIGQTIUXPGLPOE-MRXNPFEDSA-N 292.423 2.415 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCCOCC1 181770559 IRNJLPNYUUHJFX-CYBMUJFWSA-N 278.352 2.103 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC(F)(F)F 183439081 TZXPBCOOJPAGPD-ZETCQYMHSA-N 277.242 2.097 10 20 CECD CCOc1cccc(CNCCC[C@H](C)O)c1O 227959772 QIGGKAFDIYPRIF-NSHDSACASA-N 253.342 2.042 10 20 CECD CC[C@@H](NC[C@@H]1COCCN1)c1cccc(Cl)c1O 530227850 WIABLARZVLYOSI-ZWNOBZJWSA-N 284.787 2.075 10 20 CECD CCN(C)C(=O)NCc1ccc(N(C)C)c(F)c1 264895085 UQCIAYSZDVXECJ-UHFFFAOYSA-N 253.321 2.053 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 271888829 JLJPZKSIWORXNF-AAEUAGOBSA-N 294.370 2.323 10 20 CECD Cc1ccc(O)c(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)c1 271196703 NZRGDDQDGFHBBP-PZROIBLQSA-N 267.394 2.042 10 20 CECD Cc1cc(C(=O)N(C)CCC(N)=O)c(C)n1-c1ccccc1 286184844 JPRZSDLHCOVKMO-UHFFFAOYSA-N 299.374 2.042 10 20 CECD COCCn1cc(CN[C@@H](C)c2ccc(C)cc2O)cn1 281945975 BTCSVEQMPNECPX-ZDUSSCGKSA-N 289.379 2.394 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)CCOC(C)C 819076435 BYXKPGUYMKRRHI-KRWDZBQOSA-N 294.439 2.327 10 20 CECD COC(=O)[C@@]1(F)CCN(Cc2ccc(N(C)C)c(C)c2)C1 815055936 UEUNZLRYQXFUTL-MRXNPFEDSA-N 294.370 2.148 10 20 CECD CCN(C)c1ccc([C@H](C)NCCNCCOC)cc1 817964375 AAILNBBKMREYFV-AWEZNQCLSA-N 279.428 2.029 10 20 CECD C[C@@H](NC(=O)C1(F)CCOCC1)c1ccccc1O 827956280 JAKOPOWFVJIRII-SNVBAGLBSA-N 267.300 2.088 10 20 CECD CCOC1CC(O)(CNCc2cc(Cl)c(C)cc2O)C1 825710468 QHZVIOHNNQHRMV-UHFFFAOYSA-N 299.798 2.374 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)COCC2CC2)c1 728978680 SPHCSVGRNSFDKO-SNVBAGLBSA-N 279.336 2.005 10 20 CECD CCc1nc(CNCc2cc(Cl)cc(F)c2O)n[nH]1 824446077 RASKGSKLERYGLS-UHFFFAOYSA-N 284.722 2.155 10 20 CECD CCc1ncc(NCc2ccc(N3CCOCC3)cc2)cn1 902204704 KFXLAYHTDGYGNE-UHFFFAOYSA-N 298.390 2.488 10 20 CECD C[C@@H](NCc1ccccc1O)c1ccc(-c2nn[nH]n2)cc1 736135304 PFICHPQYZPBLHG-LLVKDONJSA-N 295.346 2.423 10 20 CECD CC[C@H](NCCN1CCCOCC1)c1ccc(F)cc1O 903226544 HDIRNTGVGSUHMJ-HNNXBMFYSA-N 296.386 2.294 10 20 CECD C[C@@H]1CCCN(C[C@@H](C)NC(=O)c2cc(O)cs2)C1 731870014 HVWYFBYIDGDIAR-GHMZBOCLSA-N 282.409 2.304 10 20 CECD COc1cccc(O)c1CN1CCC([C@@H]2CCNC2)CC1 843125931 CRRVYEZPXMOCQD-CQSZACIVSA-N 290.407 2.222 10 20 CECD CC[C@]1(C(=O)N[C@H](C)c2cc(OC)ccc2O)CCCN1 843489464 PIRCSKKSPKCJJO-BDJLRTHQSA-N 292.379 2.110 10 20 CECD Cn1nc(NC(=O)NCCc2ccc(N)cc2)cc1C1CC1 841242341 HAFVHFDLADFUGD-UHFFFAOYSA-N 299.378 2.244 10 20 CECD Cc1noc(C2CN(Cc3ccc(N(C)C)cc3C)C2)n1 840952898 IUTHLICHKBLATP-UHFFFAOYSA-N 286.379 2.352 10 20 CECD CO[C@@H](CS(=O)(=O)Nc1ccc(O)c(C)c1)C(C)C 842584718 ISKXGTUWIWWYIG-ZDUSSCGKSA-N 287.381 2.113 10 20 CECD CCn1cnnc1CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756418351 APNIOPMGFAPUGY-KOLCDFICSA-N 290.342 2.481 10 20 CECD CN(C)c1ccc(CNCC2(CC(=O)O)CCC2)cc1 756311742 WIJMZDBUIFIDHU-UHFFFAOYSA-N 276.380 2.487 10 20 CECD C/C(=C\C(=O)N1CCc2ncc(C)cc21)c1cnccn1 857872729 GZBIRVVUPAWXKG-XYOKQWHBSA-N 280.331 2.173 10 20 CECD COc1cc(CN(C)CC2(C)COC2)c(O)cc1C 863295827 FZNXYKOYFWXPDR-UHFFFAOYSA-N 265.353 2.178 10 20 CECD CCn1cc(C(=O)NCc2ccccc2O)c(C2CC2)n1 866756249 UQRGGZJHZTXDNT-UHFFFAOYSA-N 285.347 2.416 10 20 CECD CCOc1ccc(CN2CCOCC2(C)C)c(O)c1 769005783 NREBFFVJHCVMDU-UHFFFAOYSA-N 265.353 2.402 10 20 CECD COCCC1(CNC(=O)c2cc(O)cs2)CC1 769373735 GQAVIOLIYCWFIY-UHFFFAOYSA-N 255.339 2.000 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCC[C@@H](F)C2)c(O)c1O 1118279742 LKSSASATVRIBCG-ZJUUUORDSA-N 267.300 2.417 10 20 CECD CC[C@@H](NCCN1CCC1)c1ccc(N(C)C)cc1 773091519 HSUAQKRHKZAAPC-MRXNPFEDSA-N 261.413 2.499 10 20 CECD C[C@@H](NC(=O)c1cnsn1)c1ccc(N(C)C)cc1 773016392 CNNHZARNIJWCNL-SECBINFHSA-N 276.365 2.095 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCn3ccnc3C2)cc1C 778187975 OXYVPCSNFBAWFB-CQSZACIVSA-N 271.364 2.310 10 20 CECD O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)NCc1cccc(O)c1O 1123889278 OEOYPZJXHNVBCO-JFGNBEQYSA-N 261.321 2.150 10 20 CECD COC(=O)[C@H]1CCN(Cc2cccc(C)c2O)[C@@H]1C 787420886 LZZBEXWNEDRLAL-YPMHNXCESA-N 263.337 2.084 10 20 CECD CC[C@@H](C)Cn1cc(COc2ccc(N)cc2)nn1 881203328 HNQISPZBXNLPKD-LLVKDONJSA-N 260.341 2.485 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCN2C(C)(C)C)cc1 895488371 OTGYIQRZDCUJAA-HNNXBMFYSA-N 289.423 2.242 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1cc(F)ccc1O 798954968 IKLVTYGILXQNSZ-SNVBAGLBSA-N 269.316 2.305 10 20 CECD CCN1CCC[C@@H]1CNCc1ccc2c(c1)CCO2 37362681 QGICMMRQJHPZSM-OAHLLOKOSA-N 260.381 2.195 10 20 CECD C[S@@](=O)CCCNCc1ccc(N2CCCC2)cc1 134746183 UPPYEPHZPBSAEC-IBGZPJMESA-N 280.437 2.145 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)CCS(C)(=O)=O)c1 185790491 IUADWTQVBIBVQW-NWDGAFQWSA-N 285.409 2.174 10 20 CECD COc1ccc(CNC(=O)NC/C=C\C2CC2)c(O)c1 1325484777 LLBVRHCTURQCRR-IHWYPQMZSA-N 276.336 2.166 10 20 CECD C[C@H]1COC[C@@H]1NCc1ccc(Br)cc1O 691469702 ZPRJTWIFBUVRQY-KWQFWETISA-N 286.169 2.279 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1c1ccc[nH]1 279660374 XRVNEWRJYNRFBT-LBPRGKRZSA-N 272.304 2.403 10 20 CECD COc1ccc(O)c(CNC2CCC(OC)CC2)c1 703831159 CVXAXGKFJSCRPC-UHFFFAOYSA-N 265.353 2.448 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1ccc(N2CCCC2)cc1 1332360939 XAJMDCUWZGFXBW-RDJZCZTQSA-N 291.414 2.419 10 20 CECD C[C@@H](N[C@H](C)c1nncn1C)c1cc(F)ccc1O 94617332 SZGGYRKQBHWMMF-RKDXNWHRSA-N 264.304 2.072 10 20 CECD Oc1c(F)cc(F)cc1CN1CC[C@](O)(C2CC2)C1 1262111064 VUIYFKSMRVGOJS-CQSZACIVSA-N 269.291 2.017 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CCOC2(CCC2)C1 1521852501 WODJHTVSCDOUGB-LLVKDONJSA-N 291.347 2.063 10 20 CECD NCC1(CC(=O)NCc2ccc(N)cc2)CCCCC1 1524008249 FTNSNEFGWOJNGE-UHFFFAOYSA-N 275.396 2.184 10 20 CECD O=C(Nc1ccc(C(=O)O)c(O)c1)c1cc(O)cs1 1601598178 DDTJYLGDCXPJDI-UHFFFAOYSA-N 279.273 2.110 10 20 CECD Cc1cccc(CN2CC[C@@H](C)C[C@@H]2C(=O)O)c1O 1607850196 BNEZJTWRXRYXBC-ZWNOBZJWSA-N 263.337 2.386 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2CC=C(C(=O)O)C2)c1O 1607309406 HHVDNRITSHAXRQ-MWLCHTKSSA-N 277.320 2.225 10 20 CECD Cc1cc(CC(=O)N2CC[C@H](N)C2)c(C)n1-c1ccccc1 1579589597 KKGORQDPRNGNOR-INIZCTEOSA-N 297.402 2.196 10 20 CECD C[C@@H](Cc1cnn(C)c1)NCc1cccc(Cl)c1O 825045438 DMHSZPKNGJSVJL-JTQLQIEISA-N 279.771 2.500 10 20 CECD CCCN(Cc1ccccc1O)C[C@H]1COCCO1 827938774 RZVUTUWMVIPMLP-AWEZNQCLSA-N 265.353 2.020 10 20 CECD COc1cc(Cl)cc(CNCCn2cccn2)c1O 228671822 CDMSUTFNDJRVIQ-UHFFFAOYSA-N 281.743 2.041 10 20 CECD CCNCC1CCN(Cc2cc(OC)ccc2O)CC1 129863160 QMKQEDFTZGPORY-UHFFFAOYSA-N 278.396 2.222 10 20 CECD Cc1cc(CN[C@H](C)c2cc(F)ccc2O)n(C)n1 284520730 WQGNCOBNBNDKRZ-SNVBAGLBSA-N 263.316 2.424 10 20 CECD C[C@@H]1CCC[C@@]1(O)CNCc1cc(F)ccc1O 293951516 IUQOZPNDBNFQRZ-QMTHXVAHSA-N 253.317 2.172 10 20 CECD Cc1ccc([C@@H](C)NC[C@@]2(O)CCSC2)c(O)c1 185639116 WKHGAAJWXDBJEL-RISCZKNCSA-N 267.394 2.219 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(F)cc1O 188476383 YESBITJUGQZRDO-VHSXEESVSA-N 268.332 2.049 10 20 CECD N[C@@H]1CN(Cc2ccccc2O)C[C@H]1c1ccccc1 312374247 ITMVLICYTCFLGX-JKSUJKDBSA-N 268.360 2.319 10 20 CECD CN(C)CC1(NCc2cc(F)ccc2O)CCC1 393497977 HXCPFOUJQARNLP-UHFFFAOYSA-N 252.333 2.105 10 20 CECD O=C(O)C1(CSc2nccs2)CCOCC1 1601717096 IXBFETFOGJJUFT-UHFFFAOYSA-N 259.352 2.117 10 20 CECD COCC[C@H](C)NC(=O)NCc1ccc(N(C)C)cc1C 115672004 HCAAYHOAKJQKPL-ZDUSSCGKSA-N 293.411 2.285 10 20 CECD CO[C@@H](C)CC(=O)NCc1c(O)ccc2c1CCCC2 174516774 ILPSQHOHZOBTOQ-NSHDSACASA-N 277.364 2.312 10 20 CECD CC(C)C(=O)N1CCCN(Cc2ccccc2O)CC1 179561922 KOXJCJOBKWJKSR-UHFFFAOYSA-N 276.380 2.083 10 20 CECD C[C@@H](O)C[C@H]1CCCN1Cc1cc(F)ccc1O 180170894 MZHHCRRAQOXSQF-ZWNOBZJWSA-N 253.317 2.267 10 20 CECD CC[C@@H](SC)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 185389186 IBCXPVHQONUCNF-NOZJJQNGSA-N 283.393 2.287 10 20 CECD CCOC(=O)N1CC[C@H](NCc2cccc(C)c2O)C1 186475858 CUSWTPBQYZDYDY-ZDUSSCGKSA-N 278.352 2.021 10 20 CECD Cn1ccc(NC(=O)NCCCSc2nccs2)n1 130477299 MJXIFZDYWVUGSS-UHFFFAOYSA-N 297.409 2.181 10 20 CECD CC[C@@]1(C)CN(Cc2cc(OC)c(OC)cc2O)CCO1 190326924 ZDJMDKFDDUGOJS-INIZCTEOSA-N 295.379 2.410 10 20 CECD CC(C)Oc1ccc(N(C)C[C@H](O)Cn2cccn2)cc1 191592931 SDUGUFDLUIIINE-HNNXBMFYSA-N 289.379 2.168 10 20 CECD C[C@H]1[C@H](C(=O)O)CCN1Cc1ccc(N(C)C)cc1 92941441 VHEPSSFIRALJFF-SMDDNHRTSA-N 262.353 2.048 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](O)C(F)(F)F)c(O)c1 230659276 WCEKCVVKFCVIPT-LDYMZIIASA-N 263.259 2.274 10 20 CECD CCOc1ccc(N2CCN(C(=O)C3CC3)CC2)cc1 244097286 UHDKKXXUNIKECL-UHFFFAOYSA-N 274.364 2.144 10 20 CECD CCN(CC)c1ccc(CNCC(=O)NC2CC2)cc1F 265785369 PPXYSAKBLKLQQB-UHFFFAOYSA-N 293.386 2.040 10 20 CECD COc1cc(Cl)cc(CN(CCO)C(C)C)c1O 273738091 LKRYUGWTDHUNQG-UHFFFAOYSA-N 273.760 2.257 10 20 CECD C/C=C/C[C@H](CO)N[C@@H](C)c1cc(C(=O)OC)ccc1O 274646769 SEACEBDTPDFLFU-SOHMCZBRSA-N 293.363 2.157 10 20 CECD CC[C@H](NC[C@@]1(O)CCO[C@@H]1C)c1ccc(C)cc1O 280277970 YGPSQPAXCNQPHK-INWMFGNUSA-N 279.380 2.281 10 20 CECD COC[C@H](CO)N[C@@H](C)c1cc(Cl)c(Cl)cc1O 280843152 AVECLDBKZNXJKE-YUMQZZPRSA-N 294.178 2.357 10 20 CECD Cc1noc(C(C)(C)NCc2cccc(C)c2O)n1 285322675 XBEFMNVGNVJCIP-UHFFFAOYSA-N 261.325 2.417 10 20 CECD Cc1nnsc1CNCc1ccc(N(C)C)c(F)c1 291759749 RHEDJQMBBNWIEK-UHFFFAOYSA-N 280.372 2.341 10 20 CECD CN(C)c1ccc(CN(C(=O)c2ccnn2C)C2CC2)cc1 299600071 WMYBTXKMWBYYIK-UHFFFAOYSA-N 298.390 2.291 10 20 CECD Cc1cc(CN2CCC(CC(N)=O)CC2)ccc1N(C)C 293384160 GLIHAIYOEFRYDX-UHFFFAOYSA-N 289.423 2.148 10 20 CECD CC(C)OC[C@H](CO)N(C)Cc1ccc(N(C)C)c(F)c1 809768073 BMXCXXHRUSPZRY-AWEZNQCLSA-N 298.402 2.109 10 20 CECD CC[C@@H](C)CONC(=O)c1ccc(C)c(O)c1O 293826440 VLOZXJUECMPNCH-MRVPVSSYSA-N 253.298 2.114 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1COc3ccccc3[C@@H]1O)CC2 297217556 HBEICNJLIOQONH-GLJUWKHASA-N 297.354 2.464 10 20 CECD O=C(O)CN(Cc1ccco1)Cc1ccccc1O 819513295 KHNWVILKXWEHTA-UHFFFAOYSA-N 261.277 2.072 10 20 CECD NCC1(CC(=O)NCc2ccc(N3CCCC3)cc2)CC1 827008448 OUUYKLBNADSVBM-UHFFFAOYSA-N 287.407 2.032 10 20 CECD CNc1snc(C)c1C(=O)NCCc1ccc(N)cc1 832652940 KGFXBRYMGQFWRN-UHFFFAOYSA-N 290.392 2.048 10 20 CECD CCOc1ccc(O)c(CN(C)C2CCN(OC)CC2)c1 835076242 MGMQCFLUTXSYLA-UHFFFAOYSA-N 294.395 2.249 10 20 CECD CCC[C@@H](CNC(=O)NCc1ccc(OC)cc1O)OC 836522303 CLFADXUTNZZUAA-ZDUSSCGKSA-N 296.367 2.015 10 20 CECD CC[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)[C@@H](C)O 834889456 XYWGMWMYUIBPHW-SBMIAAHKSA-N 268.313 2.110 10 20 CECD Cc1ncc2c(n1)CC[C@H](NCc1ccc(N(C)C)cc1)C2 915228891 FGSAGUNJPOERKX-INIZCTEOSA-N 296.418 2.498 10 20 CECD Cc1ccc(C(=O)NCCCCN(C)C2CC2)c(O)c1O 837225326 QFLMNUROBWVNTC-UHFFFAOYSA-N 292.379 2.010 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CO)CC(F)(F)F 840938038 YUUYPJPARQHVBU-LBPRGKRZSA-N 290.329 2.464 10 20 CECD Oc1cc2c(cc1CN1CCO[C@@H](CF)C1)CCCC2 840172093 MCEFSELCTOYNEB-HNNXBMFYSA-N 279.355 2.441 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H]1COC[C@H]1C 926001433 ZRZYHIPKPASYSS-TZMCWYRMSA-N 292.379 2.349 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C[C@H]1CCC(=O)N1 925082535 XOOOKLJZPGPQGC-DZGCQCFKSA-N 289.423 2.208 10 20 CECD O=C(N[C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1cc(O)cs1 754498870 OULAHLHDFFVGAP-JLLWLGSASA-N 279.361 2.141 10 20 CECD CCNc1nccnc1NCc1cccc(OC)c1O 853258848 GMGMXVXIAHKJCI-UHFFFAOYSA-N 274.324 2.235 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cnn(C(F)F)c1 767901098 XJOWKDJMMBSPKB-RQOWECAXSA-N 295.245 2.341 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCOC[C@@H]1C)c1ccccc1O 868604781 RVFATVVBTJMZOP-YNEHKIRRSA-N 292.379 2.425 10 20 CECD Cc1cnc(N[C@H](C)Cc2ccc(O)c(O)c2)nc1 762800006 HFIJZLYGPPTFMP-SNVBAGLBSA-N 259.309 2.239 10 20 CECD Nc1ccc(Cc2nc(C(=O)N3C[C@H]4C[C@@H]4C3)cs2)cc1 876994400 HWBCBIAAKAMOAX-VXGBXAGGSA-N 299.399 2.408 10 20 CECD Cc1cc(O)c(CNCc2ccnc(N(C)C)n2)cc1C 776497186 QLBQKTOERFWZGH-UHFFFAOYSA-N 286.379 2.155 10 20 CECD C[C@@H](NCc1cccc(Cl)c1O)[C@H](O)C(F)(F)F 877693644 MRBRHINHQSCMRF-LDWIPMOCSA-N 283.677 2.447 10 20 CECD CC(C)(NC(=O)/C=C/c1ccc(O)c(O)c1)C1CC1 779523690 DMTIMGVOZIHWFP-XBXARRHUSA-N 261.321 2.416 10 20 CECD C[C@H](O)CCN(C)Cc1cc(Cl)cc(F)c1O 775702343 QLLHNZIXADIQMR-QMMMGPOBSA-N 261.724 2.387 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@H](OCC)[C@@H]2OC)c(O)c1 775979196 RQKSQTJWRXBGJA-VNQPRFMTSA-N 295.379 2.073 10 20 CECD Oc1ccc(F)cc1CN[C@H]1CCOC2(CCOCC2)C1 779092560 IQSJEPBYTIWITQ-AWEZNQCLSA-N 295.354 2.349 10 20 CECD Nc1ccc(CN2CCN(c3ccccc3O)CC2)cc1 1120263359 NQHWXEZVCWPDCK-UHFFFAOYSA-N 283.375 2.297 10 20 CECD COC1(C(=O)NCCCSc2nccs2)CCC1 781976570 XRTMDJQYORXFJA-UHFFFAOYSA-N 286.422 2.311 10 20 CECD C[C@@H](NC(=O)NCCCCCCN)c1ccccc1O 892212881 UHMWUZPBBCLAAR-GFCCVEGCSA-N 279.384 2.272 10 20 CECD COc1ccc(CN2CCOC3(CCC3)C2)c(O)c1OC 892106403 VCVDMIBCDZASIP-UHFFFAOYSA-N 293.363 2.164 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2c(F)cccc2C1 790906938 ZPVUPRSUTRQVFL-UHFFFAOYSA-N 287.290 2.435 10 20 CECD CN1CCCN(Cc2c(O)ccc(Cl)c2F)CC1 792161372 GIJMXZFRCRYGAH-UHFFFAOYSA-N 272.751 2.322 10 20 CECD CO[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 792164645 BRMYKRGGJPPAKD-MRVPVSSYSA-N 259.708 2.405 10 20 CECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)C1CC1 798637978 HXYLDBUHTQOUGW-XKEGTWDPSA-N 276.288 2.022 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)C(=O)NC(C)(C)C)c1 134653127 KCAPLWBNGNSAGG-NSHDSACASA-N 264.369 2.093 10 20 CECD CCc1noc(C)c1C(=O)NCc1ccccc1O 701164116 JLBUKVSVTBTBNW-UHFFFAOYSA-N 260.293 2.181 10 20 CECD O=C1NC(=S)S/C1=C/c1cccn1C1CC1 1325573273 GGKSKSMUWYIYDN-RMKNXTFCSA-N 250.348 2.312 10 20 CECD CCOC(=O)C[C@H]1CCCN1C(=O)Nc1ccc(N)cc1 1325333382 ZYQRPHYVXAWDEZ-CYBMUJFWSA-N 291.351 2.218 10 20 CECD CCc1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)n(C)n1 1337412329 DYYGWNJJXWGWRK-FNORWQNLSA-N 287.319 2.046 10 20 CECD O=C(NCCCSc1nccs1)Nc1ccnnc1 1261297665 JYIUDSCIYDCGRU-UHFFFAOYSA-N 295.393 2.237 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@@H](CF)C2)cc1 1346738810 LFYIUTGLVLGDFC-LBPRGKRZSA-N 265.332 2.160 10 20 CECD CN1CCN(c2ccc(CNC/C=C\Cl)cc2F)CC1 1352111538 HLEKPPGMPJCRPC-DJWKRKHSSA-N 297.805 2.420 10 20 CECD CC[C@@](C)(CO)NCc1cc(Br)ccc1O 152167790 IYEKZCQERRKQQX-LBPRGKRZSA-N 288.185 2.405 10 20 CECD COc1cccc(O)c1CNC[C@](C)(OC)C1CC1 812771979 FKOGCIOLXYCLFL-HNNXBMFYSA-N 265.353 2.306 10 20 CECD COc1ccc(N(C)CCn2c(C)csc2=O)cc1 844352816 JDOQMKHNTAAVRD-UHFFFAOYSA-N 278.377 2.363 10 20 CECD CN(CCC(=O)O)Cc1ccc(N2CCCC2)cc1 108245128 QCUZULIMFRGAFF-UHFFFAOYSA-N 262.353 2.193 10 20 CECD CCOc1cccc(CN[C@@H](C)CC[S@](C)=O)c1O 125566614 BGCMNPWYVLVSIQ-JEOXALJRSA-N 285.409 2.038 10 20 CECD CC(C)CN(CCN(C)C)C(=O)Nc1ccc(N)cc1 42782168 SCZPSBNLJASAIC-UHFFFAOYSA-N 278.400 2.320 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](C)[C@H]2CO)c1O 189698684 VBZBHVZEULKVDE-YMTOWFKASA-N 297.782 2.451 10 20 CECD c1cc2c(cc1CN[C@@H]1CCN(C3CC3)C1)CCCO2 709146577 FGJJLINEKBCFAU-OAHLLOKOSA-N 272.392 2.338 10 20 CECD CC[C@@H](C)N(CCO)Cc1cc(F)cc(C(C)=O)c1O 394400216 KSZFGNORFXAAIS-SNVBAGLBSA-N 283.343 2.327 10 20 CECD OCC[C@@H](NCc1ccc2c(c1)CCO2)C(F)(F)F 821206781 IPCPFFQLUDXZST-GFCCVEGCSA-N 275.270 2.024 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)NCc1c(O)cccc1Cl 113330513 GALAUYGHRFCNHK-NXEZZACHSA-N 284.787 2.438 10 20 CECD c1cncc(CCNCc2ccc(N3CCOCC3)cc2)c1 126165114 YUBLJJOPYGQFKF-UHFFFAOYSA-N 297.402 2.251 10 20 CECD CCOc1cccc(CN[C@@]2(C)CCOC2)c1O 120180427 OWFTZGWKDGQWPP-AWEZNQCLSA-N 251.326 2.060 10 20 CECD CN(C)CCCN(C)Cc1c(O)cccc1Cl 211512864 SEVYHCYBOXJWBF-UHFFFAOYSA-N 256.777 2.429 10 20 CECD COc1csc(C(=O)NCc2cc(OC)ccc2O)c1 80097434 FLRCTUPMLDEYNZ-UHFFFAOYSA-N 293.344 2.401 10 20 CECD CO[C@@H]1CCC[C@H]1NCc1ccc(N2CCOCC2)cc1 49948962 TYDFCUXKKHEICF-IAGOWNOFSA-N 290.407 2.180 10 20 CECD CN(Cc1ccc(C(=O)N(C)C)[nH]1)Cc1ccccc1O 91956610 SYTXEKMYUQZZET-UHFFFAOYSA-N 287.363 2.054 10 20 CECD C[C@H](NCc1cccc(C(N)=O)c1)c1cc(F)ccc1O 94617143 ANNKEKXXCVJGBT-JTQLQIEISA-N 288.322 2.481 10 20 CECD COc1ccc(O)c(CN2CCN(C)C[C@@H]2C(C)C)c1 182134092 HLBOOOXMWABCKD-OAHLLOKOSA-N 278.396 2.173 10 20 CECD CN1CCCc2cc(CNC(=O)NC3CCC3)ccc21 264362005 FQJNQMRNZNTFKP-UHFFFAOYSA-N 273.380 2.421 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)CC[S@@](=O)C1 277384595 GNGLUBFNBMYDSV-MLCYQJTMSA-N 287.812 2.246 10 20 CECD CC(C)Oc1ccc(N(C)CCn2cncn2)cc1 277363187 XFMFFOHXAHALSV-UHFFFAOYSA-N 260.341 2.202 10 20 CECD CCC(O)(CC)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273594069 PZJXCVQCRKRHJG-LLVKDONJSA-N 295.379 2.381 10 20 CECD Cc1nc(CCN[C@@H](C)c2cc(Cl)ccc2O)n[nH]1 273499059 YKGORZBAHYYAPQ-QMMMGPOBSA-N 280.759 2.365 10 20 CECD CC(C)[C@H]1C[C@H](NCc2cc3c(cc2O)OCO3)CCO1 271464231 GNCIECKXRJVTSX-TZMCWYRMSA-N 293.363 2.414 10 20 CECD C[C@H](NC(=O)N(C)Cc1ccccc1O)C(F)(F)F 288727517 FIYSGUSZOSJDAA-QMMMGPOBSA-N 276.258 2.484 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H]1[C@H]1CCCO1 807538434 DMJDUZZUIWKQMW-WDEREUQCSA-N 267.350 2.237 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)C(F)(F)F)c1O 290117318 IQISRSGXDLEGMA-LURJTMIESA-N 294.229 2.349 10 20 CECD CC1(C)CN(C(=O)c2c(F)ccc(O)c2O)CC(C)(C)O1 295157810 CUBOUZFEEGSMEF-UHFFFAOYSA-N 297.326 2.267 10 20 CECD C[C@@H](NCC(C)(C)N)c1ccc(N2CCOCC2)c(F)c1 817961026 WJZDJZFJOLZDNE-GFCCVEGCSA-N 295.402 2.050 10 20 CECD C[C@@H](N[C@@H]1CCCNCC1)c1cc(F)cc(F)c1O 817969202 RQDGZVJSTWGYBE-MWLCHTKSSA-N 270.323 2.463 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC(C)=NO1 824234174 FRXJNMZMQRBWLS-OAHLLOKOSA-N 289.379 2.266 10 20 CECD C[C@H](O)c1ncc(C(=O)N[C@H](C)c2ccccc2O)s1 827946431 HWWRAVHGBCULMN-BDAKNGLRSA-N 292.360 2.393 10 20 CECD Cc1cc(O)c(CNC[C@@H](O)C(C)C)cc1Cl 825278231 JCUUYHPCTGOORE-CYBMUJFWSA-N 257.761 2.461 10 20 CECD CC[C@H](CN1CCOCC1)N[C@H](C)c1ccc(F)cc1O 903343192 NJWUUJFMYNFWLJ-TZMCWYRMSA-N 296.386 2.293 10 20 CECD C[C@@H](NC[C@H](O)C1CCC1)c1cc([N+](=O)[O-])ccc1O 834906978 VKXKWIRUHPWOPK-OTYXRUKQSA-N 280.324 2.112 10 20 CECD C[C@@H](NC[C@H](O)C1CCC1)c1cc(F)cc(F)c1O 834904797 CTVMWZLIRMWRGC-OQPBUACISA-N 271.307 2.482 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)C2CCCC2)cc1 832292433 HABPAQVRPVBKFV-HNNXBMFYSA-N 275.396 2.059 10 20 CECD CON1CCC(N(C)Cc2cc(C)c(C)cc2O)CC1 835075966 GLLKOLQJBNWLCC-UHFFFAOYSA-N 278.396 2.467 10 20 CECD CCCN(C)CC(=O)NCc1ccc(N(CC)CC)cc1 730279020 RWDGFQLMAKGAQJ-UHFFFAOYSA-N 291.439 2.491 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@@H](C2CCC2)C1 839949969 VWYMMKXLNQAZLJ-LLVKDONJSA-N 261.321 2.360 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NOC2CCC2)c1 836569451 GORSPEVAKAPWSQ-VIFPVBQESA-N 280.324 2.245 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(CC)C1)c1ccc(N(C)C)cc1 834892486 VOKYCEZAZCRSMQ-GDBMZVCRSA-N 289.423 2.414 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2CC(=O)N(C3CC3)C2)c(O)c1 846204643 AGNYHRXPPZXHBT-QWHCGFSZSA-N 288.391 2.362 10 20 CECD Cc1cc(N(C)C)ccc1CNCCN1CCCC1 840936302 IXQFKWCLKIOUST-UHFFFAOYSA-N 261.413 2.246 10 20 CECD CCc1cccc(CN[C@H]2CCO[C@]3(CCOC3)C2)c1O 848899160 DFGQZXPASVDGRH-DOTOQJQBSA-N 291.391 2.382 10 20 CECD COc1cccc([C@H](C)NCCCN(C)C)c1O 846136494 IZKCWCGPCKMVCM-NSHDSACASA-N 252.358 2.003 10 20 CECD Cc1cc(Br)cc(CNC[C@H](N)C2CC2)c1O 841049739 NISHUAAWRXSJAQ-LBPRGKRZSA-N 299.212 2.290 10 20 CECD COc1cccc([C@@H](C)NCCC2(C)OCCO2)c1O 846161664 ADYWRYQHEGYMGE-LLVKDONJSA-N 281.352 2.205 10 20 CECD Nc1ccc(CCNC2CCN(c3ccccn3)CC2)cc1 841036485 SMCBBAOYIKPFGZ-UHFFFAOYSA-N 296.418 2.465 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C1(CN)CCC1 843125646 ZZJMVYFXEDZXAN-UHFFFAOYSA-N 272.751 2.498 10 20 CECD CCc1cccc(CNCc2cccn(CC)c2=O)c1O 848907273 KNQDLXFNWSGHBB-UHFFFAOYSA-N 286.375 2.426 10 20 CECD OC1CCN(c2ccc(CNc3cnccn3)cc2)CC1 853954677 NYWLYJWAFLFAGJ-UHFFFAOYSA-N 284.363 2.050 10 20 CECD CC[C@@H](NC(=O)NCc1cc(OC)ccc1O)C1CC1 853737050 YVTQWBYCRKBCJN-CYBMUJFWSA-N 278.352 2.389 10 20 CECD N[C@@]12CCC[C@@H]1CN(Cc1cc(Cl)ccc1O)C2 857226165 GSDKSPAWYWWTLU-BXUZGUMPSA-N 266.772 2.359 10 20 CECD O=C(OCCF)N(Cc1ccccc1O)C[C@@H]1CCCO1 859001696 WXPFWPWSEORUMH-ZDUSSCGKSA-N 297.326 2.479 10 20 CECD CCOC(=O)[C@H](NCc1cc(C)c(C)cc1O)C1CC1 1116739833 BOUYWSABCWSADW-OAHLLOKOSA-N 277.364 2.440 10 20 CECD CCOc1ccc(N2CCN(C(=O)C(C)(F)F)CC2)cc1 1117753576 SIBUIEDLOXYTTA-UHFFFAOYSA-N 298.333 2.389 10 20 CECD Cc1ccc(O)c(CN(C)Cc2ccc(C(N)=O)cc2)c1 1117590803 BRLRKVQGVOFNGS-UHFFFAOYSA-N 284.359 2.432 10 20 CECD CC(=O)NCC1CCN(Cc2c(C)cccc2O)CC1 876636438 YGXHXYGALDQXBE-UHFFFAOYSA-N 276.380 2.049 10 20 CECD Cc1cc(C(=O)N2C[C@H](N)C[C@@H]2C)c(C)n1-c1ccccn1 877175414 JNFDBKXHJUSZEO-SMDDNHRTSA-N 298.390 2.051 10 20 CECD COc1cccc(CNC(=O)NOC2CCCCC2)c1O 779688296 SAYZDAHIAMLWAC-UHFFFAOYSA-N 294.351 2.464 10 20 CECD CC[C@H](C[C@@H](C)CO)NCc1cc(OC)c(OC)cc1O 776220341 VTGZXYWWXGZJKT-DGCLKSJQSA-N 297.395 2.296 10 20 CECD CC[C@@H](NC[C@@]1(O)CCN(C)C1)c1cc(Cl)ccc1O 775555134 JSIPDESVBVVJEE-HIFRSBDPSA-N 298.814 2.153 10 20 CECD CC[C@@H](Nc1cnn(CCO)c1)c1ccccc1O 775541193 SGLYEGDDNRKEPM-CYBMUJFWSA-N 261.325 2.144 10 20 CECD CCOc1ccc(CN[C@@H]2CCn3ccnc3C2)c(O)c1 778187715 KUAMRUOMOWCGAL-CYBMUJFWSA-N 287.363 2.092 10 20 CECD CCN(CC)c1ccc(CNc2cc(C(N)=O)ncn2)cc1 881822068 XLGCHZYRDCBWLY-UHFFFAOYSA-N 299.378 2.034 10 20 CECD C[C@H](NC(=O)N[C@H](C)c1ccccc1O)[C@@H]1CCCNC1 891981522 LNIDZYWCTMKIFJ-YNEHKIRRSA-N 291.395 2.141 10 20 CECD COc1ccc(CN2CCC[C@@H](F)C2)c(O)c1OC 895192061 WYJLOKAIIXFUGY-LLVKDONJSA-N 269.316 2.343 10 20 CECD CC[C@@H](O)CCNCc1c(O)cccc1Br 706875070 MCFGTKOOHQYLHW-SECBINFHSA-N 288.185 2.405 10 20 CECD Cc1ncc(CCNC(=O)NCc2ccc(N)cc2)s1 1335540690 SAVPWVSVAKXCMZ-UHFFFAOYSA-N 290.392 2.076 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCO[C@@H](C)C1 770745337 GRVDJOIUNBTYMG-RYUDHWBXSA-N 265.353 2.306 10 20 CECD CN(Cc1ccccc1O)c1nnc(-c2ccco2)n1C 1341314499 HRRUHIALEKFLHJ-UHFFFAOYSA-N 284.319 2.417 10 20 CECD COc1ccc(CNC2CCSCC2)c(O)c1OC 1351986729 KBOWTGPTYDBWCY-UHFFFAOYSA-N 283.393 2.395 10 20 CECD CC[C@@H](C)n1nccc1C(=O)NCc1ccc(O)cc1O 1520240995 XAXCZAAKQYZUIB-SNVBAGLBSA-N 289.335 2.195 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)[C@@H]1C[C@H](C(=O)O)C1(C)C 1603239617 RPFUSQOXAMAWQB-FKTZTGRPSA-N 297.376 2.319 10 20 CECD COc1cccc(O)c1CNCCCCCC(=O)O 1610358991 OSLRCWGOTPEPLG-UHFFFAOYSA-N 267.325 2.135 10 20 CECD CCN(C)c1ccc(CN[C@H](C(=O)O)[C@@H](C)OC)c(C)c1 1776856629 UMNDZDISMOMCMO-DOMZBBRYSA-N 294.395 2.029 10 20 CECD C[C@@H](N=c1cc[nH]c(C(=O)O)c1)c1ccc(N(C)C)cc1 1776456644 HONUTURRANVMQX-LLVKDONJSA-N 285.347 2.441 10 20 CECD CCOc1cccc(CN[C@H](C)c2cn[nH]c2)c1O 229883651 IACKTVGXMKRTSZ-SNVBAGLBSA-N 261.325 2.365 10 20 CECD COc1cccc(CN[C@H]2CSC[C@H]2C)c1O 285375254 CMKCZLQYFQKBHU-KOLCDFICSA-N 253.367 2.242 10 20 CECD Cc1ccc(O)c(CNCc2ncc(Cl)n2C)c1 393466315 YPTLIPWZCLXRJP-UHFFFAOYSA-N 265.744 2.377 10 20 CECD COc1cccc(CNC(=O)c2cccs2)c1O 68488679 XOFMBYCEKIRASA-UHFFFAOYSA-N 263.318 2.392 10 20 CECD COc1cccc(CNC(=O)CC[C@H]2CCCCO2)c1O 111597711 KMLBTPMPAYMMAW-CYBMUJFWSA-N 293.363 2.366 10 20 CECD OC[C@@]1(NCc2ccccc2O)CCc2ccccc21 305190201 UYYWZCVGZZUSCW-KRWDZBQOSA-N 269.344 2.316 10 20 CECD COc1ccc(O)c(CN2CCOC[C@@H]2C2CC2)c1 180426155 NTUCBTFEAQGICQ-CQSZACIVSA-N 263.337 2.012 10 20 CECD COC(=O)c1ccc(CN(C)c2ccc3c(c2)OCO3)o1 121307148 GTJRKINIJADKGV-UHFFFAOYSA-N 289.287 2.431 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1c(O)cccc1Cl 120610682 HBXGOIGTMBVYJI-VIFPVBQESA-N 271.744 2.287 10 20 CECD CSCC[C@@H](C)NCc1cc2c(cc1O)OCO2 130768587 MKUSECKVMMBCDB-SECBINFHSA-N 269.366 2.352 10 20 CECD CN1C(=O)/C(=C/c2csc([N+](=O)[O-])c2)SC1=S 48642721 NCPRKQAZECRNOJ-KXFIGUGUSA-N 286.359 2.487 10 20 CECD COc1cccc(CN2CCCO[C@@H](C)C2)c1O 134155752 RUFXKWSBZMKNBS-NSHDSACASA-N 251.326 2.012 10 20 CECD c1cc(N2CCOCC2)ccc1CNCCOCC1CC1 224524682 HZXUHTUASABNKG-UHFFFAOYSA-N 290.407 2.039 10 20 CECD COc1cccc(CN(C)[C@@H]2CCN(C)C[C@@H]2C)c1O 290466430 NGVPPFVBGGCZOK-GXTWGEPZSA-N 278.396 2.173 10 20 CECD CC[C@H](C)NC(=O)CCN[C@H]1CCc2cccc(O)c21 295826678 DRWLZKHQSCXZQI-AAEUAGOBSA-N 276.380 2.274 10 20 CECD CCOc1cccc(CN[C@H]2CCc3c[nH]nc3C2)c1O 363935502 BPMCGOJUKIXVLT-ZDUSSCGKSA-N 287.363 2.161 10 20 CECD CCCOc1ccc(CN[C@H](C)c2ncnn2C)c(O)c1 276770641 VUQFSFFLAQFWCE-LLVKDONJSA-N 290.367 2.160 10 20 CECD Cc1ccc([C@@H](C)NCCC(=O)N(C)C)c(O)c1C 273364176 AXXOQCKIHYFSJW-GFCCVEGCSA-N 264.369 2.138 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cncn1C 278278106 GAHKQAJLGZQFEY-UHFFFAOYSA-N 273.336 2.178 10 20 CECD NC1[C@H]2CCC[C@H]1CC(C(=O)NCc1ccccc1O)C2 285533587 CSRXERHTCKSGET-AVHCAHFISA-N 288.391 2.162 10 20 CECD CCOCC(C)(C)CNCc1cc([N+](=O)[O-])ccc1O 288675797 WRDKJRHTKLFDIM-UHFFFAOYSA-N 282.340 2.453 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@]3(CCOC3)C2)c1 280357250 UCGLWXMXWQMMNH-XJKSGUPXSA-N 277.364 2.080 10 20 CECD CO[C@@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)CC1 371687536 YZXRHRLTFSTBOG-LLVKDONJSA-N 279.336 2.047 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCOC[C@@H]2C)cc1OC 289236823 DJZGRXNPDOVMEI-RYUDHWBXSA-N 295.379 2.172 10 20 CECD CN(C(=O)c1cc(O)cs1)C1C[C@@H]2CC[C@H](C1)N2C 807696037 ZAITYGHBRGINTR-ZACCUICWSA-N 280.393 2.151 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](F)C(F)(F)F 293546982 SOLHXYWFRBVVSO-WKEGUHRASA-N 295.232 2.045 10 20 CECD CC(=O)NCC[C@H]1CCCN(Cc2cc(C)ccc2O)C1 809778158 LBFQDFFNHQNYHA-OAHLLOKOSA-N 290.407 2.439 10 20 CECD CCN(CC)c1ccc(CNCc2cnn(C)n2)cc1F 290117598 LTMKWLBKAGPZJG-UHFFFAOYSA-N 291.374 2.090 10 20 CECD COC[C@]1(CN[C@@H](C)c2c(C)cc(C)cc2O)CCCN1 817973683 GIKGBLKNTYJIJU-WMLDXEAASA-N 292.423 2.428 10 20 CECD Cc1cccc(CNCC(C)(C)[C@@]2(O)CCCOC2)c1O 827593716 ATWGNSOMQYCISH-QGZVFWFLSA-N 293.407 2.358 10 20 CECD CO[C@H]1COCC[C@H]1CNCc1c(O)cccc1Cl 824710445 YWFQGPSIOVDLSU-HZMBPMFUSA-N 285.771 2.187 10 20 CECD COc1ccc(-c2nn[nH]n2)cc1NCc1ccccc1O 826186744 JCFISRMUHUFDKC-UHFFFAOYSA-N 297.318 2.193 10 20 CECD O=C(O)CCCNCc1cc(Cl)cc(F)c1O 821525888 HLWIJUCEZCUCOY-UHFFFAOYSA-N 261.680 2.139 10 20 CECD CN1CCN(c2ccc(CN3CC[C@H]4C[C@@H]4C3)cc2)CC1 827507683 YVXCVMHBMJQALA-DLBZAZTESA-N 285.435 2.280 10 20 CECD C[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)c2nccn21 825017914 ZVHGVAUKFHEACN-CABZTGNLSA-N 288.307 2.293 10 20 CECD COc1ccc(O)c(CNC(=O)NC[C@@H]2CC2(C)C)c1 734070024 RBJMRGMPCXAJGT-NSHDSACASA-N 278.352 2.246 10 20 CECD C[C@H](C[C@H](O)c1ccco1)NC(=O)c1cc(O)cs1 830118775 FPIITVMXIMAOPY-SCZZXKLOSA-N 281.333 2.289 10 20 CECD COC(=O)c1ccoc1COC(=O)c1cc(O)cs1 731911580 MJGUKMJWVPQQAQ-UHFFFAOYSA-N 282.273 2.190 10 20 CECD CCC[C@@H](C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832292280 DWYKYKAALPVDGL-IUODEOHRSA-N 277.412 2.305 10 20 CECD CSC(C)(C)C(=O)N(C)Cc1ccccc1O 830140376 BBCIFHHITMJQPG-UHFFFAOYSA-N 253.367 2.492 10 20 CECD CC(C)(C)OCCCC(=O)NCc1ccc(O)cc1O 910946972 XMJPZEDCVTUBPW-UHFFFAOYSA-N 281.352 2.309 10 20 CECD Cc1ccn2cc(CNC(=O)Cc3ccc(N)cc3)nc2c1 746319387 WVPQGYTWNKFBMY-UHFFFAOYSA-N 294.358 2.084 10 20 CECD COc1ccc(N(C[C@@H]2CCC(=O)N2)C(C)C)cc1F 844306899 MCPZPIVWBUMPGC-NSHDSACASA-N 280.343 2.328 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)CC[C@H]1N 843052025 OROTUMJYBITVGJ-BXKDBHETSA-N 254.761 2.215 10 20 CECD CO[C@@H](CNC(=O)NCCc1ccc(N)cc1)C(C)(C)C 841958809 SYFZKWYPQKYRRU-AWEZNQCLSA-N 293.411 2.172 10 20 CECD CN(C)c1ccc(CNCCC[C@H]2CCCN2)cc1 841072092 GEZXCQKFGFOSDF-HNNXBMFYSA-N 261.413 2.374 10 20 CECD CCCN(Cc1ccc(OCC)cc1O)[C@H]1CCNC1 843052589 OCTCLIFPLYTZDE-AWEZNQCLSA-N 278.396 2.365 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2cc(C)ns2)c1 749232881 IJFNSHXLQVDATM-UHFFFAOYSA-N 293.348 2.487 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)OCCF)C2)cc1 859196198 NORHYYKSGSDUNY-GFCCVEGCSA-N 296.342 2.217 10 20 CECD CCN(C)c1ccc(CN2CCc3cnc(N)nc3C2)cc1 857924763 XJJWMDJEYPVZIY-UHFFFAOYSA-N 297.406 2.073 10 20 CECD Oc1ccc2c(c1)CN(Cc1cc3c(cc1O)OCO3)C2 862449627 IDXHKSFVLBBEJF-UHFFFAOYSA-N 285.299 2.342 10 20 CECD CC[C@@H](CO)NCc1ccc(N2CCC(OC)CC2)cc1 931771342 FGFLBSIFPRKEID-HNNXBMFYSA-N 292.423 2.162 10 20 CECD CCOc1ccc(N(C)CCOC(=O)N(C)C)cc1 1119312654 LIIOELKTCVMQOQ-UHFFFAOYSA-N 266.341 2.220 10 20 CECD CCCN(CC)Cc1cc2c(cc1O)OC[C@@H]2O 768444568 MIDWOCUIQGQWDO-ZDUSSCGKSA-N 251.326 2.050 10 20 CECD CO[C@]1(CN[C@H](C)c2ccc(C)c(C)c2O)CCOC1 763573558 SVTGFMIJMXBODD-CJNGLKHVSA-N 279.380 2.465 10 20 CECD CC[C@@H](NCc1ccc(N2CCCC2)cc1)C(=O)O 1118176392 AUIDFAXCEMRTOV-CQSZACIVSA-N 262.353 2.240 10 20 CECD COc1ccc(CN[C@H](CC2CC2)C(=O)O)cc1C 871882865 VLEGCBIJYKDJOO-CYBMUJFWSA-N 263.337 2.347 10 20 CECD CC[C@@]1(O)CCCN(Cc2cc(OC)c(OC)cc2O)C1 877691729 UPRQJTKVCOJRJI-MRXNPFEDSA-N 295.379 2.146 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@@H](c1cc([N+](=O)[O-])ccc1O)N2 877864255 OKXGDNKOWCSAGZ-AWEZNQCLSA-N 299.286 2.463 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC(C)(C)C2)c1O 877717610 MJFAMBGUCTXSIA-UHFFFAOYSA-N 266.297 2.151 10 20 CECD Nc1ccc(OCc2cn(CC3CC(F)(F)C3)nn2)cc1 881311278 FOVMTPJUBSMEHV-UHFFFAOYSA-N 294.305 2.485 10 20 CECD c1cc(N2CCCCC2)ccc1CNC[C@@H]1COCO1 894868889 MYYJVUUFVQHGNJ-MRXNPFEDSA-N 276.380 2.139 10 20 CECD CC[C@H](NCc1ccc(OC)c(OC)c1O)[C@@H](O)C(C)C 894915432 LKXKZMYCOXASJQ-JSGCOSHPSA-N 297.395 2.295 10 20 CECD Cc1cccc(CN2C[C@H](C)S(=O)[C@@H](C)C2)c1O 792191989 HZRZSUIGUFUUNU-RYUDHWBXSA-N 267.394 2.042 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2cncc(F)c2)c1 799234367 RDGSEIFFYYQUBV-UHFFFAOYSA-N 291.282 2.257 10 20 CECD CC(C)N(C)S(=O)(=O)Nc1ccc(O)cc1Cl 85205219 REKUTEKSFCWHQZ-UHFFFAOYSA-N 278.761 2.043 10 20 CECD CNC(=O)[C@H](C)CN(C)Cc1ccc(N2CCCC2)cc1 1323317917 BXKGFCLPOUQFSW-CQSZACIVSA-N 289.423 2.101 10 20 CECD CC[C@@H](O)CNCc1c(O)cccc1Br 706852267 ZHCDLTZQORKZBM-MRVPVSSYSA-N 274.158 2.015 10 20 CECD Oc1cccc2c1[C@H](NCc1cccnc1O)CC2 714954663 WAAYPLMBWMIVTP-GFCCVEGCSA-N 256.305 2.270 10 20 CECD C[C@@H](CCO)CNCc1ccc(N2CCCC2)cc1 97436447 WBBCOVAJULYNLN-AWEZNQCLSA-N 262.397 2.395 10 20 CECD O=C(O)C1(CNCc2cc(Cl)cc(F)c2O)CC1 1601707397 GKCBJGIAWKTEBO-UHFFFAOYSA-N 273.691 2.139 10 20 CECD C[C@H](N)[C@@H](C)C(=O)NCc1c(O)ccc2ccccc12 1576088908 UVPXHDRWAMBNCG-MNOVXSKESA-N 272.348 2.145 10 20 CECD CC[C@@H]1CN(C(=O)Cc2ccc(N)cc2)[C@H](CC)CO1 404048778 JPGHRDGQDZWELX-HUUCEWRRSA-N 276.380 2.227 10 20 CECD CN(C)[C@H](CNCc1ccc(N)cc1)c1ccco1 1578408384 KPWWHEUDVGQDNK-CQSZACIVSA-N 259.353 2.254 10 20 CECD COc1ccc(O)c(CNCCCOC[C@@H]2CCCO2)c1 20146936 IVLPWYONHLIGAI-HNNXBMFYSA-N 295.379 2.076 10 20 CECD Cc1ccc(CCNC(=O)N(C)Cc2ccccc2O)cn1 111887183 WOOFWEYXMMNGTD-UHFFFAOYSA-N 299.374 2.480 10 20 CECD CCNC(=O)CN(CC)Cc1ccc(N(CC)CC)cc1 119342439 YRAWFFUBOLACOS-UHFFFAOYSA-N 291.439 2.491 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1csnn1 154925360 CDJSIPHNTHJJPZ-UHFFFAOYSA-N 276.365 2.003 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CC[C@@H](N)C2)cc1 178711700 LWBUNWZDHPBQRW-HUUCEWRRSA-N 289.423 2.276 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccc(F)c2)c1 78726263 WOBNHXQEUOAPOS-UHFFFAOYSA-N 275.279 2.470 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@@H]2CCSC2)cc1 75463834 GIEOWCIQSMNEEB-GFCCVEGCSA-N 279.409 2.057 10 20 CECD Nc1ccc(CNC(=O)CC2CCSCC2)cc1 157535919 RBGPMGLVEIMYLO-UHFFFAOYSA-N 264.394 2.418 10 20 CECD C[C@@H]1C[C@H]1c1cc(NC(=O)c2cccc(O)c2O)[nH]n1 192993341 CIUNUGIXUQAUEJ-VXNVDRBHSA-N 273.292 2.197 10 20 CECD Cc1cc(O)c(CN2CCC[C@@]23CCOC3=O)cc1C 190036975 WGZNNDQRGOFRQU-INIZCTEOSA-N 275.348 2.291 10 20 CECD CCOC(=O)N1CCC(NCc2cc(F)ccc2O)CC1 226584041 HWBKQJZUOJQQNR-UHFFFAOYSA-N 296.342 2.242 10 20 CECD Cc1ccc(O)c(CN2CCNC(=O)[C@H]2c2ccccc2)c1 92675996 XQPZFCRITQUONV-QGZVFWFLSA-N 296.370 2.374 10 20 CECD Cc1ccc([C@H](C)NC[C@]2(O)CCO[C@@H]2C)c(O)c1C 278866541 RODYTVFOEVUZMX-WOSRLPQWSA-N 279.380 2.200 10 20 CECD CNC(=O)C1CCC(N[C@@H](C)c2ccccc2O)CC1 272931937 ZQMLASCOSGVROP-HIFPTAJRSA-N 276.380 2.348 10 20 CECD COC[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCCO1 278928502 USMWMBXFYMTMCR-HOCLYGCPSA-N 296.386 2.175 10 20 CECD COc1cccc(CNC(=O)C2Cc3ccccc3C2)c1O 277665983 NPCDYYATESSWPZ-UHFFFAOYSA-N 297.354 2.432 10 20 CECD CCOc1cccc(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)c1O 271175574 FUUNDNFJQPIYJU-PVUDRZGPSA-N 297.420 2.132 10 20 CECD Cc1ccc(O)c(CN2CCOCC(F)(F)C2)c1 290241170 USLIUVSHFXYLMW-UHFFFAOYSA-N 257.280 2.168 10 20 CECD CCN(C)C(=O)[C@@H](N[C@H]1CCc2cccc(O)c21)C(C)C 296581083 UIUFQWJFQDPGLU-BBRMVZONSA-N 290.407 2.472 10 20 CECD C[C@@H]1C[C@@H](NCC(C)(C)N)c2c(O)ccc(F)c21 817960277 LNJFZNVVJKFKTE-PSASIEDQSA-N 252.333 2.407 10 20 CECD COC(=O)c1cn(Cc2ccc(N(C)C)cc2)c(C)n1 814756667 TXRHHHYDHDVTMG-UHFFFAOYSA-N 273.336 2.092 10 20 CECD CN(C)c1ccc(CNC[C@@H](O)CC(F)(F)F)cc1F 818985075 MWEIORRUABRMTE-JTQLQIEISA-N 294.292 2.295 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)CC(F)(F)F 819077888 QFKANSAIBXIUHT-ZDUSSCGKSA-N 290.329 2.464 10 20 CECD Cc1cc(O)c(CN(CC(F)F)C[C@H](C)O)cc1C 825098154 BKVJHZKIRXJDIC-NSHDSACASA-N 273.323 2.457 10 20 CECD OC[C@@H]1CCC[C@@H]1NCc1cc(Cl)c(F)cc1O 825188378 JUDVYKOGBRRIBK-UFBFGSQYSA-N 273.735 2.435 10 20 CECD O=C(O)[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 821511171 CSTPOTOWAOLHDL-ZETCQYMHSA-N 273.691 2.091 10 20 CECD CNC(=O)c1cccc(NC(=O)c2cc(O)cs2)c1C 731869407 GYBWQOUXBDKJIX-UHFFFAOYSA-N 290.344 2.374 10 20 CECD O=C(O)C[C@@H](NC(=O)c1cc(O)cs1)c1ccccc1 738564561 ANFVRHQZMGWCAH-LLVKDONJSA-N 291.328 2.400 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@@]23CCC[C@@H]2C3)cc1 913926432 CINZCDYROZSUOG-CZUORRHYSA-N 273.380 2.494 10 20 CECD CC[C@H]1CN(C)CCN1Cc1cc(OC)c(C)cc1O 840091095 IWPDPJWFDSVHDK-AWEZNQCLSA-N 278.396 2.235 10 20 CECD C[C@@H](NCCC(C)(C)S(C)(=O)=O)c1ccccc1O 840876541 NUJGHKHKKFRIED-LLVKDONJSA-N 285.409 2.256 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C(=O)N1CCCC1 840942676 UGJKZTWTMOWKDH-AWEZNQCLSA-N 289.423 2.162 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2ccccc2O)C1 840976924 ZGBDEMFHRTUSBW-HNNXBMFYSA-N 263.337 2.167 10 20 CECD C[C@@H](Nc1cc(=O)n(C)cn1)c1ccc(N(C)C)cc1 848682067 ZZJBKLIZLXEJCM-LLVKDONJSA-N 272.352 2.019 10 20 CECD CCCCC[C@H](C)NC(=O)C(=O)Nc1ccc(N)cc1 840999662 GSBSCRIYQWAMTJ-NSHDSACASA-N 277.368 2.292 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@@H]3OCC[C@@H]32)cc1 850752853 UDONUBNFEKUXDT-STQMWFEESA-N 261.325 2.054 10 20 CECD CCOC(C)(C)C(=O)NCc1ccc(N(C)C)cc1 864573424 LFGWHSFTSYWHDX-UHFFFAOYSA-N 264.369 2.184 10 20 CECD CCNC(=O)CN(C)Cc1ccc(N(CC)CC)c(F)c1 768914303 GEZFMJNJWKHQIO-UHFFFAOYSA-N 295.402 2.240 10 20 CECD Cc1ncoc1CNC(=O)NCc1ccc(N(C)C)cc1 866106746 FOGVLRPCSIHJOC-UHFFFAOYSA-N 288.351 2.048 10 20 CECD COc1nc(C)cc(N(C)Cc2ccccc2O)n1 760576679 KMPKFGLUIORPDP-UHFFFAOYSA-N 259.309 2.136 10 20 CECD CCCOc1ccc(CN[C@@]2(CO)CCOC2)cc1C 873105436 WCKRYOPIKVFBFO-MRXNPFEDSA-N 279.380 2.025 10 20 CECD CC[C@]1(O)CCN(Cc2cc(Cl)cc(OC)c2O)C1 779217818 CLIZPNRCCRYBLP-AWEZNQCLSA-N 285.771 2.401 10 20 CECD Cc1ccc(CN2CCC[C@H](CCC(N)=O)C2)c(O)c1 876649795 FWVIIGBTEFODEL-CYBMUJFWSA-N 276.380 2.178 10 20 CECD Cc1nnc(O)c(CN[C@@H]2CCc3cccc(O)c32)c1C 1117831008 JVIDMKSUHZQDBI-CYBMUJFWSA-N 285.347 2.282 10 20 CECD OC[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1116444509 WVEGAIXKDCUVSU-OAHLLOKOSA-N 260.381 2.101 10 20 CECD O=C(NC1CC1)c1ccc(NCc2ccccc2O)nc1 774524408 SLHWBPLDZFXUET-UHFFFAOYSA-N 283.331 2.292 10 20 CECD CC1(C)[C@@H](O)C[C@H]1NCc1cc(Cl)cc(F)c1O 779190734 GVRYDSKRUQBOKO-MNOVXSKESA-N 273.735 2.434 10 20 CECD COc1ccc(CN(C)C[C@H]2CCCOC2)c(O)c1OC 891948490 JSZNQNUFKYQVIN-GFCCVEGCSA-N 295.379 2.268 10 20 CECD COc1ccc(CN(C)Cc2ccccn2)c(O)c1OC 893546143 PTMQUNPUWNGGSW-UHFFFAOYSA-N 288.347 2.436 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](CO)C[C@H]1CCCO1 895749433 QZPCZWFNOINWKT-NVXWUHKLSA-N 292.423 2.081 10 20 CECD CCOc1cccc(CN2CCC[C@H](C(=O)O)C2)c1O 77253443 XGQLRRFLWMVCDP-LBPRGKRZSA-N 279.336 2.088 10 20 CECD C[C@@H](NC[C@@]1(O)CCSC1)c1ccc(F)cc1O 185638617 DEMAPXIBIRHHRR-RNCFNFMXSA-N 271.357 2.050 10 20 CECD COC[C@@H]1CN(CCN=[N+]=[N-])C[C@@H]1C(F)(F)F 409436248 YVYPBCLQDNOEBE-YUMQZZPRSA-N 252.240 2.053 10 20 CECD C[C@@H](CCO)CNCc1c(O)cccc1Br 706872026 WMYBLMBBANSYED-VIFPVBQESA-N 288.185 2.263 10 20 CECD Nc1ccc(CN[C@]2(CO)CCOc3ccccc32)cc1 1336287249 ZIFUAQVIXSZLBO-KRWDZBQOSA-N 284.359 2.029 10 20 CECD CC(C)[C@H]1C[C@@H](NC(=O)NCc2ccc(N)cc2)CCO1 1335546103 MPEIAGTWKNPMAG-LSDHHAIUSA-N 291.395 2.272 10 20 CECD COc1cccc(CNC(=O)[C@H]2CCOC(C)(C)C2)c1O 1262614283 CRUUBCDGCSOTCL-NSHDSACASA-N 293.363 2.222 10 20 CECD Nc1ccc(CNC(=O)NC[C@@H]2CCCSC2)cc1 1262582379 TUTKLDIUSOCVMR-LBPRGKRZSA-N 279.409 2.211 10 20 CECD CC[C@H](NCC1CC1)c1cccc(-c2nn[nH]n2)c1O 1590466686 LTKWJNZGGDURAW-LBPRGKRZSA-N 273.340 2.023 10 20 CECD C[C@H](NC1CCC(N)CC1)c1cc(C(=O)O)ccc1O 1593222127 HVAXKHHMBDAMPK-GCVQQVDUSA-N 278.352 2.011 10 20 CECD CN(CC=C1CCOCC1)c1ccc(OCC(=O)O)cc1 1777054174 YPALLRJKEZYNKB-UHFFFAOYSA-N 291.347 2.323 10 20 CECD C[C@@H]1SCCN(C(=O)Cc2ccc(N)cc2)[C@H]1C 157076542 OWGHZLDLSDXSLB-QWRGUYRKSA-N 264.394 2.164 10 20 CECD CC(C)[C@@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)CCO1 831505992 NGVMAMUMTNGBKJ-GJZGRUSLSA-N 276.380 2.131 10 20 CECD COc1ccc(O)c(CNCC2(C)CCOCC2)c1 224897492 PZCHQUUSDKOEDF-UHFFFAOYSA-N 265.353 2.307 10 20 CECD c1c[nH]c(CNCCCSc2nccs2)n1 123144021 DFZLVRFBLJNQBD-UHFFFAOYSA-N 254.384 2.138 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)[C@@H](C)N 156574318 JMGLBQOKJYOMHE-QWHCGFSZSA-N 277.412 2.084 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2([S@@](C)=O)CC2)c1 282342569 OWMNLPZJLSXVMZ-ADLMAVQZSA-N 267.394 2.262 10 20 CECD CCN(CCCN(C)C)Cc1cc(F)cc(F)c1O 708413861 ONKLTZKSRSPACY-UHFFFAOYSA-N 272.339 2.444 10 20 CECD CC[C@@H](C)N(C)CCNCc1cc(F)cc(F)c1O 708517795 TVCOIEXIWYJKAL-SNVBAGLBSA-N 272.339 2.490 10 20 CECD Cc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)ncn1 121546953 XZIULHKDWOSHEV-UHFFFAOYSA-N 296.374 2.097 10 20 CECD COc1cc(Cl)cc(CN(C)CC[C@@H](C)O)c1O 184695390 YMBGXPPMFAXEGL-SECBINFHSA-N 273.760 2.257 10 20 CECD C[C@H]1CN(C(=O)c2cccc(O)c2O)C[C@@H](C)S1 126430206 WMUXAFHDIHAHSI-DTORHVGOSA-N 267.350 2.064 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](N)CC(C)C 37807409 NWXLPNLUPXXKBH-MRXNPFEDSA-N 291.439 2.475 10 20 CECD O=C(O)[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 86727962 PLTZWNXFOUQNBD-VIFPVBQESA-N 269.728 2.342 10 20 CECD C[C@H]1CN[C@H](C)CN1Cc1cc(Cl)ccc1O 83407783 VJFTZCWYIRDLBS-ZJUUUORDSA-N 254.761 2.228 10 20 CECD Oc1c(Cl)cccc1CNCCCn1cccn1 135753987 DMSUGSABDFTZDJ-UHFFFAOYSA-N 265.744 2.422 10 20 CECD COc1ccc(N2CCC(NCCF)CC2)cc1 368536043 CQXGCUQMZYAWBR-UHFFFAOYSA-N 252.333 2.223 10 20 CECD COc1cc(O)c(CN[C@H](CO)CC2CCC2)cc1OC 279953015 ZSGYJGCZTHALFE-ZDUSSCGKSA-N 295.379 2.050 10 20 CECD Cc1cc(C)c([C@H](C)NCC2(C)OCCO2)c(O)c1 284937768 DSFJZNSTOOPKGG-LBPRGKRZSA-N 265.353 2.423 10 20 CECD CC(=O)C(=O)CSc1nnc(CCc2ccccc2)o1 808024752 YXXLENJYYACZEL-UHFFFAOYSA-N 290.344 2.105 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@H]2CC(=O)N(C)C2)c1O 808689170 ZLTFJSLXCLUFBV-KOLCDFICSA-N 282.771 2.235 10 20 CECD CCOc1cccc(CN2CCn3cncc3C2)c1O 291670903 WHPZIKUHHNAHMX-UHFFFAOYSA-N 273.336 2.003 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)C[C@H](C)N)CC2)cc1 817903502 QBESFDDPOUIGSD-KBPBESRZSA-N 291.439 2.379 10 20 CECD CC(C)C[C@@H](CN)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 817957584 DDQWFTPKSLZWIR-QWRGUYRKSA-N 281.356 2.324 10 20 CECD Cc1cc(C)c([C@@H](C)NCCN2CCO[C@@H](C)C2)c(O)c1 815576683 WDZKHWFIIFLUEE-LSDHHAIUSA-N 292.423 2.380 10 20 CECD CC1(C)CN(Cc2cccc(Cl)c2O)C[C@H](CO)O1 817413587 ZVDXPDBQEDVMSM-LLVKDONJSA-N 285.771 2.017 10 20 CECD CC[S@](=O)CCNCc1cc(Cl)c(C)cc1O 825282921 AVBUJTCDXUAGFV-KRWDZBQOSA-N 275.801 2.212 10 20 CECD CC1(CCC(=O)N(CC(=O)O)Cc2ccccc2O)CC1 907832194 OTABEPOXVLMHOI-UHFFFAOYSA-N 291.347 2.386 10 20 CECD CN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(O)cs2)C1 830576306 FNFRTROAAUSVRR-JQWIXIFHSA-N 280.393 2.010 10 20 CECD CC[C@@H](NC[C@H]1CCCNC1=O)c1ccc(N(C)C)cc1 840827202 GCQBNFCARLXHBL-GDBMZVCRSA-N 289.423 2.320 10 20 CECD CCOc1ccc(O)c(CN2CCC([C@H](C)N)CC2)c1 843052500 MRQCVMJBAGHNST-LBPRGKRZSA-N 278.396 2.350 10 20 CECD CCN(CC)c1ccc(CNC[C@H](C)CN)cc1F 841049475 RYPGRGSEPZJLIV-GFCCVEGCSA-N 267.392 2.356 10 20 CECD O=C(N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1cc(O)cs1 754498875 OULAHLHDFFVGAP-WCQGTBRESA-N 279.361 2.141 10 20 CECD CC(=O)Nc1c(-c2ccccn2)nc2ccccn12 751302278 MUVMOKKILQABCQ-UHFFFAOYSA-N 252.277 2.355 10 20 CECD C[C@@H](NC1COC(C)(C)OC1)c1cc(F)ccc1O 757706519 WCDSGMWUGLXSAI-SECBINFHSA-N 269.316 2.333 10 20 CECD CCOC(=O)CCN(C(=O)c1cc(O)cs1)C1CC1 754484887 YSDHFLUOXSJMFV-UHFFFAOYSA-N 283.349 2.012 10 20 CECD CN(C)c1ccc(CN[C@@]2(C)CC(C)(C)OC2=O)cc1 930872510 MEUKQYLITICWEV-INIZCTEOSA-N 276.380 2.326 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(c3ccccn3)CC2)c1 869411529 VPVUWOSBUHPJOH-UHFFFAOYSA-N 282.343 2.444 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)CC1(O)CCC1 761219334 NMVBKYRRGJOWMQ-UHFFFAOYSA-N 266.360 2.239 10 20 CECD CO[C@@H](C)CCNC(=O)N[C@H](C)c1ccccc1O 868219154 PLSKDBBQOUUCGZ-WDEREUQCSA-N 266.341 2.177 10 20 CECD CCOc1ccc(CN(C)Cc2ccon2)c(O)c1 769467801 YYESWXNBFCMFCE-UHFFFAOYSA-N 262.309 2.411 10 20 CECD Cc1ccc(CN2C[C@@H](C)O[C@@]3(CCCOC3)C2)c(O)c1 877495549 YLSTWCCXUIPOEA-PBHICJAKSA-N 291.391 2.471 10 20 CECD OCCCN(Cc1cccc(Cl)c1O)C1CC1 775700709 HWQNLZRMZLRKEE-UHFFFAOYSA-N 255.745 2.392 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@H]1C(=O)N(C)Cc1ccccc1O 878277302 QXSUUOIVUJSTLY-ZBEGNZNMSA-N 299.374 2.440 10 20 CECD COc1cc(C)cc(CNCc2snnc2C)c1O 894843669 JUIIPBMPAYTJPB-UHFFFAOYSA-N 279.365 2.159 10 20 CECD Oc1c(Cl)cc(Cl)cc1CNC[C@@H]1COCO1 894873318 QPVXDKVXCMADJF-SECBINFHSA-N 278.135 2.162 10 20 CECD Cc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)cn1 795347160 GMMIGHIBJLSDPA-UHFFFAOYSA-N 282.296 2.036 10 20 CECD CC[C@H](NC[C@H](O)c1cnn(C)c1)c1ccc(F)cc1O 796790165 XPNRFFLKDCCONH-ZFWWWQNUSA-N 293.342 2.039 10 20 CECD CC[C@H](NC[C@](C)(O)COC)c1ccc(C)cc1O 794811362 WZQHTSCGJKKEGB-ZFWWWQNUSA-N 267.369 2.139 10 20 CECD Cc1cnn(C)c1CNCCCSc1nccs1 796308443 CBCTVMOBNNZGNG-UHFFFAOYSA-N 282.438 2.457 10 20 CECD Oc1ccc(F)cc1CNC[C@@H](O)c1ccccc1 83445677 DAZLYYQZOURPFP-OAHLLOKOSA-N 261.296 2.355 10 20 CECD CCOC(=O)CCN(Cc1ccc(N)cc1)CC1CC1 1336116528 FIBPBSZENCJCSD-UHFFFAOYSA-N 276.380 2.434 10 20 CECD CC(C)Cn1cc(C(=O)NCc2ccc(N)cc2)cn1 1343565827 AVIXDTBOZUICEM-UHFFFAOYSA-N 272.352 2.051 10 20 CECD C[C@@H]1NCCN(Cc2ccc(N3CCCC3)cc2)[C@@H]1C 1345942502 BADIHXWRZXOKIO-LSDHHAIUSA-N 273.424 2.469 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CC1(CC(=O)O)CC1 1606059468 GVERDXAMMKMIMV-UHFFFAOYSA-N 290.363 2.206 10 20 CECD Cc1cc(Cl)cc(CN[C@]2(CC(=O)O)CCOC2)c1O 1610462203 FRCUOSGDHMUKLN-AWEZNQCLSA-N 299.754 2.077 10 20 CECD CN(C)c1ccc(/C=C\CNC[C@H]2C[C@@H](N)C2)cc1 1578425775 MHBVHHKEKANHRV-JQBDECOXSA-N 259.397 2.093 10 20 CECD C[C@H](NCCCCCCN)c1cc(C(=O)O)ccc1O 1593265743 WOYMWZGXSPSNRT-NSHDSACASA-N 280.368 2.260 10 20 CECD CC(=O)N1CC[C@H](CN(C)Cc2cc(C)cc(C)c2O)C1 165082341 VGHBIQIVIBCYDT-OAHLLOKOSA-N 290.407 2.309 10 20 CECD CC(C)COC[C@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 151421415 CCKZNNJCKSZGOT-RHSMWYFYSA-N 294.439 2.437 10 20 CECD COc1ccc(O)c(CNCCCN(C)C(C)C)c1 224539943 XYNNFWOHVLDNBZ-UHFFFAOYSA-N 266.385 2.221 10 20 CECD CCn1cnnc1CN[C@@H](C)c1cc(C)ccc1O 230658819 QDXRFDVGQTYNHB-NSHDSACASA-N 260.341 2.163 10 20 CECD c1cc(N2CCCC2)ccc1CNC[C@@H]1CCOC1 37738784 YSBSEQJAGUFYMC-HNNXBMFYSA-N 260.381 2.413 10 20 CECD Cc1c(CNCc2cc(F)cc(F)c2O)cnn1C 708494779 PCXLZYKFRMJKOG-UHFFFAOYSA-N 267.279 2.002 10 20 CECD CCC(CC)(CO)NCc1ccc(N(C)C)cc1 53046587 ZKPCSSBUTJBHPL-UHFFFAOYSA-N 250.386 2.393 10 20 CECD COCCOCCCN[C@H](C)c1ccccc1O 20192036 ZNXFLOOXPWFFCT-GFCCVEGCSA-N 253.342 2.096 10 20 CECD O=C(NCCCSc1nccs1)c1cncc(O)c1 127066397 FWSDIAKSTUELKV-UHFFFAOYSA-N 295.389 2.156 10 20 CECD C[C@H](NCC1(N(C)C)CCOCC1)c1cc(F)ccc1O 185450188 USKIPUSIAARWNK-LBPRGKRZSA-N 296.386 2.293 10 20 CECD CCOc1cccc(CN2CCC[C@](C)(O)C2)c1O 129474949 KFHUKTOATYUHGZ-HNNXBMFYSA-N 265.353 2.138 10 20 CECD COc1cccc(CN2C[C@H](C)O[C@H](C)C2)c1O 126892101 ZXBGKVPFWXJSAK-PHIMTYICSA-N 251.326 2.010 10 20 CECD COc1cccc(CN(C)[C@@H]2CCN(C)C[C@H]2C)c1O 290466441 NGVPPFVBGGCZOK-TZMCWYRMSA-N 278.396 2.173 10 20 CECD CCN(CC)C(=O)CN[C@H](C)c1ccc(F)cc1O 228795224 PNYAGGITQNOJBL-SNVBAGLBSA-N 268.332 2.050 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NCCCO)cc1 97176654 HJGVDBUUAOFVIK-UHFFFAOYSA-N 272.348 2.206 10 20 CECD CC[C@@H](N[C@@H](CCO)COC)c1ccc(N(C)C)cc1 269048540 WYAHFYQIAKKAJD-GOEBONIOSA-N 280.412 2.191 10 20 CECD C[C@@H](NCc1nnc2n1CCC2)c1cc(Cl)ccc1O 273361408 DCEFCDYFQLTTFA-SECBINFHSA-N 292.770 2.434 10 20 CECD Cc1cc(O)c(CNCC2(S(C)(=O)=O)CCC2)cc1C 279954654 ZSVNORBOJFJDCJ-UHFFFAOYSA-N 297.420 2.066 10 20 CECD O=C1[C@H](Sc2nccs2)CCN1C1CCOCC1 365863654 ZQWWYNQCOVBESB-SNVBAGLBSA-N 284.406 2.015 10 20 CECD Cc1cc(C)c([C@H](C)NCC(=O)NCC(F)F)c(O)c1 285418670 YCDORDXBTHSEAE-JTQLQIEISA-N 286.322 2.041 10 20 CECD CCOc1cccc(CN2CCC[C@@](F)(CO)C2)c1O 289932278 WMIKXHVDTRRILP-HNNXBMFYSA-N 283.343 2.087 10 20 CECD CC(=O)N1CCC[C@H](CN[C@@H](C)c2ccc(F)cc2O)C1 281170817 PXFHMKAIQSMHIA-WCQYABFASA-N 294.370 2.440 10 20 CECD C[C@H]1C[C@H]1CNC(=O)NCc1ccc(N(C)C)c(F)c1 299329034 OJTFUOVGLPPNJI-JQWIXIFHSA-N 279.359 2.347 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1[C@H]1CC=CCC1 819167805 HYROSFYLDGSOKN-ZDUSSCGKSA-N 286.331 2.265 10 20 CECD CCCCC[C@@H](O)C(=O)NCc1ccc(N(C)C)c(F)c1 822864234 XYKSVRQDQZFOSF-OAHLLOKOSA-N 296.386 2.449 10 20 CECD CCOc1ccc(N(C)C(=O)/C=C\c2cnn(C)c2)cc1 739611215 BKIHXWQNSYJJDX-YHYXMXQVSA-N 285.347 2.495 10 20 CECD O=C1CCCCN1CCCN[C@H]1CCc2cccc(O)c21 834571987 ZMWSKAGORDCIKU-AWEZNQCLSA-N 288.391 2.372 10 20 CECD CCOC(=O)C1(C(=O)Nc2ccc(N)cc2)CCCC1 843294625 ZCQOTGMFOYGYBP-UHFFFAOYSA-N 276.336 2.331 10 20 CECD C[C@@H](CN)CNCc1cc(Cl)cc(Cl)c1O 841048112 GYGZZCUKLWZMHI-ZETCQYMHSA-N 263.168 2.383 10 20 CECD C[C@H]1C[C@@H](NCc2cc(Cl)cc(F)c2O)CCN1 841062837 YHLORBPXJAURFS-KWQFWETISA-N 272.751 2.415 10 20 CECD COc1cccc([C@@H](C)NCCC(=O)NC(C)(C)C)c1O 846148973 DNFYETMNGJFAST-LLVKDONJSA-N 294.395 2.356 10 20 CECD C[C@H](CNC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 848391148 XAQYAVJCAZLXQW-MRVPVSSYSA-N 285.365 2.161 10 20 CECD CC(C)[C@@H](O)C(C)(C)CNC(=O)c1cc(O)cs1 754489632 SRCGOUCTTUQEBB-LLVKDONJSA-N 271.382 2.227 10 20 CECD CC[C@H](NCCN(C)C(=O)OC)c1ccc(N(C)C)cc1 850549278 CHBSZAIXCCLNEU-HNNXBMFYSA-N 293.411 2.492 10 20 CECD C[C@@H](NCc1c(O)cccc1Cl)C1(CO)CC1 696099869 QKJLWLPTUWJWFO-SECBINFHSA-N 255.745 2.296 10 20 CECD Cc1cc(O)c(CN2CCc3n[nH]cc3C2)cc1C 857876835 VSQFYFAMQLEDFD-UHFFFAOYSA-N 257.337 2.290 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@H](C)O[C@@H]2C)c1 858540592 JGDAUNLBTWPZBX-XQQFMLRXSA-N 292.379 2.313 10 20 CECD C[C@H]1C[C@H](CCNC(=O)c2cc(O)cs2)CCO1 753507919 QKOYZSWSSLWGAU-VHSXEESVSA-N 269.366 2.389 10 20 CECD CO[C@]1(CN[C@@H](C)c2ccc(C)c(C)c2O)CCOC1 763573531 SVTGFMIJMXBODD-BBRMVZONSA-N 279.380 2.465 10 20 CECD CC[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O 768450989 KYMOPICSBJEAQF-SMDDNHRTSA-N 263.337 2.192 10 20 CECD Cc1nonc1CN[C@@H](C)c1cc(F)ccc1O 872138030 YXJWWTJNSUTQEY-ZETCQYMHSA-N 251.261 2.074 10 20 CECD CCN1C[C@H](C)N(Cc2cc(F)ccc2O)C[C@@H]1C 779018345 FUKDTVGASGXGEA-RYUDHWBXSA-N 266.360 2.446 10 20 CECD Cc1cc(CN[C@@H](C)c2c(O)cccc2F)n(C)n1 886606814 GVXIGWNNYWVWBK-JTQLQIEISA-N 263.316 2.424 10 20 CECD CC[C@](C)(O)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776237233 FSXMQXJECMZAHB-WBMJQRKESA-N 293.411 2.274 10 20 CECD CCN(C)c1ccc(Cn2cc([C@H](C)NC)nn2)cc1 881313499 MHGYLLZKHIBGTD-LBPRGKRZSA-N 273.384 2.063 10 20 CECD Cc1nonc1CN[C@H](C)c1c(O)cccc1F 886650509 YCTAWGQQOJHPPY-MRVPVSSYSA-N 251.261 2.074 10 20 CECD CC1=NO[C@H](CNCc2ccc3c(c2)CCCO3)C1 895428528 IADTZTRUKZLHMG-AWEZNQCLSA-N 260.337 2.266 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCc2ccccc21 789939147 LFLNCASKKRIVMS-UHFFFAOYSA-N 273.263 2.440 10 20 CECD COC[C@@H](NCc1cc(Cl)ccc1O)[C@@H]1CCCO1 788535246 LDYMXEWHRVILTE-OCCSQVGLSA-N 285.771 2.329 10 20 CECD CCOC(=O)[C@H](C)[C@H](C)NCc1cc(F)cc(F)c1O 894454710 VGLZTTZSXDSPRM-BDAKNGLRSA-N 287.306 2.348 10 20 CECD CCN(CCC(=O)NC)Cc1cc(Cl)c(F)cc1O 897709407 OXCYGBSTYNCPOD-UHFFFAOYSA-N 288.750 2.143 10 20 CECD CCC1(NCc2ccc(OC)c(OC)c2O)CC1 894682617 BQENDMLWFHAXFS-UHFFFAOYSA-N 251.326 2.442 10 20 CECD COc1ccc(CNC(=O)C[C@H]2CCC(=O)[C@@H]2C)c(O)c1 794374430 SYOKSGAZXHCHII-GHMZBOCLSA-N 291.347 2.022 10 20 CECD CO[C@]1(CNCc2c(O)ccc(Cl)c2F)CCOC1 790990040 IGIWXQOTOPNZCO-ZDUSSCGKSA-N 289.734 2.080 10 20 CECD COc1ccc(CNS(=O)(=O)C2CCCCC2)c(O)c1 795356995 KEEFGPGXGCRMCG-UHFFFAOYSA-N 299.392 2.153 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 89636719 OSRWJNDJKVYKHV-QWHCGFSZSA-N 298.452 2.226 10 20 CECD CC[C@H](CCO)NCc1c(O)cccc1Br 706874970 FMBZTFWJFXTTDW-SECBINFHSA-N 288.185 2.405 10 20 CECD O=C1CN(Cc2ccc(N3CCCC3)cc2)CN1C1CC1 1322335209 WGOHEGAWRNVHQI-UHFFFAOYSA-N 285.391 2.051 10 20 CECD C[C@H]1COC[C@H]1NCc1ccc(N2CCCC2)cc1 710990983 VIYGBVYPZFPTBW-XJKSGUPXSA-N 260.381 2.411 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@H]1C[C@H](C)c2c(C)ccc(O)c21 1334937440 RQEZRTWEWXDNLC-TUAOUCFPSA-N 292.379 2.247 10 20 CECD CN(C)c1ccc(CN(C)C2CCC(N)CC2)cc1 91844373 ZRMLAIVGLGBLEE-UHFFFAOYSA-N 261.413 2.454 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCCC(F)F)c1 1346862377 JIGJYBLLPFBQKM-MRVPVSSYSA-N 288.294 2.416 10 20 CECD C[C@@H](NCCc1ccoc1)c1cccc(-c2nn[nH]n2)c1O 1603665147 ZKHXEKQJHVSZFI-SNVBAGLBSA-N 299.334 2.059 10 20 CECD C[C@@H](NC1CCC(C)(O)CC1)c1cc(C(=O)O)ccc1O 1593218169 DZBLAXUULAPFFW-WCVRRQIGSA-N 293.363 2.435 10 20 CECD CN(CCN(C)c1ccccc1)C(=O)Cc1ccc(N)cc1 168377482 FPGJTFZSJGYKND-UHFFFAOYSA-N 297.402 2.406 10 20 CECD C[C@H](N[C@H](C)C[S@](C)=O)c1ccc(N(C)C)cc1 168515741 IRNMNHHTHYJJGL-FTLABTOESA-N 268.426 2.170 10 20 CECD CCNC(=O)[C@H](C)NCc1ccc(N2CCCCC2)cc1 35134368 FLOZJWMSZCXZIE-AWEZNQCLSA-N 289.423 2.291 10 20 CECD CC1=C(C(=O)N(C)Cc2ccccc2O)CCCO1 156819445 MBWFHCIUPILVHA-UHFFFAOYSA-N 261.321 2.435 10 20 CECD CC1(C)[C@@H](O)C[C@H]1NCc1ccc2c(c1)CCCO2 922017126 LOLIRIHJLIELMU-CABCVRRESA-N 261.365 2.261 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1N 122381493 RCVWGVLGYSHSSQ-ZBFHGGJFSA-N 261.413 2.312 10 20 CECD C[C@H](CNCc1cc2c(cc1O)OCO2)c1nccs1 230694810 YGBHYAOVQLVSHM-SECBINFHSA-N 292.360 2.471 10 20 CECD CC(C)[C@H](CO)CN[C@H](C)c1cc(F)ccc1O 394073297 RTLVYMFYGKOFGO-MNOVXSKESA-N 255.333 2.446 10 20 CECD O=C(O)[C@H]1C[C@H]2CC[C@H]1N(Cc1ccccc1O)C2 394662430 OKPJXYMETWSFSX-KGYLQXTDSA-N 261.321 2.077 10 20 CECD COc1ccc(N2CCN(CCc3ccccn3)CC2)cc1 57848000 WNVUUYVYBXCQEW-UHFFFAOYSA-N 297.402 2.455 10 20 CECD CCCOc1ccc(CNCCc2cnn(C)c2)c(O)c1 101593976 XONJOMQDVTXFGT-UHFFFAOYSA-N 289.379 2.247 10 20 CECD Cc1ccccc1NC(=O)C(=O)N(C)Cc1ccccc1O 122333888 ZDJIATXDDKXEGI-UHFFFAOYSA-N 298.342 2.298 10 20 CECD COc1cc(N(C)CCn2cccn2)cc(OC)c1OC 125765216 RYUPXESFXNDKCX-UHFFFAOYSA-N 291.351 2.045 10 20 CECD C[C@H](NCCNC(=O)c1ccco1)c1cc(F)ccc1O 184917431 IYEXQCBQQAEULH-JTQLQIEISA-N 292.310 2.205 10 20 CECD C[C@@H](NCCNC(=O)c1ccco1)c1cc(F)ccc1O 184917446 IYEXQCBQQAEULH-SNVBAGLBSA-N 292.310 2.205 10 20 CECD C[C@H](CO)CN[C@H](C)c1ccc(Br)cc1O 134914734 NCZHVIVGDKDCCY-DTWKUNHWSA-N 288.185 2.434 10 20 CECD CC(C)N1CCN(Cc2ccc(N(C)C)cc2)CC1 131127930 OPHNEMNIUKPTHZ-UHFFFAOYSA-N 261.413 2.279 10 20 CECD CCN(Cc1cc(=O)c(O)co1)c1ccc(OC)cc1 265519885 RFDMVCQCYGSWLE-UHFFFAOYSA-N 275.304 2.381 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CC(=O)C1 270751921 CIYWAVPOUMKMOX-UHFFFAOYSA-N 274.364 2.080 10 20 CECD C[C@H]1CCN(Cc2cccc(Cl)c2O)CC[S@]1=O 277601071 LEKKNYUEPPUNOO-XTZNXHDOSA-N 287.812 2.389 10 20 CECD Oc1ccc(F)cc1CN1CCC(O)(C(F)(F)F)CC1 274389965 VDRWQVTXRDGELZ-UHFFFAOYSA-N 293.260 2.421 10 20 CECD OCC1CCN(Cc2cccc(Cl)c2O)CC1 271710923 AVJNGEGIIDCNLS-UHFFFAOYSA-N 255.745 2.250 10 20 CECD C[C@@H](NC[C@H](O)c1cnn(C)c1)c1cc(Cl)ccc1O 273464218 DIAOWOVZGVCLMI-OTYXRUKQSA-N 295.770 2.163 10 20 CECD CC[C@H](NC[C@]1(O)CCOC1)c1cccc(Cl)c1O 287277818 BHZBZNGUVSUQDP-GXTWGEPZSA-N 285.771 2.238 10 20 CECD CN(C)c1ccc(CNC(=O)NOC/C=C/Cl)cc1 290646785 MNEMYJDOQNIGRU-FPYGCLRLSA-N 283.759 2.236 10 20 CECD CCC[C@H](CNC(=O)N(C)Cc1ccccc1O)OC 297806184 YLUJPWQOAHNXLX-CYBMUJFWSA-N 280.368 2.349 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)NC1CC1 394848810 TYIPLERZAHSACJ-CYBMUJFWSA-N 289.423 2.242 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2cccc(C)c2)n1C 808013893 AGOVOSIYHAAXEG-UHFFFAOYSA-N 289.360 2.041 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cccnc1 808095982 ZLYQQYXBLYIVIH-UHFFFAOYSA-N 277.320 2.203 10 20 CECD CCOc1ccccc1NC[C@H](O)COC1CCOCC1 819392776 VXMWCYBXFSGLIQ-ZDUSSCGKSA-N 295.379 2.054 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)[C@H](C)N 818608177 QIBGHBLIPDKBRH-KGLIPLIRSA-N 291.439 2.473 10 20 CECD CCOC[C@H](O)CNc1ccccc1OCC1CC1 819450695 GCALTANAYFMSRE-CYBMUJFWSA-N 265.353 2.285 10 20 CECD C[C@@H](N[C@H]1CC12CCNCC2)c1ccc(F)cc1O 817976852 VMJRDQGTOOGJOC-YGRLFVJLSA-N 264.344 2.324 10 20 CECD Cc1cc(O)c(CNCCc2ccn(C)n2)cc1Cl 825514509 PDNTYBKVEVIQTO-UHFFFAOYSA-N 279.771 2.420 10 20 CECD CC[C@H]1CN(C)CCN1Cc1cc(F)cc(C(C)=O)c1O 821338234 YZECCNLEHVHZTE-AWEZNQCLSA-N 294.370 2.260 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCc1ccoc1 822265501 BUCRBPHYFYMGBH-UHFFFAOYSA-N 274.320 2.369 10 20 CECD c1cc(N2CCOCC2)ccc1CN1CC[C@@H]2C[C@H]2C1 827506682 KDNAQSVXBNHSJJ-CVEARBPZSA-N 272.392 2.365 10 20 CECD CCO[C@H](CC)C(=O)N[C@H](C)c1ccccc1O 827930578 LNNMWOIBEYOFOU-ZWNOBZJWSA-N 251.326 2.385 10 20 CECD CCN(CC(=O)O)Cc1ccc(N(CC)CC)cc1 901427297 YGZCSWPPOXZICP-UHFFFAOYSA-N 264.369 2.439 10 20 CECD OCC1(NCc2cc(Cl)ccc2O)CCSCC1 839176393 IVDHNPZJDXCDNT-UHFFFAOYSA-N 287.812 2.393 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1nn(C)cc1C 839682384 DAXPGOHTBMFMBW-UHFFFAOYSA-N 286.379 2.033 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H](CC)c1ccc(F)cc1O 834905125 SVMRJNDKBORAKD-UMVBOHGHSA-N 283.343 2.376 10 20 CECD CCOc1ccc(CN2CC(OC(F)F)C2)c(O)c1 839144401 NHRYLDPKVITNML-UHFFFAOYSA-N 273.279 2.214 10 20 CECD Cc1ccc([C@H](C)NC[C@]2(C)CCC(=O)N2)c(O)c1 834910394 WTMYTROICJGWRQ-NHYWBVRUSA-N 262.353 2.020 10 20 CECD O=C(NCc1ccc(O)cc1O)c1ccoc1C1CC1 910945500 BDDQJNXUMKVPMX-UHFFFAOYSA-N 273.288 2.498 10 20 CECD CN(C[C@@H](O)Cc1ccccc1)C(=O)c1cc(O)cs1 832833818 FXKWPGTXCHFRIX-LBPRGKRZSA-N 291.372 2.129 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1ccc(N(C)C)c(F)c1 846698206 CHBNLGIMFDWPGY-AAEUAGOBSA-N 265.376 2.203 10 20 CECD NC1(CNCc2cc(Br)ccc2O)CCC1 841052461 YALFTIRNEDRBII-UHFFFAOYSA-N 285.185 2.126 10 20 CECD CC(C)C[C@H](CNCc1ccc2c(c1)CCO2)C(=O)O 841816284 NVHADJNBOGSXRO-CQSZACIVSA-N 277.364 2.458 10 20 CECD CCN(CC)c1ccc(CNC[C@H](C)C(=O)O)cc1 841802050 CECOXAPCOMDKJU-LBPRGKRZSA-N 264.369 2.343 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2CC(C)C2)c1 856862859 DCTCEGXOHYHDGI-UHFFFAOYSA-N 278.352 2.246 10 20 CECD C[C@H](N[C@H]1C[C@H](O)C1)c1cc(Br)ccc1O 850579421 WTKKMLUPPLCTQI-HGNGGELXSA-N 286.169 2.329 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnco1 758153799 BOLRXTNELXLKCF-UHFFFAOYSA-N 259.309 2.013 10 20 CECD CCc1cccc(C(=O)NCc2ccccc2O)n1 857471671 GWVXCANXTSLYKD-UHFFFAOYSA-N 256.305 2.280 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCSC)c1 756352252 SAXCEVJYCVRQGT-VIFPVBQESA-N 269.366 2.192 10 20 CECD C[C@@H](C[C@H]1CCOC1)NC(=O)NCc1ccccc1O 759768565 RTWGCCJRUTUXMV-NWDGAFQWSA-N 278.352 2.007 10 20 CECD CCN1C[C@@H](C)N(Cc2cccc(OC)c2O)C[C@@H]1C 769465544 HEBSJBBSLMAZPI-QWHCGFSZSA-N 278.396 2.315 10 20 CECD C[C@@H]1CC(NC(=O)NCc2ccccc2O)C[C@@H](C)O1 767323319 WZPGQBMWJBJHOH-GHMZBOCLSA-N 278.352 2.147 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CCC(C)(C)O 935948497 NJXPBRDXHIBWGJ-UHFFFAOYSA-N 286.368 2.045 10 20 CECD COCC[C@@H](C)NC(=O)N[C@H](C)c1ccccc1O 868192412 KYCLJNXQFGFYCX-GHMZBOCLSA-N 266.341 2.177 10 20 CECD CCOc1ccc(O)c(CN(C)CC2(O)CCC2)c1 761220149 UYENKXQSABCUMK-UHFFFAOYSA-N 265.353 2.138 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1(F)CCOCC1 869146800 LQQKDXCEDPNDDD-UHFFFAOYSA-N 287.718 2.181 10 20 CECD CN(C(=O)[C@]1(c2ccccc2)CCNC1)c1ccc(N)cc1 877076105 MBSJUDUHWBYTEW-GOSISDBHSA-N 295.386 2.163 10 20 CECD CCOC(=O)N[C@@H]1CCCN(Cc2c(C)cccc2O)C1 876580114 GBADWPSKJFVLDK-CYBMUJFWSA-N 292.379 2.411 10 20 CECD CSC1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 880914236 YWCMVEVXUXUIOA-UHFFFAOYSA-N 285.340 2.205 10 20 CECD CCCNC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891464894 LFJJWEKFXNMVAL-OAHLLOKOSA-N 292.427 2.065 10 20 CECD Oc1ccccc1CN[C@H]1Cc2ccccc2[C@@H]1O 898392838 NGSLDGGLOBVCQT-HOCLYGCPSA-N 255.317 2.140 10 20 CECD COc1ccc(CN[C@@H](C)C[C@@H](C)NC(C)=O)cc1C 1133431900 LQTHRYNXIAOGRY-QWHCGFSZSA-N 278.396 2.396 10 20 CECD CC[C@@H](N[C@H](CO)C1CCOCC1)c1ccc(F)cc1O 796935887 GYSHUXAUACCRBB-HUUCEWRRSA-N 297.370 2.360 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CCC[C@@H]2C)c(O)c1 792916958 BZBJYQFJYMISMK-GWCFXTLKSA-N 278.352 2.389 10 20 CECD O=C(OCc1nc2ccccc2[nH]1)c1cccc(O)c1O 792152006 UWRKPDAXNMOSGB-UHFFFAOYSA-N 284.271 2.331 10 20 CECD CCOC(=O)c1cnc(SCCCC(=O)OC)s1 720396185 KYETVIJWFONVRK-UHFFFAOYSA-N 289.378 2.365 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2OC)C[C@@H](C)O1 769104682 JFXRILSZGVRNPA-VXGBXAGGSA-N 265.353 2.400 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@H](c3cc[nH]n3)C2)cc1 1335729561 FFYQGINIKBVVKX-ZDUSSCGKSA-N 299.378 2.081 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)c1ncnn1C 788971615 PYYYVLZFYCHQDO-QMMMGPOBSA-N 266.732 2.025 10 20 CECD C[C@@H]1C[C@H](NCCCCN)c2c(O)ccc(F)c21 1348851878 HBIDVXLWTJCNAH-KOLCDFICSA-N 252.333 2.408 10 20 CECD C[C@@H](C[S@@](C)=O)N[C@@H](C)c1ccc(N(C)C)cc1 168515839 IRNMNHHTHYJJGL-PZROIBLQSA-N 268.426 2.170 10 20 CECD Cc1cc(C(=O)N2CC[C@H](N)C2)c(C)n1-c1ccccc1 152225505 HUXASDNSNHQCFC-AWEZNQCLSA-N 283.375 2.267 10 20 CECD COc1cc(Cl)cc(CNC2(CO)CCCC2)c1O 228677534 HQFIHMDJNJVAHG-UHFFFAOYSA-N 285.771 2.449 10 20 CECD Oc1cccc(Cl)c1CNC[C@H](O)C1CCC1 316674868 YKSRNCKHDAGFHT-ZDUSSCGKSA-N 255.745 2.296 10 20 CECD C[C@H]1CCCCN1C(=O)CN(C)c1ccc(N)cc1 702092639 KSJLHNUWNWNCMJ-LBPRGKRZSA-N 261.369 2.106 10 20 CECD C[C@@H](NCC1=CCN(C)CC1)c1ccc(F)cc1O 392222451 LLYHTAXZJJMTIV-LLVKDONJSA-N 264.344 2.444 10 20 CECD C[C@@H]1CC[C@H](C(=O)O)CN1Cc1ccc(N(C)C)cc1 397048456 QDCANELPCFDMRJ-OCCSQVGLSA-N 276.380 2.438 10 20 CECD C[C@@H](NC[C@@H](O)COCC1CC1)c1ccc(N(C)C)cc1 129855767 DFLFUXDFKJEHOH-CXAGYDPISA-N 292.423 2.191 10 20 CECD Nc1ccc(CC(=O)N(Cc2ccccn2)C2CC2)cc1 37803328 FNGZILZFEFRDRF-UHFFFAOYSA-N 281.359 2.398 10 20 CECD Oc1cc2c(cc1CNCCN1CCCCCC1)OCO2 42880383 CFXXUMLBCLGRSO-UHFFFAOYSA-N 292.379 2.087 10 20 CECD COc1cc(Cl)cc(CNC[C@H](C)OC)c1O 191202729 AYDNESNGAVHYBV-QMMMGPOBSA-N 259.733 2.179 10 20 CECD CN(C)c1ccc(CNC(=O)NCCn2cccc2)cc1 267325981 ZRDWQOYBRAKSOG-UHFFFAOYSA-N 286.379 2.054 10 20 CECD CCC(O)(CC)CCNCc1cc(OC)ccc1O 276476221 ZMTKSTOYOMPQBW-UHFFFAOYSA-N 267.369 2.432 10 20 CECD COc1cccc(CNC(=O)C[C@@H]2CCC(=O)[C@@H]2C)c1O 280018843 TZKOCDHTVHRGAT-MNOVXSKESA-N 291.347 2.022 10 20 CECD CCCCCNC(=O)COc1ccc(N(C)C)cc1 289409126 PEYVGQUTCZRNRT-UHFFFAOYSA-N 264.369 2.438 10 20 CECD CCC[C@H](CNCc1cc(OC)c(OC)cc1O)OC 295189155 XBJVSQACAZJGKC-GFCCVEGCSA-N 283.368 2.314 10 20 CECD C[C@H](NCCC1=CCNCC1)c1cc(F)ccc1O 817985451 KDZTXUMEKWIMCS-NSHDSACASA-N 264.344 2.492 10 20 CECD CC[C@@H](CNC(=O)N[C@@H](C)c1cc(OC)ccc1O)OC 811969139 RYVNCAOHDPENEM-QWRGUYRKSA-N 296.367 2.186 10 20 CECD COC[C@@]1(CN[C@@H](C)c2cc(Cl)ccc2O)CCCN1 817975889 ZFQJCUFJJWNQEJ-NHYWBVRUSA-N 298.814 2.465 10 20 CECD C[C@H](NCCCNC1CC1)c1ccc(F)cc1O 817984711 XQOWHCZFXPNMJZ-JTQLQIEISA-N 252.333 2.324 10 20 CECD CSC[C@H](O)CN[C@@H](C)Cc1ccc(N(C)C)cc1C 819377351 QGDDXEGVPDADNW-XJKSGUPXSA-N 296.480 2.306 10 20 CECD Oc1ccccc1CNCCO[C@H]1CCCCO1 813333026 IFPDTIINZSUGEF-AWEZNQCLSA-N 251.326 2.025 10 20 CECD O=C(O)c1cccc(CNC(=O)c2cc(O)cs2)c1 821551402 GXHUAGOTQBTUES-UHFFFAOYSA-N 277.301 2.082 10 20 CECD COCCN(CCOC)Cc1cc(Cl)c(C)cc1O 824484576 MODJZPPBGXVAMM-UHFFFAOYSA-N 287.787 2.449 10 20 CECD CCOc1cccc(CN[C@@H]2CCC[C@@H]2C(=O)OC)c1O 827843927 HJSGTVIDKAWSGY-QWHCGFSZSA-N 293.363 2.222 10 20 CECD C[C@H](CC(=O)O)N[C@H](C)c1ccc(N2CCOCC2)cc1 820072803 YISAXDVJGKJFRW-CHWSQXEVSA-N 292.379 2.037 10 20 CECD C[C@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)C1CCC1 838392166 RUZMSUHYWKFTKO-VIFPVBQESA-N 278.304 2.260 10 20 CECD C[C@H](NCC(=O)NCC(F)F)c1ccc(Cl)cc1O 841751514 HPDISXBYPFDRRY-ZETCQYMHSA-N 292.713 2.078 10 20 CECD CC[C@@H]1CCCN1C(=O)NCCc1ccc(N)cc1 841955659 JJPGGVLIZQBIFB-CQSZACIVSA-N 261.369 2.395 10 20 CECD Cc1ccc([C@H](C)NCC[C@]2(O)CCCOC2)c(O)c1 846212879 NIASVGDXEBVLKQ-XJKSGUPXSA-N 279.380 2.283 10 20 CECD C[C@H]1CC(NC(=O)C(=O)Nc2ccc(N)cc2)C[C@H](C)C1 841047300 ZLZCUTYTCMCTOH-GHMZBOCLSA-N 289.379 2.148 10 20 CECD COc1cccc([C@H](C)NCc2cnn(C)c2C)c1O 846158297 WMFVRTYWIKRQKI-JTQLQIEISA-N 275.352 2.294 10 20 CECD COc1cccc([C@@H](C)N[C@H](CCO)CSC)c1O 846144526 LCXJSAZIHXRUFM-GHMZBOCLSA-N 285.409 2.165 10 20 CECD CCN(CC)C(=O)[C@@H](C)N1CCCc2cc(CN)ccc21 843349898 LWIJTDIDZJXKQN-CYBMUJFWSA-N 289.423 2.155 10 20 CECD CN1CCCc2cc(CN[C@@H]3[C@@H]4C[C@@H]5[C@@H]3NC[C@@H]5C4)ccc21 925532537 SPPPRTBHBBSXTG-FYAJOAKPSA-N 297.446 2.155 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCC[C@H](C)N 857107840 JXSMFWCJUXREHN-ZDUSSCGKSA-N 293.411 2.441 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@]1(C)CCOC1 754267638 AFYUFGYDNVZRFZ-INIZCTEOSA-N 276.380 2.104 10 20 CECD CC1(O)CCN(Cc2c(O)ccc3ccncc23)CC1 759752002 OWEVQYVQUHPMLK-UHFFFAOYSA-N 272.348 2.287 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@]2(C)C(=O)O)cc1 756391807 YIIGDYBZHVOERM-HOCLYGCPSA-N 276.380 2.486 10 20 CECD C[C@@H](NC(=O)CCc1ccncn1)c1ccc(N(C)C)cc1 755387813 XFJSSBMLXUBAKL-CYBMUJFWSA-N 298.390 2.353 10 20 CECD CCCCN(C)CCNC(=O)N[C@H](C)c1ccccc1O 868369614 GBBJYKVVZYOQPQ-CYBMUJFWSA-N 293.411 2.484 10 20 CECD COc1ccc(N(C)Cc2c[nH]nc2C)cc1OC 761219726 BMVFGCNNVMSHIR-UHFFFAOYSA-N 261.325 2.372 10 20 CECD CCO[C@@H](CC(=O)NCc1ccccc1O)C(C)C 761500001 ZIDGKXAJPYQWIY-AWEZNQCLSA-N 265.353 2.460 10 20 CECD COC1(CNC(=O)N[C@H](C)c2ccccc2O)CCC1 868484622 FMJKOOLNDKORGF-LLVKDONJSA-N 278.352 2.322 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3[C@H](N(C)C)[C@H]3C2)cc1 931277099 IGQBHUMMCYNSPX-FVQHAEBGSA-N 273.424 2.135 10 20 CECD C[C@@H](CCO)N(C)Cc1cc(F)c(N(C)C)cc1F 862403185 WZBUVDQFIJQLIZ-JTQLQIEISA-N 272.339 2.234 10 20 CECD C[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)[C@@H]1CO 862336873 MXJLPVKBOOVBDL-ZUZCIYMTSA-N 284.350 2.234 10 20 CECD C[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768444583 MNJANGOANKXSCW-IAQYHMDHSA-N 277.364 2.440 10 20 CECD CN(C)c1ccc(CN2Cc3cnn(C)c3C2)cc1 877632838 PDBWDGDWZPQBSA-UHFFFAOYSA-N 256.353 2.002 10 20 CECD COC(C)(C)CN(C)Cc1ccc(N2CCOCC2)cc1 770318716 NZNMQCFZCFGJOQ-UHFFFAOYSA-N 292.423 2.380 10 20 CECD COc1ncc(/C=C/C(=O)N2CCc3ccc(C)cc32)cn1 773806393 UIAYDBMKPPSVQP-GQCTYLIASA-N 295.342 2.396 10 20 CECD CCN(CC)C(=O)CNCc1cc(Cl)cc(F)c1O 776098209 XAPHVOWTZODSAI-UHFFFAOYSA-N 288.750 2.143 10 20 CECD CC(Cl)(Cl)C(=O)OCC(=O)c1ccc(O)c(O)c1 784573083 VXLHBWXLAFRFLQ-UHFFFAOYSA-N 293.102 2.018 10 20 CECD O=C1OCCN1CCOc1ccc(N2CCCC2)cc1 882981128 CKKWUDHMLRWSKG-UHFFFAOYSA-N 276.336 2.118 10 20 CECD COC(=O)[C@H]1CCN(Cc2c(O)cccc2Cl)[C@@H]1C 787420631 JRIPXIHIUUBXCV-ZJUUUORDSA-N 283.755 2.429 10 20 CECD CC[C@@H](NC(=O)c1ccc(C)c(O)c1O)C1CCOCC1 780954385 DQDKVQBWIJIEFP-CYBMUJFWSA-N 293.363 2.341 10 20 CECD CC1(CC(=O)OCC(=O)c2ccc(O)c(O)c2)CC1 784970565 NHHANAAAWLWTRJ-UHFFFAOYSA-N 264.277 2.014 10 20 CECD COc1ccc(CNCC2(OC)CCC2)c(O)c1OC 893469125 VXDKNMPRIYCDTL-UHFFFAOYSA-N 281.352 2.068 10 20 CECD Cc1cccc(CN2[C@@H](C)[C@@H](C)N(C)C(=O)[C@H]2C)c1O 895919259 DZTKFHKSXWQRBO-FRRDWIJNSA-N 276.380 2.140 10 20 CECD CC1CCN(C(=O)CN(C)Cc2ccccc2O)CC1 109772519 XQEHBXJXBFSDAD-UHFFFAOYSA-N 276.380 2.083 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](CO)CC(F)F)c(O)c1 717751421 UYWUOXXNKMQHMS-NXEZZACHSA-N 259.296 2.367 10 20 CECD O[C@@H]1CC[C@@H]2CN(Cc3ccc(N4CCCC4)cc3)C[C@@H]21 1338185403 AFXYTMAGERAWBL-BPQIPLTHSA-N 286.419 2.490 10 20 CECD C[C@H](N[C@@H](C)c1ccnn1C)c1cc(C(=O)O)ccc1O 1593204703 VNHNVQTTXYFJOJ-UWVGGRQHSA-N 289.335 2.236 10 20 CECD CN1CCC[C@H](CCNCc2cc(F)ccc2O)C1 839183148 UTANGRJFQSMAQC-GFCCVEGCSA-N 266.360 2.353 10 20 CECD COc1cccc(O)c1CNCC[C@@H]1CCCN(C)C1 839183829 ZQXBQWNIDGBIKD-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD CC[C@@H](C)NC(=O)CN(C)c1ccc(OC)cc1 844353551 RKWYPRDLOYIOKX-LLVKDONJSA-N 250.342 2.046 10 20 CECD C[C@@H](NCc1cc(Cl)ccc1O)c1ncn(C)n1 391879877 VFAONPDCINIBPI-MRVPVSSYSA-N 266.732 2.025 10 20 CECD C[C@@H]1c2cccn2CCN1Cc1cc2c(cc1O)OCO2 179568526 LODDRWCGEMCUIR-LLVKDONJSA-N 286.331 2.499 10 20 CECD CCOCCN(CC)C(=O)Nc1ccc(N)cc1 104201896 KPFKIAAZYOYWSU-UHFFFAOYSA-N 251.330 2.159 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1Cc1cc2c(cc1O)OCO2 131514067 SKQACKSKQZDFOL-CMPLNLGQSA-N 279.336 2.120 10 20 CECD COc1ccc(O)c([C@H](C)NCC(C)(C)CO)c1 122027971 VXXRHAIVICKJJS-JTQLQIEISA-N 253.342 2.070 10 20 CECD CC(C)(C)[C@H](CCO)NC(=O)/C=C/c1ccc(O)c(O)c1 181309675 CCKABWRHSLOPFD-DYLGSBMWSA-N 293.363 2.024 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccnn1C 125107115 VJYZAXHTGQRAFP-UHFFFAOYSA-N 287.367 2.116 10 20 CECD Cc1cccc(CN(C2CC2)[C@H](C)CS(C)(=O)=O)c1O 180244973 JZWFZRCRWGUTCM-GFCCVEGCSA-N 297.420 2.098 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1cccc(C)c1O 180418834 GGNUQQWRSBZQKV-CYBMUJFWSA-N 263.337 2.228 10 20 CECD C[C@@H](O)[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 180853905 QJYPRXPLJIEKTG-NXEZZACHSA-N 255.745 2.248 10 20 CECD CN(C)c1ccc(CN2CCC[C@](C)(CO)C2)cc1 93340393 OJQIMRIUAHHEGL-INIZCTEOSA-N 262.397 2.347 10 20 CECD CCN(CCc1cnn(C)c1)c1ccc(OC)cc1 265827969 JYXQYJJYELVNTC-UHFFFAOYSA-N 259.353 2.498 10 20 CECD COCCCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273440146 YECLECYUWQYLDY-SNVBAGLBSA-N 268.313 2.378 10 20 CECD CC[C@@](C)(OC)C(=O)NCc1ccc(N(C)C)c(F)c1 280052850 NPUPMWZHPFYRMQ-OAHLLOKOSA-N 282.359 2.323 10 20 CECD CN(C)c1ccc(CN2CC3(CCOC3)C2)cc1F 294049147 PHJXHBRWKHGDMG-UHFFFAOYSA-N 264.344 2.114 10 20 CECD CCC[C@H](OC)C(=O)N(C)Cc1ccccc1O 294941070 VGKOSKPZOBSQMN-ZDUSSCGKSA-N 251.326 2.166 10 20 CECD CCOc1ccc(CN(C)[C@@H]2CCCOC2)c(O)c1 809692620 BRCDVDSFAKHVAU-CYBMUJFWSA-N 265.353 2.402 10 20 CECD CCN(C)c1ccc(CN2C[C@@H](O)C(C)(C)C2)cc1 815102968 NCAWHZJRHFCTIS-OAHLLOKOSA-N 262.397 2.345 10 20 CECD COc1ccc(O)c(CNCc2cnn(CC(F)F)c2)c1 814291240 FSDYICYJXHWDPI-UHFFFAOYSA-N 297.305 2.152 10 20 CECD O=C(NCc1ccccc1O)c1conc1C(F)(F)F 816912321 SIQICCAZRWXSRP-UHFFFAOYSA-N 286.209 2.329 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccnc(F)c2)c1 728982050 IYCGLOPZQMUYQP-VIFPVBQESA-N 290.294 2.426 10 20 CECD Cc1c[nH]c(CC(N)=O)c1C(=O)N1C[C@@H](C)c2ccccc21 900219584 ZETQVLHBGOQGDI-LLVKDONJSA-N 297.358 2.115 10 20 CECD Cc1cc(C(=O)COC(=O)c2cc(O)cs2)c(C)n1C 732353419 HPRBRZQIBDQJDK-UHFFFAOYSA-N 293.344 2.449 10 20 CECD CC[C@@H](NC[C@H]1CCN1C)c1ccc(F)cc1O 903319415 ZABRAHWOOAGJOY-DGCLKSJQSA-N 252.333 2.276 10 20 CECD COc1ccc(CNCCc2cnc(C)cn2)cc1C 835062959 GZGJIDNYUMVVBN-UHFFFAOYSA-N 271.364 2.434 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CC[C@H](C2CCC2)C1 839948556 MRFJYFGZQYQLCN-JTQLQIEISA-N 279.311 2.499 10 20 CECD CC[C@H](NC(=O)Cc1ccc(N)cc1)C1CCOCC1 830950009 SMHKNWJETRHRMR-HNNXBMFYSA-N 276.380 2.133 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)Cc1cnccn1 840911993 FMWSLBIDSJKSLE-UHFFFAOYSA-N 270.380 2.483 10 20 CECD CO[C@H](C)[C@H](C)NC(=O)NCc1cc(Cl)ccc1O 845141047 ZMQHGXSXDDYZAD-DTWKUNHWSA-N 286.759 2.268 10 20 CECD COc1cc(O)c(CN[C@H](C)COCC2CC2)cc1OC 846072440 GODNDUAOYNPQBA-LLVKDONJSA-N 295.379 2.314 10 20 CECD NC1C[C@@H]2CCC[C@H](C1)N2Cc1cccc(F)c1O 843053528 AQMVSLPNWDJIOT-YHWZYXNKSA-N 264.344 2.376 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)N1CCC1 840486587 DCPBRGBBDZQECF-ZDUSSCGKSA-N 275.396 2.407 10 20 CECD C[C@H](NCc1cn(C)nn1)c1ccc(Cl)cc1O 841754410 QXVZHGNXTWNLAZ-QMMMGPOBSA-N 266.732 2.025 10 20 CECD CCOc1ccc(O)c(CN[C@H](CCN)C(F)(F)F)c1 841091251 VVWOHXLMTODTKU-GFCCVEGCSA-N 292.301 2.160 10 20 CECD CC[C@@H](CCO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756603712 JYODCPKKSJTVHD-UWVGGRQHSA-N 268.313 2.112 10 20 CECD CO[C@@H]1C[C@H](NC(=O)NCc2ccccc2O)C1(C)C 753343510 NIELIRQVTVVAQF-QWHCGFSZSA-N 278.352 2.005 10 20 CECD Cn1cc([C@H]2N(C(=O)Cc3ccc(N)cc3)CC2(C)C)cn1 852873471 VYUGKCUBSXXZKX-MRXNPFEDSA-N 298.390 2.155 10 20 CECD C[C@@H](NC1COC(C)(C)OC1)c1cc([N+](=O)[O-])ccc1O 757696835 FGXILNHLAMYAHN-SECBINFHSA-N 296.323 2.103 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@]1(C)CCCOC1 935948572 PBNWQOQWXDUVDY-INIZCTEOSA-N 298.379 2.311 10 20 CECD CCN(CC(=O)OC)Cc1cc(F)c(N(C)C)cc1F 862239126 WNCAJPGROXWJNU-UHFFFAOYSA-N 286.322 2.026 10 20 CECD C[C@@H](NCCC1OCCO1)c1ccc(N(C)C)cc1 775830476 JZVJUGKWQVIXIN-GFCCVEGCSA-N 264.369 2.166 10 20 CECD Oc1ccc(F)cc1CNC[C@@H](O)c1ccc(F)cc1 775159660 RTFPHMDQNNBLCG-OAHLLOKOSA-N 279.286 2.494 10 20 CECD C[C@@H](NC(=O)c1ccnc(O)c1)c1ccc(N(C)C)cc1 773024619 MNQQQARJHBKFER-LLVKDONJSA-N 285.347 2.344 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H]2CCC[C@H]2O)cc1 886481064 JGCWQQLIPMBULY-HZPDHXFCSA-N 262.397 2.488 10 20 CECD C[C@H](NCCCO[C@H]1CCOC1)c1c(O)cccc1F 886539000 RFUSUAGRMVMVMY-RYUDHWBXSA-N 283.343 2.378 10 20 CECD COc1ccc(CNCCNC(=O)C2CC(C)C2)cc1C 1125514101 HGUSSKRKUQVSQE-UHFFFAOYSA-N 290.407 2.256 10 20 CECD O=C(NCC1(C2CC2)CC1)c1c(F)ccc(O)c1O 789995112 VIHQOUSNFMJQRO-UHFFFAOYSA-N 265.284 2.157 10 20 CECD Cc1conc1NCc1ccc(N2CCN(C)CC2)cc1 790244990 CVHBLYMLKYVMHM-UHFFFAOYSA-N 286.379 2.347 10 20 CECD C[C@H](CC[S@](C)=O)NCc1cccc(Cl)c1O 164759064 DXRRTDYVHJKGJT-VVVCHXIZSA-N 275.801 2.292 10 20 CECD O=C(OC[C@@H]1CCC[C@H](O)C1)c1cc(O)cs1 795401338 INWUMYSEGAVAKE-BDAKNGLRSA-N 256.323 2.162 10 20 CECD COc1ccc(CNC(=O)Nc2ccc(F)nc2)c(O)c1 797635557 WMGVOWSGMKFKKN-UHFFFAOYSA-N 291.282 2.257 10 20 CECD Oc1ccccc1CNCc1cnn2ccccc12 134397945 DQTYWXZHRVOSGX-UHFFFAOYSA-N 253.305 2.330 10 20 CECD COc1ccc(O)c(CN2CCOC(C)(C)[C@H]2C)c1 687952056 DBLPNXSYHWQZJI-LLVKDONJSA-N 265.353 2.400 10 20 CECD C[C@@H](NC(=O)CCc1cnc(N)s1)c1ccccc1O 877255937 KOSSKTDZOFQJFX-SECBINFHSA-N 291.376 2.241 10 20 CECD COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3F)CC2)cc1 1348487392 LMVQYSQARVWNBD-CABCVRRESA-N 292.354 2.092 10 20 CECD C[C@@H]1C[C@@H]2CC[C@@H](C(=O)NCc3ccccc3O)CN2C1 1521266159 MMENUIMBAGZACF-YUELXQCFSA-N 288.391 2.129 10 20 CECD CC[C@](C)(NCc1ccc(OC)c(C)c1)C(=O)O 1604913406 WTPXSJVWAQSKHZ-AWEZNQCLSA-N 251.326 2.347 10 20 CECD C[C@H](N[C@@H]1CC[C@@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589953725 FQQMVPBFOZYIEW-IRCOFANPSA-N 299.378 2.412 10 20 CECD CC(C)[C@H](NCc1cccc(Cl)c1O)C(=O)O 158742025 JKVRTUDTRREZNZ-JTQLQIEISA-N 257.717 2.244 10 20 CECD COCCOCCOCCCN[C@H](C)c1ccccc1O 274543490 CQYYWIWCIWAPFI-CQSZACIVSA-N 297.395 2.113 10 20 CECD COc1cccc(O)c1CN1CC[C@@H]2OCCC[C@@H]2C1 1116444084 QDYJVIYBEUIIAG-DOMZBBRYSA-N 277.364 2.402 10 20 CECD C[C@@H](Cn1cccn1)N[C@H](C)c1ccc(F)cc1O 62747594 FGFBPZVJKQFFFI-WDEREUQCSA-N 263.316 2.467 10 20 CECD C[C@H](CNCc1cc(F)ccc1O)CC1(C)OCCO1 715907681 IJNFTIUWDCNUEN-NSHDSACASA-N 283.343 2.410 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)cc1O)C1(CO)CC1 829208501 KITMMSGGEODBMK-ZJUUUORDSA-N 253.317 2.343 10 20 CECD COc1cccc(CN(C)c2ccc3c(c2)OCO3)n1 178878438 BZUDMJPFJKTCAE-UHFFFAOYSA-N 272.304 2.455 10 20 CECD O=C(CCC(F)(F)F)NCCc1ccc(O)c(O)c1 122772850 RFHQRXACFQCKPT-UHFFFAOYSA-N 277.242 2.099 10 20 CECD CCCOc1ccc(CN[C@](C)(CCO)COC)c(O)c1 175853446 RPQRCTKOXDJYHD-MRXNPFEDSA-N 297.395 2.058 10 20 CECD COc1ccc(CN[C@H](C)CC[S@](C)=O)cc1C 125440603 KJKXJVQYPUQIOI-KZULUSFZSA-N 269.410 2.250 10 20 CECD CS[C@H](C)CC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186381964 MDSXCULLDNMOSP-NXEZZACHSA-N 283.393 2.287 10 20 CECD CCOCCC(=O)NCc1c(O)ccc2c1CCCC2 75159654 GMUVVFSELSGNTN-UHFFFAOYSA-N 277.364 2.314 10 20 CECD CN(CCOC[C@H]1CCCO1)Cc1ccccc1O 152295300 VCHBNCWTOQTHPG-CQSZACIVSA-N 265.353 2.020 10 20 CECD C[C@H](NCCN1CCOC(C)(C)C1)c1ccccc1O 183495772 LTVGSFOXOXQTGJ-ZDUSSCGKSA-N 278.396 2.154 10 20 CECD CCc1noc(CN(C)c2ccc(OC)c(F)c2)n1 121783609 RDBWBVHTJPVNQH-UHFFFAOYSA-N 265.288 2.416 10 20 CECD COC(=O)[C@]1(F)CCN(Cc2cc(C)c(C)cc2O)C1 74723041 LMRMGPFVEDSYAB-HNNXBMFYSA-N 281.327 2.096 10 20 CECD CCOCc1cc(CNC[C@H](C)OC)ccc1OC 191138154 WZTKACKIPXAYFH-LBPRGKRZSA-N 267.369 2.356 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@]23CCOC3=O)c1 190040639 WDAQPSLIRBWMGJ-INIZCTEOSA-N 291.347 2.072 10 20 CECD CN(C)c1ccc(CNC(=O)C2(O)CCCCC2)cc1 86532335 HYRKFKCVTZYZBY-UHFFFAOYSA-N 276.380 2.064 10 20 CECD CC(C)NC(=O)CN(C)c1ccc(OC(C)C)cc1 191595818 DODVUBPWAFUJOS-UHFFFAOYSA-N 264.369 2.435 10 20 CECD CC1(C)OC[C@H](CNCc2cc(Cl)ccc2O)O1 230210594 VCIJJKODPWAMEU-NSHDSACASA-N 271.744 2.287 10 20 CECD Cc1cc(C(=O)NC[C@@H](C)O)c(C)n1-c1ccc(F)cc1 97178958 LZZFOYJFWKNSDX-LLVKDONJSA-N 290.338 2.344 10 20 CECD CN(C)c1ccc(CNC(=O)C(=O)C(C)(C)C)cc1F 265011692 HHZXXJHOABXKST-UHFFFAOYSA-N 280.343 2.123 10 20 CECD C[C@H](N[C@@H](C)c1ncnn1C)c1ccc(F)c(F)c1O 276638286 OLDWWKVVJGZBAD-YUMQZZPRSA-N 282.294 2.211 10 20 CECD Cc1c(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)cnn1C 273477836 LGPLXNGDKRTGAF-VIFPVBQESA-N 290.323 2.193 10 20 CECD OC[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 271834968 RRNZVPPHPUBCJH-JTQLQIEISA-N 255.745 2.250 10 20 CECD Oc1ccc(F)cc1CN1CCOC2(CCOCC2)CC1 372127479 CISFLTFAGKOTEU-UHFFFAOYSA-N 295.354 2.303 10 20 CECD CC(C)C[C@@H]1OCCC[C@@H]1NC(=O)c1cccc(O)c1O 280408287 HQDXGCHUOTUOAI-JSGCOSHPSA-N 293.363 2.421 10 20 CECD CCCCN(CCS(=O)(=O)CC)Cc1ccccc1O 282486709 PGZDWNSFSYCBKB-UHFFFAOYSA-N 299.436 2.429 10 20 CECD C[C@@H]1COCC[C@@H]1CNC(=O)N(C)Cc1ccccc1O 287773257 GRUSOGFTXQEENO-CHWSQXEVSA-N 292.379 2.206 10 20 CECD COc1ncccc1CCNCc1ccc(N(C)C)cc1 289416565 AUOKXUWPAFHYAR-UHFFFAOYSA-N 285.391 2.489 10 20 CECD C[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)CCS1 296684630 LPXWWAFHLKHJLI-QMMMGPOBSA-N 285.340 2.205 10 20 CECD Cc1nonc1CNCc1cc(Cl)ccc1O 809743710 AUHVZFFXMVLZAC-UHFFFAOYSA-N 253.689 2.027 10 20 CECD CCOc1ccc(CN(C)C[C@@H](C)OC)c(O)c1 809717940 OQLVGZJSWOFXFD-LLVKDONJSA-N 253.342 2.258 10 20 CECD C[C@H](NCCCNC1CC1)c1cc(F)ccc1O 817984612 VUQAIVHXSFIGJC-JTQLQIEISA-N 252.333 2.324 10 20 CECD C[C@H](N)C[C@H](C)NCc1ccc2c(c1)CCCN2C 817901703 XBUSXGJDFGHRBE-STQMWFEESA-N 261.413 2.284 10 20 CECD Cc1n[nH]cc1[C@@H](C)NC[C@@H](N)c1ccc(N(C)C)cc1 817941394 JQKHDWZPNKNUTB-BDJLRTHQSA-N 287.411 2.135 10 20 CECD CCc1nnc(N(C)Cc2ccccc2O)n1CC 812037264 TWORDJNBIJAGAT-UHFFFAOYSA-N 260.341 2.202 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CC23CCNCC3)c1 817976410 LKGVQVYXFNZXPQ-IAQYHMDHSA-N 276.380 2.194 10 20 CECD CCN(C)c1ccc([C@H](C)NCC(F)(F)CN)cc1 817966493 PAZGGCQBBXIISX-NSHDSACASA-N 271.355 2.387 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2cscn2)cc1F 824669365 JZKTYINFZGXPIF-UHFFFAOYSA-N 293.367 2.207 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCS[C@@H]2C)c1O 828543318 VAFKLJJEFHPXMN-KOLCDFICSA-N 296.392 2.094 10 20 CECD Cc1ccc([C@@H](C)NC[C@]2(C)CCC(=O)N2)c(O)c1 834910387 WTMYTROICJGWRQ-ABAIWWIYSA-N 262.353 2.020 10 20 CECD COc1ccc([C@H](CO)CNCc2ccccc2O)cc1 839185309 SHUCDBWBDPBQCB-HNNXBMFYSA-N 287.359 2.267 10 20 CECD COc1ccc(O)c(CNCCC[C@@H]2CCCN2)c1 841071808 BVENNUFETBLSMQ-CYBMUJFWSA-N 264.369 2.023 10 20 CECD CCOc1ccc(CN(C[C@H](C)O)C2CC2)c(O)c1 848928500 FSQYUAGZKPKKLM-NSHDSACASA-N 265.353 2.136 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CCOC[C@@H]2OC)c1O 846170740 ZFANGVDXMVWEAY-ZOWXZIJZSA-N 295.379 2.103 10 20 CECD CC[C@@H](NCc1cccc(OC)c1O)[C@H](O)C(C)C 840968135 VTOWULYUKAARKP-TZMCWYRMSA-N 267.369 2.286 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H]2COC[C@H]2OC)cc1 842913333 ZVTWRWXYVSXHGR-DAXOMENPSA-N 278.396 2.207 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@H]1CCCCN1 841033153 NOBDZINEOBUTNA-SECBINFHSA-N 272.751 2.416 10 20 CECD NC[C@H](NCc1c(O)ccc(Cl)c1F)C1CC1 841028033 JSQODZDIEUJVQM-JTQLQIEISA-N 258.724 2.012 10 20 CECD COc1cccc(CNCCc2ccc(N)cc2)c1O 841035351 MWGOXYARCDWSKM-UHFFFAOYSA-N 272.348 2.315 10 20 CECD C[C@H](NC(=O)N[C@H]1COC[C@H]1C)c1ccc(N(C)C)cc1 922055143 MVPSEJPKCPAWBI-XUJVJEKNSA-N 291.395 2.148 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CC[C@H](O)CC2)cc1F 858153288 KKHLDIRLZFWPQD-HAQNSBGRSA-N 284.350 2.424 10 20 CECD O=C(OCC(=O)[C@@H]1C[C@H]2CC[C@H]1C2)c1cccc(O)c1O 758562273 SJNCBUFAAUYSRN-JBLDHEPKSA-N 290.315 2.260 10 20 CECD COCc1cc(C(=O)NCc2cc(Cl)ccc2O)no1 857547767 SOXDVMGXVUEQPC-UHFFFAOYSA-N 296.710 2.110 10 20 CECD FC(F)CN1CCC[C@H]1CNCc1ccc2c(c1)CCO2 858232091 SOLFORBYFKWKGR-AWEZNQCLSA-N 296.361 2.441 10 20 CECD Cc1ccc([C@H](C)Nc2cnn(CCO)c2)c(O)c1C 756857236 TVSBQTFOJQAWNN-LBPRGKRZSA-N 275.352 2.371 10 20 CECD COc1ccc(CN[C@H](CCO)C2CCOCC2)cc1C 763466886 NQZMZTTYFHYLLI-MRXNPFEDSA-N 293.407 2.271 10 20 CECD CCOc1ccc(CN(C)CCc2cnccn2)c(O)c1 761213036 BLHJPYICVIRYCH-UHFFFAOYSA-N 287.363 2.255 10 20 CECD CC[C@@H](CCO)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776146161 GNROOBRYRIPKGR-JSGCOSHPSA-N 293.411 2.274 10 20 CECD COc1cc(O)c(CNCCC(C)(C)OC)cc1OC 877707954 SGFRIAVBWXBUCZ-UHFFFAOYSA-N 283.368 2.314 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)c2ccco2)c1 775369704 FTCZWILPZSCTBU-IINYFYTJSA-N 277.320 2.378 10 20 CECD Cc1cc(O)c(CN[C@H](CCO)C(F)(F)F)cc1C 886371450 MCKKUEYHEUOGON-GFCCVEGCSA-N 277.286 2.412 10 20 CECD CN(C)c1ccc(CNc2cc(CO)ccn2)cc1 881774466 RYNGHZYEZZEIIO-UHFFFAOYSA-N 257.337 2.252 10 20 CECD OC[C@H]1CC[C@@H](NCc2cc(F)cc(F)c2O)CC1 883039302 KGSQOJPCJCYLAS-WVSHTKLVSA-N 271.307 2.311 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)cc(C)c2O)[C@@H]1C 787247292 SOBTUBHZQVQKGT-TZMCWYRMSA-N 277.364 2.392 10 20 CECD CCC1(CNC(=O)NCc2ccc(OC)cc2O)CC1 792974581 BCNXINCUAZLODG-UHFFFAOYSA-N 278.352 2.390 10 20 CECD C[C@@H]1COC[C@@H]1NCc1cc(Br)ccc1O 829431591 ISZSPOWFXDWUDC-KCJUWKMLSA-N 286.169 2.279 10 20 CECD CC(C)C[C@H](NCc1cc(F)cc(F)c1O)C(=O)O 708217261 ZHEDEUOOIYQBCN-NSHDSACASA-N 273.279 2.259 10 20 CECD CC[C@@H](F)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 1335522682 QADBDJPJJUEEIZ-OAHLLOKOSA-N 294.370 2.230 10 20 CECD C[C@@H]1OCC[C@H]1CSc1ncc(C(=O)O)s1 1604833332 CQOWFZRBHLUPRJ-BQBZGAKWSA-N 259.352 2.358 10 20 CECD COC1([C@H](N[C@@H](C)c2ccccc2O)C(=O)O)CCC1 1599084841 BTRXYDXSLBJIJI-GXFFZTMASA-N 279.336 2.065 10 20 CECD C[C@](CCF)(NCc1cccc(Cl)c1O)C(=O)O 1592507627 UMBPZXZTMIXOKY-GFCCVEGCSA-N 275.707 2.338 10 20 CECD CCN(CC)c1ccc(CN2CCC[C@@H]2C(N)=O)cc1F 160324271 JBGBBTNDVOSROT-OAHLLOKOSA-N 293.386 2.122 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCCO2)c1 157607913 HFEKNXZAGIQTSG-YGRLFVJLSA-N 279.336 2.147 10 20 CECD C[C@@H](N[C@@H]1CCCCNC1=O)c1ccc(N(C)C)cc1 37282685 VPZRJARNOYWIMO-IUODEOHRSA-N 275.396 2.072 10 20 CECD CCOC(=O)CCN[C@@H](C)c1cc(OC)ccc1O 45685933 UDEPKBNDUVQEQQ-JTQLQIEISA-N 267.325 2.005 10 20 CECD C[C@H](NCCN1CC=CCC1)c1ccc(F)cc1O 281241927 VHAVPPFUQCYNNJ-LBPRGKRZSA-N 264.344 2.444 10 20 CECD CN(C)c1ccc(CNCCCn2cccn2)cc1 73870128 RCWKQEVYWMDRGA-UHFFFAOYSA-N 258.369 2.129 10 20 CECD C[C@H](O)C[C@@H](C)CNCc1cc(F)cc(F)c1O 708481387 RTSMLRBBGODRIH-BDAKNGLRSA-N 259.296 2.167 10 20 CECD C[C@@H](CNCc1cc(F)cc(F)c1O)N(C)C1CC1 708504847 VICMINQSHWEHMD-VIFPVBQESA-N 270.323 2.243 10 20 CECD C[C@@H](NC(=O)[C@H]1CC12CCOCC2)c1ccccc1O 827937071 JVPUGFLEAFLWOL-DGCLKSJQSA-N 275.348 2.386 10 20 CECD Cc1noc(C)c1S(=O)(=O)N[C@H](C)c1ccccc1O 867835043 ZUNNEVMXWPFSMD-MRVPVSSYSA-N 296.348 2.037 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCS1 173504122 IFCRBOPDGFGSKJ-NSHDSACASA-N 281.377 2.448 10 20 CECD COc1ccc(O)c(CNCc2ccc3c(c2)OCO3)c1 20124485 LXBVVVJWOGHSIZ-UHFFFAOYSA-N 287.315 2.419 10 20 CECD COC[C@@H](O)CCN[C@H](C)c1cc2c(cc1O)CCCC2 186203080 YKBYBKNKYOZDON-DOMZBBRYSA-N 293.407 2.319 10 20 CECD CC(C)(CNC(=O)c1cccc(O)c1O)N1CCCCC1 186746365 AFZAENRLWZFOKU-UHFFFAOYSA-N 292.379 2.092 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(F)c(F)cc1F 182533128 PKFZSTHWDLQWTG-UHFFFAOYSA-N 297.232 2.445 10 20 CECD COc1cc(O)c(CN[C@@H]2CCC[C@@H]2CCO)cc1OC 190303859 BACNIPWPZPGLST-DGCLKSJQSA-N 295.379 2.050 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@H]1C[C@H]2CC[C@H]1NC2 530245767 DJDHBNBHQFJSNK-WQHBLYJGSA-N 284.762 2.415 10 20 CECD CCN1C(=O)/C(=C\c2ccc(C(=O)OC)[nH]2)SC1=S 267589980 MPLYQIJGIKJWIK-RMKNXTFCSA-N 296.373 2.022 10 20 CECD Oc1ccc(Cl)cc1CN1CCOC[C@H]1c1ncon1 369840670 NPKLTTVPAYHRFQ-NSHDSACASA-N 295.726 2.002 10 20 CECD CC(C)(CCCO)CNCc1cc([N+](=O)[O-])ccc1O 271462418 GHIWAXHIEIPVMC-UHFFFAOYSA-N 282.340 2.189 10 20 CECD OCCO[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 271171233 IXCGPEPTUKRXMK-NSHDSACASA-N 285.771 2.019 10 20 CECD COCC[C@@](C)(O)CN[C@@H](C)c1ccc(C)c(C)c1O 273581534 MTLGGLRZRUQPDU-XJKSGUPXSA-N 281.396 2.447 10 20 CECD C[C@H](NC[C@H](CO)[C@H]1CCOC1)c1cc(Cl)ccc1O 280921508 RCYZBFNLHJYTIC-SDDRHHMPSA-N 299.798 2.341 10 20 CECD CN(CCCN1CCCC1)Cc1cc2c(cc1O)OCO2 281107932 AZGJZYVYTDCPAF-UHFFFAOYSA-N 292.379 2.039 10 20 CECD CCCCOCCNC(=O)COc1ccc(N(C)C)cc1 289453384 UZPHCYKMRGIJBB-UHFFFAOYSA-N 294.395 2.064 10 20 CECD C[C@@H]1C[C@@H](NCC2(CC(N)=O)CC2)c2c(O)ccc(F)c21 817586554 PMGZWQBQGBACMG-MWLCHTKSSA-N 292.354 2.325 10 20 CECD CCCN1C[C@H](CN[C@@H](C)c2ccc(F)cc2O)CC1=O 817589840 QDWPVPMONBCJJX-RYUDHWBXSA-N 294.370 2.440 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCCNC2)c1 817946130 RZMKOSFYZXUJIB-RYUDHWBXSA-N 264.369 2.051 10 20 CECD CCCN(CC)C[C@H](C)NCc1cc2c(cc1O)OCO2 810180555 BEGKZJSFLUMQJB-LBPRGKRZSA-N 294.395 2.331 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2cc(Cl)cc(F)c2O)C1 827501107 QOXJQFTULMZBLY-WKFQBHICSA-N 287.718 2.226 10 20 CECD COc1cc2c(c(OC)c1)N(CCC1OCCO1)CCC2 839654953 CTTHZVXLCSZWCO-UHFFFAOYSA-N 293.363 2.219 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@@H]1CCC[C@H]1O 835079914 GAFAZDIQEAKLGH-GHMZBOCLSA-N 259.708 2.188 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H](C)c1cc(F)cc(F)c1O 834904857 SCQZTBUTFNDGCY-BZHVJNSISA-N 287.306 2.125 10 20 CECD C[C@@H]1CCC[C@@H](C)N1NC(=O)/C=C/c1ccc(O)c(O)c1 907998125 VOQPIXKEJNSFKO-FUDMEFDJSA-N 290.363 2.405 10 20 CECD Cc1ccc([C@H](C)C(=O)NCc2ccc(O)cc2O)o1 910950450 FJFFZRREIBJZET-JTQLQIEISA-N 275.304 2.419 10 20 CECD CCOC(=O)[C@H](F)C1CN(Cc2cccc(CC)c2O)C1 848913774 DRECXEHGJMUVDP-CQSZACIVSA-N 295.354 2.288 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1(N(C)C)CC1 841889505 BIKVMKGMDLTMOD-UHFFFAOYSA-N 261.413 2.245 10 20 CECD CCOCc1cc(CN[C@H]2C[C@H](C(=O)O)C2)ccc1OC 849231733 GHJSQBWZFZWHLT-MQMHXKEQSA-N 293.363 2.185 10 20 CECD COc1ccc(N(C)CCN(C)c2ccnc(C)n2)cc1 845672086 IIGXFVBQZRNCFD-UHFFFAOYSA-N 286.379 2.366 10 20 CECD CC(C)C[C@@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 746313998 FTFSLOLRVMSDBX-MRXNPFEDSA-N 289.423 2.276 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CO[C@H](C)C2)c1 842775292 LYAJEGROQJHUSB-PWSUYJOCSA-N 251.326 2.058 10 20 CECD CN(CC(F)(F)F)C(=O)NCCc1ccc(N)cc1 850586628 AGSFZYSVLSSQCU-UHFFFAOYSA-N 275.274 2.015 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1conc1C 935945136 LXRGGNNZAYUGPM-UHFFFAOYSA-N 281.308 2.104 10 20 CECD CCOc1cncc(CNCc2cc(OC)ccc2O)c1 856770973 UIFBMCWCHPOYCO-UHFFFAOYSA-N 288.347 2.484 10 20 CECD C[C@@H](NC(=O)NCC(C)(F)F)c1ccccc1O 868650463 KAWCKHAQCZUTOB-MRVPVSSYSA-N 258.268 2.408 10 20 CECD C[C@H](NCCC1(C)OCCO1)c1cc(F)cc(F)c1O 760890824 BYMKIGNSMMKHPH-VIFPVBQESA-N 287.306 2.474 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1nocc1C 865904685 QECGMZJHTRREPY-UHFFFAOYSA-N 273.336 2.287 10 20 CECD COc1ccc2c(c1)CCCN2Cn1cc([N+](=O)[O-])cn1 766339410 GFAKLVXKLCNZDU-UHFFFAOYSA-N 288.307 2.210 10 20 CECD Cc1ccc(CNCCCc2cnn(C)c2)c(O)c1 876997220 QFHHUVPZQYPLDZ-UHFFFAOYSA-N 259.353 2.157 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2C[C@@H]3C[C@H]3C2)c1O 862441349 QQUAXWLBNZBORO-YUMQZZPRSA-N 268.700 2.406 10 20 CECD CCCOc1ccc(CN[C@H](C)C(=O)O)cc1C 871871929 IBYXSDSARVQAKN-LLVKDONJSA-N 251.326 2.347 10 20 CECD CC[C@@H](NC[C@@H](O)CN(C)C)c1cc(Cl)ccc1O 775501298 GCMIVIQYMFUXGC-DGCLKSJQSA-N 286.803 2.009 10 20 CECD Cc1ccc(CNCCC(C)(C)S(C)(=O)=O)c(O)c1 877588860 AQLYSZZXGZXKLZ-UHFFFAOYSA-N 285.409 2.004 10 20 CECD COc1ccc(CNCc2ccon2)cc1Cn1cccn1 873069776 NQRTUUBJFLNIDQ-UHFFFAOYSA-N 298.346 2.218 10 20 CECD Cc1ncsc1/C=C\C(=O)NCc1ccccc1O 777275256 OVADOYZKVZNATH-SREVYHEPSA-N 274.345 2.487 10 20 CECD Cc1cccc(O)c1CN1C[C@@H](C)OC2(CCOCC2)C1 877486895 SUSWHCQPCRTBKQ-CQSZACIVSA-N 291.391 2.471 10 20 CECD COc1cc(O)c(CN2CCC[C@H](CCO)C2)cc1OC 775682494 ZCBIJVTVYQZZFV-GFCCVEGCSA-N 295.379 2.004 10 20 CECD Cc1c(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)cnn1C 772998975 YWBQVZPGJAAYOJ-NSHDSACASA-N 286.379 2.286 10 20 CECD COc1ccc(CN[C@H](C)[C@H]2CCCOC2)c(O)c1OC 893471022 BMCMWAKXCITAHS-YPMHNXCESA-N 295.379 2.314 10 20 CECD O=C(N[C@@H]1CCC[C@H](F)C1)c1cccc(O)c1O 1332485326 NHMLIMGPPPZBRA-DTWKUNHWSA-N 253.273 2.108 10 20 CECD COC(=O)C(C)(C)CCN(C)Cc1ccccc1O 792787855 ITGAUOBOWCQWJH-UHFFFAOYSA-N 265.353 2.413 10 20 CECD CCCN(Cc1ccccc1O)[C@H](C)C(=O)OC 76074134 VWOTUGMBMLPKQS-LLVKDONJSA-N 251.326 2.166 10 20 CECD CC(C)NC(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 135103645 AAHIOQYFTXSDHY-ZDUSSCGKSA-N 277.412 2.318 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)c1c(C)noc1C 78005192 TWJKYJIJYSWURW-UHFFFAOYSA-N 282.321 2.106 10 20 CECD COc1ccc(CN[C@H]2CC[C@H](OC)C2)c(O)c1OC 1333716894 HGKJNXWOFRVRNR-RYUDHWBXSA-N 281.352 2.067 10 20 CECD Nc1ccc(CNC(=O)N[C@@H](CO)C2CCCCC2)cc1 1337070031 GUGHCTUXCASUMW-HNNXBMFYSA-N 291.395 2.009 10 20 CECD Cc1ncc(C(=O)NCc2ccc(O)cc2O)c(C2CC2)n1 1339583533 GHBBPKLJPTZPKO-UHFFFAOYSA-N 299.330 2.004 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC[C@@H](F)C1 1345723968 VBHZRKPMXGHHPX-VXGBXAGGSA-N 266.316 2.472 10 20 CECD Cc1nnc2c(N(C)Cc3ccc(N(C)C)cc3)nccn12 1262676790 PWMQQQVQFCIHTP-UHFFFAOYSA-N 296.378 2.135 10 20 CECD CCOc1cccc(CN(CC(=O)OC)CC(C)C)c1O 1341568747 DJTLYXUJSXCZLE-UHFFFAOYSA-N 295.379 2.422 10 20 CECD C[C@H]1CC=C(C(=O)NCc2cccc(O)c2O)CC1 1349080080 YVMCYPPVQCKCQR-JTQLQIEISA-N 261.321 2.460 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCN[C@H](C)C1 1341710943 COHAZTONNBMACZ-ZIAGYGMSSA-N 289.423 2.065 10 20 CECD Nc1ccc(CNC(=O)N2[C@H]3CCC[C@H]2CC3)cc1 1357792376 WAEPVISPXIHOGO-KBPBESRZSA-N 259.353 2.495 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1c(O)ccc2ccncc12 1589440987 HEPLFZQXQXTWOW-ZDUSSCGKSA-N 274.320 2.235 10 20 CECD CCN1CCc2cc(CN[C@H](C(=O)O)C(C)C)ccc21 1776877659 XBCJZAIKEHCALI-HNNXBMFYSA-N 276.380 2.268 10 20 CECD CCO[C@H]1C[C@@H](NCc2cc(OC)ccc2O)C1 839147360 INSGUEZEYWENLL-BJHJDKERSA-N 251.326 2.058 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccccn1 8406736 ZVQGMEFPHKFXIO-UHFFFAOYSA-N 269.348 2.420 10 20 CECD COC(=O)c1ccc(NCc2ccccc2O)nc1C 163771543 ZFDKVJMCGFBODS-UHFFFAOYSA-N 272.304 2.494 10 20 CECD C[C@H](NCC1(CO)CCC1)c1ccc(F)cc1O 186546983 WNZNJVMHASNRGU-JTQLQIEISA-N 253.317 2.345 10 20 CECD Oc1ccc(Cl)cc1CNC[C@]1(O)CCSC1 304673388 YBWMERAQCXYGGS-GFCCVEGCSA-N 273.785 2.003 10 20 CECD CCC1(CNCc2cc(F)cc(F)c2O)COC1 708394290 VIXZQAIXEPVKCP-UHFFFAOYSA-N 257.280 2.187 10 20 CECD COc1ccccc1CCNC(=O)Cc1ccc(N)cc1 20185679 VGVUPVQHQNWNPE-UHFFFAOYSA-N 284.359 2.179 10 20 CECD C1=CCN(c2ccc(CNc3ncccn3)cc2)C1 301332424 FDAXZQTXXMPWIJ-UHFFFAOYSA-N 252.321 2.465 10 20 CECD O=C(CCc1ccc(O)cc1)NCc1ccc(O)c(O)c1 184056257 RCMNKMGEZYKEGV-UHFFFAOYSA-N 287.315 2.052 10 20 CECD Cc1nn(C)cc1C(=O)NCc1c(O)ccc2c1CCCC2 75159600 JTOHJKNGHOUDBY-UHFFFAOYSA-N 299.374 2.243 10 20 CECD COc1ccc(N(C)CC(=O)OCC(C)C)c(OC)c1 181493422 IKWMZOYPOORXSE-UHFFFAOYSA-N 281.352 2.339 10 20 CECD COc1ccc(CNCc2cccc(C(N)=O)c2)cc1C 35231671 NQKTVGMFHKUMLL-UHFFFAOYSA-N 284.359 2.392 10 20 CECD CCCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(N)cc1 236676414 MGECRHHOHUXQCJ-AWEZNQCLSA-N 289.379 2.389 10 20 CECD Cc1cccc(C(=O)N2CCOc3cc(N(C)C)ccc32)n1 266324449 HSNMNJHKCKRCSM-UHFFFAOYSA-N 297.358 2.495 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@@H]1O 271412528 XXQROTWGFYMGEH-RNCFNFMXSA-N 255.745 2.248 10 20 CECD COc1cccc(CNC(=O)NOC2CCCC2)c1O 271699716 HANVDYPDMYKWDO-UHFFFAOYSA-N 280.324 2.074 10 20 CECD C[C@H](NC[C@@]1(N(C)C)CCSC1)c1ccccc1O 272931971 ZQRYRUNWPUVEKW-WFASDCNBSA-N 280.437 2.480 10 20 CECD Cc1ccc([C@@H](O)CNCc2cccc(C)c2O)o1 271767649 AVJZSZKOFIZELL-ZDUSSCGKSA-N 261.321 2.425 10 20 CECD CC[C@@H](NCCCS(C)(=O)=O)c1ccc(C)cc1O 280054231 JTEVOWCZMXFXQS-CYBMUJFWSA-N 285.409 2.176 10 20 CECD COc1cc(O)c(CN2CC[C@H](OC)C[C@@H]2C)cc1OC 282364292 PVYMTIWKKMZDDS-AAEUAGOBSA-N 295.379 2.409 10 20 CECD COc1cccc(CNC(=O)[C@@H](C)C(C)(F)F)c1O 293597094 DLEAAQXISULLPA-MRVPVSSYSA-N 273.279 2.308 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H](O)c2cnn(C)c2)c(O)c1 294841730 RXRYWQUENNHJCK-IUODEOHRSA-N 289.379 2.127 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](CO)CC2)c1O 293167095 OZKJILWVHKCJAA-GFCCVEGCSA-N 295.354 2.328 10 20 CECD NC(=O)[C@H]1CC[C@H](CN[C@H]2CCc3cccc(O)c32)CC1 817587603 ZJPLBJSABZNGNR-UBHSHLNASA-N 288.391 2.261 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@](C)(O)C1CC1 819761277 OKXZQFVFMFPUSF-INIZCTEOSA-N 298.379 2.045 10 20 CECD CSC1(CNCc2ccccc2O)CCN(C)CC1 810170517 MDWNHQGUSUAONT-UHFFFAOYSA-N 280.437 2.309 10 20 CECD Cn1ncc(CCCNCc2c(O)ccc(Cl)c2F)n1 815145315 RPWFHSAGAQUKIC-UHFFFAOYSA-N 298.749 2.036 10 20 CECD CC[C@@H](NCCNCCOC)c1cccc(Cl)c1O 817965522 WNHMECGEFMVOEI-CYBMUJFWSA-N 286.803 2.322 10 20 CECD OC[C@@H](NCc1cc(Cl)c(F)cc1O)C1CC1 816551851 QQLQSMCNQXOKEW-LLVKDONJSA-N 259.708 2.045 10 20 CECD CCCNC(=S)N[C@@H](C)c1cc(OC)ccc1O 728793212 QTRPJKIWRBUXQE-VIFPVBQESA-N 268.382 2.336 10 20 CECD COCC1(NCc2cc(OC)c(OC)cc2O)CCCC1 826834888 XYSOJYXQLWIKQH-UHFFFAOYSA-N 295.379 2.458 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)C[C@H](C(F)(F)F)O1 829414992 IKPQUSPAVVSWCU-IMTBSYHQSA-N 295.282 2.246 10 20 CECD C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)CO1 827608302 XZEVZARWTOEIIX-GXTWGEPZSA-N 291.395 2.071 10 20 CECD COc1ncc(/C=C\C(=O)N2CCCc3ccccc32)cn1 492701680 FCBMSECEBDMSQC-HJWRWDBZSA-N 295.342 2.478 10 20 CECD Cc1csc(NCCNC(=O)c2cc(O)cs2)n1 909449015 KWEUIZPTOHVTKZ-UHFFFAOYSA-N 283.378 2.061 10 20 CECD COc1ccc2c(c1)CCCN2CCN1CCCC1=O 917077404 NIIIETQCMITVCL-UHFFFAOYSA-N 274.364 2.070 10 20 CECD C[C@@H](NC[C@H](O)c1cnn(C)c1)c1ccc(Cl)cc1O 841748534 AMMCJSMZCQNGEE-OTYXRUKQSA-N 295.770 2.163 10 20 CECD COc1cccc([C@H](C)N[C@H](C)CO[C@H]2CCOC2)c1O 846150906 SVIYNGDIBDEYIP-AGIUHOORSA-N 295.379 2.245 10 20 CECD COc1cccc([C@@H](C)NCc2cc(C)[nH]n2)c1O 846143421 FTDZFKGARBBXBE-SNVBAGLBSA-N 261.325 2.283 10 20 CECD CC[C@@H](N)CNCc1cc(Br)cc(C)c1O 841070948 ABYAENVJTFOVOD-LLVKDONJSA-N 287.201 2.290 10 20 CECD CCOc1ccc(CNCCCNC2CC2)c(O)c1 841091586 AYWAWWSSMSJWQF-UHFFFAOYSA-N 264.369 2.023 10 20 CECD C[C@@H]1SCC[C@@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 844106852 LFUMBOVADTYDJV-VQHWEZBXSA-N 279.361 2.121 10 20 CECD COC(=O)CC1CC(NCc2cc(Cl)ccc2O)C1 846056334 VMYHDZQPVGYQMR-UHFFFAOYSA-N 283.755 2.477 10 20 CECD COC[C@@](C)(O)CN[C@H](C)c1cc2c(cc1O)CCCC2 756579493 ZZNPZBKCOPVONT-PXAZEXFGSA-N 293.407 2.319 10 20 CECD C[C@H](NC[C@](C)(O)C(F)F)c1ccc(N(C)C)cc1 698562043 DNFLIUYRVCZUCC-HZMBPMFUSA-N 272.339 2.419 10 20 CECD Cc1ccc(O)c(CNC(=O)CC[C@@H]2CCCO2)c1 862760831 XADDMUYLQVTHBJ-ZDUSSCGKSA-N 263.337 2.276 10 20 CECD COc1cc(N2CCCC2)c([N+](=O)[O-])cc1OC 32256935 KQLBSEKXMAMJNT-UHFFFAOYSA-N 252.270 2.212 10 20 CECD COc1ccc2c(c1)CCCN2CCOC(=O)N(C)C 1116662000 MUFAUNBUUFBIOH-UHFFFAOYSA-N 278.352 2.146 10 20 CECD CC(C)c1cc(C(=O)N(C)c2ccc(N)cc2)n[nH]1 877079880 AEEQYEROBQBBTC-UHFFFAOYSA-N 258.325 2.392 10 20 CECD COC1([C@H](C)NCc2ccc(C)cc2O)CCOCC1 877598847 UUIGTBZUXSEAHP-ZDUSSCGKSA-N 279.380 2.374 10 20 CECD CC[C@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@H]1O 1116448813 GEHKPYBZOSLKRP-DOTOQJQBSA-N 274.408 2.490 10 20 CECD CCCOc1ccc(CNC[C@]2(O)CCO[C@H]2C)cc1C 873116448 FTXJFEQLRZMUBR-WMLDXEAASA-N 293.407 2.413 10 20 CECD CCN(C)c1ccc(CN2CCC[C@](C)(O)C2)cc1 773822308 UNLWISYFEIZJFK-INIZCTEOSA-N 262.397 2.490 10 20 CECD CC(C)Nc1ccccc1NC[C@H]1CCS(=O)(=O)C1 871845650 GHFKCSCCSGWXBA-GFCCVEGCSA-N 282.409 2.354 10 20 CECD C[C@@H](NC1CCN(CC(C)(C)O)CC1)c1ccccc1O 877755889 RBGDCPCICQDHPP-CYBMUJFWSA-N 292.423 2.278 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)CC1(C)CCC1 881914947 GKZQOAOBZOAVJZ-UHFFFAOYSA-N 283.393 2.344 10 20 CECD COc1ccc(CNCCNC(=O)C(F)=C(C)C)cc1C 1125599853 YPYXGYUPXWCJIV-UHFFFAOYSA-N 294.370 2.473 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Cc1cncs1 782482049 KOORQGUDBKOIJU-UHFFFAOYSA-N 289.404 2.376 10 20 CECD COc1cc(CN2CCC[C@@](C)(O)CC2)c(O)cc1C 794666939 LSXWOOOEOZYALH-MRXNPFEDSA-N 279.380 2.446 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 793794988 AMXAEBRSAQVVRB-ZIBATOQPSA-N 295.379 2.206 10 20 CECD CO[C@H]1C[C@H](NCc2ccc(Br)cc2O)C1 706533955 WLYOCJYWAMBHLN-XYPYZODXSA-N 286.169 2.422 10 20 CECD Cc1cc(C(=O)Nc2c(Cl)ccc3nonc23)ncn1 1327166085 FLMKLXYLWPBOTF-UHFFFAOYSA-N 289.682 2.227 10 20 CECD O=C(NCC(C1CC1)C1CC1)c1c(F)ccc(O)c1O 1327980475 KRCWGCMTYAMYHI-UHFFFAOYSA-N 279.311 2.403 10 20 CECD CC[C@@H]1C[C@H]1Cn1cc(COc2ccc(N)cc2)nn1 905830550 RZASXXDVIUCCEL-NEPJUHHUSA-N 272.352 2.485 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@H](OC)C2)c1 776252576 GZEXEZBVEQXRJS-OLZOCXBDSA-N 265.353 2.448 10 20 CECD COCC1(CCNC(=O)NCc2ccc(N)cc2)CCC1 1336877799 RWZNSIIJTHUSQJ-UHFFFAOYSA-N 291.395 2.275 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1C[C@H]2C[C@H]1[C@@H]1C[C@H]21 1348047596 OJJHRDRMQLDWQZ-UJPOAAIJSA-N 273.332 2.006 10 20 CECD CNc1ncccc1C(=O)N(C)Cc1ccc(N(C)C)cc1 1346416918 CNDKIYFHCLKSFN-UHFFFAOYSA-N 298.390 2.462 10 20 CECD C[C@H]1CCc2[nH]nc(C(=O)NCc3ccc(N)cc3)c2C1 1342699802 OSUSEONJVPAMAP-JTQLQIEISA-N 284.363 2.047 10 20 CECD CO[C@H]1C[C@H](NC(=O)NCc2ccc(N)cc2)C12CCC2 1353412886 CUTRPVAXBCVDDL-KBPBESRZSA-N 289.379 2.026 10 20 CECD C[C@@H](NCc1nc(C(=O)O)cs1)c1ccccc1O 1607423314 ANDVDFFWFGSQQS-MRVPVSSYSA-N 278.333 2.398 10 20 CECD NC[C@H](C(=O)NCc1ccc(N)cc1)C1CCCCCC1 1524019439 SCMZZOXVIAEJCR-INIZCTEOSA-N 289.423 2.430 10 20 CECD C[C@H](CCN(C)C)N[C@H](C)c1cc(C(=O)O)ccc1O 1604142255 LGMIFERGWPHXRA-GHMZBOCLSA-N 280.368 2.081 10 20 CECD C[C@@H](NC[C@@H]1[C@@H](C(=O)O)C1(F)F)c1ccccc1O 1607422520 ZAYBGJGBDGAQJP-ZOFUNIGCSA-N 271.263 2.009 10 20 CECD Cc1oc(C(=O)O)cc1COc1cccc(-n2ccnn2)c1 1610579010 VYMQJWHUPIVOBF-UHFFFAOYSA-N 299.286 2.446 10 20 CECD Cc1cc(CCNC(=O)[C@@H](C)N)c(C)n1-c1ccccc1 1574133263 AQBAUYJTKLAGMC-CYBMUJFWSA-N 285.391 2.100 10 20 CECD COc1ccc(CN[C@@H]2[C@@H](C)CCN[C@H]2C)cc1C 1579216534 ZBBYDNURADNJRI-DETPVDSQSA-N 262.397 2.480 10 20 CECD C[C@@H]1CNC[C@H]1CCNCc1cc(F)c(N(C)C)cc1F 1579453731 IWVVUPFHZQRACZ-VXGBXAGGSA-N 297.393 2.366 10 20 CECD O=C(O)C1(CN[C@H]2CCc3cccc(O)c32)CCC1 1594879990 KOBCOJJFDVIYOQ-NSHDSACASA-N 261.321 2.224 10 20 CECD CCN(C)c1ccc(CN2CC[C@](CF)(C(=O)O)C2)cc1 1776855887 BMNTVWUPFUSUMW-MRXNPFEDSA-N 294.370 2.389 10 20 CECD CCOc1ccc(N(C)Cc2cc(=O)c(O)co2)cc1 150734396 URUITGPPPZAZMT-UHFFFAOYSA-N 275.304 2.381 10 20 CECD CC1(C)C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)CCO1 160467052 FENNJSRYOGWAPT-NSHDSACASA-N 280.324 2.348 10 20 CECD CCS(=O)(=O)N(Cc1ccccc1O)C1CCCC1 151326200 ANDDUUCMSJXLTC-UHFFFAOYSA-N 283.393 2.487 10 20 CECD C[C@@H]1CCN(CCN[C@@H]2CCc3cccc(O)c32)C1 834611533 MJHJMRIJJLRFKQ-TZMCWYRMSA-N 260.381 2.311 10 20 CECD Oc1c(F)cc(F)cc1CN1CC[C@@]2(CCOC2)C1 708381440 AUVITDCDMHHUTB-CQSZACIVSA-N 269.291 2.283 10 20 CECD CN(Cc1cc(F)cc(F)c1O)Cc1nccn1C 708386498 VGLVOMFKYWOOJK-UHFFFAOYSA-N 267.279 2.036 10 20 CECD Oc1c(F)cc(F)cc1CNCCc1cscn1 708468808 XVCMABFUSFVHGN-UHFFFAOYSA-N 270.304 2.459 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)c2n[nH]c(C)n2)c1 392461493 OZHSZDLZLHHZGM-RKDXNWHRSA-N 276.340 2.239 10 20 CECD Cc1nc([C@@H](C)NCc2cccc(Cl)c2O)n[nH]1 392460656 KVPXJKGKLDMBEB-SSDOTTSWSA-N 266.732 2.323 10 20 CECD Cc1ccc(C(=O)N[C@H](C)C(C)(C)CN(C)C)c(O)c1O 179515771 VUFKVPIHHXVLFH-LLVKDONJSA-N 294.395 2.112 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CN(C)C(C)C 115490655 LBIBTOOUEKJLSQ-UHFFFAOYSA-N 277.412 2.017 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cncnc1C 115280579 SLMRBGSALRFLEE-UHFFFAOYSA-N 284.363 2.089 10 20 CECD CCOC(=O)CN(CC)Cc1cc(F)cc(C(C)=O)c1O 79403831 JTQYRLMDOBQWLN-UHFFFAOYSA-N 297.326 2.119 10 20 CECD CCC(=O)N1CC[C@H](NCc2c(O)cccc2Cl)C1 134524134 HVCMJEOBTPHTFO-JTQLQIEISA-N 282.771 2.146 10 20 CECD CC[C@H]1CN(Cc2cc(F)ccc2O)CC[C@@H]1N 220234231 NXKITIPZQWGPLB-GWCFXTLKSA-N 252.333 2.091 10 20 CECD O=C1NC(=S)S/C1=C\c1nccn1-c1ccccc1 191208041 IIXJNHCVCCEIDL-NTMALXAHSA-N 287.369 2.361 10 20 CECD CC[C@@H](C)N(CC(=O)O)Cc1ccc(N(C)C)cc1 86752180 LLJNPCKVFLHMEK-GFCCVEGCSA-N 264.369 2.438 10 20 CECD Cc1ccc(O)c(CNc2nnc(-c3cnn(C)c3)o2)c1 195019363 BDXVBLWIKYLIKR-UHFFFAOYSA-N 285.307 2.096 10 20 CECD Cc1cc(O)nc([C@@H](C)N(C)Cc2ccccc2O)n1 192669569 ZXOBPHFZFKECAJ-LLVKDONJSA-N 273.336 2.389 10 20 CECD C[C@H]([C@@H](C)S(C)(=O)=O)N(C)Cc1ccc(N(C)C)cc1 93420058 XLMIPUZVBNQINP-CHWSQXEVSA-N 298.452 2.006 10 20 CECD CCOC(=O)CN(CC)Cc1cccc(OCC)c1O 92399536 HNIAXJSCORFEOD-UHFFFAOYSA-N 281.352 2.176 10 20 CECD CCOc1cccc(CN[C@@H](CO)CC2CCC2)c1O 279661600 GLJMXELWFSXUOU-CQSZACIVSA-N 279.380 2.432 10 20 CECD Nc1ccc(CCNC(=O)c2noc3c2CCCCC3)cc1 818544759 MQGZTARQDYLPFB-UHFFFAOYSA-N 299.374 2.498 10 20 CECD COc1ccc(N2CC[C@H](CN[C@H]3CCO[C@H]3C)C2)cc1 818221459 MUFAEKODGHTQQA-VBQJREDUSA-N 290.407 2.289 10 20 CECD OC[C@@H]1CCCN1Cc1ccc(Br)cc1O 824617522 IEVFBVPHBZVHNY-NSHDSACASA-N 286.169 2.111 10 20 CECD C[C@@H](NC(=O)c1n[nH]c2c1CCC2)c1ccccc1O 827930860 SLCMGSNRUDJLLH-SECBINFHSA-N 271.320 2.095 10 20 CECD C[C@H](NC(=O)c1cc(C=O)cn1C)c1ccc(N(C)C)cc1 829818521 XZRLJODPEWIIHV-LBPRGKRZSA-N 299.374 2.395 10 20 CECD O=C(O)CNCc1ccc2c(c1)CCN2Cc1ccccc1 903988107 NUNKTWINLXCIRT-UHFFFAOYSA-N 296.370 2.424 10 20 CECD COc1ccc(O)c(CNC(=O)N2CCCCCC2)c1 734068638 GXVDLVKOIGLVNF-UHFFFAOYSA-N 278.352 2.486 10 20 CECD COc1cccc(CNc2ccc(-c3nn[nH]n3)cc2)c1O 737133011 VCDZYRPESMKPEH-UHFFFAOYSA-N 297.318 2.193 10 20 CECD Nc1ccc(OCCNc2ccc(Cl)nn2)cc1 63130697 UAEYHBUAYAPICJ-UHFFFAOYSA-N 264.716 2.203 10 20 CECD COc1ccc(N(C)CCN(C)C[C@H]2CCOC2)cc1 844399895 RSUDAJMUNSWVJW-CQSZACIVSA-N 278.396 2.100 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@@H](c2ccncc2)C1 848101102 KRMPWNSBFLSDHH-GFCCVEGCSA-N 284.315 2.123 10 20 CECD Nc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccccc3)C2)cc1 746478605 DLATWIYXHDFEMN-LBPRGKRZSA-N 295.342 2.260 10 20 CECD CCOC(=O)[C@@H](C)N(C)CCN(C)c1ccc(OC)cc1 844399762 OCSQCFLAXDFFDM-CYBMUJFWSA-N 294.395 2.015 10 20 CECD CCOC(=O)[C@@H](CC)C(=O)NCc1cc(Cl)ccc1O 846475356 CRLBWHPSAUIUIY-NSHDSACASA-N 299.754 2.251 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@@H](C)c1cccc(OC)c1O 846163132 KXUAFCWSXCTXGE-NJZAAPMLSA-N 295.379 2.245 10 20 CECD COc1ccc(N(C)CCN(C)CC[C@H]2CCOC2)cc1 844401896 PPFJKDQVTLBUJA-HNNXBMFYSA-N 292.423 2.490 10 20 CECD C[C@H](CC(=O)O)CC(=O)NCc1cc(Cl)ccc1O 911331877 QUZSJFVWFSAGMP-QMMMGPOBSA-N 285.727 2.163 10 20 CECD Cc1cc(N(C)C)ccc1CNc1nccn2cnnc12 743460898 PTUGVQQOQOOOCB-UHFFFAOYSA-N 282.351 2.111 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C)[C@@H](CN)C2)c1 841100812 KPQKJDHVXKXCBT-OCCSQVGLSA-N 278.396 2.208 10 20 CECD COc1ccc(N(C)Cc2cnc(C)cn2)cc1OC 749441457 WXDZYLWSNMUSCF-UHFFFAOYSA-N 273.336 2.439 10 20 CECD CN(C)c1ccc(NC(=O)NCc2ccccc2O)cn1 748443028 KXPWKYNPKGVCRT-UHFFFAOYSA-N 286.335 2.175 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)[C@@H](C)OC)c1O 846162864 CWNGTJZJWXWUBK-GARJFASQSA-N 253.342 2.475 10 20 CECD CC(C)[C@H](N)CCN(C)Cc1cccc(F)c1O 843056451 KKLIBZJTQUHSKD-CYBMUJFWSA-N 254.349 2.337 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1C[C@@H]1C=CCC1 925064609 BIYQJRJLXNONKD-GFCCVEGCSA-N 286.331 2.123 10 20 CECD CCN(CC)c1ccc(CNCCN2CCC2)cc1F 752101018 HAQOGGQHPKSDDX-UHFFFAOYSA-N 279.403 2.467 10 20 CECD CC(C)OCCNCc1cc(Cl)cc([N+](=O)[O-])c1O 757976726 ASBWQUVYROXVPL-UHFFFAOYSA-N 288.731 2.468 10 20 CECD O=C(NCC1CCN(CC2CC2)CC1)c1cc(O)cs1 856414545 MUSWSWXWZWRSLJ-UHFFFAOYSA-N 294.420 2.306 10 20 CECD CN(C)CCCCNCc1cc(F)c(N(C)C)cc1F 858115433 FRYHSQZHNJCJBC-UHFFFAOYSA-N 285.382 2.462 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CC[C@H](O)CC2)c1 756771449 WYOIFSGJYPTTAT-RAIGVLPGSA-N 293.363 2.133 10 20 CECD CCOC(=O)[C@@]1(C)CCC[C@H]1NC(=O)c1cc(O)cs1 856303602 LOHXEOQKXVVNSE-RISCZKNCSA-N 297.376 2.305 10 20 CECD C[C@H](NC(=O)CCCCO)c1ccc(N(C)C)cc1 867503421 KLRXABNZMARKOL-LBPRGKRZSA-N 264.369 2.092 10 20 CECD Cc1ccc(CN2CCCN(C(=O)C3CC3)CC2)c(O)c1 877457831 DBNUVLZAIZQLDD-UHFFFAOYSA-N 288.391 2.145 10 20 CECD CCCOc1ccc(CN[C@H](COC)C(=O)OC)cc1C 877469862 UXLLZFXPJIMZGW-CQSZACIVSA-N 295.379 2.061 10 20 CECD Cc1ccc(CN2CC(O)(c3ccccc3)C2)c(O)c1 877537545 NRSXUIMVXNUIMG-UHFFFAOYSA-N 269.344 2.404 10 20 CECD CCn1nnc(C)c1CN[C@H](C)c1ccccc1O 877755618 IHWNFWUYKBCVJA-SNVBAGLBSA-N 260.341 2.163 10 20 CECD CC[C@@H](NCCN1C[C@@H]2CC[C@H](C1)O2)c1ccccc1O 776005846 CZHWRYVULZXRJO-IJEWVQPXSA-N 290.407 2.296 10 20 CECD C[C@H](NC(=O)[C@@H]1CCCOC1)c1ccc(N(C)C)cc1 773015431 OGTMHTMCVBUOIE-GXTWGEPZSA-N 276.380 2.356 10 20 CECD Oc1c(F)cc(F)cc1CN1CCO[C@@H](C(F)F)C1 894675419 FSDMRMLPDJJHLM-SNVBAGLBSA-N 279.233 2.136 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@@H](C2OCCO2)C1 896384313 JSDJHEDADRGINU-SNVBAGLBSA-N 283.755 2.240 10 20 CECD COc1cc(C)cc(CN[C@H]2CCO[C@H](C)C2)c1O 894359418 ODYRMWLOQDKZJW-YPMHNXCESA-N 265.353 2.366 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2cccc(OC)c2O)C1 93770481 WLWWXOUENSWJEQ-ZDUSSCGKSA-N 278.396 2.174 10 20 CECD Cc1ocnc1C(=O)Nc1c(Cl)ccc2nonc12 1322263206 DLNHZJDPWIGWRR-UHFFFAOYSA-N 278.655 2.425 10 20 CECD NC[C@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1326198893 DNWSHGFDSYUROB-MRXNPFEDSA-N 273.424 2.458 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1ccc(N(C)C)cc1 686595600 GKJNLRWMOJATMI-HZPDHXFCSA-N 278.396 2.036 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC[C@H]1CCOC1 1324664776 ALWXELQHZXSDGE-FXMSTWTQSA-N 278.304 2.081 10 20 CECD COc1ccc(CN[C@@H](C)C[C@H]2CCOC2)c(O)c1OC 1335478344 GPCBZYKFRFMNTE-NWDGAFQWSA-N 295.379 2.314 10 20 CECD Cc1nc(CCC(=O)NCc2ccc(N)cc2)cs1 1342023131 SOKOOCZKXMYUPT-UHFFFAOYSA-N 275.377 2.283 10 20 CECD CO[C@H]1CCC[C@@H]1C(=O)NCc1cc(C)ccc1O 1347202437 HKVHXMBFVZSEGW-JSGCOSHPSA-N 263.337 2.132 10 20 CECD CC1(C)C[C@H](NC(=O)NCc2ccc(N)cc2)C(C)(C)O1 1357338531 YGJOGGJXJSBCRV-ZDUSSCGKSA-N 291.395 2.414 10 20 CECD C[C@H](N[C@H](C)CCCCN)c1cc(C(=O)O)ccc1O 1609738991 ZIAXGZMEIDYYSN-MNOVXSKESA-N 280.368 2.259 10 20 CECD CCC(C)(C)OCC(=O)NCc1ccc(N)cc1 1576947736 DGYUYWPSGKUZPA-UHFFFAOYSA-N 250.342 2.090 10 20 CECD COc1ccc(O)c(CN[C@H](CCO)C(C)(C)C)c1 231073221 NEGOJULONZPKGB-CQSZACIVSA-N 267.369 2.288 10 20 CECD C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)[C@H]1CN 252173565 OMHOTDWAVXAHRA-CJNGLKHVSA-N 261.413 2.312 10 20 CECD C[C@@H](NCc1cc2c(cc1O)OCO2)c1ccccn1 42879412 XVDYHZIHCKESRE-SNVBAGLBSA-N 272.304 2.367 10 20 CECD C[C@@H](CNC(=O)c1cccc(O)c1O)c1nccs1 193162769 YICYNWNBIRFXRB-QMMMGPOBSA-N 278.333 2.088 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CO[C@H](C)C2)c1 402305801 KFDIEAYTLJVPEN-VWYCJHECSA-N 251.326 2.229 10 20 CECD Nc1ccc(NC(=O)N2CC[C@H]3[C@@H](C2)C3(F)F)cc1 1580447617 HZHOYHSXVQUPDY-WDEREUQCSA-N 267.279 2.388 10 20 CECD CC1(C)[C@H]2CN(Cc3cc4c(cc3O)OCO4)C[C@@H]21 172942026 CDGWHYDTQSACLG-QWRGUYRKSA-N 261.321 2.209 10 20 CECD COCCCCN1CCN(c2ccc(OC)cc2)CC1 117870618 YCNWIMJDTBCEPN-UHFFFAOYSA-N 278.396 2.244 10 20 CECD CN(C)c1ccc(CNC2CCC(O)CC2)cc1F 113312049 URLNGUCGRZMPAY-UHFFFAOYSA-N 266.360 2.285 10 20 CECD CS[C@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 69914286 QCOWRHIAGKKTGD-SECBINFHSA-N 270.373 2.259 10 20 CECD CC[C@H](C)C[C@@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 400859798 MOQNKEVDWYEOMW-XJKSGUPXSA-N 291.439 2.475 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCc1cccc(O)c1 181224912 MCQSNWBKEKWHSK-FNORWQNLSA-N 299.326 2.176 10 20 CECD COCCCCCNC(=O)/C=C/c1ccc(O)c(O)c1 180994400 HSARFMXNCKSUKE-SOFGYWHQSA-N 279.336 2.044 10 20 CECD CCOc1ccc(O)c(CN2CCSCC2)c1 126227079 OXPQQJJUEOEFNN-UHFFFAOYSA-N 253.367 2.340 10 20 CECD COCCN(C)Cc1cc(Cl)cc(C(C)=O)c1O 42459777 BVHJUVYZWRKUPF-UHFFFAOYSA-N 271.744 2.326 10 20 CECD CCO[C@@H]1C[C@H](NCc2cccc(Cl)c2O)[C@H]1OC 274934350 PCDRQVPXHKPIER-OUCADQQQSA-N 285.771 2.328 10 20 CECD Cc1ccc([C@H](C)NCc2nnc3n2CCC3)c(O)c1 273446087 ZXVYFRSUURZXIR-NSHDSACASA-N 272.352 2.089 10 20 CECD COc1ccc(CNCCC2(O)CCOCC2)cc1C 285497435 MNFJPOSHKMAMGG-UHFFFAOYSA-N 279.380 2.025 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2OC)C[C@@H](C)[S@]1=O 809699234 LZUVTJYITZRZLD-FKANQGBASA-N 297.420 2.132 10 20 CECD CCN(Cc1nc(C)no1)c1ccc(OC)c(OC)c1 299261953 GANALKSTGIXKDQ-UHFFFAOYSA-N 277.324 2.422 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@@H](C)NC(C)=O 801548522 WEHGQXSZMKXVJX-GFCCVEGCSA-N 292.379 2.046 10 20 CECD C[C@@H](NC1CC1)C(=O)NCc1ccc(N2CCCC2)cc1 296330704 HTPFBNOJBGKKSK-CYBMUJFWSA-N 287.407 2.044 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cc(C=O)c[nH]2)c1 815835016 IBNDTYWODBBZBW-VIFPVBQESA-N 288.303 2.032 10 20 CECD Cc1cc(CN2CCC[C@@H]2CCO)ccc1N(C)C 815095611 FDMROOMTJKHSFJ-OAHLLOKOSA-N 262.397 2.408 10 20 CECD COc1ccc2c(c1)C[C@@H](C(C)C)CN2CC(=O)O 817874289 PHAJAGQTCHVBDX-GFCCVEGCSA-N 263.337 2.415 10 20 CECD C[C@@H](NCc1ccc(-c2nn[nH]n2)cc1)c1ccccc1O 824612074 IQGZAGDCGDEOPV-LLVKDONJSA-N 295.346 2.423 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCOC1 822834280 WKAWIOKFCSEJGP-ZFWWWQNUSA-N 290.407 2.145 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCCN(C)C2=O)cc1Cl 825331724 RHNIBEPUXRZRMJ-GFCCVEGCSA-N 282.771 2.064 10 20 CECD COc1ccc(CN[C@]2(CC(=O)O)CCCOC2)cc1C 901523463 CNORJVJCIIDNAK-INIZCTEOSA-N 293.363 2.117 10 20 CECD COc1cc(CN2CC[C@@H]2CO)c(O)c(C(C)(C)C)c1 902629442 DKFNVOHNVPPSFX-GFCCVEGCSA-N 279.380 2.265 10 20 CECD CN1CCCc2cc(CNC(=O)C[C@H]3CCOC3)ccc21 739536782 PPHIKNAVZFOSEU-CQSZACIVSA-N 288.391 2.112 10 20 CECD CN(C)C[C@H]1CCN(Cc2c(O)ccc3ccncc23)C1 738227715 OMPATSILXQTHCA-CYBMUJFWSA-N 285.391 2.324 10 20 CECD CCOc1ccc(O)c(CN2CCC(C)(C(=O)O)CC2)c1 843041350 QRPNOUOEBPMKSO-UHFFFAOYSA-N 293.363 2.478 10 20 CECD C[C@@H]1CC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)C[C@H]1C 841088431 WKRQFWXUIRGWSR-JTNHKYCSSA-N 289.379 2.148 10 20 CECD C[C@H](CCCN)NCc1c(O)ccc(Cl)c1F 841080044 NFTVXPFSOJFBIQ-MRVPVSSYSA-N 260.740 2.402 10 20 CECD CO[C@@H](CC(C)C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 841418451 TVVJFWJZPDSXFZ-ABAIWWIYSA-N 295.379 2.206 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC[C@H]1N 843053026 XXVOGGGRBZAOAD-GZMMTYOYSA-N 299.758 2.123 10 20 CECD COC1([C@H](C)NC(=O)c2ccc(C)c(O)c2O)CCC1 840531586 GABHBYKXXNAHBL-JTQLQIEISA-N 279.336 2.094 10 20 CECD Cc1ccc2c(c1)/C(=C/c1cnc(N(C)C)n1C)C(=O)N2C 840721214 UHNLIZPLIATEGG-ZROIWOOFSA-N 296.374 2.312 10 20 CECD CSC[C@@](C)(O)CNCc1ccc(N(C)C)cc1C 840933229 FWZCTIIIWMWLMV-HNNXBMFYSA-N 282.453 2.265 10 20 CECD CCC[C@@H](O)CN(C)CCN(C)c1ccc(OC)cc1 844402902 WJIDERCEIRGJBC-OAHLLOKOSA-N 280.412 2.224 10 20 CECD CCc1cccc(CN2CCO[C@]3(CCO[C@@H]3C)C2)c1O 848908380 SHBWRCFMGLZWBO-CXAGYDPISA-N 291.391 2.334 10 20 CECD COCCOC[C@H](C)NCc1ccc2c(c1)CCCO2 921782078 DLSRTJRUTBVFGQ-ZDUSSCGKSA-N 279.380 2.153 10 20 CECD COc1ccc(N2CCC(NC[C@@H](N)C(C)C)CC2)cc1 841029104 GHTQUGXKZIKIIT-QGZVFWFLSA-N 291.439 2.237 10 20 CECD C[C@@H](CC(=O)N(C)Cc1ccccc1O)n1ccnc1 845790835 DMPORNSHBIRJLB-LBPRGKRZSA-N 273.336 2.198 10 20 CECD O=C(N[C@@H]1CCc2cc(O)ccc2C1)c1cccc(O)c1O 768821232 ISFZVDKTWWXWQR-GFCCVEGCSA-N 299.326 2.091 10 20 CECD CCOc1ccc(CN2C[C@@H](C)[C@H](C(=O)OC)C2)c(O)c1 769514544 JDQSFATZBINQGO-BXUZGUMPSA-N 293.363 2.032 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@H](C)S(C)(=O)=O)cc1 773104977 PMHJKATVJIKPPW-QWHCGFSZSA-N 298.452 2.226 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2CCO[C@H]2C)cc1 878406800 DABGKPLZASLKIV-STQMWFEESA-N 293.363 2.100 10 20 CECD C[C@H](C[S@@](C)=O)N(C)Cc1cc(Cl)cc(F)c1O 776521225 MTEGTTYOVKBNKL-NTCNTBNZSA-N 293.791 2.384 10 20 CECD CC[C@H](C)NC(=O)CCNCc1cc(C)ccc1O 71408186 UXFPDKUXUXSUQT-LBPRGKRZSA-N 264.369 2.095 10 20 CECD C[C@H](O)C[C@H](C)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776248419 IXUNAJODOYTRFO-RWMBFGLXSA-N 293.411 2.272 10 20 CECD C[C@H](N[C@@H](C)c1ncnn1C)c1c(O)cccc1F 886598580 FROCYSIEXGOUDN-IUCAKERBSA-N 264.304 2.072 10 20 CECD C[C@@H](NCc1cc([N+](=O)[O-])ccc1O)[C@H]1CCCOC1 779985463 FUKOUJZKQSJRFT-MNOVXSKESA-N 280.324 2.205 10 20 CECD CON(Cc1cc2c(cc1O)OC[C@H]2O)CC(C)(C)C 789514096 AVUJLOULAHUHRN-CYBMUJFWSA-N 281.352 2.228 10 20 CECD COc1cc(C)cc(CN(C)Cc2cn[nH]c2)c1O 894028480 RXSRRGJOPCAKBJ-UHFFFAOYSA-N 261.325 2.064 10 20 CECD Oc1c(Cl)cc(Cl)cc1CNC[C@H]1COCO1 894873324 QPVXDKVXCMADJF-VIFPVBQESA-N 278.135 2.162 10 20 CECD COc1ccc(CNC(=O)NCC2(C)CC2)c(O)c1 792977459 WQLUPDIBQZRMLS-UHFFFAOYSA-N 264.325 2.000 10 20 CECD Cc1cccc(NC(=S)NNc2nc3ccccn3n2)c1 790344258 IYROKITVDAOLLC-UHFFFAOYSA-N 298.375 2.351 10 20 CECD CCn1ncnc1CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 794841096 LNGFZUFVGOMJAU-GXSJLCMTSA-N 290.342 2.481 10 20 CECD C[C@@H]1CSC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 796396563 SMUTZHJHACFWFP-KCJUWKMLSA-N 268.338 2.142 10 20 CECD COC(=O)[C@@H](NCc1c(O)ccc(Cl)c1F)C1CC1 792180673 RNZDDJXNGBRMMB-LBPRGKRZSA-N 287.718 2.226 10 20 CECD Cc1c[nH]nc1CNCc1cc(Cl)ccc1O 716502468 XOXYKOHIJCGAJJ-UHFFFAOYSA-N 251.717 2.367 10 20 CECD COC(=O)[C@H]1CCCCCN1Cc1ccc(N)cc1 1356083751 ZUWOTXNOYFMMKC-CQSZACIVSA-N 262.353 2.186 10 20 CECD CC[C@@H](CCO)CN[C@H](C)c1cc(C(=O)O)ccc1O 1605022659 XLYNQWATQOJRMO-MNOVXSKESA-N 281.352 2.150 10 20 CECD O=C(OCc1ccsc1C(=O)O)c1cccc(O)c1O 1610879945 KKVOZERIXZTKIO-UHFFFAOYSA-N 294.284 2.215 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cccc(F)n2)c1 152374426 LFTAMYWQZOSJQN-VIFPVBQESA-N 290.294 2.426 10 20 CECD COc1ccc(N(C)CC(=O)Nc2cc(C)no2)cc1 844353099 GOLWIVOBMBUADI-UHFFFAOYSA-N 275.308 2.067 10 20 CECD COc1ccc(O)c(CNC[C@@H](O)CC(C)(C)C)c1 224823439 YKXSGTSCEZJMOY-LBPRGKRZSA-N 267.369 2.288 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CCCOC2)c1 38043967 VUWDCXPWQNHNLH-VXGBXAGGSA-N 265.353 2.478 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCC(=O)NC(C)C)c1 181270474 LZTBSKDHTFGJQV-GFCCVEGCSA-N 264.369 2.266 10 20 CECD Cc1ccc(O)c(CNC[C@@H]2CCN(C3CC3)C2)c1 71408004 JZFQEROGUYNVEQ-ZDUSSCGKSA-N 260.381 2.275 10 20 CECD C[C@@H](NCc1cc(F)cc(F)c1O)c1cnn(C)c1 708494447 JZJVXYKDNCFOHV-MRVPVSSYSA-N 267.279 2.255 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1C(=O)O 383286498 UIARZGKNIBWYNO-DOMZBBRYSA-N 276.380 2.295 10 20 CECD CN1CC=C(CN[C@H]2CCc3cccc(O)c32)CC1 392248003 RREZQRCDPMSUSI-AWEZNQCLSA-N 258.365 2.231 10 20 CECD COCc1noc(COc2ccc(N3CCCC3)cc2)n1 179690012 FWKYSQGRQFLNJJ-UHFFFAOYSA-N 289.335 2.395 10 20 CECD COc1ccc(NC(=O)c2ccc(C)c(O)c2O)c(C)n1 179545374 CRJFGFHZEHBOJL-UHFFFAOYSA-N 288.303 2.371 10 20 CECD COc1cccc(CNC[C@H]2CCCS2)c1O 122033368 BPUZIQKLNWVPAB-LLVKDONJSA-N 253.367 2.386 10 20 CECD COc1cccc(CNC(=O)/C=C/c2ccc[nH]2)c1O 188551543 HCYZFLAYERXNQC-BQYQJAHWSA-N 272.304 2.059 10 20 CECD C[C@H](N[C@H](C)CCN1CCN(C)CC1)c1ccccc1O 186566955 ANKDEIFTQFDTMM-CABCVRRESA-N 291.439 2.069 10 20 CECD CCN(Cc1cc(OC)ccc1O)C[C@H](O)C(F)(F)F 189868547 YJHOEXCSMFJXFB-LBPRGKRZSA-N 293.285 2.146 10 20 CECD O=C(Nc1cc(Cl)ccn1)c1cccc(O)c1O 126907086 XQBXOTDMYTYFCC-UHFFFAOYSA-N 264.668 2.399 10 20 CECD C[C@@H](NCc1ccnn1C)c1ccc(F)c(F)c1O 191200229 QIHNNKNANPNAHA-MRVPVSSYSA-N 267.279 2.255 10 20 CECD COC(=O)c1ccoc1CN(C)Cc1ccccc1O 264628454 UFYSIZQHIDYNPH-UHFFFAOYSA-N 275.304 2.404 10 20 CECD COc1cc(Cl)cc(CN[C@H]2C[C@H]3CC[C@H]2NC3)c1O 530246607 QGKQYZVRJBAXJA-WQAKAFBOSA-N 296.798 2.284 10 20 CECD C[C@@H](NC[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O 273372639 GLSWGCNLXHMGHB-MWLCHTKSSA-N 266.297 2.130 10 20 CECD CC[C@H](NC[C@H](CO)[C@H]1CCOC1)c1ccccc1O 280782321 GYJRYSCZWOUNOD-GUTXKFCHSA-N 279.380 2.078 10 20 CECD CC[C@@H](NC[C@@H]1CCS(=O)(=O)C1)c1ccc(C)cc1O 280260112 XDISGEQJXYBMPD-GXTWGEPZSA-N 297.420 2.176 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@]2(CCOC2)O1 280254020 LIZAENSJEZJFJV-YOEHRIQHSA-N 290.407 2.132 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H](CO)CCOC)cc1 281552313 JKHHXIMKZVLEJF-UKRRQHHQSA-N 280.412 2.191 10 20 CECD CN(C)c1ccc(CN2CCOCC(F)(F)C2)cc1 289424396 NACNRBOTGGODQH-UHFFFAOYSA-N 270.323 2.220 10 20 CECD CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@@H](C)[S@]1=O 289831922 UGWDDIDKMGUPBM-BBEGDGIKSA-N 281.421 2.432 10 20 CECD O=C(CCn1ccnc1)NCc1ccc(N2CCCC2)cc1 299671930 QYLJAMBMQMKQAU-UHFFFAOYSA-N 298.390 2.190 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C1 295638113 QLAXDYPSLKEREB-UKKRHICBSA-N 291.322 2.355 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H](CCO)CC2)c(O)c1O 817698220 RUQGBXDGBYRYMN-GFCCVEGCSA-N 293.363 2.031 10 20 CECD CCCN1C[C@@H](CNCc2cc(Cl)ccc2O)CC1=O 817410858 IVDNXSLJQUGUQU-LLVKDONJSA-N 296.798 2.394 10 20 CECD C[C@@H](N[C@H]1CCNC1)c1cc(Br)ccc1O 817945026 RPVJAUBGMIGLKJ-SCZZXKLOSA-N 285.185 2.167 10 20 CECD CCOc1ccc(CNC[C@H](OC)C2CC2)c(O)c1 815152966 CPMMNHGFSUYFEA-HNNXBMFYSA-N 265.353 2.306 10 20 CECD CC(C)[C@](C)(CC(=O)O)NCc1ccccc1O 901818663 KIJAPPRRYRLWEH-AWEZNQCLSA-N 251.326 2.371 10 20 CECD COC(=O)c1cnc(SCC(=O)C2(Cl)CC2)s1 917778331 PMJAHXMTCCWUNM-UHFFFAOYSA-N 291.781 2.362 10 20 CECD CCON(C(=O)/C=C/c1ccc(O)c(O)c1)C(C)C 844077753 NWLGZRDLUBTHOG-SOFGYWHQSA-N 265.309 2.300 10 20 CECD COc1cc(O)c(CN[C@H]2CCCC[C@@H]2CN)cc1OC 841028527 ASFFIYTUAGYKFB-YPMHNXCESA-N 294.395 2.017 10 20 CECD CC[C@@H](C)[C@](C)(O)CNC(=O)Nc1ccc(N)cc1 841300831 WQILZIQKZBLMLW-QMTHXVAHSA-N 265.357 2.187 10 20 CECD Cc1cc(CN2CC[C@H](C(=O)O)[C@H]2C)ccc1N(C)C 846285074 NLCZCKOHWZSQSM-OCCSQVGLSA-N 276.380 2.356 10 20 CECD CN(C)c1ccc(CN(C)C2CCNCC2)cc1F 843044329 CYMHFKBZOOTXPH-UHFFFAOYSA-N 265.376 2.076 10 20 CECD C[C@@H]1CC=C(C(=O)NCc2ccc(O)cc2O)CC1 910945785 YVUNOIYDYVYTFW-SNVBAGLBSA-N 261.321 2.460 10 20 CECD CCC[C@H]1CNCCN1Cc1cccc(F)c1O 843058664 ZWWCCXHKYZTLRO-LBPRGKRZSA-N 252.333 2.105 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)C[C@H](C)N)c1 843129234 OEEQVDNNUHVJCN-QWRGUYRKSA-N 252.358 2.006 10 20 CECD COc1cccc([C@@H](C)NCCc2cnc(C)cn2)c1O 846168099 GVMLGCDLIWCJLP-GFCCVEGCSA-N 287.363 2.393 10 20 CECD CCC(CC)(CO)C(=O)NCc1ccc(N(C)C)cc1 847297046 YKCILACHZDIJOR-UHFFFAOYSA-N 278.396 2.168 10 20 CECD C[C@H](N[C@H](C)C[S@@](C)=O)c1ccc(Cl)cc1O 841753908 OJGAGXNEKLHNTM-KSRUKNBBSA-N 275.801 2.463 10 20 CECD CC1(C)C[C@@]1(C)NC(=O)NCCc1ccc(N)cc1 851662858 MAAVERSHHDVTKC-OAHLLOKOSA-N 261.369 2.299 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H]1CCC(=O)O1 851722885 SCWASBDVGZLFDU-ZDUSSCGKSA-N 261.321 2.153 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H]1CCN1C 925413648 UBEYHWWSMXJKFU-CQSZACIVSA-N 291.395 2.018 10 20 CECD C[C@H](N[C@@H]1CCN(C)[C@H](C)C1)c1cc([N+](=O)[O-])ccc1O 756610038 HCSJXMUZZSKTED-GRYCIOLGSA-N 293.367 2.434 10 20 CECD CC(C)[C@@H](O)CN[C@H](C)c1cc(F)cc(F)c1O 756586858 VPHHSCAFYPDUOQ-PELKAZGASA-N 259.296 2.338 10 20 CECD CC[C@@H](NCc1nc(C(N)=O)cs1)c1ccccc1O 850539597 DVXPRMBMRXCCHA-SNVBAGLBSA-N 291.376 2.189 10 20 CECD CCC[C@H](O)CCN[C@@H](C)c1cc(C(=O)OC)ccc1O 927015009 DRKGHTILNAXAGS-AAEUAGOBSA-N 295.379 2.381 10 20 CECD Cc1cnc(NCc2ccc(N3CCC(O)CC3)cc2)nc1 853955069 CNCFDOWQLWQFEP-UHFFFAOYSA-N 298.390 2.358 10 20 CECD CCN(CC)c1ccc(CNC(=O)/C=C/COC)cc1 864927745 ZBJLHMKYJSJTMV-VOTSOKGWSA-N 276.380 2.352 10 20 CECD C[C@@H](NC[C@@H]1CC2(CCNCC2)CO1)c1ccccc1O 873293113 XZHPTTMJNWCRHS-KGLIPLIRSA-N 290.407 2.202 10 20 CECD Cc1cccc(O)c1CN(C)Cc1nnc2ccccn12 876655912 YCHPZCUDOAIYSW-UHFFFAOYSA-N 282.347 2.375 10 20 CECD CC[C@@H]1[C@H](C)CCN1Cc1cc2c(cc1O)OC[C@@H]2O 774618423 JTMYCPUDRLTBPU-YVLXSGLVSA-N 277.364 2.438 10 20 CECD Cc1ccc(O)c(CN[C@@H](C)C[C@@H]2CCCC(=O)N2)c1 877652493 INBRISMUZNGBOH-JSGCOSHPSA-N 276.380 2.238 10 20 CECD Cc1cccc(O)c1CNC[C@@H]1CN(CC(C)C)CCO1 876880806 NDFLYANFRMITFQ-OAHLLOKOSA-N 292.423 2.147 10 20 CECD C[C@@H](Nc1ccnc(N)n1)c1ccc(N2CCOCC2)cc1 1120806063 SSQFJCSVOIVUDU-GFCCVEGCSA-N 299.378 2.069 10 20 CECD Nc1ccc(CN2CCC[C@H](N3CCCC3=O)CC2)cc1 1120371221 CERNTGBSDMEBMO-INIZCTEOSA-N 287.407 2.246 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@H](C)c1c(O)cccc1F 886627152 UTAPDQWLLBVQIM-ZJUUUORDSA-N 268.332 2.095 10 20 CECD CC(C)(CNC(=O)NCc1ccc(N)cc1)c1ccccn1 1120623108 GUDQITMYQAKCKL-UHFFFAOYSA-N 298.390 2.441 10 20 CECD CCOc1ccc(CN2CCc3ncncc3C2)c(O)c1 895722872 MLYBVHIANOKXFO-UHFFFAOYSA-N 285.347 2.139 10 20 CECD COc1cc(C)cc(CNC[C@@H](CO)CC2CC2)c1O 895278553 MPUOCOHZCYOJFW-ZDUSSCGKSA-N 279.380 2.207 10 20 CECD COCc1nccc(N[C@H](C)Cc2ccc(O)c(O)c2)n1 893113046 TUBMTWRRYACTJW-SNVBAGLBSA-N 289.335 2.077 10 20 CECD CCOC1CC(N(C)Cc2ccc(OC)c(OC)c2O)C1 894510868 NIMHUTYWEFWEMP-UHFFFAOYSA-N 295.379 2.409 10 20 CECD Cc1ccc([C@@H](C)NCC2CCS(=O)(=O)CC2)c(O)c1 186185436 JCJYWDJYYXNYGW-GFCCVEGCSA-N 297.420 2.176 10 20 CECD CN(C)C(C)(C)CNCc1cc(F)cc(F)c1O 708441766 KZHTUSUYFUWZAO-UHFFFAOYSA-N 258.312 2.100 10 20 CECD CC1=CCN(c2nnc(-c3sccc3O)n2C)CC1 1339574825 WCJSTGCFGDPDES-UHFFFAOYSA-N 276.365 2.406 10 20 CECD Oc1c(Br)cccc1CNC[C@H]1C[C@@H](O)C1 720986945 VPIPFIUQXQEGBH-WAAGHKOSSA-N 286.169 2.015 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCCSC1 1337444160 HIFIOUGQALVURM-HYXAFXHYSA-N 265.334 2.034 10 20 CECD CCOC(CCNCc1c(O)cccc1OC)OCC 786831632 MVAPNPNOJFASHI-UHFFFAOYSA-N 283.368 2.280 10 20 CECD CN(C)c1ccc(CN[C@@H](CC(F)(F)F)C(=O)O)cc1 1350610689 KHPNWORMWKBLNU-NSHDSACASA-N 290.285 2.248 10 20 CECD COc1cc(C)c(CNC2CC3(CC(N)C3)C2)c(O)c1 1579145252 XVTROYHULDTTNV-UHFFFAOYSA-N 276.380 2.069 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@]3(CCOC3)C2)c1O 153729527 VJXNEIFKSOSLIL-INIZCTEOSA-N 293.338 2.346 10 20 CECD CCOC(=O)C[C@@H]1CCCN1Cc1ccccc1O 156270792 MUJCXBZZCQXSKT-ZDUSSCGKSA-N 263.337 2.310 10 20 CECD Fc1cnccc1CNCc1ccc2c(c1)CCO2 823752471 GMTSQFAAGLGDTG-UHFFFAOYSA-N 258.296 2.445 10 20 CECD CC[C@@H]1C[C@H](NCc2cccc(OC)c2O)CCO1 824383922 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DVSWHOFDHQMURV-UHFFFAOYSA-N 280.393 2.429 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)CNC)cc1F 236906551 WUTODLZUGPAECM-LBPRGKRZSA-N 295.402 2.144 10 20 CECD Cc1ccc(CN[C@@H](C)c2cc(F)ccc2O)c(=O)n1C 279513640 NTQARQARFLSHBD-NSHDSACASA-N 290.338 2.389 10 20 CECD COC(=O)CCN(Cc1cccc(C)c1O)C(C)C 271898905 YVBKNPMUGFOJBZ-UHFFFAOYSA-N 265.353 2.474 10 20 CECD CN1CC[C@@H]2CCN(Cc3cccc(F)c3O)[C@H]2C1 272259470 AMCHDPVRHSUXIO-RISCZKNCSA-N 264.344 2.057 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)c(F)c1O)c1nncn1C 276896660 INBQECQIBGRBQX-SFYZADRCSA-N 282.294 2.211 10 20 CECD C[C@@H](O)[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 272543282 PPNXEPSESJJJMF-DGCLKSJQSA-N 266.360 2.094 10 20 CECD CC(C)[C@H](NCc1cc(F)ccc1O)c1nncn1C 289316140 FFCNUVNSBKVHII-ZDUSSCGKSA-N 278.331 2.147 10 20 CECD C[C@@H](NCC1([S@](C)=O)CC1)c1ccc(F)c(F)c1O 282175501 FIHPWSODRSFOCV-YLVJLNSGSA-N 289.347 2.232 10 20 CECD COc1cc(O)c(CN[C@@H]2CCCCC[C@H]2O)cc1OC 289247361 AUMXLIYHNJAQAP-CHWSQXEVSA-N 295.379 2.193 10 20 CECD CCOCC1(C(=O)N(C)Cc2ccccc2O)CC1 281898985 HSIKOJYVKIHXHH-UHFFFAOYSA-N 263.337 2.167 10 20 CECD C[C@@H](O)c1ncc(CNCc2ccc3c(c2)CCO3)s1 809612549 QILIADLFWJRGAI-SNVBAGLBSA-N 290.388 2.421 10 20 CECD Cc1c(CNC(=O)CN2CC[C@H](C)C2)n(C)c2ccccc12 565201506 MGFWPXLSEVHZTJ-ZDUSSCGKSA-N 299.418 2.445 10 20 CECD CS(=O)(=O)CC1CCC(NCc2ccccc2O)CC1 293581570 DXOQPICOIJZAPP-UHFFFAOYSA-N 297.420 2.085 10 20 CECD C[C@@H]1C[C@@H](NC[C@@H]2C[C@H](F)CN2)c2c(O)ccc(F)c21 817977065 ZXVCZBRIISPTSD-FYLLDIAZSA-N 282.334 2.369 10 20 CECD Cc1ccc(C(=O)OCc2cccnc2C)c(O)c1O 811112855 RVXGRSHFQRCFBO-UHFFFAOYSA-N 273.288 2.467 10 20 CECD C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cc2c(cc1O)CCCC2 817977137 CFWCUDXGSHRKQU-ZQWVLENNSA-N 272.392 2.139 10 20 CECD C[C@@H]1C[C@H](N[C@@H](CN)C2CC2)c2c(O)ccc(F)c21 817961316 XCSPGXHTZJNTHN-ZHAHWJHGSA-N 264.344 2.407 10 20 CECD CCOc1ccc(O)c(CN[C@@H](CC(C)C)C(=O)O)c1 820387616 UWCAKPDCQMZQAQ-ZDUSSCGKSA-N 281.352 2.380 10 20 CECD COC(=O)C1(CNCc2cc(Cl)c(C)cc2O)CC1 825555165 DNQUPXYIQJGUSR-UHFFFAOYSA-N 283.755 2.397 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCC[C@@]2(C)N)cc1 825973923 TUVLFSZMPNLRNX-DOTOQJQBSA-N 289.423 2.276 10 20 CECD CCOc1ccc(N(C)Cc2ccc(-c3nn[nH]n3)o2)cc1 825638794 PBLVCRHTPYSNQX-UHFFFAOYSA-N 299.334 2.495 10 20 CECD O=C(O)[C@@H]1CCCN(Cc2c(O)ccc3ccncc23)C1 739582847 KBLUXAZHMGTKIH-GFCCVEGCSA-N 286.331 2.237 10 20 CECD CCc1nocc1CN(C)c1ccc(OCC(=O)O)cc1 902018035 SDPCYWVTXWUHMK-UHFFFAOYSA-N 290.319 2.337 10 20 CECD COc1ccc(N(C)Cc2cn(C3CC3)nn2)cc1OC 906257791 BFRCHANQEIQCPE-UHFFFAOYSA-N 288.351 2.267 10 20 CECD CC1(C)C(C(=O)NCc2ccc(O)cc2O)C1(C)C 910951609 UYKCQTIAOHUHHL-UHFFFAOYSA-N 263.337 2.396 10 20 CECD COc1ccc(CNC(=S)NCc2cccn2C)cc1 743061642 NQUCGUIDMDLHTH-UHFFFAOYSA-N 289.404 2.198 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(C)=O)C[C@@H]2C)cc1C 742218430 HOZPOLYMTPGJRK-XJKSGUPXSA-N 290.407 2.350 10 20 CECD C[C@@H]1CCCN(Cc2cccc(F)c2O)[C@@H]1CCN 844901209 FZCVMLSBEXUJPN-BXUZGUMPSA-N 266.360 2.481 10 20 CECD CCC(CC)CN(CC)C(=O)C(=O)Nc1ccc(N)cc1 841015760 IEEBFVAKXZQQMR-UHFFFAOYSA-N 291.395 2.492 10 20 CECD CO[C@]1(C)CCCN(C(=O)NCCc2ccc(N)cc2)C1 841957372 AKOWLUZGFXIVIC-MRXNPFEDSA-N 291.395 2.022 10 20 CECD CC[C@H](CS(=O)(=O)Nc1ccc(O)cc1Cl)OC 849308375 MQLOTNIWSOPBDD-SECBINFHSA-N 293.772 2.212 10 20 CECD CCOc1ccc(CN[C@H]2CCN(C)[C@@H](C)C2)c(O)c1 742374628 AQWZPBLGNVLUPS-JSGCOSHPSA-N 278.396 2.363 10 20 CECD CCc1nncn1CCN[C@H](C)c1cc(F)cc(F)c1O 756618432 BPPVSSRPRSKZBG-SECBINFHSA-N 296.321 2.175 10 20 CECD C1=C[C@@H](NCc2ccc(N3CCOCC3)cc2)CC1 698193761 BYUKCQXCHZAKSP-OAHLLOKOSA-N 258.365 2.331 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)[C@@H](C)C2)c1 764265806 SZMKQPQFEVJREU-WDEREUQCSA-N 291.347 2.022 10 20 CECD Cc1ccc(O)c(CNC(=O)CCc2ccccn2)c1 862757439 UMYRHHLLNIHGSJ-UHFFFAOYSA-N 270.332 2.345 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2O[C@H](C)C[C@@H]2C)c1 862755448 HIQAGUADERYARY-MISXGVKJSA-N 263.337 2.130 10 20 CECD Cc1n[nH]cc1CN(C)c1ccc(OCCN(C)C)cc1 761223883 UBJLJMMCMOBBNJ-UHFFFAOYSA-N 288.395 2.295 10 20 CECD COc1cccc(O)c1CN1CCC[C@H]1CN1CCCC1 769143942 DKJPRGULPBNCNJ-AWEZNQCLSA-N 290.407 2.461 10 20 CECD OC1CCN(c2ccc(CN3C[C@@H]4C[C@H]4C3)cc2)CC1 877651639 ZIBJCZAGISUZJD-GJZGRUSLSA-N 272.392 2.099 10 20 CECD C[C@@H](NC[C@@H](O)C1CCC1)c1c(O)cccc1F 886621984 HNHWJOUUVWFANO-NOZJJQNGSA-N 253.317 2.343 10 20 CECD CC[C@H](N[C@H](C)CC(N)=O)c1ccc(C)cc1O 794810577 LWONYQYUTMRRJN-PWSUYJOCSA-N 250.342 2.005 10 20 CECD COc1cc(C)cc(CNCCOCC(F)F)c1O 894538618 STTAQEKEXDUVBC-UHFFFAOYSA-N 275.295 2.081 10 20 CECD CC[C@@H](C)N1CCN(Cc2cc(OC)ccc2O)CC1 133821869 HUVPOMRJNBDBQX-CYBMUJFWSA-N 278.396 2.317 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(C)COC2)c1 94721664 SZSJVBQYBMCELT-SNVBAGLBSA-N 251.326 2.088 10 20 CECD CCc1cccc(CN2CCCN(C(=O)OC)CC2)c1O 1329984423 RRFCEWTVPHZPCN-UHFFFAOYSA-N 292.379 2.229 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)F)c1cc(F)ccc1O 717765976 AHOJWHGSLMJJQI-VXNVDRBHSA-N 263.259 2.198 10 20 CECD Nc1ccc(CNC(=O)N2C[C@@H]3[C@H]4CC[C@@H](C4)[C@H]3C2)cc1 1335737169 LDDLXPUHDYRMEH-WMHQRMGPSA-N 285.391 2.456 10 20 CECD CCC[C@@](C)(NCc1ccc(N)cc1)C(=O)OC 1336116973 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WPKFLCTWONQEEX-HZMBPMFUSA-N 251.326 2.058 10 20 CECD Cc1cccc(CN2CC[C@@H](N3CCCC3)C2)c1O 124582745 YYNXIVHMPBMDTK-OAHLLOKOSA-N 260.381 2.371 10 20 CECD C[S@](=O)C1(CNCc2c(O)cccc2Cl)CCC1 280710188 UAUDVUWIIGRWAF-SFHVURJKSA-N 287.812 2.436 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccccc2O)c(C)nn1 383992474 UZSICKMETIXZAG-UHFFFAOYSA-N 271.320 2.071 10 20 CECD C[C@H](CC[S@](C)=O)NCc1ccc2c(c1)CCCO2 921831463 WIYVHAMWXUXNGI-BLVKFPJESA-N 281.421 2.258 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncnc2[nH]ncc12 301309723 XZTJPVINYGYAQN-UHFFFAOYSA-N 282.351 2.339 10 20 CECD CC(C)COCCCNC(=O)/C=C/c1ccc(O)c(O)c1 180607305 MDYHHZJOJBOGKB-FNORWQNLSA-N 293.363 2.290 10 20 CECD CC[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCO1 31729795 ZTDLCAJYYYPCAW-HNNXBMFYSA-N 291.395 2.073 10 20 CECD CC[C@H](CCO)NCc1cc(Br)ccc1O 77453245 HMMXWRFJZHFLSK-LLVKDONJSA-N 288.185 2.405 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1n[nH]c2ccccc12 136942409 YBOGLCPFXCTRGS-UHFFFAOYSA-N 295.342 2.470 10 20 CECD CCCC[C@H](COC)NC(=O)c1cccc(O)c1O 193078930 CTFLXYVINLZVSA-SNVBAGLBSA-N 267.325 2.033 10 20 CECD COc1ccc(O)c(CN2CCO[C@H](C)[C@H]2C)c1 180257274 PKVUOEZTCJJQEH-GHMZBOCLSA-N 251.326 2.010 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)CCCO)c1 94941812 ANWWKFZPSRKPCU-QWRGUYRKSA-N 253.342 2.212 10 20 CECD C[C@@H]1[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@@H]1C1CC1 528863874 QVIJZSVNRBVKPM-YZMDESFKSA-N 261.321 2.006 10 20 CECD CN(C(=O)/C=C\c1cncc(F)c1)c1ncccc1F 254958650 UKLAWZVBYZALAF-PLNGDYQASA-N 275.258 2.431 10 20 CECD C[C@@H](NCCC1(C)OCCO1)c1cc(F)ccc1O 183904775 PNWHOXFZADLMOY-SNVBAGLBSA-N 269.316 2.335 10 20 CECD Oc1cc2c(cc1CN[C@H]1CCOC3(CCC3)C1)OCO2 268983701 SFQFMXYUOJMCAB-LBPRGKRZSA-N 291.347 2.312 10 20 CECD Cc1noc(C(C)C)c1C(=O)NCc1ccc(O)c(O)c1 272206268 BKGHDLJVUPXRLQ-UHFFFAOYSA-N 290.319 2.448 10 20 CECD COC(=O)c1ccc(CN(C)c2ccc3c(c2)OCO3)[nH]1 272748608 NCCAYKMLLXQQQI-UHFFFAOYSA-N 288.303 2.166 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@H](n2cncn2)C1 372817388 ZFVIUTIADAUHGM-VIFPVBQESA-N 296.733 2.223 10 20 CECD CS[C@H](CO)[C@H](C)NCc1ccc2c(c1)CCCO2 921764164 GNBZQMWWSUCUDL-XHDPSFHLSA-N 281.421 2.214 10 20 CECD Cc1cc(CN2CC[C@@H]([C@@H](C)O)C2)ccc1N(C)C 294773586 ZJSFYRZVJISFHY-UKRRQHHQSA-N 262.397 2.264 10 20 CECD C[C@@H](CCO)CCNCc1ccc(N2CCOCC2)cc1 397769725 KQJYXHMNENUURN-OAHLLOKOSA-N 292.423 2.021 10 20 CECD CC1(C)C[C@H]1CN1C(=O)CN(Cc2ccccc2O)C1=O 819168293 ORNSSTJRDNPVBY-LBPRGKRZSA-N 288.347 2.203 10 20 CECD O=C(NCc1ccccc1O)Nc1ccn2ccnc2c1 810229687 HPIQNIIUUKNGII-UHFFFAOYSA-N 282.303 2.362 10 20 CECD Oc1ccccc1CNCC[C@@]1(O)C[C@H]2CC[C@H]1C2 813783613 DAJVARBSDRSXLB-DUVNUKRYSA-N 261.365 2.423 10 20 CECD CC[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(F)F 824510761 ZRMRWQJSHUZJSD-SECBINFHSA-N 260.240 2.434 10 20 CECD CCOc1ccc(CN(C2CC2)C2COC2)c(O)c1 824472469 SCTDQBQZQFURNK-UHFFFAOYSA-N 263.337 2.154 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1 824839352 XDOVWHHZVGHEEY-WMHQRMGPSA-N 257.333 2.086 10 20 CECD O=C(NC[C@H]1CCCCS1)c1c(F)ccc(O)c1O 828253796 YLTJFCXSWNGCHP-MRVPVSSYSA-N 285.340 2.252 10 20 CECD O=C(O)C[C@@H]1CCCN1Cc1c(O)ccc2ccncc12 833210854 OHHNXEMUWMSFHR-LBPRGKRZSA-N 286.331 2.380 10 20 CECD Cc1cccc2c1CCCN2C(=O)c1ccoc1CC(N)=O 671725825 MCXASSBBFNDPQH-UHFFFAOYSA-N 298.342 2.209 10 20 CECD c1csc(SCc2noc3c2COCC3)n1 916758876 ADILHWLNVDZAQO-UHFFFAOYSA-N 254.336 2.496 10 20 CECD CN1CCCc2cc(CNC(=O)O[C@@H]3CCOC3)ccc21 914014807 MRCQLRCEBXILPS-CQSZACIVSA-N 290.363 2.084 10 20 CECD O=C1CCCN1C(=O)CSc1ncc(Cl)s1 849998616 QHCQNSVRCNRCTE-UHFFFAOYSA-N 276.770 2.038 10 20 CECD CCN1CCCN(C(=O)c2cc(O)cs2)[C@@H](C)C1 910275445 VSHVSLJWDHCVAV-JTQLQIEISA-N 268.382 2.010 10 20 CECD Nc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1 848594376 JZRLPTXAOKWIOV-LSDHHAIUSA-N 288.395 2.407 10 20 CECD CN(C)c1ccc(CN2[C@H]3CCNC[C@H]2CC3)cc1F 843058357 PSEDLZHAIMTWCI-ZIAGYGMSSA-N 277.387 2.218 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(OC)o2)c1 847590123 SEMUVZHSURQRQC-VIFPVBQESA-N 291.303 2.493 10 20 CECD Cc1cc(Br)cc(CNC2CCNCC2)c1O 841026879 UNJZUDNJCNILNN-UHFFFAOYSA-N 299.212 2.305 10 20 CECD CCOC(=O)c1cc(NC(=O)c2cc(O)cs2)cn1C 743783287 DASAWSRWWWGUPM-UHFFFAOYSA-N 294.332 2.221 10 20 CECD C[C@@H](NCc1ccc(N2CCCC2)cc1)c1cnnn1C 924650359 XEKWXBSPFQYTLN-CYBMUJFWSA-N 285.395 2.266 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1coc(C=O)c1 929533638 UHJQGCPUQDSMFC-UHFFFAOYSA-N 286.331 2.430 10 20 CECD C[C@@H]1C[C@@H](NCCO[C@@H]2CCOC2)c2c(O)ccc(F)c21 927079040 CLGZFMREFYUABA-NQBHXWOUSA-N 295.354 2.475 10 20 CECD CC1CCN(C[C@H](C)NC(=O)c2cc(O)cs2)CC1 855899541 OELTYCUGDGOWQO-NSHDSACASA-N 282.409 2.304 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H](C(=O)O)C1CCCC1 852947578 LTMWBKKLTAPZME-CQSZACIVSA-N 291.347 2.242 10 20 CECD CCC(CC)NC(=N)NCc1ccc(OC)cc1O 864465278 SLHASPHOPXQNCL-UHFFFAOYSA-N 265.357 2.203 10 20 CECD COC(=O)C(C)(C)N(C)Cc1ccc(N(C)C)cc1 769304720 CENULEPRPCSZEM-UHFFFAOYSA-N 264.369 2.136 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H](C)CSC)c1O 775028715 SFKJUEXOOIVYSF-MRVPVSSYSA-N 286.353 2.150 10 20 CECD OC[C@H](NCc1cc(Cl)cc(F)c1O)C1CC1 776177526 RHYFPNASTPVXFG-NSHDSACASA-N 259.708 2.045 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCC[C@@H]([S@@](C)=O)C1 877622722 BLZAJLILMUEGOL-VLXJIEOASA-N 281.421 2.480 10 20 CECD CCCn1cc(CN[C@H](C)c2cc(OC)ccc2O)nn1 877533705 QHROJEFNDSGEKR-LLVKDONJSA-N 290.367 2.253 10 20 CECD CCN(CC)C(=O)CN[C@H](C)c1c(O)cccc1F 886513123 UPBZJTVBQHMZSG-SNVBAGLBSA-N 268.332 2.050 10 20 CECD CC[C@@]1(CO)CCCN1Cc1cc(F)cc(F)c1O 894534296 RKPUUPAFPZQPQQ-AWEZNQCLSA-N 271.307 2.407 10 20 CECD COCCC1(NC(=O)c2ccc(C)c(O)c2O)CCC1 794164552 WICLZGAPLAHGKF-UHFFFAOYSA-N 279.336 2.095 10 20 CECD Oc1cc2c(cc1CNCc1ccccc1)OCO2 42879067 NYYQIFPDPXYIEN-UHFFFAOYSA-N 257.289 2.411 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@@H]2CCO)c1O 189951038 PJGPTFHBFWIAQV-DGCLKSJQSA-N 265.353 2.042 10 20 CECD COc1cccc(CNC[C@@H]2C[C@H](C)O[C@@H]2C)c1O 686510846 IESWMSOBPVMVEN-LOWVWBTDSA-N 265.353 2.304 10 20 CECD O=C(Cc1ccc(O)c(O)c1)Nc1ccc(C(=O)O)s1 1601361521 NIRPESAHFXTYJJ-UHFFFAOYSA-N 293.300 2.039 10 20 CECD COc1cc(C)c(CN2CC[C@@H](C(=O)O)[C@H](C)C2)c(O)c1 1574182034 NBJUYHIHQWHXHV-DGCLKSJQSA-N 293.363 2.252 10 20 CECD C[C@@H](CNCc1c(O)ccc(Cl)c1F)[C@H](F)C(=O)O 1776423157 BAWNAMWNZYSLBO-WKEGUHRASA-N 293.697 2.333 10 20 CECD CN(C)c1ccc(CN2C[C@@H](C(=O)O)CC2(C)C)cc1 1777039392 SQRBNZXVAYAIRV-ZDUSSCGKSA-N 276.380 2.438 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC(=O)NC(C)C 36781633 UCXIIDOUMHZNKF-NWDGAFQWSA-N 276.380 2.363 10 20 CECD CC(C)C(=O)NCCN[C@@H](C)c1ccc(N(C)C)cc1 37219942 KBQVROUZEYRXHZ-ZDUSSCGKSA-N 277.412 2.175 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCCN(C)C2)c1 44534963 RIDCNRAHBOMUQX-QWHCGFSZSA-N 278.396 2.393 10 20 CECD CC(C)OCC(=O)NCc1ccc2c(c1)CCCN2C 58770334 CGNPLQKRNSHOIC-UHFFFAOYSA-N 276.380 2.110 10 20 CECD COc1cccc(CNC(=O)c2ccccc2)c1O 68488720 KOCKROAEJGHLKR-UHFFFAOYSA-N 257.289 2.331 10 20 CECD CC(C)OC(=O)CCN(C)Cc1ccccc1O 72629635 PKMDBYUSOULSNI-UHFFFAOYSA-N 251.326 2.166 10 20 CECD COc1ccc(N2CCN(C[C@@H]3CC[C@H](C)O3)CC2)cc1 188535340 NOIMNTOFLLAMJY-YOEHRIQHSA-N 290.407 2.385 10 20 CECD Oc1ccccc1CN1CCN(C2CCCC2)CC1 133877846 DVUSJPLSBVCRAO-UHFFFAOYSA-N 260.381 2.452 10 20 CECD COc1cccc(CNC(=O)c2cc(C(C)C)no2)c1O 73110381 SIYFLEJBMZVFJC-UHFFFAOYSA-N 290.319 2.442 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@H](O)C(F)(F)F 183923113 UKBQFGYXNWSQCC-LBPRGKRZSA-N 276.302 2.108 10 20 CECD Cc1nnc([C@H](C)NC(=O)NCc2ccccc2O)s1 273696825 OGPPGTPEIASNTQ-QMMMGPOBSA-N 292.364 2.113 10 20 CECD CC(C)n1cnc(C(=O)N(C)Cc2ccccc2O)c1 282558261 BBDCTEIVLVQCMW-UHFFFAOYSA-N 273.336 2.442 10 20 CECD CC[C@@H](NC[C@H](COC)OC)c1ccc(C)cc1O 280269075 XSTPRBNEUPVDIO-TZMCWYRMSA-N 267.369 2.403 10 20 CECD COc1ccc(N(C)C(=O)C2=CC[C@@H](N)C2)cc1Cl 638027442 WLMQUOVJSUDOIR-SNVBAGLBSA-N 280.755 2.359 10 20 CECD C[C@@H](NCCC(C)(C)CO)c1cc([N+](=O)[O-])ccc1O 296556134 RVWBHBSUEUJVFT-SNVBAGLBSA-N 282.340 2.360 10 20 CECD CC1(C)CN(C(=O)c2cccc(O)c2O)[C@@H]1[C@H]1CCCO1 290610086 NTKWZBJYSXVORL-TZMCWYRMSA-N 291.347 2.127 10 20 CECD CC(=O)C(=O)CSc1ncccc1Br 808022304 JBEKEVKKYQZAHR-UHFFFAOYSA-N 274.139 2.094 10 20 CECD CC(C)Oc1ccc(N(C)C[C@H](O)CN(C)C2CC2)cc1 809989046 WQEBKPIRURTMCM-MRXNPFEDSA-N 292.423 2.365 10 20 CECD COc1ccc(N(C)Cc2csnn2)c(OC)c1 809577478 ZKVIRTZQRAADFV-UHFFFAOYSA-N 265.338 2.192 10 20 CECD C[C@H](NC[C@@H]1CNCCCO1)c1cc(Cl)ccc1O 817981696 MSAISSXMQUJVDJ-JQWIXIFHSA-N 284.787 2.075 10 20 CECD CNC(=O)N1CCN(Cc2ccc3ccccc3c2O)CC1 816515973 QNTZVIWOROKWEH-UHFFFAOYSA-N 299.374 2.002 10 20 CECD C[C@H](N)C[C@H](C)NCc1ccc(N(C)C)c(F)c1 817901938 ZUUOWWDEFXQYFE-QWRGUYRKSA-N 253.365 2.107 10 20 CECD Cc1cc(CN(C)Cc2cn[nH]c2)ccc1N(C)C 815072720 SEOJSCGQSYLJHG-UHFFFAOYSA-N 258.369 2.416 10 20 CECD CCOc1ccc(CN2C[C@H](C)C[C@@H](C(=O)O)C2)c(O)c1 817881839 PTDSIZIPEATBHL-DGCLKSJQSA-N 293.363 2.334 10 20 CECD C[C@@H](NC[C@H]1CCCN1)c1cc(F)cc(F)c1O 817951452 FWHSMABJBPFFFD-PSASIEDQSA-N 256.296 2.073 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H](OC)C2CC2)cc1 822840757 BXLIXVVLFQASJR-HNNXBMFYSA-N 293.363 2.100 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](OCCO)C2)cc1Cl 824767789 AXVDPMRXZICTIW-ZDUSSCGKSA-N 299.798 2.327 10 20 CECD CCN(CCc1ccccn1)C(=O)Cc1ccc(N)cc1 830360767 SZVNBZNNFNGUDP-UHFFFAOYSA-N 283.375 2.298 10 20 CECD COc1cccc(CNC(=O)/C=C\c2ccc(O)c(O)c2)c1 588403379 IIKJGEICLKIHMW-VURMDHGXSA-N 299.326 2.436 10 20 CECD CCOC(=O)[C@H](CC)N(C(=O)c1cc(O)cs1)C1CC1 832824006 RJYCLFYNZNGSPN-NSHDSACASA-N 297.376 2.400 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(CC)C1)c1ccc(N(C)C)cc1 834892490 VOKYCEZAZCRSMQ-GOEBONIOSA-N 289.423 2.414 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H]([C@@H]2CCNC2)C1 843125191 NRLQZEAPUYUNBL-ZIAGYGMSSA-N 290.407 2.222 10 20 CECD CCc1cccc(CN(CC(N)=O)Cc2ccccc2)c1O 848884031 HIQPTLGWQJPTLZ-UHFFFAOYSA-N 298.386 2.442 10 20 CECD COc1cccc(CNC(=O)NC[C@H]2CC2(C)C)c1O 745816839 PCMLWJHHURCWFA-LLVKDONJSA-N 278.352 2.246 10 20 CECD Cc1cccc(CN[C@H]2CCN(C(C)(C)C)C2=O)c1O 843414909 FNHVVBVPWXDNGO-ZDUSSCGKSA-N 276.380 2.190 10 20 CECD COCC[C@@H](C)NC(=O)NCc1cc(Cl)ccc1O 844941777 RWHUBNSISSBOES-SECBINFHSA-N 286.759 2.270 10 20 CECD CCOc1ccc(O)c(CN2CCC(C)(N)CC2)c1 843109532 XTHPODVGIUTHRO-UHFFFAOYSA-N 264.369 2.104 10 20 CECD Nc1ccc(NC(=O)NC[C@@H]2COC3(CCCC3)O2)cc1 841295986 MEFYXSVQCZNYEV-CYBMUJFWSA-N 291.351 2.076 10 20 CECD CCc1cccc(CN[C@H](CCO)CSC)c1O 848896429 ARKBXLWJDCWQIL-CYBMUJFWSA-N 269.410 2.158 10 20 CECD CNC(=O)[C@H]1CCCN(Cc2ccc(N(C)C)cc2C)C1 840914857 HHLXAPTYHHAURI-HNNXBMFYSA-N 289.423 2.019 10 20 CECD CCC[C@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 929936339 VPLTURATRDVRRV-INIZCTEOSA-N 290.407 2.405 10 20 CECD O=C(OCCOc1cccc(F)c1)c1cccc(O)c1O 758562470 RXDKPMZJEGUZIX-UHFFFAOYSA-N 292.262 2.473 10 20 CECD C[C@H](NC/C=C/CO)c1ccc(Br)cc1O 850507908 IXKQIKFBZNZGSM-HPOULIHZSA-N 286.169 2.354 10 20 CECD CO[C@H](C)[C@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850565203 CBKPYZFZDXFBQL-UONOGXRCSA-N 292.423 2.161 10 20 CECD CCOc1cccc(CN(CCO)[C@H](C)CC)c1O 862387811 QLLYBOGMRQTBPP-GFCCVEGCSA-N 267.369 2.384 10 20 CECD Cc1ccc(CN[C@@H]2COc3ccccc3[C@H]2O)c(O)c1 877537305 KPTHPTKAZLGSIJ-RHSMWYFYSA-N 285.343 2.285 10 20 CECD CCCN(C)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775403609 JNOSSVSHMBUKOR-ZDUSSCGKSA-N 277.412 2.272 10 20 CECD CC(C)c1n[nH]c(CN[C@H](C)c2ccccc2O)n1 879649385 PNJUDRZCCGOJGN-SNVBAGLBSA-N 260.341 2.485 10 20 CECD Cc1cccc(O)c1CN1CC(OC(=O)NC(C)C)C1 877582440 WAKSCEZGLPMGHC-UHFFFAOYSA-N 278.352 2.019 10 20 CECD C[C@@H](NC[C@@H]1CC2(CC2)C(=O)O1)c1ccccc1O 879649580 WLEWJUVRPTZGFJ-MNOVXSKESA-N 261.321 2.139 10 20 CECD CN1CCN(c2ccc(/C=C/c3ccncn3)cc2)CC1 771527165 FTUSBYWLFQYNDQ-GORDUTHDSA-N 280.375 2.399 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1Cc2ccccc2[C@@H]1O 898387511 PHAKMSVIWMXLMI-HOCLYGCPSA-N 291.297 2.418 10 20 CECD OC1CCN(c2ccc(CN3CC[C@H](CF)C3)cc2)CC1 895566518 AAZFYQDQVFFWPX-OAHLLOKOSA-N 292.398 2.439 10 20 CECD C[C@@H](NC(=O)CCc1cncnc1)c1ccc(N(C)C)cc1 794435853 XBYSDGMXQJSBBB-CYBMUJFWSA-N 298.390 2.353 10 20 CECD O=C(Nc1ccc(F)nc1)c1c(F)ccc(O)c1O 790074634 FCJQQLUUQHULST-UHFFFAOYSA-N 266.203 2.023 10 20 CECD CN(CC(=O)NCc1cccs1)Cc1ccc(N)cc1 1335286425 ZOCHYFBYOYFTTH-UHFFFAOYSA-N 289.404 2.079 10 20 CECD O=C(O)[C@H](NCc1ccc2c(c1)CCCO2)C1CCC1 1355404816 CPXMFOGEMJJHDD-OAHLLOKOSA-N 275.348 2.355 10 20 CECD COc1ccc(N(C[C@H]2CN(C)C(=O)O2)C(C)C)cc1F 1327809934 CLFQSDWYUTYBIL-GFCCVEGCSA-N 296.342 2.500 10 20 CECD COc1cc(O)c(CN(C)CCCF)cc1OC 1333845718 FEPKPNFWDMHKAL-UHFFFAOYSA-N 257.305 2.201 10 20 CECD CC1=NO[C@](C)(C(=O)N[C@H](C)c2ccccc2O)C1 1262637231 NHFSYRDDUUJRBI-YGRLFVJLSA-N 262.309 2.124 10 20 CECD COCC[C@@H](C)N[C@@H](C)c1cc(C(=O)O)ccc1O 1606852358 ITEPQQHMWBLBIH-ZJUUUORDSA-N 267.325 2.166 10 20 CECD CCN1C(=O)/C(=C/c2cc(C(=O)O)co2)SC1=S 1610005298 CCLHDHYIKZSDAJ-YWEYNIOJSA-N 283.330 2.199 10 20 CECD C[C@H](N[C@H](C)c1cc(C(=O)O)ccc1O)c1nccn1C 1593202749 BCQQZMFZJPVMOD-ZJUUUORDSA-N 289.335 2.236 10 20 CECD CC[C@](C)(CC(=O)O)NCc1cc(F)c(F)cc1O 1594824976 ITSDQGCZHGDQCS-CYBMUJFWSA-N 273.279 2.403 10 20 CECD COc1cccc(CNC2CCC(C(=O)O)CC2)c1O 86735327 UYSRBOMXUWXVDF-UHFFFAOYSA-N 279.336 2.134 10 20 CECD COc1cc(Cl)cc(CN2CCNC(C)(C)C2)c1O 396075866 RFTSEJNEJAXKMG-UHFFFAOYSA-N 284.787 2.238 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NC2CCOCC2)s1 1537963206 ZZYRUJZYZWSCGT-UHFFFAOYSA-N 266.326 2.467 10 20 CECD Cc1nccc(C(=O)NCc2ccc3c(c2)CCCN3C)n1 58770285 LQQRQXJLLUOVFB-UHFFFAOYSA-N 296.374 2.097 10 20 CECD COc1cccc(CNC(=O)Nc2nc(C)cs2)c1O 170791888 LCFDXIRNSIFVCA-UHFFFAOYSA-N 293.348 2.487 10 20 CECD COc1cccc(CNC(=O)c2ccccc2F)c1O 68488716 IVWIIMCWPZAFGW-UHFFFAOYSA-N 275.279 2.470 10 20 CECD CCc1cc(O)nc(CN(C)Cc2ccccc2O)n1 120489027 BJGCQHKOQMTSKI-UHFFFAOYSA-N 273.336 2.082 10 20 CECD C[C@@H](OC1CCCCC1)C(=O)NCc1ccc(O)cc1O 1354072711 QAANXQLYOSHXMI-LLVKDONJSA-N 293.363 2.452 10 20 CECD Cc1csc(CNC(=O)/C=C/c2ccc(O)c(O)c2)n1 180905169 LSQZNAQUYJVHKO-HWKANZROSA-N 290.344 2.192 10 20 CECD C[C@@H](O)[C@H]1CCN(Cc2cccc(Cl)c2O)C1 180853936 QJYPRXPLJIEKTG-ZJUUUORDSA-N 255.745 2.248 10 20 CECD CN(C)C(C)(C)CNCc1c(O)cccc1Cl 83551290 QOEHKIAWJPORMR-UHFFFAOYSA-N 256.777 2.475 10 20 CECD CN(Cc1ccc(N2CCOCC2)c(F)c1)CC(F)F 92509018 VTMMOCFWAFOTTR-UHFFFAOYSA-N 288.313 2.359 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1cc(Cl)ccc1O 91985885 FEJAGXHXBUPGKP-VIFPVBQESA-N 271.744 2.287 10 20 CECD CCc1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)o1 268339982 ALMWMBBUNSJOGI-UITAMQMPSA-N 297.357 2.128 10 20 CECD Oc1cccc(Cl)c1CN1CCCC2(C1)OCCO2 272717801 DTOGHJGIMDJZQW-UHFFFAOYSA-N 283.755 2.385 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](O)c2cnn(C)c2)c(O)c1C 273555396 GUCYPLAFKLUZET-DOMZBBRYSA-N 289.379 2.127 10 20 CECD CN(Cc1cc(-c2ccccc2)ccc1O)[C@@H]1COC[C@H]1O 289832161 UIBRYUNGWOBKEL-SJLPKXTDSA-N 299.370 2.251 10 20 CECD O=C1O[C@H]2C[C@H]1N(Cc1c(O)ccc3ccccc13)C2 294861348 TVWRMDFRFNUCFG-SMDDNHRTSA-N 269.300 2.045 10 20 CECD CSC[C@@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 295294401 JQHYFXURMAFXNV-SECBINFHSA-N 299.367 2.452 10 20 CECD C[C@@H]1C[C@H](CO)CN(Cc2cccc(Cl)c2O)C1 817412437 LIMMRGKHNSLBEV-MNOVXSKESA-N 269.772 2.496 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H](C)N(C)C 823663891 RLCYDGWMOKCEPN-ZIAGYGMSSA-N 291.439 2.058 10 20 CECD CN(C)CCCCC(=O)N(C)Cc1ccccc1O 729522561 YVINZOBTXPKXEH-UHFFFAOYSA-N 264.369 2.083 10 20 CECD Cc1ccncc1/C=C/C(=O)N1C[C@@H](O)Cc2ccccc21 493632921 PXQUASZPCLHUHS-MOEXGYKKSA-N 294.354 2.353 10 20 CECD CC(=O)c1cc(F)cc(CNC(C)(C)CC(=O)O)c1O 825946937 XYPSFPCZFZCEAD-UHFFFAOYSA-N 283.299 2.077 10 20 CECD C[C@H](Cc1cnccn1)NCc1ccc(N(C)C)c(F)c1 733326121 KAYZHHRSSIONDG-GFCCVEGCSA-N 288.370 2.403 10 20 CECD C[C@H](NC(=O)NCc1ccncn1)c1ccc(N(C)C)cc1 838558538 GNBUUQICDCKYRB-LBPRGKRZSA-N 299.378 2.103 10 20 CECD CCc1cccc(CN[C@H](CC2CC2)C(=O)OC)c1O 848917195 PSAZUMKBOBWHLB-CQSZACIVSA-N 277.364 2.386 10 20 CECD COc1cc(O)c(CN2C[C@@H]3[C@@H](C2)C3(F)F)cc1OC 844759346 XFXSLVXQORJPSN-NXEZZACHSA-N 285.290 2.106 10 20 CECD C[C@@H](CNC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 848391149 XAQYAVJCAZLXQW-QMMMGPOBSA-N 285.365 2.161 10 20 CECD CCC[C@@H](O)CCNC(=O)NCc1ccc(N(C)C)cc1 913926431 CGZUUZSCPCCDRC-OAHLLOKOSA-N 293.411 2.103 10 20 CECD O=C(O)[C@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 840997674 ZECMCVOUXFBBQZ-QMMMGPOBSA-N 287.718 2.481 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)NCc1ccc(N(C)C)cc1C 840936271 HYNJZFZFWNNGGL-UONOGXRCSA-N 291.439 2.454 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)C2(C)CC2)cc1 844853752 FCKGSMQSQKOUEE-UHFFFAOYSA-N 276.380 2.390 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@H](C)N1 843049382 MOBILTUDXAGZNC-NXEZZACHSA-N 254.761 2.228 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)Cn2ccnc2)c1O 846138210 AAIFZGMXNGWGCO-RYUDHWBXSA-N 275.352 2.337 10 20 CECD CCn1ccc(CN[C@H]2CCc3cccc(O)c32)n1 840840679 NKFPBYPAEZTXLT-ZDUSSCGKSA-N 257.337 2.386 10 20 CECD COc1cccc(O)c1CN1CCC([C@H](C)CO)CC1 846058104 LGSAITWFLMJQSM-GFCCVEGCSA-N 279.380 2.241 10 20 CECD Cc1cc(N(C)C)ccc1CNCC[C@@H]1CCNC1 841037515 UYURHSKGFQEORP-AWEZNQCLSA-N 261.413 2.150 10 20 CECD C[C@H]1C[C@H](NCc2ccc(N(C)C)cc2)c2ncnn21 850352497 YMLXRVPJZRPWOT-FZMZJTMJSA-N 271.368 2.140 10 20 CECD CN(C)c1cc(F)c(CN2CCc3n[nH]cc3C2)cc1F 857877932 PYELPWSYKQCXEB-UHFFFAOYSA-N 292.333 2.312 10 20 CECD CO[C@H]1C[C@H](NC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 858986075 XPPRZQZYGFDCGV-CTYIDZIISA-N 291.395 2.071 10 20 CECD CCN(CCC(=O)NC)Cc1ccc(N(C)CC)cc1 933863476 ZSLORANFBQUEDR-UHFFFAOYSA-N 277.412 2.101 10 20 CECD CCOc1ccc(CN2C[C@H](C)OC[C@@H]2C)c(O)c1 768537656 RIQGHVZKIQCGOW-RYUDHWBXSA-N 265.353 2.400 10 20 CECD CN(C)c1cc(F)c(CN2C[C@@H](O)C(C)(C)C2)cc1F 862352103 XTKAKDXEOMTNBD-CQSZACIVSA-N 284.350 2.234 10 20 CECD C[C@@H](NC(=O)c1cnns1)c1ccc(N(C)C)cc1 773007372 HTLQWQPMTWYWMS-SECBINFHSA-N 276.365 2.095 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2[C@@H](C)C2(F)F)c1 1123770537 SMLTXNRJXDMJBL-LWINAJNOSA-N 285.290 2.479 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H](C)C(=O)N(C)C)cc1 773048433 RCBPVKKTCPCSON-QWHCGFSZSA-N 277.412 2.270 10 20 CECD CCO[C@@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 779481781 OJXKWWJWLFWLFW-STMXVASLSA-N 291.347 2.139 10 20 CECD CO[C@H]1CCN(C(=O)NCc2ccc(N)cc2)CC1(C)C 1120592360 VZDWEFLEBNASAW-AWEZNQCLSA-N 291.395 2.225 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@@H](C)c1c(O)cccc1F 886512327 CDGJRMDLUQAPPR-MNOVXSKESA-N 282.359 2.487 10 20 CECD C[C@@H](NCc1c(O)ccc(Cl)c1F)c1nncn1C 790959984 QAJRKNYNYCIEIE-SSDOTTSWSA-N 284.722 2.164 10 20 CECD Cc1cc2c(N(C)Cc3ccccc3O)nccn2n1 302865802 YFBXFOZEBMMYRZ-UHFFFAOYSA-N 268.320 2.380 10 20 CECD CCOc1ccc(CN[C@H]2CCC[C@@H]2C(=O)OC)c(O)c1 1321867808 NBTKPCDMEGVYBO-KBPBESRZSA-N 293.363 2.222 10 20 CECD CN1CC[C@]2(CCN(Cc3cc(F)cc(F)c3O)C2)C1 708424625 YYEZGNPIRVJNRS-HNNXBMFYSA-N 282.334 2.198 10 20 CECD CN(C)C1(CNCc2cc(F)cc(F)c2O)CCC1 708503147 OKZTXPZEHNVUBJ-UHFFFAOYSA-N 270.323 2.244 10 20 CECD CCCC(=O)NC[C@H]1CCCN(Cc2ccc(N)cc2)C1 1345159144 CLEPGVTXFGNPRR-OAHLLOKOSA-N 289.423 2.397 10 20 CECD CCO[C@@H](CC(=O)NCc1ccc(N)cc1)C(C)C 1342701084 XCCVKGMHADVXRF-AWEZNQCLSA-N 264.369 2.336 10 20 CECD O=C(O)c1cnc(SC[C@H]2CCCC[C@H]2O)s1 1602537260 PEQLVCZNWNWPET-HTQZYQBOSA-N 273.379 2.485 10 20 CECD Nc1ccc(NC(=O)NCCCCCCC(=O)O)cc1 1601216953 XIDMJPGXBQTXIX-UHFFFAOYSA-N 279.340 2.425 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2CCOCC2)c1 104190172 QDWOWQOPYJDJCA-LLVKDONJSA-N 265.353 2.478 10 20 CECD CC(C)[C@H]1NCC12CCN(C(=O)c1cc(O)cs1)CC2 1575519190 AKBDCIYFXRVACM-CYBMUJFWSA-N 294.420 2.304 10 20 CECD Nc1ccc(CNC(=O)COc2cc(F)cc(F)c2)cc1 1580443403 BWVYTDYNTWSDBW-UHFFFAOYSA-N 292.285 2.242 10 20 CECD O=C(O)[C@]1(NCc2cc(F)cc(F)c2O)CCC[C@H]2C[C@H]21 1777600641 PYESXKPCEVNOOJ-AVZKPZGTSA-N 297.301 2.403 10 20 CECD COc1cc(Cl)cc(CNCC(C)(C)N(C)C)c1O 228669257 WGFPEJJBNYRELV-UHFFFAOYSA-N 286.803 2.484 10 20 CECD CCN(CC)C(=O)CN[C@@H](C)c1cc(F)ccc1O 228794837 RGSLBUHZMBSYNR-JTQLQIEISA-N 268.332 2.050 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(N(C)C)cc2)CN1C1CC1 122329027 DVCJRSVYSXVPTC-DZGCQCFKSA-N 273.424 2.467 10 20 CECD O=C(Nc1ccc2c(c1)OCO2)c1cccc(O)c1O 126235710 BTJYBXHDTRFXJX-UHFFFAOYSA-N 273.244 2.079 10 20 CECD O=C(NCCOC1CCCCC1)c1cccc(O)c1O 126421693 ZHJWTHIWVSBGBH-UHFFFAOYSA-N 279.336 2.177 10 20 CECD C[C@@H](NCCc1cncn1C)c1ccc(F)cc1O 401762833 WIIDKTAYNYRENE-SNVBAGLBSA-N 263.316 2.158 10 20 CECD C[C@H](CN1CCCC1=O)NCc1c(O)cccc1Cl 83552029 PIWDASFPYXCWBL-SNVBAGLBSA-N 282.771 2.146 10 20 CECD COc1cccc(CN2CCCCC[C@H]2C(=O)O)c1O 86814534 IXSOBVDPLMJBAH-LBPRGKRZSA-N 279.336 2.230 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(OC)c1O)[C@@H](C)O 386742857 YVRSUHPZBSMSIU-LDYMZIIASA-N 273.760 2.303 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCCNC)cc1 178711427 NJOVIBDROWOFMY-UHFFFAOYSA-N 277.412 2.149 10 20 CECD CC(C)OC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 308758957 SVIJEDSKXCGIBL-LBPRGKRZSA-N 264.369 2.355 10 20 CECD Cn1c(Cl)cnc1CNCc1ccccc1O 134264392 SWTWZXPTJONCIV-UHFFFAOYSA-N 251.717 2.069 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CC=CCC2)c1 114541789 VZHHZZIQHBDKTK-NSHDSACASA-N 261.321 2.373 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C)ccc2O)c1 114542263 HYJMIOILLVMXFB-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CCCC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 62574808 MBXRDDRYYNKXKU-ZDUSSCGKSA-N 276.380 2.438 10 20 CECD Cc1ccc([C@H](C)NC[C@H](C)CN2CCOCC2)c(O)c1 185505330 CFFYKTKPCBHKPE-GJZGRUSLSA-N 292.423 2.320 10 20 CECD CCC[C@@]1(C)C(=O)NCCN1Cc1ccc(N(C)C)cc1 189039268 XJHHAIJXCJRBSW-KRWDZBQOSA-N 289.423 2.243 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1cc(C)ccc1O 185510810 ASDMJINHUITFHY-UHIISALHSA-N 269.410 2.464 10 20 CECD CCCCO[C@@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183486651 LMKHLZRHTIYWGI-RYUDHWBXSA-N 295.379 2.350 10 20 CECD CC[C@]1(CO)CCCN1Cc1cc(OC)ccc1O 191957330 MVDZJRJYCXVROV-OAHLLOKOSA-N 265.353 2.138 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@H]1CCCO1 49740468 OOGAMRBBTFSLLA-MRXNPFEDSA-N 288.391 2.472 10 20 CECD COc1cc(O)c(CN[C@H]2CCC[C@H]2CCO)cc1OC 190303915 BACNIPWPZPGLST-AAEUAGOBSA-N 295.379 2.050 10 20 CECD CCCc1cc(NC(=O)c2cccc(O)c2O)n(C)n1 193152413 LGBCQRLNMUKPGQ-UHFFFAOYSA-N 275.308 2.036 10 20 CECD Oc1ccc(Cl)cc1CNCCN1CCSCC1 226246884 WTNCNIMGFFGKEH-UHFFFAOYSA-N 286.828 2.184 10 20 CECD CCN(CCCO)Cc1cc(Cl)cc(C(C)=O)c1O 135822495 BCEIYCFWAYSKMO-UHFFFAOYSA-N 285.771 2.453 10 20 CECD C[C@@H](O)[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1 92971142 QXEVBMPBHNAJEH-CJNGLKHVSA-N 262.397 2.488 10 20 CECD C[C@H]1OCC[C@]1(C)NCc1ccc(N2CCOCC2)cc1 230153966 REGPEJJZMRWTHP-PBHICJAKSA-N 290.407 2.180 10 20 CECD CCOc1cccc(CN2CCOC[C@@H]2C2CC2)c1O 93645468 VUNJLFDXQGCXFG-CQSZACIVSA-N 277.364 2.402 10 20 CECD C[C@](O)(CN[C@H]1CCc2cccc(O)c21)C(F)(F)F 296964111 RFYNVYBQGPFQQR-CABZTGNLSA-N 275.270 2.282 10 20 CECD CCCN(Cc1cc(OC)c(OC)cc1O)CC(C)(C)O 271753183 WKDZLIVPVKUFEY-UHFFFAOYSA-N 297.395 2.392 10 20 CECD COC(=O)C(C)(C)CCNCc1cccc(OC)c1O 285511041 NKGONCIKVWXDHO-UHFFFAOYSA-N 281.352 2.080 10 20 CECD Oc1cccc(Cl)c1CNCc1nc(C2CC2)n[nH]1 294807166 NLYDJNALDVZHPN-UHFFFAOYSA-N 278.743 2.331 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H]1CCCCO1 808095005 NXCIXFXRLNZHFE-GFCCVEGCSA-N 298.379 2.453 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1cccc(Cl)c1O 298779657 KMNKTZGKYFOLBB-ZDUSSCGKSA-N 268.744 2.276 10 20 CECD CCCCN(Cc1ccccc1O)CC1(CO)COC1 801596344 VXIZQNGQZSHKLK-UHFFFAOYSA-N 279.380 2.003 10 20 CECD COc1ccc(N(Cc2cnn(C)n2)CC(C)C)cc1 809958277 QNWURJMTZAPTMB-UHFFFAOYSA-N 274.368 2.486 10 20 CECD CCOc1ccc(CN2CCn3cncc3C2)c(O)c1 811514772 FWKMBMZQYBMQEU-UHFFFAOYSA-N 273.336 2.003 10 20 CECD CC[C@H](NCCO)c1ccc(C(F)(F)F)cc1O 810206652 BGJCRIPMHCHUJJ-JTQLQIEISA-N 263.259 2.444 10 20 CECD COc1ccc(O)c(CN2CC[C@@]3(CCCN(C)C3)C2)c1 816642268 VCSDTKHEKXSVFX-QGZVFWFLSA-N 290.407 2.319 10 20 CECD C[C@H](NCc1ccc(CC(N)=O)cc1)c1ccccc1O 810242988 VJIYZUGXXMXQRG-LBPRGKRZSA-N 284.359 2.271 10 20 CECD CCOC(=O)/C=C/CSc1ncc(C(=O)OC)s1 829681604 ZWMYYRVYXQXXGU-SNAWJCMRSA-N 287.362 2.141 10 20 CECD C[C@H]1CCCCN1CCCNC(=O)c1cc(O)cs1 732258616 WPTLFHYMERLBPH-NSHDSACASA-N 282.409 2.448 10 20 CECD Nc1ccc(CCNC(=O)Nc2cnc(C3CC3)nc2)cc1 841105685 YXIOTHJHDDSGGE-UHFFFAOYSA-N 297.362 2.300 10 20 CECD CCN(C[C@@H]1CCCO1)C(=O)NCCc1ccc(N)cc1 841956540 GTAVDSFZMVFILY-HNNXBMFYSA-N 291.395 2.022 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@@H]([C@H](C)N)C2)cc1 843056920 CAYZIMTZWAXRTM-WMLDXEAASA-N 291.439 2.081 10 20 CECD Cc1cc(O)c(CNCCN2CC[C@H](C)C2)cc1C 744450604 XMKGWTOXZUWCQU-LBPRGKRZSA-N 262.397 2.440 10 20 CECD Nc1ccc(NC(=O)C(=O)NC2CCCCCC2)cc1 841000073 NYELLGNNOFMBKG-UHFFFAOYSA-N 275.352 2.046 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H]2CCCNC2)cc1 844901180 FUSHGFRUFLFPAO-OAHLLOKOSA-N 291.439 2.063 10 20 CECD CCN(CCCO)Cc1ccc(N(C)C)cc1C 840915889 GVHUOTSVCOFBAL-UHFFFAOYSA-N 250.386 2.265 10 20 CECD C[C@H](C[S@@](C)=O)N[C@H](C)c1ccc(Cl)cc1O 841753907 OJGAGXNEKLHNTM-CGMALJKESA-N 275.801 2.463 10 20 CECD C[C@H]1COC(C)(C)CN1C(=O)c1cc(O)cs1 754494569 QGEZVHSUTWVHPG-QMMMGPOBSA-N 255.339 2.093 10 20 CECD COC1CC(N[C@@H](C)c2ccc(N3CCOCC3)cc2)C1 757678783 HUNVNIHHSPIECD-KTAKPFMOSA-N 290.407 2.351 10 20 CECD COc1ccc(N(C)Cc2cc(C)n(C)n2)c(OC)c1 752125921 LUBQHIDZIMAHDN-UHFFFAOYSA-N 275.352 2.382 10 20 CECD CCOC(=O)[C@@H](NC(=O)c1cc(O)cs1)C(C)(C)C 753344978 YYCBWDCOZMAHKL-SNVBAGLBSA-N 285.365 2.161 10 20 CECD CN(C)c1cc(F)c(CN2[C@H]3CC[C@H]2COC3)cc1F 862392549 MSUOCJPNBZHTLP-RYUDHWBXSA-N 282.334 2.394 10 20 CECD CCN1C[C@H](C)N(C(=O)c2cc(O)cs2)C[C@H]1C 766251675 XHBONJZCOXNXCB-ZJUUUORDSA-N 268.382 2.008 10 20 CECD C[C@@H](NCCC1CC(O)C1)c1cc(F)cc(F)c1O 762650312 QFCNITDJOJDRMY-FKTRJACZSA-N 271.307 2.482 10 20 CECD Cc1ccc(O)c(CN[C@@H](CC(C)C)C(=O)O)c1 71408581 HXZKFWQPEXDOKC-LBPRGKRZSA-N 251.326 2.290 10 20 CECD CN(C(=O)c1cc2c(cn1)OCCC2)c1ccc(N)cc1 1119299290 GPUJYNQDNCMENL-UHFFFAOYSA-N 283.331 2.265 10 20 CECD O=C(NCc1ccccc1O)c1c(F)ccc(O)c1F 774061608 BPHIYSCLNUXFOX-UHFFFAOYSA-N 279.242 2.306 10 20 CECD Cc1cccc(O)c1CN[C@@H](C)C(=O)OC(C)C 877573330 XVYGVJITSBDCFN-NSHDSACASA-N 251.326 2.130 10 20 CECD CN1CCCc2cc(CNC(=O)N3C[C@@H]4C[C@H]4C3)ccc21 888004890 APLNSUGHHAAMLJ-GJZGRUSLSA-N 285.391 2.230 10 20 CECD Cc1ncoc1CNCc1ccc(N2CCOCC2)cc1 894199725 DMTLFNVSNFBYOT-UHFFFAOYSA-N 287.363 2.109 10 20 CECD C[C@H]1C[C@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)CO1 784312043 JOMLDRQSYASELD-JSGCOSHPSA-N 276.380 2.136 10 20 CECD COC(=O)N1CCC[C@H](N[C@@H](C)c2ccccc2O)C1 783505591 IEWZPAVOYQOPGF-RYUDHWBXSA-N 278.352 2.274 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@H](C)c1cc(F)cc(F)c1O 788986092 ZOBMPRPBXZSUSL-BDAKNGLRSA-N 286.322 2.188 10 20 CECD Oc1c(F)cc(F)cc1CNCCO[C@H]1CCCCO1 894792337 ARRMKWVNTHUQOF-ZDUSSCGKSA-N 287.306 2.303 10 20 CECD CC(C)Cc1cc(NC(=O)c2cccc(O)c2O)n(C)n1 790599191 UVBBCVDEOBKHED-UHFFFAOYSA-N 289.335 2.282 10 20 CECD COc1ccc(NCc2cccc(OC)c2O)cn1 19877737 HKTYNSBFJQDNCP-UHFFFAOYSA-N 260.293 2.417 10 20 CECD COc1cccc(O)c1CN1CCN(CC(C)C)CC1 728300122 XXVWXEGRTAGAKX-UHFFFAOYSA-N 278.396 2.174 10 20 CECD CCN1CCC[C@@H](CNC(=O)Nc2ccc(N)cc2)C1 1326087508 AGNPCZVYQWXKML-LBPRGKRZSA-N 276.384 2.122 10 20 CECD O=C(O)[C@H]1CCCN1Cc1ccc(N2CCCC2)cc1 1331403016 LRUJQVAKNPZYJJ-OAHLLOKOSA-N 274.364 2.336 10 20 CECD O=C(c1c[nH]nc1-c1cccnc1)N1CCc2ncccc21 1333543391 MMRYFFVWHMTIKG-UHFFFAOYSA-N 291.314 2.070 10 20 CECD Oc1cccc(Cl)c1CN1C[C@H]2COC[C@H]2C1 718250975 MQKWLYPMQCYNRJ-AOOOYVTPSA-N 253.729 2.124 10 20 CECD COc1ccc(O)c([C@H](C)NCCN2CC[C@@H](C)C2)c1 775370593 XAHZYVGHEBKTBZ-OLZOCXBDSA-N 278.396 2.393 10 20 CECD Cc1cnc(COc2ccc(N(C)C)c(C(=O)O)c2)o1 1600621833 UMHNTWLRNDIIOE-UHFFFAOYSA-N 276.292 2.326 10 20 CECD CN(C)c1cc(F)c(CN2C[C@H]3CCC[C@@]3(N)C2)cc1F 1578423120 PNSRNHBTQBLIEJ-MLGOLLRUSA-N 295.377 2.344 10 20 CECD C[C@@H](NCCC1(C)CC1)c1cccc(-c2nn[nH]n2)c1O 1589960814 HGWXCIISZBBKCT-SNVBAGLBSA-N 287.367 2.413 10 20 CECD CC[C@H](NCCc1ccc(N)cc1)C1(C(=O)O)CCC1 1595298563 PEVFUWAHFXPJHN-AWEZNQCLSA-N 276.380 2.434 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(O)cc1 209197785 QEFITTUAKPOZPK-WAPJZHGLSA-N 271.272 2.455 10 20 CECD CCOc1cccc(CNCc2cnn(C)c2C)c1O 156584921 MQEGJJBEFXESRQ-UHFFFAOYSA-N 275.352 2.123 10 20 CECD CC(C)Cc1nnc(NC(=O)c2cccc(O)c2O)s1 186854984 GBROOOIMPXNJAF-UHFFFAOYSA-N 293.348 2.400 10 20 CECD O=C(COc1ccccc1)NCc1ccccc1O 82284337 IDXXQMXTGZOGSL-UHFFFAOYSA-N 257.289 2.087 10 20 CECD CC[C@@H](N[C@H]1CCCN(C)C1=O)c1ccccc1O 704340975 OBJGAYDPIOWPRV-OLZOCXBDSA-N 262.353 2.054 10 20 CECD COCCCCCNC(=O)NCc1cc(OC)ccc1O 114592864 FDPJMBHGCZWJMQ-UHFFFAOYSA-N 296.367 2.017 10 20 CECD C[C@H](NCc1ncc[nH]1)c1ccc(N2CCOCC2)cc1 67694975 JCWOKMJJBSBXOA-ZDUSSCGKSA-N 286.379 2.097 10 20 CECD CCCOC(=O)[C@H](C)N(C)c1ccc2c(c1)OCO2 121353570 XNVUECVPXVYBHC-JTQLQIEISA-N 265.309 2.193 10 20 CECD C[C@@H](CN[C@H](C)c1ccccc1O)CN1CCOCC1 183522719 PFXKCNJYRUBJLJ-UONOGXRCSA-N 278.396 2.011 10 20 CECD COc1ccc(O)c([C@H](C)NCCCO[C@H]2CCOC2)c1 182392001 PUCSOOFZWJBXFE-JSGCOSHPSA-N 295.379 2.247 10 20 CECD COc1ccc(N(C)C(=O)c2ccc(C)c(O)c2O)cn1 182235088 ZAPZDXJOFUASQH-UHFFFAOYSA-N 288.303 2.086 10 20 CECD CCOCCOCCN(C)Cc1cc(C)cc(OC)c1O 189236166 HIHGGIGMBNSHMX-UHFFFAOYSA-N 297.395 2.194 10 20 CECD C/C(C=C1C(=O)N(C)C(=O)N(C)C1=O)=C/c1ccccc1 96285902 QKVGENYBSQVPNW-LUAWRHEFSA-N 284.315 2.067 10 20 CECD Cc1ccc(CN[C@@H](C)c2ccccc2O)c(=O)n1C 279442260 HOCHFEWXWXBZDA-LBPRGKRZSA-N 272.348 2.250 10 20 CECD CN(C)c1ccc(CNC(=O)NC2CC(F)(F)C2)cc1 277109597 XJPCZQBDJCQINR-UHFFFAOYSA-N 283.322 2.350 10 20 CECD COC(=O)[C@@H](CC(F)(F)F)NCc1cc(C)ccc1O 276451684 JYIIWOBAFABXFS-SNVBAGLBSA-N 291.269 2.284 10 20 CECD COc1cc(O)c(CN(C)Cc2ccon2)cc1OC 271073256 FTAWSFBDHUKZMZ-UHFFFAOYSA-N 278.308 2.029 10 20 CECD CCn1cnnc1CN[C@H](C)c1c(C)cc(C)cc1O 284014099 IKMXXRFCKIRBGN-GFCCVEGCSA-N 274.368 2.471 10 20 CECD CC[C@H](NCCS(=O)(=O)CC)c1ccc(F)cc1O 285918644 DQYGIKNWJCKPRK-LBPRGKRZSA-N 289.372 2.007 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@]2(CCOC2)O1 280363178 UOMJYSWZOWSSSE-ABAIWWIYSA-N 297.782 2.425 10 20 CECD CC[C@@H](NC1CN(C(=O)OC)C1)c1ccc(C)cc1O 280083167 LWIZDPLVAHIVQY-CYBMUJFWSA-N 278.352 2.192 10 20 CECD CC[C@H](NC[C@@H]1CNCCO1)c1cc(Cl)ccc1O 817982890 JHFSTQMAOKGLLS-AAEUAGOBSA-N 284.787 2.075 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1 824839380 XTQCLXYMZPXNDE-XJNFMUPTSA-N 287.359 2.176 10 20 CECD C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cncn1C)c1ccccc1O 827952617 YQDZUWMQQVCRIO-RAIGVLPGSA-N 285.347 2.107 10 20 CECD COc1ncc(/C=C\C(=O)N(C)c2ccccc2)cn1 492714315 XCEMDQZPZQLYLC-HJWRWDBZSA-N 269.304 2.161 10 20 CECD COc1ccc(O)c(CN(CCC(=O)O)CC(C)C)c1 833733888 UXFABBFQDKEHBK-UHFFFAOYSA-N 281.352 2.334 10 20 CECD COc1ccc2c(c1)CCCN2CC(=O)NCC1CCC1 731210595 UCIKETMPMMYLOO-UHFFFAOYSA-N 288.391 2.364 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@]2(C)CCC(=O)N2)cc1 834910073 VLVVSDOIMQDZSG-DYVFJYSZSA-N 289.423 2.462 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2CCC2)c1 734067397 XJLAGCORGIQNFJ-UHFFFAOYSA-N 264.325 2.000 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@H](C)[C@@H]1C 841692494 RRWQGVNHONOLIZ-CZFOOCMKSA-N 277.364 2.294 10 20 CECD Cc1cccc(CNCc2ccc(CCN)cc2)c1O 841032131 MGPFEZSQYCFNRP-UHFFFAOYSA-N 270.376 2.492 10 20 CECD COC1(CCNC(=O)NCCc2ccc(N)cc2)CCC1 841910302 NRKQYNKKOWOPIT-UHFFFAOYSA-N 291.395 2.070 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCS[C@@H]2C)c(O)c1O 844109080 VDAMNRLIHYFEGE-PSASIEDQSA-N 267.350 2.030 10 20 CECD COCCC1(C(=O)NCc2cc(Cl)ccc2O)CC1 846474909 CUROYEPUYITPBX-UHFFFAOYSA-N 283.755 2.479 10 20 CECD COc1cc(O)c(CN[C@@H]2CCCC[C@H]2CN)cc1OC 841028526 ASFFIYTUAGYKFB-WCQYABFASA-N 294.395 2.017 10 20 CECD COc1cccc([C@H](C)N[C@H](C)Cn2ccnc2)c1O 846138199 AAIFZGMXNGWGCO-NEPJUHHUSA-N 275.352 2.337 10 20 CECD CCc1cc(NCc2ccccc2O)n2ncnc2n1 748308646 VPYKCVJVRDNTOZ-UHFFFAOYSA-N 269.308 2.004 10 20 CECD Cc1csc(CCNC(=O)NCc2ccccc2O)n1 748458659 ADXSMIYBBBNEJG-UHFFFAOYSA-N 291.376 2.199 10 20 CECD CCOc1cccc(NC(=O)c2cc(O)cs2)n1 746694180 PZGHFQJQWKSPGK-UHFFFAOYSA-N 264.306 2.500 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1C[C@@]12CCOC2 846472642 CXAFOZRLYWOPJB-BXUZGUMPSA-N 281.739 2.088 10 20 CECD O=C1NC(=S)S/C1=C/c1ccc(-n2cccn2)cc1 844152308 DJZYCTIUUYBAAK-DHZHZOJOSA-N 287.369 2.361 10 20 CECD CCC[C@]1(NC(=O)c2cc(O)cs2)CCOC1 854431018 PBBVACJYESMTFD-LBPRGKRZSA-N 255.339 2.143 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2COCCO2)c2c(O)ccc(F)c21 756433592 DLZMJWYGTUMHDW-SCVCMEIPSA-N 281.327 2.085 10 20 CECD COCCOCCCN[C@@H](C)c1cc(F)cc(F)c1O 756360621 UYYMNDCQXXEJJO-JTQLQIEISA-N 289.322 2.374 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)[C@@H](C)CN1C 775983113 BCEMKENWEYEHSW-STQMWFEESA-N 279.403 2.416 10 20 CECD CC[C@@](C)(O)c1cn(Cc2ccc(N(C)C)cc2)nn1 881272323 SNYLYPZLUNZVHV-OAHLLOKOSA-N 274.368 2.010 10 20 CECD CN(C)c1ccc(CNc2cc(CO)ccn2)cc1F 881865844 CQVQMTYWECYBGQ-UHFFFAOYSA-N 275.327 2.391 10 20 CECD CC(=O)N1CCC[C@H](CN[C@@H](C)c2c(O)cccc2F)C1 886604685 AQVAJTUMCHRXFR-WCQYABFASA-N 294.370 2.440 10 20 CECD CN(CCCF)C(=O)NCc1ccc(N(C)C)cc1 887634258 JTZHDJWASCYOQW-UHFFFAOYSA-N 267.348 2.254 10 20 CECD OCC[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 779014877 QSXFAPDSZIDWIP-NSHDSACASA-N 253.317 2.126 10 20 CECD Nc1ccc(OCc2cn(CC3CCC3)nn2)cc1 881214705 VYHKHTYEVCYVCS-UHFFFAOYSA-N 258.325 2.239 10 20 CECD C[C@@H]1CCc2[nH]nc(C(=O)Nc3ccc(N)cc3)c2C1 884009438 WIKPLLJMNKOBRO-SECBINFHSA-N 270.336 2.369 10 20 CECD COc1ccc(CNC(=O)NCC2CCCC2)c(O)c1 792838109 IENXZKZHBMSNHI-UHFFFAOYSA-N 278.352 2.390 10 20 CECD CC(C)(CO)NCc1cccc(Br)c1O 42411837 RPEOZLCFQHPCHP-UHFFFAOYSA-N 274.158 2.015 10 20 CECD C[C@H]1COC[C@H]1NCc1c(O)cccc1Br 706805240 TXSTZJIDCJATPI-GZMMTYOYSA-N 286.169 2.279 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCCC(F)F 1332449680 QIUVGVMRBULWSK-GQCTYLIASA-N 271.263 2.273 10 20 CECD Nc1ccc(CNC(=O)N2CCC(c3cn[nH]c3)CC2)cc1 1335737053 KVBNWLLCKFTOSI-UHFFFAOYSA-N 299.378 2.081 10 20 CECD Oc1ccccc1CN(CCF)C[C@@H]1CCCO1 759347919 OFGIFWUKUVEEES-ZDUSSCGKSA-N 253.317 2.343 10 20 CECD CCC[C@H](NCc1cc(F)c(N(C)C)cc1F)C(=O)O 1331846727 SRHCGVBCOGMWRL-LBPRGKRZSA-N 286.322 2.374 10 20 CECD Cc1ccc2c(c1)N[C@H](c1cc(O)ccc1O)NC2=O 1333386685 QWODAPHTVZEYIU-AWEZNQCLSA-N 270.288 2.260 10 20 CECD C[C@@H]1CC[C@H](CCC(=O)NCc2cccc(O)c2O)O1 1347543129 WXARMUSKPPAKGM-ZYHUDNBSSA-N 279.336 2.062 10 20 CECD CCCC[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O 1605247177 GRGFZRXKXLRIEF-STMXVASLSA-N 294.303 2.298 10 20 CECD Cc1cc(O)c(CN[C@@H](C)CC(=O)O)c(Cl)c1 1605213536 ROFWNBLWQNXOAI-QMMMGPOBSA-N 257.717 2.307 10 20 CECD COc1ccc(N(C)C[C@@H]2[C@@H](C(=O)O)C2(F)F)cc1 1599584554 XYGCMSLYNYLSKI-MNOVXSKESA-N 271.263 2.097 10 20 CECD C[C@H]1CC[C@@](NCc2cc(F)cc(F)c2O)(C(=O)O)C1 1776628574 JIIGSWXUFHLPGY-RTHLEPHNSA-N 285.290 2.403 10 20 CECD CO[C@@]1(CN[C@@H](C)c2ccc(C)cc2O)CCOC1 123157271 DRQKFDKWMQODBT-SWLSCSKDSA-N 265.353 2.157 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)CN2CCOCC2)c(O)c1 36932531 MCRDXJBHDAOPEN-KBPBESRZSA-N 278.396 2.072 10 20 CECD Cc1nnsc1CNCc1cc(Cl)ccc1O 384205858 BTFPPHAFVHLBEN-UHFFFAOYSA-N 269.757 2.495 10 20 CECD CCc1cccc(CN(C)CCCN(C)C)c1O 821984691 YGMQYRKXPBFAKZ-UHFFFAOYSA-N 250.386 2.338 10 20 CECD CNC[C@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2O)C1 50158914 GTOXGQXEDFOMNT-GFCCVEGCSA-N 294.370 2.165 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CCOC1 66097166 VPJAWJPHAQDSSC-ZDUSSCGKSA-N 263.337 2.167 10 20 CECD Oc1ccccc1CN(Cc1c[nH]cn1)C[C@@H]1CCCO1 179570325 WTVXHOAUWAKRDR-HNNXBMFYSA-N 287.363 2.297 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccco2)cc1 31726680 NOQBABQJIIMRQT-UHFFFAOYSA-N 273.336 2.345 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)[C@@H]1CCSC1 125020569 LFHMHVWIAHKVMF-SNVBAGLBSA-N 267.350 2.058 10 20 CECD C[C@@H](CC(=O)c1ccccc1)NC(=O)c1cccc(O)c1O 185838641 VQZIBCUEERTCCP-NSHDSACASA-N 299.326 2.489 10 20 CECD C[C@H](NC[C@@]1(O)CCOC1)c1cc2c(cc1O)CCCC2 186178174 HLFHLRHZPOLXED-SJCJKPOMSA-N 291.391 2.073 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1cncn1C 175582510 JRXIWDSDNYDBAE-UHFFFAOYSA-N 258.369 2.118 10 20 CECD CCN(C)c1ccc(Cn2ccc(=O)c([N+](=O)[O-])c2)cc1 130797936 WOWUCFDVAJIUEH-UHFFFAOYSA-N 287.319 2.261 10 20 CECD CC[C@@H](C(=O)NCc1cccc(OC)c1O)N(CC)CC 269173313 IUJQPHLDZBEKJM-ZDUSSCGKSA-N 294.395 2.137 10 20 CECD CN1Cc2ccccc2[C@H](NC(=O)c2cccc(O)c2O)C1 369082900 GWRZTLKGQAPWIP-CQSZACIVSA-N 298.342 2.014 10 20 CECD CN(Cc1ccccc1O)C(=O)NOC1CCCC1 271705015 IIAXOBKYMMFBCY-UHFFFAOYSA-N 264.325 2.408 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCCC[C@H]2N(C)C)c1 1341800916 BQQZKELCQUKMBX-HUUCEWRRSA-N 278.396 2.363 10 20 CECD CCOc1ccc(O)c(CNCc2snnc2C)c1 291686290 ILICAXHQJWDLMD-UHFFFAOYSA-N 279.365 2.241 10 20 CECD C[C@H](CO[C@H]1CCOC1)N[C@H]1CCc2cccc(O)c21 297944513 YIKIVNRQKBWCEV-XBFCOCLRSA-N 277.364 2.163 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1ncc[nH]1 806870323 PDLGMRHCROTUAS-UHFFFAOYSA-N 286.379 2.033 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCCC(=O)N(C)C)c1O 808687088 JTGNQRMZQVECHG-SNVBAGLBSA-N 284.787 2.483 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)CCC1(F)F 811780534 OKYWLVRPEXVOBP-RNCFNFMXSA-N 299.317 2.295 10 20 CECD C[C@@H]1C[C@@H](NC[C@@H](N)C2CC2)c2c(O)ccc(F)c21 817964676 DBTBCYLXXNJQFR-GGZOMVNGSA-N 264.344 2.407 10 20 CECD O=C1CCCCC[C@@H](C(=O)NCc2ccc(O)c(O)c2)C1 813488837 GVTJIZUSXWZPTH-GFCCVEGCSA-N 291.347 2.254 10 20 CECD CC[C@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCN1 817896389 ICVCTLOSAVGGEP-HOTGVXAUSA-N 261.413 2.373 10 20 CECD CCN1CCN(Cc2cc(Cl)c(C)cc2O)CC1 824484668 PUXJCFLXLDCKFQ-UHFFFAOYSA-N 268.788 2.492 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ncoc2C)c1 729535253 NYIZAEOCWYAHMC-QMMMGPOBSA-N 276.292 2.188 10 20 CECD O=Cc1nc(/C=C/c2ccc(N3CCC(O)CC3)cc2)c[nH]1 905085834 UAXUFGCVMHSVBR-DAFODLJHSA-N 297.358 2.354 10 20 CECD CN(C[C@@H]1C[C@]12CCOC2)c1ccc(OCC(=O)O)cc1 903601132 FMFRPUOVCPQHEK-LRDDRELGSA-N 291.347 2.013 10 20 CECD O=C(O[C@@H](Cc1ccccc1)C(=O)O)c1cc(O)cs1 738715236 VKBMDGCMDUVJCQ-NSHDSACASA-N 292.312 2.306 10 20 CECD COc1cc(O)c(CN[C@@H](C)C2(OC)CCC2)cc1OC 840969487 FSYASEKYJJPKMI-NSHDSACASA-N 295.379 2.457 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](F)C(=O)O)cc1F 841816359 SHMRJLOOAQFDSR-GFCCVEGCSA-N 286.322 2.184 10 20 CECD C[C@@H]1C[C@H](NCCCSc2nccs2)CO1 842684035 VYMLXZNKMXUJOG-ZJUUUORDSA-N 258.412 2.392 10 20 CECD COc1cccc([C@@H](C)NCc2snnc2C)c1O 846170426 NPZXBQPCJLWQMN-MRVPVSSYSA-N 279.365 2.412 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCNCC2(C)C)c1 841073480 VCVLENMQHUAACL-HNNXBMFYSA-N 278.396 2.269 10 20 CECD COC[C@@H]1CCCCN1C(=O)NCCc1ccc(N)cc1 841955801 ODFWBHBEBWKQMY-HNNXBMFYSA-N 291.395 2.022 10 20 CECD COC[C@@H]1CCN(Cc2cc(C)cc(OC)c2O)C1 754741783 NOEDZYAIIPWXEW-GFCCVEGCSA-N 265.353 2.178 10 20 CECD Cc1cc(CN(C)C2(CN)CCC2)ccc1N(C)C 923361226 FSJZLHAXEFBNQC-UHFFFAOYSA-N 261.413 2.374 10 20 CECD C[C@H](NCCOC[C@H]1CCOC1)c1cc(F)ccc1O 756565203 WUVQCBNLKACSKZ-RYUDHWBXSA-N 283.343 2.235 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@@H]2O)C[C@H]1CC1(C)C 853628030 LTVMIQXMYVUHIE-RISCZKNCSA-N 277.364 2.296 10 20 CECD CN(C(=O)c1cn2c(n1)CCCC2)c1ccc(N)cc1 696150250 DYCIAUOSYGOZSV-UHFFFAOYSA-N 270.336 2.078 10 20 CECD Cc1nc(C)c(C(=O)NCc2ccc3c(c2)CCCN3C)[nH]1 857085341 FGIAGZPOZFGRQW-UHFFFAOYSA-N 298.390 2.339 10 20 CECD C[C@]1(CNC(=O)c2cc(O)cs2)CCCC[C@H]1O 762549661 NLZJRTBTKKHOFW-DGCLKSJQSA-N 269.366 2.125 10 20 CECD CCN(Cc1cc2c(cc1O)OC[C@@H]2O)CC1CC1 768447986 SMYDJOAJWDLMRD-AWEZNQCLSA-N 263.337 2.050 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1coc(C)n1 935949412 ZJGTWCKYGHNFLM-UHFFFAOYSA-N 281.308 2.104 10 20 CECD CCCCN(CCO)Cc1ccc(OCC)cc1O 768140925 ZNDGMQYTJVMJCU-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CC[C@@H]1C[C@H](C)CN1Cc1cc2c(cc1O)OC[C@H]2O 768464966 CYFPAXZRQTYXBI-JVLSTEMRSA-N 277.364 2.438 10 20 CECD C[C@@H](NC(=O)C1CSC1)c1ccc(N(C)C)cc1 867503700 OVQGSSDUXDENRI-SNVBAGLBSA-N 264.394 2.293 10 20 CECD O=C(NCc1cccc(Br)c1O)c1ccon1 765737159 RDWHQVGZLHVNSB-UHFFFAOYSA-N 297.108 2.073 10 20 CECD Cc1ccc(C(=O)N2C[C@H]3CC=CC[C@H]3C2)c(O)c1O 871520635 NBESPYRPNUCHDY-TXEJJXNPSA-N 273.332 2.444 10 20 CECD COC(=O)[C@]1(C)CCCN(Cc2c(C)cccc2O)C1 877591551 FSQFAUDJUUFDOO-MRXNPFEDSA-N 277.364 2.476 10 20 CECD Cc1cccc(O)c1CN1CCC(CC(=O)N(C)C)CC1 877187779 GZWPUABCJUJNJQ-UHFFFAOYSA-N 290.407 2.391 10 20 CECD C[C@@H](NC(=O)[C@@H](O)C(C)(C)C)c1ccc(N(C)C)cc1 775412303 WJBGRLZBVGMTSY-BXUZGUMPSA-N 278.396 2.337 10 20 CECD Cc1ccc(C(=O)NOC2CCCCC2)c(O)c1O 779322850 YZBFSHXKBYCFCQ-UHFFFAOYSA-N 265.309 2.400 10 20 CECD COc1ccc(O)c(CNC(=O)c2nc(C)c(C)s2)c1 770491793 DTGKPMSYVZXSNW-UHFFFAOYSA-N 292.360 2.404 10 20 CECD Cc1noc([C@H](C)NCc2cc(F)cc(F)c2O)n1 894543234 OQHSKAFUSWRRBA-LURJTMIESA-N 269.251 2.213 10 20 CECD COc1ccc(CN[C@@H](C)CC(C)(C)O)c(O)c1OC 894700557 RUHOWLCAYIDZFI-JTQLQIEISA-N 283.368 2.049 10 20 CECD COc1ccc(CNC(=O)c2ccc3cc[nH]c3n2)c(O)c1 794388661 ZJRMREPRVKEGKU-UHFFFAOYSA-N 297.314 2.207 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CC[C@@H](C)O2)c1O 894970184 SRWXVRNMKZFRGN-YPMHNXCESA-N 265.353 2.366 10 20 CECD CN(Cc1ccc(N)cc1)Cc1nccn1C(F)F 1345159769 KWIPPNVXRVKOEB-UHFFFAOYSA-N 266.295 2.492 10 20 CECD CC[C@H](NCCC(=O)NC(C)C)c1ccccc1O 135734304 ZKSMMQNWCGWBFX-ZDUSSCGKSA-N 264.369 2.348 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)C1CCN(C)CC1 396448361 RNKBOYYRLKERFQ-ZDUSSCGKSA-N 274.408 2.441 10 20 CECD CN(C)c1ccc(CNC(=O)NC(C)(C)CF)cc1F 1320354655 GMEDSSGAGOZSJZ-UHFFFAOYSA-N 285.338 2.439 10 20 CECD C[C@H](CNC(=O)NCc1ccc(N)cc1)c1nccs1 1336975525 PUCXJUPTTLKKAP-SNVBAGLBSA-N 290.392 2.328 10 20 CECD COc1cc(C)cc(CN[C@H]2CC[C@@H](OC)C2)c1O 1332708731 VIBOWLWYONBDFS-QWHCGFSZSA-N 265.353 2.366 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@]1(F)CCOC1 1342394747 HEUNCWNGGAYZLY-MRXNPFEDSA-N 293.338 2.016 10 20 CECD CN1CCCc2cc(CNC(=O)[C@H]3C[C@H]3F)ccc21 1347470701 DGWXGDSDAAWFMO-QWHCGFSZSA-N 262.328 2.043 10 20 CECD Nc1ccc(CN2C[C@@H](N)[C@H](c3ccccc3)C2)cc1 1345160778 YTBSUBAWFSULQQ-DLBZAZTESA-N 267.376 2.196 10 20 CECD C[C@@H](N[C@@H]1CCCC[C@H]1O)c1cc(C(=O)O)ccc1O 1604357744 PFINMPZWAKKAAV-GAJTVXKRSA-N 279.336 2.045 10 20 CECD Nc1ccc(CNC(=O)NC[C@@H]2Cc3ccccc3O2)cc1 1580445798 WLTYDVVSYVJQHD-HNNXBMFYSA-N 297.358 2.072 10 20 CECD COc1cc(C)cc(CN[C@@H](C(=O)O)C(C)(C)C)c1O 1599393207 YUFVYWRHIAGRQX-ZDUSSCGKSA-N 281.352 2.298 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H]3[C@H](C2)[C@@H]3C(=O)O)cc1 1776856139 VTWOUDFSDVEWCY-OWCLPIDISA-N 288.391 2.295 10 20 CECD COc1cc(O)c(CN(C)CCOCC2CC2)cc1OC 160388095 KUCXNHLUDDOPFS-UHFFFAOYSA-N 295.379 2.268 10 20 CECD CN1CCN(Cc2cc(Cl)cc(Cl)c2O)CC1 154403558 LNMZQBZRKSLUEU-UHFFFAOYSA-N 275.179 2.446 10 20 CECD CC[C@@H](NCCOCCN(C)C)c1ccccc1O 219311665 VHZYFUOHOFDFJY-CQSZACIVSA-N 266.385 2.011 10 20 CECD Cc1cccc(CN(C)CC2CCN(C)CC2)c1O 124590451 YKPRYUPXFKVFGA-UHFFFAOYSA-N 262.397 2.474 10 20 CECD COc1ccc(O)c([C@@H](C)NC2CCN(C)CC2)c1 37267115 KOCSLGHGYMKVHA-LLVKDONJSA-N 264.369 2.146 10 20 CECD C[C@H](N[C@H](C)c1ncn(C)n1)c1ccc(F)cc1O 275802437 YNGJADDUCWSGBN-DTWKUNHWSA-N 264.304 2.072 10 20 CECD CC[C@H](C)[C@H](CNCc1cc2c(cc1O)OCO2)OC 294115507 DFXDIFZVMOOCEC-BONVTDFDSA-N 281.352 2.272 10 20 CECD C[C@@H](CN[C@H]1CCc2cccc(O)c21)N(C)C1CC1 297776129 PLLHELHKQBBQFV-FZMZJTMJSA-N 260.381 2.452 10 20 CECD CC(C)N(C)C[C@H](C)NCc1ccc2c(c1)CCO2 311827499 DPZPOGAMKUPJEE-ZDUSSCGKSA-N 262.397 2.440 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCCC[C@@H]1O 708562577 VSNPBZPHGBNJSE-RYUDHWBXSA-N 257.280 2.064 10 20 CECD COC[C@]1(C)CCN(Cc2cc(F)ccc2O)C1 381361344 KIQLOYHAYDGELG-CQSZACIVSA-N 253.317 2.390 10 20 CECD CCc1nnc(CN2CCOc3cc(N(C)C)ccc32)o1 175027971 DXCWJIPBAXPEPG-UHFFFAOYSA-N 288.351 2.097 10 20 CECD COCC(C)(C)NCc1ccc(N2CCOCC2)c(F)c1 66995924 RUJNFWVDZDMZEW-UHFFFAOYSA-N 296.386 2.177 10 20 CECD Cc1ccc2ncc(/C=C3\SC(=S)NC3=O)n2c1 178765517 BFICMHCXAPIUEW-WTKPLQERSA-N 275.358 2.132 10 20 CECD CC[C@H](C)[C@](C)(O)CNCc1cc2c(cc1O)OCO2 112380124 VFVSSMSWRNQPDJ-ZUZCIYMTSA-N 281.352 2.008 10 20 CECD CN1CCN(c2ccc(CN(C)CCCF)cc2F)CC1 1350340784 FVXZUGLQDIMHJY-UHFFFAOYSA-N 297.393 2.369 10 20 CECD COc1ccc(N(C)Cc2ncnn2C)cc1Cl 121928152 BBGVNOIDGXDHID-UHFFFAOYSA-N 266.732 2.114 10 20 CECD C[C@H](NCCN1CCOCC1(C)C)c1cc(F)ccc1O 185334139 FXZXWEIGLXDHSB-LBPRGKRZSA-N 296.386 2.293 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCOCC2(C)C)c1 185333684 OGMVDMJFXCOGNG-AWEZNQCLSA-N 292.423 2.462 10 20 CECD COc1cccc(CNC(=O)CCCOC(C)C)c1O 183651747 KFTPULJTNIRZAK-UHFFFAOYSA-N 281.352 2.222 10 20 CECD CO[C@@H](CNC(=O)c1cccc(O)c1O)c1ccccc1 188252394 RXMDTVXAOQMAHD-AWEZNQCLSA-N 287.315 2.215 10 20 CECD CCc1cnc(CNC(=O)NCc2ccccc2O)s1 76197594 SQTDQRBVNDZKNY-UHFFFAOYSA-N 291.376 2.411 10 20 CECD CNCCC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 43618681 NRAISCLXLPTTBZ-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COCCN(CCC(=O)OC)Cc1cc(C)c(C)cc1O 93415960 ZITYBLUXEYGUBN-UHFFFAOYSA-N 295.379 2.021 10 20 CECD CCOc1ccc(O)c(CNC[C@H]2CCCOC2)c1 237048921 KBVLOZVEFKSHHJ-GFCCVEGCSA-N 265.353 2.307 10 20 CECD COC(=O)CC(C)(C)NCc1cc(C)c(C)cc1O 237128270 VOXZAWWTCRZZJM-UHFFFAOYSA-N 265.353 2.440 10 20 CECD CC[C@H](N[C@@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 268802954 DZXNSTASFIFWFY-HIFRSBDPSA-N 275.396 2.024 10 20 CECD C[C@@H](N[C@H]1CCN(c2cnn(C)c2)C1)c1ccccc1O 367785882 XEPVDVDTWKCWMC-OLZOCXBDSA-N 286.379 2.055 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1O 271412518 XXQROTWGFYMGEH-NOZJJQNGSA-N 255.745 2.248 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@@H]2C)c1O 278281692 TURMDSGFULAOSI-VIFPVBQESA-N 266.297 2.293 10 20 CECD CCSCCCNC(=O)/C=C/c1ccc(O)c(O)c1 282077355 NQCWKQUMDOOECZ-FNORWQNLSA-N 281.377 2.370 10 20 CECD CO[C@@H](C)CN(C)C(=O)NCc1ccc(N(C)C)c(F)c1 287193718 LCWMYIBTYPHCGL-NSHDSACASA-N 297.374 2.068 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1ccccc1O 281402563 XRCBALWLMNVJPF-NSHDSACASA-N 251.326 2.166 10 20 CECD CC[C@H](NCc1cnnn1C)c1cccc(Cl)c1O 287178678 CNQZKNFIYMZLNB-LBPRGKRZSA-N 280.759 2.415 10 20 CECD CNC(=O)[C@@H]1CCCCN1Cc1ccc(N(C)C)c(C)c1 292952087 CCGIWVOZOULGKG-INIZCTEOSA-N 289.423 2.162 10 20 CECD COc1cccc(CN[C@@H](C)C2(OC)CCOCC2)c1O 817419143 BVDAQNJNPSORGU-LBPRGKRZSA-N 295.379 2.075 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](C)C[C@@H](CO)C2)c1 817412922 QZCRPWYOCPIYDS-QWHCGFSZSA-N 279.380 2.241 10 20 CECD COc1ccc2c(c1)CN(C(=O)Cc1ccc(N)cc1)CC2 827656282 HOVVDTINRMMFKO-UHFFFAOYSA-N 296.370 2.405 10 20 CECD CC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)[C@@H]1CCCO1 588408615 OSEQOLKFARLUPO-UXWAYSASSA-N 291.347 2.185 10 20 CECD CCOc1ccc(CN[C@@H](C)Cc2cnn(C)c2)c(O)c1 825045636 IJNJUHWRJYNORA-LBPRGKRZSA-N 289.379 2.245 10 20 CECD C[C@@H]1SCCN(C(=O)/C=C\c2ccc(O)c(O)c2)[C@@H]1C 588404450 CLNPJDARGOSYSJ-FPNIURKZSA-N 293.388 2.463 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(N(C)C)cc1 834904071 MMYRLDPQKVAIDX-APHBMKBZSA-N 278.396 2.207 10 20 CECD C[C@@H]1C[C@@H](N[C@@H]2CC[C@H](C(N)=O)C2)c2c(O)ccc(F)c21 834905880 AFRZADDUQWHXMS-DTHBNOIPSA-N 292.354 2.323 10 20 CECD C[C@@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(O)cc1O 910951941 ZCIDQTCJEGANSX-ABAIWWIYSA-N 293.363 2.309 10 20 CECD Cc1cccc2ncc(/C=C3\SC(=S)NC3=O)n12 748994661 QKDASJURPKESIX-UITAMQMPSA-N 275.358 2.132 10 20 CECD N=C(NCc1c(O)ccc2c1CCCC2)NC1CCC1 849010985 HURBTZBVVNACSO-UHFFFAOYSA-N 273.380 2.437 10 20 CECD Oc1ccc(F)cc1CNCCC[C@H]1CCCN1 841071749 ALEYFPLJYDCIQN-ZDUSSCGKSA-N 252.333 2.153 10 20 CECD C/C=C\C[C@H](CO)N[C@@H](C)c1cccc(OC)c1O 846165841 ZQWJIEMVDVGCEG-KBIXYVOKSA-N 265.353 2.379 10 20 CECD C[C@H]1NCCN(Cc2cc(Cl)cc(F)c2O)[C@@H]1C 843056847 AUHINIGQPNBLSY-RKDXNWHRSA-N 272.751 2.367 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](CO)[C@@H]2C)c1 840978725 PBTYSTMFUAKEIR-QWHCGFSZSA-N 279.380 2.384 10 20 CECD COc1cccc(CNC[C@H](C)C(=O)OC(C)(C)C)c1O 848565747 LICGWNUYEIAWTP-NSHDSACASA-N 295.379 2.468 10 20 CECD O=C(O)CCCCC(=O)NCc1cc(Cl)ccc1O 911330434 LKDAPSBHDJMXKD-UHFFFAOYSA-N 285.727 2.307 10 20 CECD CC1(C)C(=O)N[C@@H]1C1CCN(Cc2ccccc2O)CC1 848919271 VAHVEBGFRSBACJ-OAHLLOKOSA-N 288.391 2.129 10 20 CECD CN1CC(=O)N[C@@H]1c1cc(-c2ccccc2)ccc1O 749702876 VPZJVGZETSPKMW-INIZCTEOSA-N 268.316 2.119 10 20 CECD CO[C@@H]1COCC[C@@H]1CNCc1ccc(N(C)C)cc1C 840949948 DEIVAEOBTKNVSL-NVXWUHKLSA-N 292.423 2.202 10 20 CECD Cn1ccc(CCC(=O)NCc2cc(Cl)ccc2O)n1 846475283 BPHXGCFNQNYTNN-UHFFFAOYSA-N 293.754 2.028 10 20 CECD CCN(CC)c1ccc(CNCC2(C(=O)O)CC2)cc1 841808701 NIZASBQNUIDYRE-UHFFFAOYSA-N 276.380 2.487 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnn(C)c1Cl 857466619 AVVKRXITEUXBEO-UHFFFAOYSA-N 279.727 2.051 10 20 CECD CCOc1ccc(CN[C@H](CO)CC2CC2)c(O)c1 754833856 LYTIUGOKDKTNHX-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD CC1(C)OCC(NCc2cc(Cl)cc(F)c2O)CO1 758012915 XTVUTFWGAAZRQG-UHFFFAOYSA-N 289.734 2.426 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CCN(C)C2)c2c(O)ccc(F)c21 756534696 MXCDFYWCEONYFS-FOGDFJRCSA-N 264.344 2.373 10 20 CECD COc1cc(CNCC[S@@](C)=O)c(O)c(C(C)(C)C)c1 850138210 AMKUMMYGMBBPMA-HXUWFJFHSA-N 299.436 2.166 10 20 CECD C[C@@H](NCC1(CO)CCC1)c1cc(F)cc(F)c1O 757655779 GRCGEFCCBXSBKL-SECBINFHSA-N 271.307 2.484 10 20 CECD Cc1cncc(COC(=O)c2cccc(O)c2O)c1 758562035 PZVJXXBVRNEYEF-UHFFFAOYSA-N 259.261 2.158 10 20 CECD COC(C)(C)CCNCc1cc([N+](=O)[O-])ccc1O 865755706 DLWYZLOKNRFZII-UHFFFAOYSA-N 268.313 2.205 10 20 CECD CCCc1cc(C(=O)NCc2ccccc2O)cc(O)n1 934935159 FFTREPJYUXEHBO-UHFFFAOYSA-N 286.331 2.375 10 20 CECD CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc(OC)c(C)c1 765797177 QEBOBIMSHCLSKI-KBPBESRZSA-N 276.380 2.008 10 20 CECD Cc1ccn(C[C@@H](C)C(=O)N(C)c2ccc(N)cc2)n1 877077166 YJGUWNYKYUNHDZ-LLVKDONJSA-N 272.352 2.073 10 20 CECD C[C@H](NCc1ccc(N2CCCC2)cc1)c1ncnn1C 1116755606 OFZIFZXSYBLLEN-ZDUSSCGKSA-N 285.395 2.266 10 20 CECD COC(OC)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 874107602 CFAIXDRTAXXESE-UHFFFAOYSA-N 294.395 2.109 10 20 CECD COc1cccc(O)c1CN1CCO[C@H](COC(C)C)C1 770687297 DWQVZNRBJATYHD-ZDUSSCGKSA-N 295.379 2.027 10 20 CECD Cc1n[nH]cc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 773018888 JCIJMVGIEPSXPX-SNVBAGLBSA-N 272.352 2.275 10 20 CECD C[C@@H](NC[C@H]1CC2(CCNCC2)CO1)c1ccccc1O 873293115 XZHPTTMJNWCRHS-ZIAGYGMSSA-N 290.407 2.202 10 20 CECD COc1cc(O)c(CN[C@H]2C[C@@H](OC)C2(C)C)cc1OC 776231889 PSBQBCSHOKBXAW-LSDHHAIUSA-N 295.379 2.313 10 20 CECD NC(=O)[C@@H](Cc1ccc(F)cc1)Sc1nccs1 783895943 VLQCGJNLHGTOPZ-SNVBAGLBSA-N 282.365 2.471 10 20 CECD O=C1NCC2(CCN(Cc3c(O)cccc3Cl)CC2)O1 783722572 GEGGSCHLQGHRGE-UHFFFAOYSA-N 296.754 2.120 10 20 CECD COCC1(NCc2cc(C)cc(OC)c2O)CCC1 894693886 AMAMTJIDVPEWFF-UHFFFAOYSA-N 265.353 2.368 10 20 CECD COc1cc(CNC[C@@H]2COCO2)c(O)c(C(C)(C)C)c1 894886044 UGLVKRRETOUGSW-CYBMUJFWSA-N 295.379 2.161 10 20 CECD O=C1NC(=S)S/C1=C/c1cnn(C2CCC2)c1 899336352 UITNOLCXBCUQBX-RUDMXATFSA-N 265.363 2.097 10 20 CECD COc1ccc(CN[C@@H](C)C[C@H](C)NC(C)=O)cc1C 1133431902 LQTHRYNXIAOGRY-STQMWFEESA-N 278.396 2.396 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2ccc3c(c2)CCO3)C1 792203398 RXGLIZNBEBLNSF-KGLIPLIRSA-N 275.348 2.053 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1O[C@@H](C)C[C@H]1C 799938022 NNXPWRIDYNYKKA-DVOMOZLQSA-N 290.407 2.491 10 20 CECD C[C@@H]1CSC[C@@H]1NC(=O)NCc1ccc(N(C)C)cc1 796603969 CGYUULNTBFGKJP-RISCZKNCSA-N 293.436 2.303 10 20 CECD CCc1cc(NCc2ccc(OC)cc2O)n2ncnc2n1 795284124 IMMCVXDDEIUQPH-UHFFFAOYSA-N 299.334 2.013 10 20 CECD C[C@H]1COC(C)(C)CN1Cc1cc2c(cc1O)OCO2 792722278 KTDDVTWNCNKFOD-JTQLQIEISA-N 279.336 2.120 10 20 CECD CCN(CC)[C@@H]1CCN(Cc2cc(OC)ccc2O)C1 134060093 UFXRWXYSUZCYON-CQSZACIVSA-N 278.396 2.317 10 20 CECD CCCOc1ccc(CN2CC[C@H](N(C)C)C2)c(O)c1 134182647 CPMYTTYPZADFOK-AWEZNQCLSA-N 278.396 2.317 10 20 CECD C[C@@H]1CC[C@H](NCCc2ccc(N)cc2)[C@H](n2cncn2)C1 1327841089 VDQTUYZGLUFUKF-XOKHGSTOSA-N 299.422 2.422 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCC(CO)CC2)c1 1325340843 SGKHLPCWEADKRC-CQSZACIVSA-N 292.423 2.056 10 20 CECD COC(=O)[C@H]1CCC[C@@H]1NCc1cccc(Cl)c1O 1320837919 VWLRGYZBWVJEHI-JQWIXIFHSA-N 283.755 2.477 10 20 CECD Cc1ccc(O)c(CNc2c([N+](=O)[O-])c(C)nn2C)c1 1328804085 MVJZVWOKSJBAPU-UHFFFAOYSA-N 276.296 2.263 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)C(=O)OC(C)(C)C 708408302 FPTXXANAGSOXBX-QMMMGPOBSA-N 287.306 2.490 10 20 CECD COc1ccc2c(c1)OC[C@H](NCc1ccc(N)cc1)C2 1334754851 TVIOTABJYVOJEZ-OAHLLOKOSA-N 284.359 2.371 10 20 CECD C[C@H]1OCC[C@@H]1CSc1ncc(C(=O)O)s1 1604833339 CQOWFZRBHLUPRJ-RNFRBKRXSA-N 259.352 2.358 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](C(=O)O)C(C)C)c1 1604821255 USLAUGOMPSACDE-ZWNOBZJWSA-N 281.352 2.408 10 20 CECD Cc1ccc(O)c(CN(CCC(=O)O)C[C@@H]2CCCO2)c1 1600464446 BZWGWLOOQAQINQ-AWEZNQCLSA-N 293.363 2.156 10 20 CECD CN(C)c1ccc(OCCOC2CCC2)cc1C(=O)O 1606058739 MPQBOOPZCBFSRI-UHFFFAOYSA-N 279.336 2.399 10 20 CECD CN(C(=O)C1=CC[C@H](N)C1)c1nsc2ccccc12 1578368778 UQXPVRDVQMPTPT-JTQLQIEISA-N 273.361 2.307 10 20 CECD CCc1cccc(C(=O)NCc2ccc(N)cc2)c1O 1578265831 MNCQXCOPYKCFNQ-UHFFFAOYSA-N 270.332 2.467 10 20 CECD O=C(O)[C@H]1CCCCN1Cc1cc(F)c(F)cc1O 1574842083 BJQMSIIJVDBAQR-LLVKDONJSA-N 271.263 2.110 10 20 CECD COc1cc(CN2CC[C@@](C)(C(=O)O)C2)c(O)cc1C 1594056198 GWQXIJSOFSCGKA-OAHLLOKOSA-N 279.336 2.006 10 20 CECD Cc1cccc(CN[C@@H]2CCN3CCCC[C@@H]23)c1O 224543338 IYDYLPIRXCNAFK-CABCVRRESA-N 260.381 2.417 10 20 CECD CN[C@H]1CCCN(Cc2cc(Cl)cc(OC)c2O)C1 229102703 IYVHGKSWCLCLKN-LBPRGKRZSA-N 284.787 2.238 10 20 CECD COc1cc(Cl)cc(CNCCOCCF)c1O 702647382 UMAMKMKDRDCTPH-UHFFFAOYSA-N 277.723 2.130 10 20 CECD C[C@@H]1C[C@H](NCc2cc(F)cc(F)c2O)CCO1 708436159 KFPLKVPLIOQETL-LDYMZIIASA-N 257.280 2.328 10 20 CECD COc1ccc(CNCc2cccnc2O)cc1C 714957335 WWRRYBRYWCCJTH-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CCN(Cc1cc(Br)ccc1O)C(N)=O 174038436 JJXYFLWZSBHNJB-UHFFFAOYSA-N 273.130 2.055 10 20 CECD Cc1c(CCC(=O)N(C)Cc2ccccc2O)cnn1C 129608620 KMRCUEXKBGOSAP-UHFFFAOYSA-N 287.363 2.025 10 20 CECD COCCC1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 181226958 IKAPJTNGJQCQMB-HWKANZROSA-N 291.347 2.044 10 20 CECD CCN(CC(N)=O)C(=O)c1ccc(-n2c(C)ccc2C)cc1 189705759 PLBJMDZLMNBSEF-UHFFFAOYSA-N 299.374 2.042 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@H](C2OCCO2)C1 180058114 FWDHJVPPBKKMON-NSHDSACASA-N 281.327 2.116 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@H](O)COCC(C)C)c1 185116890 JRIJOKSETXZEFT-KGLIPLIRSA-N 281.396 2.385 10 20 CECD Cc1ncsc1/C=C/C(=O)NCc1ccc(O)c(O)c1 189007040 LKGZSECHZFHWPD-SNAWJCMRSA-N 290.344 2.192 10 20 CECD CC(C)COC[C@@H](O)CN[C@H](C)c1cc(F)ccc1O 185117734 AKEQERDXOCAVPQ-YPMHNXCESA-N 285.359 2.215 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CC[C@@H]1CCCN1 315319751 ZSKXFOHRYKKOMW-HNNXBMFYSA-N 289.423 2.243 10 20 CECD c1cc(CCNCc2ccc(N3CCOCC3)cc2)ccn1 315125682 JFXSOEXFYVVPQH-UHFFFAOYSA-N 297.402 2.251 10 20 CECD CNC(=O)[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 180219663 CFRKFZZMEGCYQO-LLVKDONJSA-N 282.771 2.004 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H]([C@@H](C)O)C2)c1 136831169 XXIOTZUTVNMXAX-OLZOCXBDSA-N 279.380 2.384 10 20 CECD CN(C)c1ccc(CNC(=O)CC(F)(F)F)cc1 44604865 AMIUFYAGIAMOKO-UHFFFAOYSA-N 260.259 2.321 10 20 CECD CCCN(C)C[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1 236763129 FIUURXQZMIBSHB-HNNXBMFYSA-N 289.423 2.002 10 20 CECD CCCN(Cc1ccccc1O)c1c([N+](=O)[O-])ncn1C 269403568 XOATXOBRKRWYHD-UHFFFAOYSA-N 290.323 2.451 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2ccc(N(C)C)cc2)CCO1 271890308 OGVKWRSOEWJIIC-OCCSQVGLSA-N 276.380 2.184 10 20 CECD O=C(N[C@H]1CC=CCC1)c1c(F)ccc(O)c1O 277805820 WBGKKHZXSNZJTB-QMMMGPOBSA-N 251.257 2.075 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC(C)C)c1 273428414 VACXWIBZTBJPHY-SNVBAGLBSA-N 251.326 2.485 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1cccc(C)c1O 281315654 QTOKFYSFBPLGSD-GFCCVEGCSA-N 265.353 2.474 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1cnccn1 298393156 KXYFMEYVBYJNSC-UHFFFAOYSA-N 282.347 2.007 10 20 CECD CN(C)CCN(C)Cc1c(O)ccc(Cl)c1F 809729314 FDTHWYRFYXBLSS-UHFFFAOYSA-N 260.740 2.178 10 20 CECD CCOc1cccc(CNCc2cccc(OC)c2O)n1 809740455 ZFEIZUKFPMLVTM-UHFFFAOYSA-N 288.347 2.484 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)cc1 394631013 BQBCNGZYOZHOCC-BPUTZDHNSA-N 288.391 2.438 10 20 CECD OC[C@H](CC(F)F)NCc1ccc2c(c1)CCCO2 922059242 JRLMSECNCGDLQA-LBPRGKRZSA-N 271.307 2.117 10 20 CECD C[C@H]1C[C@H](NCC(C)(C)N)c2c(O)ccc(F)c21 817960280 LNJFZNVVJKFKTE-WPRPVWTQSA-N 252.333 2.407 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCN2C)[C@H]1CCCN1 817900618 OPWNDVQHCHIXFA-XJKSGUPXSA-N 273.424 2.299 10 20 CECD COC(=O)c1cn(Cc2ccc(N(C)C)c(C)c2)c(C)n1 814756332 MKJASGHJSPUVJR-UHFFFAOYSA-N 287.363 2.401 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](F)C(F)(F)F)c1 810348335 UEFOLGRKHXLAIE-LDWIPMOCSA-N 295.232 2.478 10 20 CECD Cc1cc(O)c(CN2CC[C@](F)(CO)C2)cc1Cl 825803662 DXPSALYEMOVHDW-CYBMUJFWSA-N 273.735 2.260 10 20 CECD CN(C(=O)/C=C/c1ccc(Cl)nc1)c1ccn(C)n1 492701090 DXALFNXVBFJXRY-GQCTYLIASA-N 276.727 2.145 10 20 CECD CCc1nnc(C(=O)N(C)Cc2ccccc2O)s1 901051912 GYIQYIPXJXELAI-UHFFFAOYSA-N 277.349 2.078 10 20 CECD COc1ccc(O)c(CN[C@H](C2CC2)[C@@H](CO)C2CC2)c1 824845560 MEFKMEALFXPVGP-DOTOQJQBSA-N 291.391 2.288 10 20 CECD Oc1cccc2c1[C@H](NCCCOC[C@H]1CCOC1)CC2 834598994 URDUCYUQKGKFAV-UKRRQHHQSA-N 291.391 2.412 10 20 CECD CC(C)CCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832293210 RHWHRASZXRQMIE-OAHLLOKOSA-N 277.412 2.305 10 20 CECD NCCCCCC(=O)NCc1c(O)ccc2c1CCCC2 830597268 CXXOCFGGIBDCCX-UHFFFAOYSA-N 290.407 2.406 10 20 CECD CONC(=O)NCCc1cc(C)n(-c2ccccc2)c1C 913461851 VSGLDHUBCOMJEO-UHFFFAOYSA-N 287.363 2.497 10 20 CECD COc1cccc([C@@H](C)NC[C@@H](O)C(C)C)c1O 846145206 NFAHWWSKNLDSKA-ZYHUDNBSSA-N 253.342 2.068 10 20 CECD COc1cccc(CN(C2CCNCC2)C2CC2)c1O 843043678 CBVXNOHKSXFYMW-UHFFFAOYSA-N 276.380 2.117 10 20 CECD CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(Cl)cc1O 841745310 XHHWYAKLABWUSS-DTWKUNHWSA-N 270.760 2.221 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H]1CC[C@@H](O)C1 840942204 VMQDFZVGCXSLPN-CZUORRHYSA-N 262.397 2.312 10 20 CECD N[C@H]1CCCO[C@@H]1C1CCN(Cc2ccccc2O)CC1 841100091 UKZHDDCFTGYOLX-DOTOQJQBSA-N 290.407 2.111 10 20 CECD COc1ccc(N(C)CC(=O)N(C)Cc2ccco2)cc1 844353759 ZKMNPHXNXKXZEC-UHFFFAOYSA-N 288.347 2.383 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCOC[C@H]2C)c1 756537352 YHTPVYXYTBCWBV-ZIAGYGMSSA-N 278.396 2.072 10 20 CECD Cn1ncc(C2CC2)c1CNC(=O)Nc1ccc(N)cc1 850751142 UUMPCMUQTJHTJD-UHFFFAOYSA-N 285.351 2.201 10 20 CECD CC[C@@H](NC(=O)NCc1cc(C)ccc1O)[C@H]1CCCO1 858323975 KJPHALMDRDGVCD-UKRRQHHQSA-N 292.379 2.457 10 20 CECD CCOC(=O)/C=C/CN[C@@H](C)c1cc(OC)ccc1O 930215771 ZENHOVRMUYWWGF-QRGHLMKCSA-N 279.336 2.171 10 20 CECD COc1cc(O)c(CNc2cnn(CCF)c2)cc1OC 862483823 UTTIQBLJMPUQKG-UHFFFAOYSA-N 295.314 2.188 10 20 CECD C[C@H](NCCOC[C@H]1CCOC1)c1ccc(N(C)C)cc1 765898621 IPILAPGGFYNFKZ-GJZGRUSLSA-N 292.423 2.456 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H]2C[C@H]3CC[C@H]2O3)c1 862754533 FMVOTGRURNYTIW-UXIGCNINSA-N 275.348 2.274 10 20 CECD C[C@H](NC(=O)N[C@H](C)c1ccccc1O)c1cnn(C)c1 868301872 BMVFHRPCGCHUER-WDEREUQCSA-N 288.351 2.247 10 20 CECD CCCN(Cc1ccccc1O)c1ncnc2c1ncn2C 770470936 VXVLLUIHSWRKLR-UHFFFAOYSA-N 297.362 2.486 10 20 CECD COc1ccc(CNCCNC(=O)CCC2CC2)cc1C 1125023106 BHUBWTGWHWZQIA-UHFFFAOYSA-N 290.407 2.400 10 20 CECD CCOc1ccc(N(C)CCN2C[C@@H]3CC[C@H](C2)O3)cc1 775620045 WLSGADQTUYULCH-CALCHBBNSA-N 290.407 2.385 10 20 CECD C=C/C=C/CCNC(=O)NCc1cccc(OC)c1O 883914566 VNGHJFGFVCCQOV-SNAWJCMRSA-N 276.336 2.332 10 20 CECD Cc1nc(O)cc(NCc2ccc(N(C)C)cc2)n1 891577286 BAZKEGZTGDCZKN-UHFFFAOYSA-N 258.325 2.169 10 20 CECD COc1ccc(O)c([C@H](C)NCc2n[nH]cc2C)c1 716484104 SLYFIRPSEYVFGU-JTQLQIEISA-N 261.325 2.283 10 20 CECD CN(C)c1ccc(OCC[C@H]2CCCO2)cc1C(=O)O 1606058835 QCERUOKHWDMWKQ-LLVKDONJSA-N 279.336 2.399 10 20 CECD CN(C)c1ccc(CNCC23CC(C(=O)O)(C2)C3)cc1 1777040286 RSVQOLVWXIFRJE-UHFFFAOYSA-N 274.364 2.097 10 20 CECD C[C@H](N[C@@H]1CC[C@H]2CNC[C@@H]2C1)c1ccccc1O 817987076 PSMWJLOSEOHKEF-XDQVBPFNSA-N 260.381 2.431 10 20 CECD CC(=O)c1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1 40414104 NGCLBKOKKPSHQH-UHFFFAOYSA-N 291.328 2.396 10 20 CECD CC[C@@H](N[C@H](C)c1ncn(C)n1)c1ccccc1O 275720049 NOWIRKOPFMWTEA-ZYHUDNBSSA-N 260.341 2.323 10 20 CECD C[C@@H](N)[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1 63191471 SRSSVXUOTVFAAC-CJNGLKHVSA-N 261.413 2.454 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)c2n[nH]c(C)n2)c1O 392456911 KXMWLJVXUFZRIJ-SSDOTTSWSA-N 296.758 2.332 10 20 CECD CCn1cc(NC(=O)N[C@H](C)c2ccccc2O)cn1 864424022 HQKZOIVCVNLDKM-SNVBAGLBSA-N 274.324 2.491 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](C(C)C)N(C)C)c1 106917592 UBQCQLYNWOCAHQ-XHDPSFHLSA-N 294.395 2.164 10 20 CECD CCS(=O)(=O)NCc1ccc(N2CCC(C)CC2)cc1 108403596 IAMXQYRGZQHVJI-UHFFFAOYSA-N 296.436 2.362 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCCN1CCCC1=O 405365289 TVKRAWCTODFEQT-CHWSQXEVSA-N 288.391 2.461 10 20 CECD COC(=O)[C@H]1CCCCN1Cc1cc(F)ccc1O 179894050 MHHAVFGDDMERFO-GFCCVEGCSA-N 267.300 2.059 10 20 CECD CCCCCN(CCO)C(=O)/C=C/c1ccc(O)c(O)c1 181263849 PTHSSUHTTUTMOO-SOFGYWHQSA-N 293.363 2.122 10 20 CECD C[C@H]1CC(=O)CC[C@@H]1C(=O)N(C)Cc1ccccc1O 136462790 XFGHHJWPYGOXGT-FZMZJTMJSA-N 275.348 2.356 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2CCC(O)CC2)c1 194477499 MWOSSVSWBBYRDT-UNXYVOJBSA-N 293.363 2.129 10 20 CECD CCCN(Cc1cc(C)ccc1O)[C@@H]1CCS(=O)(=O)C1 161108279 AGKYYIADHZOXHU-CQSZACIVSA-N 297.420 2.100 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@H](C)C(=O)O)c1O 269238699 APACYWFNBKICNU-SSDOTTSWSA-N 285.727 2.153 10 20 CECD CC(C)OCCCCNC(=O)NCc1ccccc1O 272951519 KBGAGRARAUXULM-UHFFFAOYSA-N 280.368 2.397 10 20 CECD CC1(C)CCN(C(=O)c2c(F)ccc(O)c2O)C1 276566863 JTDGURRTEAXYTJ-UHFFFAOYSA-N 253.273 2.109 10 20 CECD CNC(=O)CCCN[C@H](C)c1ccc(C)c(C)c1O 273465203 DPEZBKKJZYDLGX-GFCCVEGCSA-N 264.369 2.186 10 20 CECD Cc1ncc2c(n1)CC[C@H](NCc1cc(F)ccc1O)C2 373121953 DHFZKASJRQEMFL-AWEZNQCLSA-N 287.338 2.277 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)NCCF)c1ccc(F)cc1O 287333293 GBKDTULKGSIIMW-JOYOIKCWSA-N 286.322 2.046 10 20 CECD O=S(=O)(NCc1cc(Cl)cc(Cl)c1O)C1CC1 805134963 LPNWHEFFDHUYOJ-UHFFFAOYSA-N 296.175 2.281 10 20 CECD CCOc1ccc(CNc2ccc(CCO)nc2)c(O)c1 806669560 DMGAJABCLXSUFN-UHFFFAOYSA-N 288.347 2.333 10 20 CECD Cc1cc(O)c(CN2CCC(F)(F)[C@H](CO)C2)cc1C 291022854 AMZLUFXKZJQYQP-ZDUSSCGKSA-N 285.334 2.459 10 20 CECD COc1cccc(CN2CCC3(CC2)OCCCO3)c1O 293791732 ZXOMJKNIEMKXJH-UHFFFAOYSA-N 293.363 2.130 10 20 CECD Oc1cccc(Cl)c1CN1CC2(CCOC2)C1 293997896 MDDVFMBZPRCTQA-UHFFFAOYSA-N 253.729 2.268 10 20 CECD CC[C@H](CN[C@H](C)c1cc([N+](=O)[O-])ccc1O)OC 810259139 CBQBCRVCKWKGQN-MWLCHTKSSA-N 268.313 2.376 10 20 CECD COc1ccc(N2CC[C@@H](CNCC3(C)COC3)C2)cc1 818220106 FFROYTARNLALDH-AWEZNQCLSA-N 290.407 2.148 10 20 CECD CC(C)CN(CC(N)=O)Cc1ccc2ccccc2c1O 816488663 BJTAXASZXLAGJN-UHFFFAOYSA-N 286.375 2.489 10 20 CECD C[C@H](O)C1(NCc2cc(Cl)cc(F)c2O)CC1 827585958 ROQGCXPRSWXELK-ZETCQYMHSA-N 259.708 2.188 10 20 CECD CCOc1ccc(CN[C@@H](C)c2nc(C)no2)c(O)c1 729684415 OYZUELPWPJATPH-VIFPVBQESA-N 277.324 2.333 10 20 CECD COC[C@H](CNCc1cc(Cl)c(C)cc1O)OC 825479753 RNARHZDLIILBRY-NSHDSACASA-N 273.760 2.105 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCc2nccn2C1)c1ccccc1O 827930821 ROAWMATUVGUJDC-VXGBXAGGSA-N 285.347 2.029 10 20 CECD O=C(C[C@@H]1CCOC1)NCc1ccc(N2CCCC2)cc1 739692792 HQWPABHOYUCMEB-HNNXBMFYSA-N 288.391 2.330 10 20 CECD C/C=C/C[C@@H](NC(=O)c1cc(O)cs1)C(=O)OCC 832228393 RCIBXRLIZQTYTL-RXNUUUNCSA-N 283.349 2.081 10 20 CECD CN(C)c1ccc(CN[C@H](CC(F)F)C(=O)O)cc1F 901811285 DTIAVLUDFXTWDK-SNVBAGLBSA-N 290.285 2.090 10 20 CECD Oc1cccc2c1[C@H](NC[C@H](O)COc1ccccc1)CC2 834502626 RKSYMSZCMJOAED-GOEBONIOSA-N 299.370 2.409 10 20 CECD Cc1ccc(C(=O)NCCCSc2nccs2)nn1 839682385 ZAHOIXWYAAUKKP-UHFFFAOYSA-N 294.405 2.154 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nn1cnc2ccccc21 588403429 NJWUHKHVELQJSE-VURMDHGXSA-N 295.298 2.231 10 20 CECD CN(C)c1ccc(CN2CC(OCC(F)F)C2)cc1F 839138830 UJGWORKXFAPHGA-UHFFFAOYSA-N 288.313 2.358 10 20 CECD O=C(NC[C@H](C(=O)O)c1ccccc1)c1cc(O)cs1 833133360 IZPNFASPLZWVSA-NSHDSACASA-N 291.328 2.052 10 20 CECD C[C@@H]1CC/C(=C\C(=O)NCc2ccc(O)cc2O)C1 910951263 QKTDIMFIOUAXFT-UEUZTHOGSA-N 261.321 2.460 10 20 CECD CCOc1ccc(CN2[C@H]3CCNC[C@H]2CC3)c(O)c1 843057975 JPGUPSRZHRLEIB-ZIAGYGMSSA-N 276.380 2.117 10 20 CECD NC[C@@H]1CC[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 841084950 QTDLUFHCWMKKCP-LDYMZIIASA-N 299.758 2.171 10 20 CECD C[C@@H](NC[C@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 846205517 HTCFKGFJSBZDRU-VXGBXAGGSA-N 274.364 2.054 10 20 CECD NCCCCCCN1CCCc2cc(CN)ccc21 846218462 VDFWMZFIRPLINS-UHFFFAOYSA-N 261.413 2.417 10 20 CECD CCN1C[C@H](N[C@@H](C)c2ccc(Cl)cc2O)CC1=O 841759296 YJLZNTKSSOBCTI-GXSJLCMTSA-N 282.771 2.317 10 20 CECD Oc1c(Cl)cccc1CNCC[C@@H]1CCNC1 841037075 SDWSJNOODWNJSV-JTQLQIEISA-N 254.761 2.135 10 20 CECD CC[C@@H](NC/C=C\c1ccc(N(C)C)cc1)C(=O)O 840996399 MSTYRHGSVOXXTI-GEXIGZQTSA-N 262.353 2.219 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CCc3c(nnn3C)C2)c1 848565221 VEYJTJQDHDLMPD-VXGBXAGGSA-N 286.379 2.037 10 20 CECD CCOc1ccc(CN[C@@H](CN)CC(C)C)c(O)c1 841037957 DPXCHZAUIVLHIZ-CYBMUJFWSA-N 266.385 2.254 10 20 CECD CCOc1cncc(/C=C2\SC(=S)N(C)C2=O)c1 856717686 HHMVLUOKORTAKQ-YHYXMXQVSA-N 280.374 2.311 10 20 CECD C[C@H](NC1COC(C)(C)OC1)c1cc(F)ccc1O 757706522 WCDSGMWUGLXSAI-VIFPVBQESA-N 269.316 2.333 10 20 CECD CC[C@H](NCc1ccc(N(CC)CC)cc1)C(=O)NC 697835688 GKXZNWHULBJIRI-HNNXBMFYSA-N 277.412 2.147 10 20 CECD CCc1nncn1CCN[C@@H](C)c1cc(F)ccc1O 756620470 KIASPUFCGJIFCH-JTQLQIEISA-N 278.331 2.036 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)C1(CO)CC1 696098793 HKZMQIZSASRLOU-VIFPVBQESA-N 255.745 2.296 10 20 CECD C[C@@H](Cn1cccn1)NC(=O)N[C@H](C)c1ccccc1O 868100434 XXNWCFMFJXUTAM-NWDGAFQWSA-N 288.351 2.038 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)C[C@@H]2C)c1 862757625 AEJSLCZVRITNEU-FZMZJTMJSA-N 275.348 2.322 10 20 CECD C[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768438032 OQQYSNPMFGOMRN-IINYFYTJSA-N 263.337 2.050 10 20 CECD CN(CCO)Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 768137646 RAOKPVXQOHLBFV-UHFFFAOYSA-N 293.367 2.009 10 20 CECD CCOC(=O)[C@@H]1CSCCN1Cc1ccc(C)cc1O 876562955 WRMZZZWSFOXSCT-ZDUSSCGKSA-N 295.404 2.181 10 20 CECD COCCCN(C)Cc1ccc(N2CCC(O)CC2)cc1 876645650 PPFIQMUHFLCZLF-UHFFFAOYSA-N 292.423 2.116 10 20 CECD CC(C)[C@@](C)(O)C(=O)N(C)Cc1ccc(N(C)C)cc1 771103671 LRRMEENZAINFAA-MRXNPFEDSA-N 278.396 2.118 10 20 CECD CCN(CCCO)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776240036 ULKOFWIANKOODW-ZDUSSCGKSA-N 293.411 2.228 10 20 CECD CC(C)[C@H]1C[C@@H](NC(=O)c2cc(O)cs2)CCO1 772932660 JPBJPZCMOVORBP-GXSJLCMTSA-N 269.366 2.387 10 20 CECD O=C(Cc1ccc(Cl)cn1)NCc1ccc(O)c(O)c1 786412025 ZQIWWUDOFYCJFY-UHFFFAOYSA-N 292.722 2.005 10 20 CECD Cc1cc(O)c(CN2CC(N3CCCC3=O)C2)cc1Cl 897784866 LFMNRYUHIWFJCJ-UHFFFAOYSA-N 294.782 2.161 10 20 CECD CCOC(=O)C1(CC(=O)NCc2ccccc2O)CCC1 789816400 OFURUOFIHFWQNS-UHFFFAOYSA-N 291.347 2.132 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)COC(C)=O)c1 894502807 UJLPJWJAZIJHLN-UWVGGRQHSA-N 267.325 2.003 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@H]1CCC=CO1 780742417 GRZXMXOLHOUBAQ-CYBMUJFWSA-N 276.336 2.226 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cc(O)ncn1 892563672 FQEGGLOWOQKFBN-UHFFFAOYSA-N 258.325 2.169 10 20 CECD O[C@@H](CNCc1ccc2c(c1)CCO2)c1ccccc1 37363044 FGVSLTXDUFHIMT-INIZCTEOSA-N 269.344 2.445 10 20 CECD CCO[C@H]1C[C@H](N[C@H](C)c2cc(C(=O)O)ccc2O)C1 1605653772 KCAFHTUDJJHGPO-YUSALJHKSA-N 279.336 2.309 10 20 CECD O=C(O)[C@@H](CC1CC1)NCc1ccc(Cl)cc1O 1601639943 ULHNRRQTVXFSTE-LLVKDONJSA-N 269.728 2.389 10 20 CECD Nc1ccc(NC(=O)c2c(F)ccc(O)c2O)cc1 1580449914 XNMAMASPYXZHLW-UHFFFAOYSA-N 262.240 2.071 10 20 CECD Oc1ccc(CCNc2nnc(C3CC3)s2)cc1O 811811604 YKSIDEIKUFZPDT-UHFFFAOYSA-N 277.349 2.481 10 20 CECD c1cc2c(cc1CN[C@@H]1CC[C@@H]3CNC[C@@H]3C1)CCO2 843341598 VSBSIHJELQFTLA-OWCLPIDISA-N 272.392 2.099 10 20 CECD Oc1ccc(F)cc1CNCCCOC[C@@H]1CCCO1 226582982 OZYSBXQBIVIDKW-AWEZNQCLSA-N 283.343 2.207 10 20 CECD CNC[C@H]1CCCN(Cc2cc(Cl)cc(OC)c2O)C1 229102454 ZGSJZDVZIDGTFD-LLVKDONJSA-N 298.814 2.486 10 20 CECD NC(=O)c1cccc(CNCc2cc(Cl)ccc2O)c1 36902822 QCZRCUGFNYVXIQ-UHFFFAOYSA-N 290.750 2.434 10 20 CECD COc1cccc(CNCCc2ccc(O)cc2)c1O 40735288 SFJSNUYLQIZYOH-UHFFFAOYSA-N 273.332 2.439 10 20 CECD COc1cccc(CN2CCCC[C@@H]2[C@@H](C)N)c1O 63191265 XHYLCCOROGYTHP-DGCLKSJQSA-N 264.369 2.103 10 20 CECD COc1ccc(N(C)Cc2nc(C)no2)cc1OC 63617177 GGECLRWTDQZWLM-UHFFFAOYSA-N 263.297 2.032 10 20 CECD CC(C)(C)N1CCC(NC(=O)c2cccc(O)c2O)CC1 186982942 MDOHMCYEQMYURK-UHFFFAOYSA-N 292.379 2.091 10 20 CECD Oc1c(Cl)cccc1CNCCN1CCSCC1 225927707 LXZBMXXRUCTZOU-UHFFFAOYSA-N 286.828 2.184 10 20 CECD CCN(CC)c1ccc(CNCC(C)(C)O)cc1 96480995 WORYDYXXCJKLFG-UHFFFAOYSA-N 250.386 2.393 10 20 CECD COC1(C(=O)NCc2ccc3c(c2)CCCN3C)CCC1 272721161 JSQGNRBULBBRAD-UHFFFAOYSA-N 288.391 2.254 10 20 CECD CN(C)c1ccc(CN(CCO)C2CCC2)cc1F 275937999 HYNDWVSNWAKHRV-UHFFFAOYSA-N 266.360 2.239 10 20 CECD CC(C)n1cnc(C(=O)NCc2ccccc2O)c1 282549592 ALTBZAGSVNWRMP-UHFFFAOYSA-N 259.309 2.100 10 20 CECD CCCN(CC)C[C@@H](C)NCc1cc2c(cc1O)OCO2 289446063 BEGKZJSFLUMQJB-GFCCVEGCSA-N 294.395 2.331 10 20 CECD Cc1cc(=O)n(Cc2ccc(N(C)C)cc2)cc1[N+](=O)[O-] 292626497 KDMQCILNHFUOFZ-UHFFFAOYSA-N 287.319 2.179 10 20 CECD CCOc1cccc(CN2CC[C@]3(CCN(C)C3)C2)c1O 292781230 LKSCHSQOEVRPJK-KRWDZBQOSA-N 290.407 2.319 10 20 CECD CC(C)NC(=O)CN(Cc1ccc(N(C)C)cc1)C(C)C 298727361 RBMKMXFKCFACAG-UHFFFAOYSA-N 291.439 2.488 10 20 CECD COc1ccc(O)c(CNc2cccc3c2CNC3=O)c1 809722420 WVHIFEOEEMGWEP-UHFFFAOYSA-N 284.315 2.256 10 20 CECD CN(C)C1(CN[C@H]2CCc3cccc(O)c32)CCOCC1 297629085 JGVOVKYOLPYOHN-AWEZNQCLSA-N 290.407 2.080 10 20 CECD O=C1C[C@H](NCc2cc(Cl)c(F)cc2O)CN1C1CC1 816562961 FVHVHNGYHZWZTG-VIFPVBQESA-N 298.745 2.038 10 20 CECD C[C@@H](NC[C@@H]1C[C@H](F)CN1)c1ccc(N(C)C)cc1 817976388 KZMLFDAJMPGDEB-XBFCOCLRSA-N 265.376 2.103 10 20 CECD CC[C@H](NC[C@@H]1CCCN1)c1ccc(F)cc1O 817954592 ZMDVMWFKTLKAMD-AAEUAGOBSA-N 252.333 2.324 10 20 CECD Nc1ccc(CCNC(=O)c2ccc(C3CC3)nc2O)cc1 911782495 JYOAUVCREFXEKQ-UHFFFAOYSA-N 297.358 2.219 10 20 CECD CCNC(=O)CN(CC(C)C)c1ccc(OC)cc1 747682042 HZORZKIOTRFDMP-UHFFFAOYSA-N 264.369 2.294 10 20 CECD COc1cccc([C@H](C)NC2CCN(C(C)=O)CC2)c1O 846136945 MLBSLWAIXLYVAA-NSHDSACASA-N 292.379 2.062 10 20 CECD CCOc1ccc(CN[C@@H](C)C[C@H](C)N)c(O)c1 843129871 SHIIGFHECYENIL-QWRGUYRKSA-N 252.358 2.006 10 20 CECD CCCN(Cc1cc(OC)ccc1O)[C@H]1CCN(C)C1 843422818 SUUVEEJIRUKAIN-AWEZNQCLSA-N 278.396 2.317 10 20 CECD COc1cccc(O)c1CN(C)Cc1cccnc1 757875416 OXGNORILHIQWRS-UHFFFAOYSA-N 258.321 2.428 10 20 CECD Cc1cc(CN2CCSC[C@H]2C(=O)O)ccc1N(C)C 851705914 YSCPADSXLYKCND-AWEZNQCLSA-N 294.420 2.063 10 20 CECD CC(C)[S@@](C)(=O)=NC(=O)/C=C/c1ccc(O)c(O)c1 926053712 FTDTZRNVVNWZDZ-WSSFADSRSA-N 283.349 2.144 10 20 CECD Cc1ccc([C@@H](C)NCCS(=O)(=O)CC2CC2)c(O)c1 756760209 IWBSZWKENLUMKT-GFCCVEGCSA-N 297.420 2.176 10 20 CECD OCCCN(Cc1cc(Cl)ccc1O)C1CC1 769404612 MFFMOTRJPCGYEF-UHFFFAOYSA-N 255.745 2.392 10 20 CECD C[C@@H](NC(=O)NC[C@]1(C)CCOC1)c1ccccc1O 868248457 OOTMPKFZXLWXEX-ABAIWWIYSA-N 278.352 2.179 10 20 CECD Cc1ccc(CN(CCCO)Cc2ccccn2)c(O)c1 877527514 PGMBEIIPTWQAQY-UHFFFAOYSA-N 286.375 2.480 10 20 CECD CCCOc1ccc(CN[C@@H](CC)C(=O)NC)cc1C 873129671 PSUVXZJOENPHNS-AWEZNQCLSA-N 278.396 2.398 10 20 CECD COc1cccc(CNC[C@H]2CCC[C@H]2OC)c1O 774831725 YAGORTNXCFWRGP-DGCLKSJQSA-N 265.353 2.306 10 20 CECD COc1cc(Cl)cc(CN[C@H]2C[C@@H](C(=O)O)C2)c1O 874045715 CWEGMFMUKNWJML-WKFQBHICSA-N 285.727 2.007 10 20 CECD O=C(NC[C@@H]1COC2(CCCCC2)O1)c1cc(O)cs1 776249743 WPWUTWHRPYDFSH-LLVKDONJSA-N 297.376 2.259 10 20 CECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)c1ccco1 782470147 QSNPECJNHZVOQX-UHFFFAOYSA-N 294.376 2.133 10 20 CECD COc1ccc(CN(CCO)Cc2ccccc2O)cc1 895711638 SPTVJRZJZYEZDB-UHFFFAOYSA-N 287.359 2.395 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H](O)COC(C)C 797722507 MEVLBKVLUAVPAP-AWEZNQCLSA-N 279.380 2.234 10 20 CECD COc1cc(O)c(CN2CCC[C@](C)(OC)C2)cc1OC 793217755 PJUNPBLUQHAYFG-INIZCTEOSA-N 295.379 2.410 10 20 CECD COc1ccc(CNC(=O)c2coc(C3CC3)n2)c(O)c1 794379307 LAIXEBMUQGTMEG-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CN(C)[C@H]1CCCC[C@@H]1NC(=O)NCc1ccccc1O 1318428037 VQLAWYPXINLAKW-KBPBESRZSA-N 291.395 2.064 10 20 CECD CC[C@H](CO)NCc1c(O)cccc1Br 706829170 OKOICPTYJSSILG-MRVPVSSYSA-N 274.158 2.015 10 20 CECD CCCN(Cc1ccnn1C)c1ccc(CN)cc1 194979896 GDZGKYQTNLHRRQ-UHFFFAOYSA-N 258.369 2.295 10 20 CECD CC(C)c1nnsc1C(=O)NCc1ccc(O)cc1O 1336535030 PERQYRRXCRAMNT-UHFFFAOYSA-N 293.348 2.003 10 20 CECD CCN(CC(=O)O)Cc1cc(Cl)cc(F)c1O 1609992568 LPENVIXBAKWSNT-UHFFFAOYSA-N 261.680 2.091 10 20 CECD CCc1cccc(CN2CC[C@H](C)[C@H](C(=O)O)C2)c1O 1603975071 CPOUONYNVDSMDJ-SMDDNHRTSA-N 277.364 2.497 10 20 CECD COc1cc(C)cc(CN2CCC[C@@]2(C)C(=O)O)c1O 1594054511 QYGKEYKDYZWKAR-HNNXBMFYSA-N 279.336 2.148 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H]1[C@@H](C(=O)O)C1(F)F 1599628310 MPZXVSWQYFPRTC-YPMHNXCESA-N 297.301 2.414 10 20 CECD C[C@H](N[C@@H]1CCC[C@@H](N)C1)c1cc(C(=O)O)ccc1O 1593221823 BIQBLOZMSYQVKU-MVWJERBFSA-N 278.352 2.011 10 20 CECD CCN1CCc2cc(CNCC(F)(F)CC(=O)O)ccc21 1776877330 OFXSESKOQBVIDL-UHFFFAOYSA-N 298.333 2.269 10 20 CECD O[C@@H]1CC[C@@H](CNCc2ccc3c(c2)CCCO3)C1 922043989 IMXBVCSMKWOHOF-UKRRQHHQSA-N 261.365 2.262 10 20 CECD CCNCC1CCN(Cc2c(O)cccc2OC)CC1 843056131 UHIAQRFFSBBXJY-UHFFFAOYSA-N 278.396 2.222 10 20 CECD NC1C[C@@H]2CCC[C@H](C1)N2Cc1cc(F)ccc1O 843054232 STGXWVKEGUCXIY-AGUYFDCRSA-N 264.344 2.376 10 20 CECD CCN1CCC[C@H]1CN[C@H]1CCc2cccc(O)c21 296095299 UBHLPRDTZSMVCI-KBPBESRZSA-N 260.381 2.453 10 20 CECD C=Cn1cc(CNCc2ccc(N(C)C)cc2)cn1 194343800 RJZUWAUXCGZCDG-UHFFFAOYSA-N 256.353 2.339 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1CCC=CO1 708553366 BMPKMMGNMYVYBH-LLVKDONJSA-N 255.264 2.453 10 20 CECD C[C@@H]1CC=CC[C@H]1C(=O)NCCc1ccc(O)c(O)c1 286841066 VXYXZQPTUDJMBJ-DGCLKSJQSA-N 275.348 2.359 10 20 CECD COCc1ccc(CNCc2cc(OC)ccc2O)o1 128125337 QQGXQTWURIDTPS-UHFFFAOYSA-N 277.320 2.430 10 20 CECD COCCCOCCN(C)Cc1cc(F)ccc1O 181522654 SSMXEVCFAGPFOD-UHFFFAOYSA-N 271.332 2.016 10 20 CECD CCCCCS(=O)(=O)NCc1cccc(OC)c1O 184546195 GMCXFTOXKUFKEA-UHFFFAOYSA-N 287.381 2.010 10 20 CECD CC1([C@H]2CCCN(Cc3ccccc3O)C2)OCCO1 183240015 CNZHFHDKOXGWLI-AWEZNQCLSA-N 277.364 2.367 10 20 CECD C[C@H](CCS(C)(=O)=O)N[C@H](C)c1ccc(N(C)C)cc1 127214026 JZPYTDKGJSYDGW-CHWSQXEVSA-N 298.452 2.226 10 20 CECD COCC(=O)Nc1ccc2c(c1)C(=O)c1ccccc1C2=O 75284582 QWMWINARESKRDR-UHFFFAOYSA-N 295.294 2.047 10 20 CECD CC(=O)Nc1cccc(CNC(=O)Cc2ccc(N)cc2)c1 236576143 RZOVZEJRASHBRN-UHFFFAOYSA-N 297.358 2.086 10 20 CECD CC(C)N1C[C@H](N[C@H](C)c2ccccc2O)CC1=O 272910661 WNMXMAYFZNAJBN-VXGBXAGGSA-N 262.353 2.052 10 20 CECD COC[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 273472168 JWHLCSAXKDIERK-NOZJJQNGSA-N 280.324 2.376 10 20 CECD C[C@H]1C[C@@H](CNC(=O)N(C)Cc2ccccc2O)CCO1 271491394 FOCCDGYRNQJJOO-STQMWFEESA-N 292.379 2.349 10 20 CECD CCOc1ccc(O)c(CNCC2=CCN(C)CC2)c1 271817410 MDPWPMBWHKMLEK-UHFFFAOYSA-N 276.380 2.142 10 20 CECD Cc1ccc(O)c(CN[C@]2(CO)CCOc3ccccc32)c1 282212435 DKSDBHDODHECIM-SFHVURJKSA-N 299.370 2.461 10 20 CECD CC[C@@H](NCCN1CCCOCC1)c1ccccc1O 809751941 YSXQXCGRTGQJTK-OAHLLOKOSA-N 278.396 2.155 10 20 CECD CCN1C[C@@H](NCc2ccc(N(CC)CC)cc2)CC1=O 391475146 OAYJOYJAGWTNIC-HNNXBMFYSA-N 289.423 2.243 10 20 CECD COc1cccc(CN[C@@H](C)c2ccnc(O)c2)c1O 815148549 ZFZCQGBETMZISG-JTQLQIEISA-N 274.320 2.352 10 20 CECD CC(C)(CO)CNCc1cc(Cl)c(F)cc1O 816558935 RAIMODCSHGKUTL-UHFFFAOYSA-N 261.724 2.293 10 20 CECD Cc1cc(CN2CC[C@@H](n3cncn3)C2)ccc1N(C)C 815094652 FOOAULLFQUGDJD-OAHLLOKOSA-N 285.395 2.100 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H](C)S(C)(=O)=O)c(O)c1 815598246 QBYIXZWRXWRWLV-NWDGAFQWSA-N 285.409 2.093 10 20 CECD CCC[C@H](OC)C(=O)N[C@H](C)c1ccccc1O 827952478 UIQWBFGJZTZGTF-MFKMUULPSA-N 251.326 2.385 10 20 CECD C[C@@H](NC(=O)[C@H]1C[C@H]2CC(=O)[C@@H]1C2)c1ccccc1O 827952489 VFYJOXGRJVDYEK-DNIRFERGSA-N 273.332 2.185 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)COc1cccnc1 734468333 UYYIYVMOFXNBRH-UHFFFAOYSA-N 299.374 2.151 10 20 CECD FC1(F)CCNC[C@@H]1NCc1ccc2c(c1)CCCO2 904354639 IBNBLJSAYLQPQD-AWEZNQCLSA-N 282.334 2.098 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@H]1C(=O)O 833629509 JZDGFHNYRUZIIH-PSASIEDQSA-N 269.728 2.198 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C(=O)O)[C@@H](C)C2)cc1C 832899476 OIIPGVAGBLLPGV-WCQYABFASA-N 263.337 2.162 10 20 CECD NCC[C@@H](NCc1c(O)ccc(Cl)c1F)C(F)F 841073268 GPHZDRADNJPOEK-MRVPVSSYSA-N 282.693 2.257 10 20 CECD Nc1ccc(CCNC(=O)NCCC(F)(F)F)cc1 841845062 HPBNYJGUSZBAMU-UHFFFAOYSA-N 275.274 2.063 10 20 CECD C[C@H]1C[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CO1 842773555 APGMVHADYVVJAF-XVKPBYJWSA-N 286.715 2.221 10 20 CECD C[C@H]1CC/C(=C\C(=O)NCc2ccc(O)cc2O)C1 910951264 QKTDIMFIOUAXFT-VUBLIPMDSA-N 261.321 2.460 10 20 CECD NC[C@H]1CC[C@@H](NCc2cc(Cl)ccc2O)C1 841085213 XBATVYFPUSDYIF-JOYOIKCWSA-N 254.761 2.263 10 20 CECD O=C(/C=C/[C@H]1CCOC1)NCc1cc(Cl)ccc1O 846476165 JTMQMCHOCOHCHO-DTWDLQQISA-N 281.739 2.255 10 20 CECD C[C@H]1CCN(Cc2cccc(F)c2O)C[C@H]1C(=O)O 843039080 AHMVCPMIVRPQJL-GXSJLCMTSA-N 267.300 2.074 10 20 CECD CCOCCCN(C)c1ccc(OCC(=O)O)cc1 846279834 NDKSRIOHXOJJQR-UHFFFAOYSA-N 267.325 2.013 10 20 CECD C[C@H](NCCCn1cncn1)c1ccc(Cl)cc1O 841749330 CNLMRKJLAFCCOQ-JTQLQIEISA-N 280.759 2.378 10 20 CECD CCSC1(CNC(=O)c2ccc(C)c(O)c2O)CC1 856065685 WVXRUXJOMHCHQJ-UHFFFAOYSA-N 281.377 2.422 10 20 CECD C[C@@H](NC[C@@H](O)CN(C)C)c1ccc2ccccc2c1O 756557847 WQQGIXCHHBKDPL-TZMCWYRMSA-N 288.391 2.119 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](C)Cn2ccc(C)n2)c1 869409609 BPMVQDGOONCBHB-LBPRGKRZSA-N 287.363 2.158 10 20 CECD C[C@@H](NC(=O)C[C@@](C)(O)C1CC1)c1ccc(N(C)C)cc1 775404175 LWEJIVCSRIRKHI-SJKOYZFVSA-N 290.407 2.481 10 20 CECD CCOc1ccc(CN2C[C@H](C)N(C)C[C@H]2C)c(O)c1 775981486 QXZNMJNIKLRUMQ-QWHCGFSZSA-N 278.396 2.315 10 20 CECD CCOC(=O)C1(CNCc2cc(OCC)ccc2O)CC1 770666358 ZIPUZBOQSFFEEE-UHFFFAOYSA-N 293.363 2.224 10 20 CECD CC(C)(C)[S@@](=O)CCNCc1cc(F)cc(F)c1O 883007627 BFGFNKRXPUOVMU-IBGZPJMESA-N 291.363 2.307 10 20 CECD CCOc1ccc(CNC[C@@H]2CC(C)=NO2)c(O)c1 895312181 VVHQKSDBMPJRJN-ZDUSSCGKSA-N 264.325 2.045 10 20 CECD Cc1nc([C@@H](C)NCc2cc(Cl)cc(F)c2O)n[nH]1 894771977 CLDPKSPJQDJODN-ZCFIWIBFSA-N 284.722 2.462 10 20 CECD O[C@H]1C[C@@H](CNCc2ccc(N3CCCC3)cc2)C1 720958671 ZIELWDPCEBRHTD-FZNQNYSPSA-N 260.381 2.147 10 20 CECD CCOc1cccc(CN2C[C@@H](C)N(C)C[C@H]2C)c1O 775981340 PNLOAFFFRLBDNL-CHWSQXEVSA-N 278.396 2.315 10 20 CECD Cc1nc(C)c(CNC(=O)NCc2ccc(N)cc2)s1 1336976039 WJDKNOXYUGJBNE-UHFFFAOYSA-N 290.392 2.342 10 20 CECD C[C@@H](NC(=O)NCc1cnccn1)c1ccc(N(C)C)cc1 1343420163 HQBXKKAAGFVXKE-GFCCVEGCSA-N 299.378 2.103 10 20 CECD O=C(O)/C=C/c1ccc(N2CC3(CC3)C2)c([N+](=O)[O-])c1 1601880543 BAGGPQYQYCUHNF-DUXPYHPUSA-N 274.276 2.293 10 20 CECD C[C@H](NC[C@@H]1CCCOC1)c1cc(C(=O)O)ccc1O 1593257237 MQHQVJRBFLDEAG-QWRGUYRKSA-N 279.336 2.168 10 20 CECD CCOc1ccc(N(C)CC(=O)N(CC)CC)cc1 150729391 WVQHDHAMRHYBSI-UHFFFAOYSA-N 264.369 2.390 10 20 CECD CC(C)N1CC[C@H](CNCc2cc(F)ccc2O)C1 232666027 YVQXQLQVQUIUNX-GFCCVEGCSA-N 266.360 2.351 10 20 CECD CC[C@H](C)[C@H](NCc1ccc2c(c1)CCO2)C(=O)OC 37363453 ROGZPTOOBJGUIA-NHYWBVRUSA-N 277.364 2.299 10 20 CECD CCc1nsc(NCCc2ccc(O)c(O)c2)n1 92665994 KFHHQLRFJRZXIW-UHFFFAOYSA-N 265.338 2.166 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2([S@@](C)=O)CC2)c1 282342583 OWMNLPZJLSXVMZ-BBATYDOGSA-N 267.394 2.262 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCCC[C@@H]2O)c1 51991916 LDEBEVOUTOHZAM-XEGUGMAKSA-N 265.353 2.355 10 20 CECD CN(C)C[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 180230735 IFXMRMOHTBOBFZ-NSHDSACASA-N 268.788 2.429 10 20 CECD CS[C@H]1CCCCN(C(=O)c2cccc(O)c2O)C1 193142879 SIBHAISNVYIGIQ-JTQLQIEISA-N 281.377 2.456 10 20 CECD CCc1cccc(CN(C)CC(=O)N(CC)CC)c1O 692092349 KOULOPQKHXNAQW-UHFFFAOYSA-N 278.396 2.255 10 20 CECD C[C@@H](NCCc1nnc2ccccn12)c1ccccc1O 20128209 FVHVXNUTTWVWOF-GFCCVEGCSA-N 282.347 2.328 10 20 CECD CN(C)c1ccc(CN2CCC(CO)CC2)cc1F 127062661 KKNLIXAZTZBYMB-UHFFFAOYSA-N 266.360 2.096 10 20 CECD CSC[C@@H](C)NC(=O)NCc1ccc(N(C)C)c(F)c1 77798676 YFOCUVNZSHQDTP-SNVBAGLBSA-N 299.415 2.442 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)NC[C@H](C)O 127776083 KLNXIFFZNCRQPN-NSHDSACASA-N 278.377 2.266 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)c1ccc(C)c(O)c1O 182508983 FSPOFLXZMHKUCW-JTQLQIEISA-N 281.352 2.340 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2cccc(Cl)c2O)C1 180567734 LLANJHYOBNIKDU-CQSZACIVSA-N 283.755 2.431 10 20 CECD C[C@H](CC[S@](C)=O)N[C@H](C)c1ccc(F)cc1O 252815241 UWEBFDITFIEQRO-MHNGPXOMSA-N 273.373 2.339 10 20 CECD C[C@@H]1CN(CCCNCc2cc(F)ccc2O)CCCO1 277646513 YUSNJEXUKGOGHP-CYBMUJFWSA-N 296.386 2.122 10 20 CECD COC(=O)[C@H]1C[C@@H](C)CCN1Cc1cccc(OC)c1O 274850747 BFXARDMUJPGGKI-WCQYABFASA-N 293.363 2.174 10 20 CECD CCN(CC)c1ccc(CN(CC)[C@H]2CCNC2=O)cc1 281782474 NFQSJOQUEFSOBC-INIZCTEOSA-N 289.423 2.243 10 20 CECD CCOC1CC(N(C)C(=O)c2ccc(C)c(O)c2O)C1 293381103 LQXHPSPLMFXJNL-UHFFFAOYSA-N 279.336 2.046 10 20 CECD COc1cccc(CN2CC[C@H](O)C23CCCC3)c1O 293517621 AQOCQVANKSYRGZ-AWEZNQCLSA-N 277.364 2.280 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCCOCC1 816493170 RQVUOXDVGVFABU-UHFFFAOYSA-N 259.708 2.407 10 20 CECD C[C@H]1CCC[C@@H]1N1C(=O)CN(Cc2ccccc2O)C1=O 819167730 HPBIINHCHVUGPH-AAEUAGOBSA-N 288.347 2.345 10 20 CECD C[C@@H](NC(=O)C1(N(C)C)CCC1)c1ccccc1O 827941442 RWXXZUXPDDOZFY-LLVKDONJSA-N 262.353 2.054 10 20 CECD CCn1ncc(/C=C2\C(=O)N(C)c3ccc(C)cc32)n1 901511665 ZOGQMSDNCFOGBV-JYRVWZFOSA-N 268.320 2.123 10 20 CECD COc1cccc([C@H](C)NCC[C@@H](O)C2CC2)c1O 903410187 DPFKPQNIAVOLFT-GXFFZTMASA-N 265.353 2.212 10 20 CECD CCC[C@H](C)NC(=O)[C@H](C)OC(=O)c1cc(O)cs1 732352692 CDVIXKYXDPQIRC-IUCAKERBSA-N 285.365 2.304 10 20 CECD CCOC(=O)/C(=C\c1cncn1C(C)C)c1nccn1C 901464299 GOBHIJNZYRXTKD-JYRVWZFOSA-N 288.351 2.301 10 20 CECD C[C@H](N[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1O 62748451 PAKIPIQDDAGNOZ-XDTLVQLUSA-N 253.317 2.485 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H](C)C2CC2)c1 734017568 NUUKTHGVDUYDAU-SNVBAGLBSA-N 263.337 2.453 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@]2(C)CCC(=O)N2)c(O)c1 834909631 STKFABQJUNIZJT-LRDDRELGSA-N 276.380 2.328 10 20 CECD COc1ccc(CNC2(CC(=O)O)CCOCC2)cc1C 832341993 PYXXYFQNXPQNRM-UHFFFAOYSA-N 293.363 2.117 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@@H]1CCCCN1 841033154 NOBDZINEOBUTNA-VIFPVBQESA-N 272.751 2.416 10 20 CECD NCC[C@H]1CCCN(Cc2cccc(F)c2O)C1 843112330 HJIFGNDESSSBKE-LLVKDONJSA-N 252.333 2.092 10 20 CECD Cc1nc(CCN[C@@H](C)c2ccc(Cl)cc2O)n[nH]1 841753985 OWGXGICWCBKZIO-QMMMGPOBSA-N 280.759 2.365 10 20 CECD CCn1ccc(CN[C@@H](C)c2cc(OC)ccc2O)n1 840839978 CCVOSFCMYXXMHF-NSHDSACASA-N 275.352 2.468 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C)[C@@H](CN)C2)c1O 842478599 LDCOACARPABGLJ-MFKMUULPSA-N 294.370 2.151 10 20 CECD CCc1cccc(CN(CCO)CC(F)F)c1O 848908400 SUSDQMSMNSCLHV-UHFFFAOYSA-N 259.296 2.014 10 20 CECD Cc1cccc(CCNC(=O)NCCc2ccc(N)cc2)n1 841891477 QBQOZVSCUARCJF-UHFFFAOYSA-N 298.390 2.057 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H](C(=O)O)C(C)(C)C)cc1 849364549 MESBWUSIPDTKGN-ZDUSSCGKSA-N 292.379 2.116 10 20 CECD CC(C)CN1CC[C@@H](CNC(=O)c2cc(O)cs2)C1 757440876 ZYRLZIHBOTVWDQ-NSHDSACASA-N 282.409 2.161 10 20 CECD COC(=O)N(C)CCN[C@@H](C)c1c(C)cc(C)cc1O 850547352 DIVRDNHNIOJJNI-LBPRGKRZSA-N 280.368 2.358 10 20 CECD CCOC(=O)[C@@]1(C)CCC[C@@H]1NC(=O)c1cc(O)cs1 856303601 LOHXEOQKXVVNSE-FZMZJTMJSA-N 297.376 2.305 10 20 CECD C[C@@H]1C(=O)N([C@H](C)c2ccc(N(C)C)cc2)C(=O)N1C 761578832 XIFKBWDHGAPXOK-GHMZBOCLSA-N 275.352 2.096 10 20 CECD OC1CCN(c2ccc(CN3CC[C@H]4C[C@@H]4C3)cc2)CC1 877636377 VJEXYABFMOHODQ-JKSUJKDBSA-N 286.419 2.490 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCN(CC(F)(F)F)C1 876991109 HJTNPPLRZKIRGE-LLVKDONJSA-N 288.313 2.427 10 20 CECD CO[C@H]1CCN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 776237747 IGZUYHIWWQTCHX-DOMZBBRYSA-N 291.395 2.244 10 20 CECD CC(C)n1cc(CN[C@H](C)c2ccccc2O)nn1 877755910 SFWBGOZUEHVVAB-LLVKDONJSA-N 260.341 2.415 10 20 CECD C[C@H](NC(=O)N[C@]1(C)CCOC1)c1ccc(N(C)C)cc1 776237910 KCCZFGMMZLWGDF-BLLLJJGKSA-N 291.395 2.292 10 20 CECD C[C@@H](NC(=O)c1cccnc1O)c1ccc(N(C)C)cc1 775406228 WEVGHWCEXFJCSD-LLVKDONJSA-N 285.347 2.344 10 20 CECD CCn1ncnc1COc1ccc(N2CCCC2)cc1 786893327 GWNWNMVELXTWLL-UHFFFAOYSA-N 272.352 2.477 10 20 CECD C[C@@H]1COC[C@H]1NCc1cc(Cl)c(F)cc1O 896735311 ZJNQTGPPAOYSEZ-RDDDGLTNSA-N 259.708 2.309 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOC[C@@H]1[C@@H]1CCCO1 894747495 LUSQWRDSGHALIU-KGLIPLIRSA-N 299.317 2.050 10 20 CECD COc1ccc(CNC[C@H]2C[C@@H](C)N(C(C)=O)C2)cc1C 980276916 YSSRCMMPMXLMMD-CZUORRHYSA-N 290.407 2.350 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cc(N)ncn1 1337042383 KIZNVSRHJZEGNK-UHFFFAOYSA-N 257.341 2.045 10 20 CECD C[C@H](N[C@@H](CCO)C1CC1)c1cc(F)ccc1O 756740715 SSJFWUKMVCHBSS-ZANVPECISA-N 253.317 2.343 10 20 CECD O=C(NOC1CCCCC1)c1cccc(O)c1O 790942620 AGMNWXDSWSCVTJ-UHFFFAOYSA-N 251.282 2.092 10 20 CECD COC(=O)c1ccc(CN[C@H](C)c2ccccc2O)[nH]1 877756444 IZDNKDJIHSWDON-SNVBAGLBSA-N 274.320 2.358 10 20 CECD C[C@H](NCc1ccc(-c2nn[nH]n2)o1)c1ccccc1O 1591770228 WIDFAASSMPOCGR-VIFPVBQESA-N 285.307 2.016 10 20 CECD CC[C@H](CCC(=O)O)NCc1ccc2c(c1)CCO2 1776710359 CITZFUKAVVOUEV-CYBMUJFWSA-N 263.337 2.355 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CCCCCO)c1O 227081683 BPMLMOPIJSWJOB-UHFFFAOYSA-N 283.343 2.328 10 20 CECD Cc1noc(C)c1CN(C)C(=O)Cc1ccc(N)cc1 37819138 IICOVJNETSVCPU-UHFFFAOYSA-N 273.336 2.075 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCCN1 817902850 ZKQSRGFBQONGEZ-WFASDCNBSA-N 260.381 2.242 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](CCO)C(F)(F)F)c1 886802036 XSTBHZCPVLUKEE-UFBFGSQYSA-N 293.285 2.365 10 20 CECD CCCCOCCNC(=O)NCc1cc(OC)ccc1O 114592576 JZWYYWDCBSIXND-UHFFFAOYSA-N 296.367 2.017 10 20 CECD COc1cccc(CNC(=O)CC[C@@H]2CCCCO2)c1O 111597709 KMLBTPMPAYMMAW-ZDUSSCGKSA-N 293.363 2.366 10 20 CECD CN(Cc1cccnc1)C(=O)NCc1ccc(N(C)C)cc1 120444576 ZTWFQQFMBUDWOJ-UHFFFAOYSA-N 298.390 2.489 10 20 CECD CCO[C@@H]1C[C@H](NC(=O)c2cccc(O)c2O)C12CCC2 187129793 KNTVIICLYNTGCU-QWHCGFSZSA-N 291.347 2.175 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](OCCOC)C2)c1 188814540 XDCXFGWPJWZYRH-OAHLLOKOSA-N 295.379 2.028 10 20 CECD Cc1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1C#N 182408633 UWYLSTVAVIKTRA-UHFFFAOYSA-N 288.328 2.373 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1cccn1C 80591301 QAUFYSXEKDPBPZ-UHFFFAOYSA-N 273.336 2.072 10 20 CECD C[C@]1(C(N)=O)CCN(Cc2c(O)ccc3ccccc23)C1 235716734 YGRDAZCVMFRGOB-KRWDZBQOSA-N 284.359 2.243 10 20 CECD COCCCCCNC(=O)Nc1ccc(N)cc1 234725195 VZTLCVLNRIZBGZ-UHFFFAOYSA-N 251.330 2.207 10 20 CECD COc1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1 98074452 UAPFREIFPVLCPL-UHFFFAOYSA-N 287.315 2.079 10 20 CECD C[C@H]1CCCN(C[C@H](C)NC(=O)Cc2ccc(N)cc2)C1 263271162 PCRGZAUCFBWJRT-KBPBESRZSA-N 289.423 2.048 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)[S@@](=O)CC2)cc1C 277808541 YBHUHZBFPKGCLP-DJJJIMSYSA-N 281.421 2.352 10 20 CECD CCC1(O)CCN(Cc2cc(F)ccc2O)CC1 272325778 VFGWIKJABZXCRC-UHFFFAOYSA-N 253.317 2.268 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@](O)(C3CC3)C2)c1 369683486 LXRMJUXPSZPRKJ-INIZCTEOSA-N 277.364 2.138 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CCCCNC2=O)c(O)c1C 273411839 PVMRHEGWJAZVOF-TZMCWYRMSA-N 276.380 2.328 10 20 CECD Oc1ccc(Cl)cc1CN1CCOC[C@@H]1[C@@H]1CCCO1 377707910 WIZHMHRYUQUIMP-HIFRSBDPSA-N 297.782 2.425 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)C(=O)NCCF)c(O)c1C 282773567 PAUWIEZEIWBBKN-NEPJUHHUSA-N 282.359 2.134 10 20 CECD CCN(CC)c1ccc(CN[C@H]2COC[C@@H]2OC)cc1F 289689964 DAYZJDDBFWNTCT-HOCLYGCPSA-N 296.386 2.175 10 20 CECD COCc1ccc(CNCc2cccc(OC)c2O)o1 289548753 XLYBLNVKOQOSAF-UHFFFAOYSA-N 277.320 2.430 10 20 CECD Cc1nc(C(C)C)oc1C(=O)NCc1ccc(O)c(O)c1 293658476 IUUXZYKBTSZRPP-UHFFFAOYSA-N 290.319 2.448 10 20 CECD CCCCN(C)C[C@@H](C)NC(=O)NCc1ccccc1O 291787102 GKZNIUUEMQOZPZ-CYBMUJFWSA-N 293.411 2.312 10 20 CECD OC[C@]12C[C@H]1CN(Cc1ccc3ccccc3c1O)C2 816586591 MHKKTXYXLNSNKX-WMLDXEAASA-N 269.344 2.360 10 20 CECD OC[C@H]1CCCN(Cc2cc(F)ccc2O)CC1 816665364 DLGFCBURLPWHTA-NSHDSACASA-N 253.317 2.126 10 20 CECD C[C@@H](OCC1CC1)C(=O)N[C@H](C)c1ccccc1O 827930770 QJUWLCAHXVQDAY-GHMZBOCLSA-N 263.337 2.385 10 20 CECD CCOc1ccc(CN(C)Cc2cnc[nH]2)c(O)c1 826769620 OWGCJVOSQSDSAK-UHFFFAOYSA-N 261.325 2.146 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H](CC)c1ccccc1O 825196679 LZFDPVONVZEYGE-GZBFAFLISA-N 265.353 2.237 10 20 CECD Cc1cc(O)c(CNC(C)(C)CC(=O)O)cc1C 832900318 XHKNKXQNWSZJLV-UHFFFAOYSA-N 251.326 2.352 10 20 CECD C[C@H](NCCCON)c1ccc(Br)cc1O 902422984 IAJWTJVXHXIZTB-QMMMGPOBSA-N 289.173 2.086 10 20 CECD Oc1cccc2c1[C@H](NC[C@H](O)c1ccco1)CC2 834502165 NFZGTMGAVHOWCU-YPMHNXCESA-N 259.305 2.296 10 20 CECD O=C(O)CC1(NCc2cc(Cl)ccc2O)CCOCC1 833205901 IGSGQOWAAJLZCD-UHFFFAOYSA-N 299.754 2.159 10 20 CECD CCOc1ccc(O)c(CN2CC(OC(F)F)C2)c1 839144975 QHUQKHLTCFPHSN-UHFFFAOYSA-N 273.279 2.214 10 20 CECD COc1cccc(CNC(=O)NC[C@H](C)C2CC2)c1O 745772632 YFKPVASZLIIBKI-JTQLQIEISA-N 278.352 2.246 10 20 CECD O=C1C[C@H](CNCc2cc(Cl)ccc2O)CN1C1CC1 846075558 SARBTLSZHXKUFS-SNVBAGLBSA-N 294.782 2.146 10 20 CECD Cc1nc(C(=O)NCc2ccccc2O)c2ccccn12 741280885 ZNRWOGLTLPOBCF-UHFFFAOYSA-N 281.315 2.278 10 20 CECD Cc1cc(O)c(CN2CCC(OCCCN)CC2)cc1C 843056571 QZTYAOOOCQIZJL-UHFFFAOYSA-N 292.423 2.339 10 20 CECD COc1cccc(O)c1CNC[C@H](C)C(=O)OC(C)(C)C 848565856 NGANITLXJOVTLG-NSHDSACASA-N 295.379 2.468 10 20 CECD CCc1nc([C@H](C)NCc2cccc(CC)c2O)n[nH]1 848901193 WNKCAKVMKWIBKD-JTQLQIEISA-N 274.368 2.486 10 20 CECD Cn1ncc2c1CCC[C@H]2NC(=O)Nc1ccc(N)cc1 841302070 KRRXWWDCJMEAKT-CYBMUJFWSA-N 285.351 2.201 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNC[C@@H]2CCCCN2)c1O 841033767 ZGQVUHPQLATVQP-NSHDSACASA-N 299.758 2.186 10 20 CECD NCC[C@@H]1CCCN(Cc2cccc(F)c2O)C1 843112332 HJIFGNDESSSBKE-NSHDSACASA-N 252.333 2.092 10 20 CECD CCCN(CC)CCNC(=O)NCc1cc(C)ccc1O 858286874 IOZBGWPHCGMHNE-UHFFFAOYSA-N 293.411 2.232 10 20 CECD Cc1cc(O)c(CN2C[C@H]3CCC[C@]3(N)C2)cc1C 857226760 YWDFBBPBNKHWFB-ZBFHGGJFSA-N 260.381 2.322 10 20 CECD CCOC(C)(C)CNC(=O)NCc1cc(C)ccc1O 858378697 OODRTEODAVPHKE-UHFFFAOYSA-N 280.368 2.315 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CCC[C@]3(N)C2)cc1F 857225906 AFIKYEQGVHFBQB-CJNGLKHVSA-N 277.387 2.205 10 20 CECD COc1cccc(O)c1CN1CCN(C2CCC2)CC1 769415496 ZKBKYCNHEXKNHE-UHFFFAOYSA-N 276.380 2.071 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(OC)c(C)c1 765797179 QEBOBIMSHCLSKI-KGLIPLIRSA-N 276.380 2.008 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cc(OC)c(C)cc2O)C1 768464822 AVMWVOFWJCWSNE-CQSZACIVSA-N 292.423 2.483 10 20 CECD CCN(CCC(=O)OC)Cc1c(C)cccc1O 876630647 HEPRPBHEGSFQAI-UHFFFAOYSA-N 251.326 2.086 10 20 CECD C[C@@H](NC(=O)NCCC(C)(C)C(=O)O)c1ccccc1O 874405574 RBLMYXXXGPJCFX-SNVBAGLBSA-N 294.351 2.253 10 20 CECD Cc1ccc(CN2CCCC[C@@H]2C2OCCO2)c(O)c1 876680298 ZFAXEFMKAYNDEM-CQSZACIVSA-N 277.364 2.428 10 20 CECD CSC[C@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 778149020 BVXJPWFCYWSGNH-SMDDNHRTSA-N 268.426 2.127 10 20 CECD C[C@H](NC(=O)c1cocn1)c1ccc(N(C)C)cc1 773022202 VFRZQMOBWWOBSD-JTQLQIEISA-N 259.309 2.232 10 20 CECD CC(C)CNC(=O)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 1116569037 YZVDGZXHPRECKY-CMPLNLGQSA-N 294.370 2.441 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CC12CCC2 874786122 YDKDBWVBTWMISK-MASHWEEQSA-N 259.305 2.170 10 20 CECD CCN(C)c1ccc(CN2CCSC[C@H]2CO)cc1 773810865 CKLRFYZHOLFQBR-OAHLLOKOSA-N 280.437 2.052 10 20 CECD C[C@@H]1CCc2[nH]nc(C(=O)NCCc3ccc(N)cc3)c2C1 884028277 BYJNNBMJRXAPKV-LLVKDONJSA-N 298.390 2.089 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCO[C@@]2(CCOC2)C1 883081886 QSZNTXKTOKOVGA-DOMZBBRYSA-N 299.317 2.098 10 20 CECD COc1cc(C)cc(CNC[C@@H](OC)C(F)(F)F)c1O 894251821 QFKLCBJNILMZKY-LLVKDONJSA-N 293.285 2.376 10 20 CECD C[C@]1(O)CCCN(Cc2cc(F)cc(F)c2O)CC1 894603074 KFLQWCFWIUPCJT-AWEZNQCLSA-N 271.307 2.407 10 20 CECD COc1ccc(CNCc2cnccc2C)c(O)c1OC 894729765 SQVIIBHDBSTIHX-UHFFFAOYSA-N 288.347 2.403 10 20 CECD O=C(NCCC1=CCN(c2cccc(F)n2)CC1)C1CC1 1089803531 LPMPTHSPHGUPKS-UHFFFAOYSA-N 289.354 2.274 10 20 CECD Nc1ccc(NC(=O)N(CCO)C2CCCCC2)cc1 42526546 SWVCYBKSIHSTMA-UHFFFAOYSA-N 277.368 2.428 10 20 CECD COc1cccc(CN2CCO[C@H](C(C)C)C2)c1O 709028500 OIZGIHOYQONLGS-AWEZNQCLSA-N 265.353 2.258 10 20 CECD COc1cccc(O)c1CN[C@H]1CCOC(C)(C)C1 754080997 VTUOJQNOWYUHPV-NSHDSACASA-N 265.353 2.448 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1[C@@H]2Cc3ccccc3[C@H]21 1263896446 ZJWFZMDJNFPTMU-FVQBIDKESA-N 295.338 2.300 10 20 CECD CO[C@@H]1CCC[C@@H]1C(=O)NCc1cc(C)ccc1O 1347202436 HKVHXMBFVZSEGW-GXTWGEPZSA-N 263.337 2.132 10 20 CECD Cc1ccc([C@H](C)C(=O)NCc2cccc(O)c2O)o1 1528771318 NGIVCZSFEWIMQW-JTQLQIEISA-N 275.304 2.419 10 20 CECD CC(C)[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)O 1609943258 MLIKXZJSBKAHBV-UFBFGSQYSA-N 282.296 2.060 10 20 CECD CN1CCC[C@@H]2CN(Cc3ccccc3O)CC[C@@H]21 156093142 QLPCLSCAAFVWKM-HIFRSBDPSA-N 260.381 2.308 10 20 CECD CC[C@@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CCO1 37323497 QAFYVDCFSZNTKI-CYBMUJFWSA-N 281.327 2.345 10 20 CECD Cc1nc(C)c(C(=O)N(C)Cc2ccccc2O)o1 175199100 FMWIEBJYJFNBNI-UHFFFAOYSA-N 260.293 2.269 10 20 CECD CC(C)(C)[C@@H](CO)NCc1cc(F)cc(F)c1O 708501800 JFWMNSAXBWBYCT-LLVKDONJSA-N 259.296 2.167 10 20 CECD CCOc1cccc(CN[C@@H](CO)CC(F)(F)F)c1O 717812324 TXQAGAISPURQAB-SNVBAGLBSA-N 293.285 2.194 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCCN1 817902847 ZKQSRGFBQONGEZ-DOMZBBRYSA-N 260.381 2.242 10 20 CECD COc1ccc(N2CCCN(c3ncccn3)CC2)cc1 52511555 XLPLCTJRYDSDSC-UHFFFAOYSA-N 284.363 2.202 10 20 CECD COc1cccc(CNC(=O)c2ccc[nH]c2=S)c1O 105652059 QIZACDAFNMLKPJ-UHFFFAOYSA-N 290.344 2.388 10 20 CECD Cc1nc2n(n1)C[C@@H](NCc1c(O)cccc1Cl)CC2 113333716 VBTALGYRWRSELE-JTQLQIEISA-N 292.770 2.050 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccn2C)cc1F 69913615 HBSXLRAELFIKBA-UHFFFAOYSA-N 275.327 2.160 10 20 CECD CN(Cc1c(O)cccc1Cl)CC(C)(C)CN 128348232 RZVDURYHBQPPAH-UHFFFAOYSA-N 256.777 2.462 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1OCCc2ccccc21 182548438 NSWOIBYJLXAUFF-INIZCTEOSA-N 299.326 2.028 10 20 CECD Cc1ccc([C@H](C)NCCSCCCO)c(O)c1 185379010 MUAZMMMKOHOBDH-LBPRGKRZSA-N 269.410 2.467 10 20 CECD COCCN(C)CCCN[C@H](C)c1ccc(F)cc1O 185008537 KSNDBDNKLWJKAS-GFCCVEGCSA-N 284.375 2.150 10 20 CECD OCC1(CN2CCCc3cc(OC(F)F)ccc32)COC1 89117024 WUYWSWABGPZBBO-UHFFFAOYSA-N 299.317 2.050 10 20 CECD COc1cccc(CNCc2cnc(N(C)C)s2)c1O 289410591 HSDVUBXRAOUONA-UHFFFAOYSA-N 293.392 2.213 10 20 CECD C[C@@H]1CCC[C@@H](CO)N1Cc1ccc(N(C)C)cc1 193439805 NFULROIQMQAFPB-CJNGLKHVSA-N 262.397 2.488 10 20 CECD CNC(=O)CC1CCN(Cc2ccc(N(C)C)cc2)CC1 93587627 NXJWDOWLTUYMFG-UHFFFAOYSA-N 289.423 2.101 10 20 CECD Cc1cc(O)c(CN2CC(=O)N[C@@H]3CCCC[C@H]32)cc1C 245568674 VJRDOOSNBPPNLX-HUUCEWRRSA-N 288.391 2.252 10 20 CECD CCn1ccnc1CNCc1ccc(N(C)C)cc1 51921211 BUCDPLGSXAQAEQ-UHFFFAOYSA-N 258.369 2.259 10 20 CECD Cc1cc(O)c(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)cc1C 265663717 XVXDMVZVTMLKFQ-JMERFSKESA-N 281.421 2.350 10 20 CECD O=C1CCC[C@H]1[C@H]1COCCN1Cc1cc(F)ccc1O 373752174 VQYBIOAJZRSSJX-UONOGXRCSA-N 293.338 2.101 10 20 CECD CC[C@H](NCC1([S@@](C)=O)CC1)c1ccc(F)cc1O 287500351 NRNFHCKEWIFVRV-HXPMCKFVSA-N 285.384 2.483 10 20 CECD CCOC1(C(=O)NCc2ccccc2O)CCCC1 286839671 VQMRWPKFEILWPI-UHFFFAOYSA-N 263.337 2.358 10 20 CECD OC[C@H]1CN(Cc2ccccc2O)CC[C@H]1C(F)(F)F 289685262 OCCXOPSSMVIIRD-VXGBXAGGSA-N 289.297 2.385 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCC[C@H](C(=O)O)C1 386498816 PUKSGFDTCIFEJK-NEPJUHHUSA-N 291.347 2.242 10 20 CECD COCC1(CCNC(=O)NCc2ccccc2O)CCC1 297787538 ODTDSVBERAANLN-UHFFFAOYSA-N 292.379 2.398 10 20 CECD CO[C@H](CN[C@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 293751408 QIPOABRERJQPKX-YMTOWFKASA-N 280.324 2.376 10 20 CECD COCCN(C)CCN[C@H](C)c1c(C)cc(C)cc1O 293261026 CAGKZVKSFIWPON-CQSZACIVSA-N 280.412 2.238 10 20 CECD COCC[C@@H]1COCCN1Cc1ccc(N(C)C)c(C)c1 293489981 GMGNEBYPLMNKKG-MRXNPFEDSA-N 292.423 2.298 10 20 CECD CN(C)c1ccc(CNC(=O)OC[C@@H]2CCCO2)cc1F 804975542 OWAHLELXRTYBNT-LBPRGKRZSA-N 296.342 2.297 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnccn1 807840226 VFTOURWTZHIPQR-UHFFFAOYSA-N 298.129 2.419 10 20 CECD CCn1ccnc1C(=O)NCc1ccc(N(C)C)c(F)c1 291585250 VKASYULIJSUZDO-UHFFFAOYSA-N 290.342 2.038 10 20 CECD Cc1ccc(CS(=O)(=O)NCc2ccccc2O)cc1 808295537 ZRCYUVNHSMASPU-UHFFFAOYSA-N 291.372 2.320 10 20 CECD C[C@@H]1CN(C2CC2)C[C@@H]1N[C@H]1CCc2cccc(O)c21 297820732 RJVSAKZQPUDJRQ-UGFHNGPFSA-N 272.392 2.452 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(N)cc2)n[nH]1 297136462 HUCAIHAUSGYRMY-UHFFFAOYSA-N 258.325 2.045 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)OC[C@@H]2CCCO2)c1 805011557 LKCZQRNOELPTCT-PWSUYJOCSA-N 295.335 2.367 10 20 CECD Cc1cccc(CN[C@H](C2CC2)[C@]2(CO)CCCO2)c1O 816667176 FQOONMXMEVGLQZ-IAGOWNOFSA-N 291.391 2.110 10 20 CECD C[C@]1(CN[C@@H]2CCc3cccc(O)c32)CCCNC1 817966443 NZWKBZQDYSCCAP-CJNGLKHVSA-N 260.381 2.359 10 20 CECD C[C@@H](O)C1(NCc2cc(Cl)c(F)cc2O)CC1 827586544 YOKLOLBILSDGHY-SSDOTTSWSA-N 259.708 2.188 10 20 CECD CC[C@H](CN1CCOCC1)N[C@@H](C)c1ccc(F)cc1O 903343189 NJWUUJFMYNFWLJ-GXTWGEPZSA-N 296.386 2.293 10 20 CECD CC[C@@H](NCCN1CCCOCC1)c1ccc(C)cc1O 903226531 GZGBOTCGRCJFLL-MRXNPFEDSA-N 292.423 2.464 10 20 CECD COc1ccc(N(C)C[C@@H](N)CC(F)F)cc1OC 903906177 UAOCDNNOJREXGT-VIFPVBQESA-N 274.311 2.123 10 20 CECD C[C@H](NCc1nnnn1C1CC1)c1ccc(Cl)cc1O 841747463 BJKUGJVATHHXQV-QMMMGPOBSA-N 293.758 2.218 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)c1cc[nH]n1 742475412 LZKCUXKDERBYJW-UHFFFAOYSA-N 284.363 2.330 10 20 CECD C[C@@H]1CC2(CCOCC2)CN1C(=O)c1cc(O)cs1 844152943 CUBAGMWLHAUPTK-SNVBAGLBSA-N 281.377 2.485 10 20 CECD CCOc1ccc(O)c(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)c1 843060220 YEJMOBGIXJVJQV-MAZHCROVSA-N 290.407 2.350 10 20 CECD Cc1ccncc1CN(C)c1ccc(OCC(=O)O)cc1 846279394 BUCPBRXPVOZSKC-UHFFFAOYSA-N 286.331 2.490 10 20 CECD C[C@@H]1NCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)[C@H]1C 843058863 ZZKWRYHBZLSGAB-IUCAKERBSA-N 299.758 2.136 10 20 CECD COc1ccc(N2CCC(NC3CCOCC3)CC2)cc1 742369733 PMPPIGZPXQWKPD-UHFFFAOYSA-N 290.407 2.433 10 20 CECD C[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)CC1 841114885 JAXQYUYMQHICEA-YPMHNXCESA-N 289.379 2.292 10 20 CECD C[C@H](N[C@@H](C)c1ccc(Cl)cc1O)C(=O)NCCF 841752258 NWCHLJFMBKOEHT-IUCAKERBSA-N 288.750 2.170 10 20 CECD C[C@@H](N[C@H]1CCN(C)C1)c1ccc(Cl)cc1O 841748063 VVWNKYXBQHQWIP-KOLCDFICSA-N 254.761 2.400 10 20 CECD CC[C@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccccc1O 825284628 TWCRNMDJPDCGRK-LOWVWBTDSA-N 262.353 2.087 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2CCN(C3CC3)C2)cc1F 858128029 YOZUATWSLNFPJS-GFCCVEGCSA-N 295.377 2.357 10 20 CECD COc1ncccc1C(=O)NCc1cc(Cl)ccc1O 857547730 RGNKYYZEUXLBOY-UHFFFAOYSA-N 292.722 2.379 10 20 CECD OCc1cc(NCc2ccc(N3CCOCC3)cc2)ccn1 858361667 YELWIZRMOTXMIM-UHFFFAOYSA-N 299.374 2.023 10 20 CECD CCON(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 753650927 JCJNIBKSDWBDAH-NSHDSACASA-N 265.357 2.407 10 20 CECD CN(CCNCc1cc(Cl)c(F)cc1O)CC(F)F 862550196 JUBCWWCFRHVZGN-UHFFFAOYSA-N 296.720 2.471 10 20 CECD CCOC(=O)[C@@H]1CSCCN1Cc1cc(C)ccc1O 768230040 PYZPBQQEVYJDLC-ZDUSSCGKSA-N 295.404 2.181 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1coc(C=O)c1 935947289 VRLMMDLPDIAMFC-UHFFFAOYSA-N 294.303 2.213 10 20 CECD Cc1cc(S(=O)(=O)N[C@H](C)c2ccccc2O)sn1 867834480 JGHWLFATAJVQIL-SECBINFHSA-N 298.389 2.197 10 20 CECD Cc1ccc(O)c(CNc2c3c(nc4ncnn24)CCC3)c1 865968741 VRTUEFHDYVOIMP-UHFFFAOYSA-N 295.346 2.239 10 20 CECD CO[C@H](CC(=O)NCc1cc(C)ccc1O)C(F)(F)F 862754740 ISUWWVQUUNTJIW-LLVKDONJSA-N 291.269 2.284 10 20 CECD COc1cc(CN2CCC[C@@H]2C[C@H](C)O)c(O)cc1C 768461487 DFKIPLPUGCKTSH-GXTWGEPZSA-N 279.380 2.445 10 20 CECD Cc1ccc(CN2CC[C@@H](C(=O)N3CCCC3)C2)c(O)c1 877529382 AZFMKFAITSWOBW-OAHLLOKOSA-N 288.391 2.145 10 20 CECD CCC[C@H]1NC(=O)N(Cc2ccc(N(C)C)cc2C)C1=O 777655233 HDZLZMAOXIPIAX-CQSZACIVSA-N 289.379 2.282 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)C(F)(F)F 773764276 ZRHHNSYHCQUPJC-JGVFFNPUSA-N 291.269 2.343 10 20 CECD CC(=O)NC1CCC(NCc2cc(F)cc(F)c2O)CC1 882955853 ULJPTSDJUSDCID-UHFFFAOYSA-N 298.333 2.207 10 20 CECD COc1ccc(O)c(CNc2cc(C)nc3nc(C)nn23)c1 881984294 KONTYPGJOKPFOQ-UHFFFAOYSA-N 299.334 2.067 10 20 CECD COCC1(C(=O)NCc2cccc(O)c2O)CCCCC1 1123890240 VZLFAEUMXTUMID-UHFFFAOYSA-N 293.363 2.311 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@H]1CC[C@H](O)C1 789585475 AAGDIFNNMWAVQK-KCJUWKMLSA-N 273.735 2.435 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCC[C@@H](N)C1)c1ccccc1O 892090616 WZAODFGDGQJJJL-IJLUTSLNSA-N 277.368 2.022 10 20 CECD COCC[C@@H](C)CNCc1cc(F)cc(F)c1O 883145441 AQMNPSWIIAJCEE-SECBINFHSA-N 259.296 2.433 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@H]1CCCOC1 781028986 NGWTXRDSTBAPGF-FXOGGVSJSA-N 291.347 2.042 10 20 CECD COc1cc(C)cc(CN2CC(C(F)F)C2)c1O 894977818 XKIGJQXYKJKSCX-UHFFFAOYSA-N 257.280 2.406 10 20 CECD COc1ccc(CN2CC[C@H](O)C(C)(C)C2)c(O)c1OC 893884132 AQZQVPPYJCJIRU-ZDUSSCGKSA-N 295.379 2.002 10 20 CECD CO[C@H](C)[C@H](C)NCc1ccc(N2CCOCC2)cc1 189114544 UMJTUVBNOWDGMA-UONOGXRCSA-N 278.396 2.036 10 20 CECD C[C@@H](C(=O)Nc1c(Cl)ccc2nonc12)n1cccn1 1329519961 SMGXFRSXECSAGA-ZETCQYMHSA-N 291.698 2.272 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCCCCN 1325682297 WILWCCKSJIJDNK-UHFFFAOYSA-N 279.384 2.053 10 20 CECD CNC[C@H](C)CNCc1cc(Cl)cc(F)c1O 1348516129 SQXLXLBQYRPFGL-QMMMGPOBSA-N 260.740 2.130 10 20 CECD C=C=CCNC(=O)NCc1ccc2c(c1)CCCN2C 1520781073 RIZMHHQMFQXURY-UHFFFAOYSA-N 271.364 2.209 10 20 CECD CCN(C)c1ccc(CN2C[C@H]3CC[C@H]2CN3)cc1 1577658143 XPDSCNVYYCVLSW-ZBFHGGJFSA-N 259.397 2.079 10 20 CECD Cc1cc(N(C)C)ccc1CN(C1CC1)[C@@H](C)C(=O)O 1594311622 MZEJEIGQMDPXQR-LBPRGKRZSA-N 276.380 2.499 10 20 CECD O=C(O)c1ccc(C(=O)N2Cc3cccc(O)c3C2)cc1 1595215434 GTJCZNSKZKOIHX-UHFFFAOYSA-N 283.283 2.246 10 20 CECD CCOCc1cc(CNC[C@@H](C)C(=O)O)ccc1OC 1776909151 SSEDMNPOAZALAX-LLVKDONJSA-N 281.352 2.042 10 20 CECD CC[C@@H](NCc1nncn1C)c1ccc(N(C)C)cc1 152320066 SIDXFULVALMZLL-CQSZACIVSA-N 273.384 2.122 10 20 CECD CC(C)(CNCc1ccc2c(c1)CCO2)CC(=O)O 258964929 WFQUTKOOVCIMKV-UHFFFAOYSA-N 263.337 2.212 10 20 CECD C[C@H]1CCCN(Cc2cc(F)ccc2O)[C@@H]1C(=O)O 818631661 MHQDYYGGBCFASS-ZANVPECISA-N 267.300 2.216 10 20 CECD CCOc1cccc(CN(C)C[C@H]2CCCN2C)c1O 211723362 QVAQCALGBVVIKK-CQSZACIVSA-N 278.396 2.317 10 20 CECD Cc1cc(CNCCC(N)=O)c(C)n1-c1ccccc1 36746789 VAIUUBQHADVDJP-UHFFFAOYSA-N 271.364 2.059 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(O)cc1O 182610946 XRPGROCRCHPONB-UHFFFAOYSA-N 273.288 2.076 10 20 CECD CCN(CC)c1ccc(CNCCS(=O)(=O)CC)cc1 69173282 CKPGWBRWHJREBQ-UHFFFAOYSA-N 298.452 2.057 10 20 CECD CN(C)c1ccc(CN[C@H](CO)C(C)(C)C)cc1 194634236 VORRVVWJCSPGEZ-CQSZACIVSA-N 250.386 2.249 10 20 CECD Nc1ccc(CC(=O)N2CCCC(F)(F)CC2)cc1 702853211 FPGGRTCYVDDICH-UHFFFAOYSA-N 268.307 2.459 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1C(F)(F)F 913020756 YJIBPRBVSGBNEM-VIFPVBQESA-N 275.226 2.265 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CC[C@@H]2C[C@@H]2C1 1352668902 FUFJVZMFZOSGTK-CKYFFXLPSA-N 261.321 2.150 10 20 CECD Cc1ccc(O)c([C@H](C)NCC(C)(C)N2CCOCC2)c1 35628756 AAZGADVOPWPRPZ-AWEZNQCLSA-N 292.423 2.462 10 20 CECD Cc1cccc(CN(C)[C@H](C)C(=O)OC(C)C)c1O 180557321 OZXSLWHGMXWIFZ-GFCCVEGCSA-N 265.353 2.473 10 20 CECD COc1ccc(O)c(CN2CC[C@H]3OCCC[C@H]3C2)c1 245854369 NDCJJSOAEMAPBU-BLLLJJGKSA-N 277.364 2.402 10 20 CECD Cc1ccc(NCCCNC(=O)Cc2ccc(N)cc2)nc1 262665374 JDUDIWBMAVOVED-UHFFFAOYSA-N 298.390 2.133 10 20 CECD C[C@H]1CCN(Cc2c(O)cccc2Cl)CC[S@]1=O 277766789 VVHSPLFDWUCVNX-XTZNXHDOSA-N 287.812 2.389 10 20 CECD COc1ccc(O)c(CNC(C)(C)c2noc(C)n2)c1 271867041 LUNMCBBPWIXZFT-UHFFFAOYSA-N 277.324 2.117 10 20 CECD COc1ccc2c(c1)CCCCN2CCN1CCCC1=O 378339412 NWBXPUYSXWRCBP-UHFFFAOYSA-N 288.391 2.460 10 20 CECD CN(C)c1ccc(CN2CC([C@H]3CCOC3)C2)cc1F 376137277 XCSXOSLEOOPRRH-ZDUSSCGKSA-N 278.371 2.360 10 20 CECD Cc1cc(CN2CC[S@](=O)C[C@@H](C)C2)ccc1N(C)C 294121119 NIBXQJUDRCDAGG-RBZFPXEDSA-N 294.464 2.261 10 20 CECD Cc1cc(Br)cc([C@@H](C)NCCN)c1O 817934486 JMZAEGHCSHSXCR-MRVPVSSYSA-N 273.174 2.072 10 20 CECD C[C@@H](NC(=O)[C@@](C)(O)C1CCC1)c1ccc(N(C)C)cc1 813525323 QDHYTBSWKVAOSY-PXAZEXFGSA-N 290.407 2.481 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)N(C)Cc2ccccc2O)C1 816889025 JPFOODOODBKNFJ-BXUZGUMPSA-N 299.374 2.440 10 20 CECD C[C@H](C[S@@](C)=O)NCc1ccc2ccccc2c1O 816568054 VDBVPBNUKLQHIZ-NSPYISDASA-N 277.389 2.402 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@@H](C)c1cc(F)ccc1O 903343183 NJCZFRCMHLGPMO-JSGCOSHPSA-N 296.386 2.293 10 20 CECD CCn1nc(C)c(CNCc2ccc(OC)c(C)c2)n1 823752805 NQIPEHAZKIWUBC-UHFFFAOYSA-N 274.368 2.213 10 20 CECD COc1cccc(CNC(=O)/C=C\c2ccc(O)cc2)c1O 588468870 HZHLYUZKFZSIIT-YFHOEESVSA-N 299.326 2.436 10 20 CECD CC(C)C[C@@]1(CO)CCCN1C(=O)c1cc(O)cs1 834310727 NAIRIDZFVHHXRC-CQSZACIVSA-N 283.393 2.467 10 20 CECD NCCc1ccc(CNCc2cc(F)ccc2O)cc1 841032053 IJNQQQMZYRCZHV-UHFFFAOYSA-N 274.339 2.322 10 20 CECD C[C@H](NC[C@@H](O)COCC1CC1)c1ccc(Cl)cc1O 841748810 ZDMXSNRGPDQYPX-GXFFZTMASA-N 299.798 2.484 10 20 CECD C[C@H]1CC[C@@H](CNC(=O)NCc2cc(Cl)ccc2O)O1 845253655 YALJDODCKLHCFI-CABZTGNLSA-N 298.770 2.412 10 20 CECD Cn1nccc1C(=O)NCc1ccc(N2CCCCC2)cc1 748843400 AWBBLTITLXMKMO-UHFFFAOYSA-N 298.390 2.340 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCNCC2(C)C)cc1F 841072354 IYQOCKWUPLEKEZ-OAHLLOKOSA-N 279.403 2.369 10 20 CECD C[C@H]1C[C@@H](NCCN2CCCC2=O)c2c(O)ccc(F)c21 846205109 FAVAIJPBWWLUNQ-CMPLNLGQSA-N 292.354 2.292 10 20 CECD CN1CCCc2cc(CNc3cnccn3)ccc21 746718398 DBOGMLLFLYFWPA-UHFFFAOYSA-N 254.337 2.471 10 20 CECD Cc1cc(CN2CC[C@H](N)[C@@H](C)C2)ccc1N(C)C 923291455 SQMIGAFBIGEWPD-ZFWWWQNUSA-N 261.413 2.230 10 20 CECD CCOc1cccc(CN[C@@H]2CCOC[C@@H]2OCC)c1O 759172221 DRASEBJLHSPZQV-HIFRSBDPSA-N 295.379 2.075 10 20 CECD C[C@@H]1C[C@H](N[C@H]2CCN(C)C2)c2c(O)ccc(F)c21 756534698 MXCDFYWCEONYFS-SCVCMEIPSA-N 264.344 2.373 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2C[C@]2(C)OC)c1 850571532 RXRXNFGYZYZDPE-RJIBLYRGSA-N 279.336 2.007 10 20 CECD C[C@@H](N[C@@H](CCO)C1CC1)c1cc([N+](=O)[O-])ccc1O 756740782 UHRQBLJSJVFNQQ-RNCFNFMXSA-N 280.324 2.112 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1ccc(O)nc1 865466305 SSTJZKMXNAUKQB-UHFFFAOYSA-N 271.364 2.451 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1CCC(F)(F)C1 763704768 NWQMJDVFOHWTNF-JTQLQIEISA-N 270.279 2.379 10 20 CECD C[C@@]1(CNC(=O)c2cc(O)cs2)CCO[C@@H]1C1CC1 768737520 QTOHSJDQSMVROJ-OCCSQVGLSA-N 281.377 2.389 10 20 CECD CCCOc1ccc(CN[C@H](C)C(=O)N(C)OC)cc1C 873145201 IYJUVCLLPZJBJI-CYBMUJFWSA-N 294.395 2.282 10 20 CECD Cc1ccc(CN[C@@H](C)C(=O)NC(C)(C)C)c(O)c1 876974071 XKBKATYIDMPEFC-NSHDSACASA-N 264.369 2.093 10 20 CECD CN(Cc1cccn1C)C(=O)/C=C/c1ccc(O)c(O)c1 779486855 VQJNRGXPCHTJMV-SOFGYWHQSA-N 286.331 2.108 10 20 CECD CCC[C@@H](O)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776247705 VUBZRVDIDKYBES-IUODEOHRSA-N 293.411 2.274 10 20 CECD OC[C@H]1CCCN1Cc1cc(Cl)cc(F)c1O 775647862 FSFTXFSHWRUHJP-SNVBAGLBSA-N 259.708 2.141 10 20 CECD CC[C@@H](N)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881377199 IGQOQGUDNXKJSV-CYBMUJFWSA-N 273.384 2.111 10 20 CECD CCc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1O 778925598 KYYUPCLTWHNJGT-UHFFFAOYSA-N 287.315 2.296 10 20 CECD CC(C)[C@@H](NC(=O)Cc1ccc(N)cc1)c1cnn(C)c1 1122225921 FKHTTWYCSCDTDG-MRXNPFEDSA-N 286.379 2.058 10 20 CECD Cc1cc(Cn2cc([C@H](O)C3CC3)nn2)ccc1N(C)C 881377870 WKYYEHCTKWNBQV-MRXNPFEDSA-N 286.379 2.144 10 20 CECD CN(Cc1ncc[nH]1)Cc1cc(Cl)cc([N+](=O)[O-])c1O 894583457 ANVPSCJQMNPEII-UHFFFAOYSA-N 296.714 2.309 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H](O)CC2)c1O 894866286 NCBRWTWGDMRSHC-CYBMUJFWSA-N 265.353 2.056 10 20 CECD C[C@]1(O)CCN(Cc2c(O)ccc(Cl)c2F)C1 792171183 ZCCCZDYLRPORFD-LBPRGKRZSA-N 259.708 2.141 10 20 CECD OCC1(CNCc2c(O)ccc(Cl)c2F)CC1 790974394 TXXVEZHGEAXWNH-UHFFFAOYSA-N 259.708 2.047 10 20 CECD CN1CCC[C@@H](CNCc2cc(Cl)ccc2O)C1 44534557 PMEPOXUALPKRMS-NSHDSACASA-N 268.788 2.477 10 20 CECD COc1cccc(O)c1CN1C[C@@H]2CCC[C@]2(C(=O)O)C1 1607326665 QTYCTRLNSBCLLJ-ZBEGNZNMSA-N 291.347 2.088 10 20 CECD CC(C)(C)C(=O)OCSc1ncc(C(=O)O)s1 1609653888 ZCASMDWZTRBRRD-UHFFFAOYSA-N 275.351 2.480 10 20 CECD CCN(C)c1ccc(CN2C[C@@H]3CC[C@@H]3[C@@H]2C(=O)O)cc1 1776856101 OGLPBLGBTBJYQP-CWRNSKLLSA-N 288.391 2.438 10 20 CECD CCOc1ccc(N(C)CC(=O)NCC(C)C)cc1 150732522 AXDBKJSOGSPWHL-UHFFFAOYSA-N 264.369 2.294 10 20 CECD C[C@@H]1CCC[C@@H](OCC(=O)NCc2ccc(O)c(O)c2)C1 159026566 ZVQCJUBZEQXJKV-DGCLKSJQSA-N 293.363 2.309 10 20 CECD CCc1cccc(CNCCNC(=O)C(C)(C)C)c1O 848896310 YKHJDNSHVFXCKH-UHFFFAOYSA-N 278.396 2.207 10 20 CECD CCN(CC)C(=O)CN[C@@H](C)c1ccc(C)cc1O 228792777 QIAVARXIVRJORH-LBPRGKRZSA-N 264.369 2.220 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@H]2NCC[C@@H]2C1 311210131 KZKNJEBSCHJXAB-ZWNOBZJWSA-N 266.772 2.229 10 20 CECD CCc1cccc(CNC2CCN(C(C)=O)CC2)c1O 691459614 LBQLNYUIFUGIGS-UHFFFAOYSA-N 276.380 2.055 10 20 CECD Cc1cccc(CN[C@@H](CO)CC(F)(F)F)c1O 717817858 LTWSYKJNTJZHMD-SNVBAGLBSA-N 263.259 2.104 10 20 CECD Oc1ccc(F)cc1CNCc1ccc(F)cn1 779093511 FGSCMGLALHSCTA-UHFFFAOYSA-N 250.248 2.355 10 20 CECD COc1ccc(O)c(CN(C)C[C@@H]2CCCC[C@@H]2O)c1 305845608 SMFKHSYVTNXCFY-WFASDCNBSA-N 279.380 2.384 10 20 CECD Cc1ccc([C@H](C)NCC2(N(C)C)CCOCC2)c(O)c1 185450034 ZSGJQMWLYODEHG-AWEZNQCLSA-N 292.423 2.462 10 20 CECD CO[C@H](CNC(=O)NCc1ccccc1O)C(C)(C)C 73939600 OHBPSVPYWBKDNI-CYBMUJFWSA-N 280.368 2.253 10 20 CECD Cc1cccc(CN[C@H](C)C(=O)NCc2ccco2)c1O 181198130 MQNITEOERYUOMR-GFCCVEGCSA-N 288.347 2.088 10 20 CECD Cc1ccc(C(=O)NCC2(C3CC3)CC2)c(O)c1O 182891456 QAOWFUBMUDENKM-UHFFFAOYSA-N 261.321 2.326 10 20 CECD COCCOC[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1 93753986 IVPVSAXHDPLEJV-MRXNPFEDSA-N 292.423 2.238 10 20 CECD Cc1c(CNC(=O)N2CC(F)C2)n(C)c2ccccc12 336407898 JGDNULYUZDZLRN-UHFFFAOYSA-N 275.327 2.350 10 20 CECD CN(Cc1cc(Cl)ccc1O)CC(C)(C)CN 93873178 FGEDMQOSOGYTJQ-UHFFFAOYSA-N 256.777 2.462 10 20 CECD COC(=O)[C@@H]1CC12CCN(Cc1ccccc1O)CC2 272241888 GRYJXGYEQCVLDP-ZDUSSCGKSA-N 275.348 2.167 10 20 CECD COC[C@H](CCO)N[C@H](C)c1cc2c(cc1O)CCCC2 273591202 PHWHMQNXXGPYBX-DOMZBBRYSA-N 293.407 2.319 10 20 CECD COC(=O)c1cnc(SCc2nnc(C)s2)s1 295268794 JKJCWUBFACJHTM-UHFFFAOYSA-N 287.391 2.382 10 20 CECD CN1CCCc2cc(CNC(=O)c3ccsn3)ccc21 294858121 ZZRMGFIIYFJBQT-UHFFFAOYSA-N 287.388 2.456 10 20 CECD CC[C@@H](N[C@H]1CCCN(CCCO)C1)c1ccccc1O 295193032 XNUKLRZVPXFQSU-GOEBONIOSA-N 292.423 2.280 10 20 CECD C[C@@H]1C[C@H](NC[C@@H]2CCCN2)c2c(O)ccc(F)c21 817953228 XQFBLEHEQPXQHG-SCVCMEIPSA-N 264.344 2.421 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@@H]1C[C@H]1C1CCC1 819630815 LWCUDPOLOQMMNC-XEBOPQQMSA-N 273.332 2.416 10 20 CECD OC1(CNCc2ccc(N3CCSCC3)cc2)CCC1 818964394 UVYGCMKQNRCAFS-UHFFFAOYSA-N 292.448 2.244 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@](C)(O)C2CCC2)c1 813489358 WWBVOKFCBCFMQX-MGPLVRAMSA-N 293.363 2.129 10 20 CECD COC[C@@H](O)CN1C[C@@H](C(C)C)Cc2cc(OC)ccc21 817298683 OOYIKSVTHCBKHX-GJZGRUSLSA-N 293.407 2.337 10 20 CECD CCOc1ccc(O)c(CN[C@@H](CC)[C@@H](C)O)c1 824921619 OGKPWJUAWNVUQG-MFKMUULPSA-N 253.342 2.040 10 20 CECD CCC[C@@H](OC)C(=O)N[C@@H](C)c1cc(OC)ccc1O 825736527 BKASWKVXGPAWQS-IINYFYTJSA-N 281.352 2.393 10 20 CECD CN1C[C@@H]2CCCN(Cc3ccc(N(C)C)cc3)[C@@H]2C1 822520508 DTYMSNUKNIPSDH-DOTOQJQBSA-N 273.424 2.279 10 20 CECD C[C@@H](NC(=O)[C@H](C)c1cnn(C)c1)c1ccccc1O 827937603 ZROIZCSHFWHGTO-GHMZBOCLSA-N 273.336 2.107 10 20 CECD O=C(O)[C@@H](Cc1ccccc1)NCc1cccc(F)c1O 821541645 WYQBIVOSXHXMMH-CQSZACIVSA-N 289.306 2.317 10 20 CECD C[C@@H](NC(=O)c1cc(O)nc(C2CC2)n1)c1ccccc1O 827946722 QJJUKZDWGBPDPW-SECBINFHSA-N 299.330 2.256 10 20 CECD OC[C@@H](NCc1ccccc1O)c1ccc(F)cc1 734851058 SUNXBFFLOZTBAW-CQSZACIVSA-N 261.296 2.355 10 20 CECD Cc1nn(C)c(C)c1[C@@H](C)C(=O)Nc1ccc(N)cc1 832244762 URBOQYUYTIOUNK-SECBINFHSA-N 272.352 2.361 10 20 CECD CN(CCc1ccncc1)C(=O)c1cc(O)cs1 732278045 COJCMNCNMSQREL-UHFFFAOYSA-N 262.334 2.163 10 20 CECD CC[C@H]1COC(C)(C)CN1C(=O)c1cc(O)cs1 846657930 IGSGMMMKXSSIHP-VIFPVBQESA-N 269.366 2.483 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@]3(C(=O)O)C2)cc1 846282771 DJUNMXXNKXNCOM-YOEHRIQHSA-N 288.391 2.439 10 20 CECD CC1(C)NCC[C@@H]1NCc1cccc(Cl)c1O 841086536 OLJXHZKOUAQBCQ-NSHDSACASA-N 254.761 2.276 10 20 CECD C[C@H]1C[C@@H](NCc2cccc(Cl)c2O)CCN1 841061179 FWGQDNUZVGBHAB-ONGXEEELSA-N 254.761 2.276 10 20 CECD CCn1ccc(CN[C@@H]2CCc3cccc(O)c32)n1 840840678 NKFPBYPAEZTXLT-CYBMUJFWSA-N 257.337 2.386 10 20 CECD CCOc1cccc(CNC[C@H]2CCCCN2)c1O 841033372 SESBBQDESRCZGS-CYBMUJFWSA-N 264.369 2.023 10 20 CECD COc1cc(Cl)cc(CNC[C@@H](N)C(C)C)c1O 841031002 QQUGATXJRQEIJM-LLVKDONJSA-N 272.776 2.127 10 20 CECD COc1cccc([C@H](C)NC[C@](C)(O)C(F)(F)F)c1O 846156551 FYDOUQYCNLUUFC-UFBFGSQYSA-N 293.285 2.365 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@H]1CCCNC1 841043021 MOOGNCAZIMAXHZ-QMMMGPOBSA-N 258.724 2.026 10 20 CECD O=C(CNCc1ccc2c(c1)CCCO2)NC1CCCC1 921726871 IGLVPHXSFBFDIZ-UHFFFAOYSA-N 288.391 2.160 10 20 CECD C[C@@H](N[C@@H](C(N)=O)c1ccccc1)c1cc(F)ccc1O 756382793 UJASNNUALBNBNP-MEBBXXQBSA-N 288.322 2.409 10 20 CECD CCN(CC)c1ccc(CNc2nccc(CO)n2)cc1 767182601 XERFXWVHAVZWLH-UHFFFAOYSA-N 286.379 2.427 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2(C(C)C)COC2)c1 934940543 OUDWAGRHVXUKGW-LLVKDONJSA-N 293.363 2.251 10 20 CECD CC(C)N(Cc1cc2c(cc1O)OC[C@@H]2O)CC(F)F 768462846 OEZXHDQJJMLNFG-LBPRGKRZSA-N 287.306 2.294 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2C[C@H]3C[C@H]3C2)c1O 862441348 QQUAXWLBNZBORO-OCAPTIKFSA-N 268.700 2.406 10 20 CECD CC1(C)CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCCO1 779517415 ANQIATWNNVVDSU-ALCCZGGFSA-N 291.347 2.139 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cccc(Cl)c1O 778926960 HXLJVVHKUDRCKQ-UHFFFAOYSA-N 293.706 2.387 10 20 CECD Cc1ccnc(CN2CCOc3cc(N(C)C)ccc32)n1 774753985 WFCPFZQYZWBYRP-UHFFFAOYSA-N 284.363 2.250 10 20 CECD C[C@@H](NCC1(C(N)=O)CCCC1)c1c(O)cccc1F 886528382 LFVPEPAQKXJBGK-SNVBAGLBSA-N 280.343 2.228 10 20 CECD CCn1cc([C@@H](C)NC(=O)NCc2ccc(N)cc2)cn1 1120625350 YAKSPWAQDBUKCY-LLVKDONJSA-N 287.367 2.046 10 20 CECD COc1cc(O)c(CN[C@H](C)[C@@H]2CCCOC2)cc1OC 780780327 QAZALPJYVWRUPD-VXGBXAGGSA-N 295.379 2.314 10 20 CECD Cc1cccc(CN2CCO[C@H](c3ccnn3C)C2)c1O 897558427 HYYVTOKJFDAUQY-HNNXBMFYSA-N 287.363 2.008 10 20 CECD COc1ccc(CNC(=O)c2sc(C)nc2C)c(O)c1 794388427 SYJOUOHYTWKLKA-UHFFFAOYSA-N 292.360 2.404 10 20 CECD CCN1C(=O)/C(=C\c2ccoc2C(=O)OC)SC1=S 796972569 RJLGTAAPPDOYEL-SOFGYWHQSA-N 297.357 2.287 10 20 CECD O=C(C[C@@H]1CCCO1)Nc1c(Cl)ccc2nonc12 1324859268 SRIGTTXGTLIOQL-ZETCQYMHSA-N 281.699 2.384 10 20 CECD C[C@H]1N(Cc2cc3c(cc2O)OCO3)CCOC1(C)C 687954739 SMOGYNFKMAYUSU-SNVBAGLBSA-N 279.336 2.120 10 20 CECD C[C@H](O)CCNCc1cc(Br)cc(F)c1O 715743340 AECGHFXLKCCYBC-ZETCQYMHSA-N 292.148 2.154 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CO)CC2CC2)c1 756768670 FXXLYPGOPZJIIW-PWSUYJOCSA-N 265.353 2.212 10 20 CECD CC(C)C[C@@H]1COCCN1C(=O)NCc1ccc(N)cc1 1262603775 UTAYYJIVMWLWRG-OAHLLOKOSA-N 291.395 2.225 10 20 CECD CSC[C@H]1CCCN1C(=O)NCc1ccc(N)cc1 1262603913 ZBQOJKCCRFKLBN-CYBMUJFWSA-N 279.409 2.306 10 20 CECD CCc1nc([C@H](C)Sc2ncc(C(=O)O)s2)n[nH]1 1605842272 FJMSSSMOTRPZIG-YFKPBYRVSA-N 284.366 2.375 10 20 CECD Cc1[nH]nc(C(C)C)c1C(=O)NCc1cccc(O)c1O 1548791621 NZXQNNBWCGXWBC-UHFFFAOYSA-N 289.335 2.183 10 20 CECD CCOc1ccc(CN[C@@H](CC2CC2)C(=O)O)c(O)c1 1610041839 FPDAASRVCAUGQN-ZDUSSCGKSA-N 279.336 2.134 10 20 CECD NC[C@@]12CC[C@@H]1CCN2Cc1cc(Cl)c(F)cc1O 1580253723 QZMJHHVLEXUTIH-YGRLFVJLSA-N 284.762 2.498 10 20 CECD COc1ccccc1C(=O)NCc1ccc(O)c(O)c1 158896085 MQUJDUHNJAXBAN-UHFFFAOYSA-N 273.288 2.036 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCN1C 817290024 AMUVBYXEPRUDPM-INIZCTEOSA-N 261.413 2.279 10 20 CECD CC[C@]1(C(=O)O)CCCN(Cc2ccc(N)cc2)C1 1120268481 FYEDFTAHSLRDBH-HNNXBMFYSA-N 262.353 2.346 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H](C(=O)O)C1 846279446 AFEAYCMOYVVALN-DOMZBBRYSA-N 276.380 2.438 10 20 CECD Cc1nc(CCNCc2cc3c(cc2O)OCO3)cs1 227436688 HUWZKKRGISWEMN-UHFFFAOYSA-N 292.360 2.218 10 20 CECD COc1cc(Cl)cc(CN(C)CCCN(C)C)c1O 229120909 DEGDCSSOAUKCNL-UHFFFAOYSA-N 286.803 2.438 10 20 CECD CN(CCNC(=O)Nc1ccc(N)cc1)C1CCCC1 71379513 QPTWGCKYTPGIMV-UHFFFAOYSA-N 276.384 2.265 10 20 CECD COc1cc(Br)cc(CNCCF)c1O 309072571 GCUAGLGULAHVIU-UHFFFAOYSA-N 278.121 2.222 10 20 CECD C[C@H](C(=O)O)N(Cc1ccc(N(C)C)cc1)C1CC1 738646264 QEBOPXQTTFERIR-LLVKDONJSA-N 262.353 2.190 10 20 CECD CCCCO[C@H](C)C(=O)NCc1cccc(OC)c1O 105649357 PRAWRAMCGSSMQO-LLVKDONJSA-N 281.352 2.222 10 20 CECD CS[C@@H](C)CNC(=O)NCc1ccc(N(C)C)cc1 119381632 TVWKRUUIULJOPL-NSHDSACASA-N 281.425 2.303 10 20 CECD CC(C)N(C)CC(=O)NCc1ccc2c(c1)CCCN2C 57559446 RXSNJTZYUPNMKG-UHFFFAOYSA-N 289.423 2.025 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)[C@H](C)CO)cc1 179319596 QKNXZOAQBRNBIF-CYBMUJFWSA-N 293.411 2.055 10 20 CECD O=C1NC(=S)S/C1=C/c1ccc(N2CCCC2)nc1 176949850 VUWQRQZDIGYKRL-JXMROGBWSA-N 291.401 2.171 10 20 CECD CC[C@@H](NCCC(=O)N(C)C)c1ccc(N(C)C)cc1 178294333 RJPIGPGUKYIEIR-OAHLLOKOSA-N 277.412 2.272 10 20 CECD C[C@@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(N(C)C)cc1 90181695 COCMTYZNVRRTET-TZMCWYRMSA-N 287.407 2.167 10 20 CECD OCCN(Cc1cccnc1)Cc1cc(Cl)ccc1O 93085960 ZNOFGWIFTUWVBA-UHFFFAOYSA-N 292.766 2.435 10 20 CECD CCN(Cc1cc(C)c(C)cc1O)[C@@H](C)CS(C)(=O)=O 93390536 LYUURJKGNHVPBT-ZDUSSCGKSA-N 299.436 2.264 10 20 CECD CC[C@@H](O)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273605141 TVZJGPJOKHCYJX-MWLCHTKSSA-N 268.313 2.112 10 20 CECD C[C@H](N[C@@H]1CCO[C@]2(CCOC2)C1)c1ccccc1O 368602874 LIRYWQHBBSHGFY-WOSRLPQWSA-N 277.364 2.381 10 20 CECD COc1cccc(CN2C[C@@H]3C[C@H]4C[C@H]3[C@@H]2[C@@H]4OC)c1O 289623719 LRCUXTOILSZUGZ-MQZQPLMUSA-N 289.375 2.256 10 20 CECD CC(C)[C@H](O)C(C)(C)CNC(=O)c1c(F)ccc(O)c1O 296613369 UHCNBIMQILZEMP-ZDUSSCGKSA-N 299.342 2.010 10 20 CECD C[C@@H](N[C@@H]1COC[C@H]1O)c1cc(Cl)c(Cl)cc1O 296048840 UYTKFSKIBQWVCK-KXHDPYLZSA-N 292.162 2.109 10 20 CECD Cc1cc(Cl)cc([C@H](C)NC[C@@H]2COCCO2)c1O 808677836 FJSGHTMVBSNPPA-CMPLNLGQSA-N 285.771 2.420 10 20 CECD C[C@H]1C[C@@H](O)CN1Cc1cc(Cl)c(F)cc1O 816589428 XZTQOGJHLMCUMH-IONNQARKSA-N 259.708 2.140 10 20 CECD Cn1cc(/C=C2/C(=O)N3CCCc4cccc2c43)cn1 817345253 FOJUPZNLLZFXGZ-RIYZIHGNSA-N 265.316 2.254 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CC[C@H](CN)C2)c1 817982510 UFPCKBOHJSHZEM-SRVKXCTJSA-N 264.369 2.179 10 20 CECD C[C@@H](NCC[C@H]1CCNC1)c1ccc(F)cc1O 817955003 OFRHNLUFYNEXMY-GHMZBOCLSA-N 252.333 2.182 10 20 CECD COC(=O)C1(NC(=O)c2cc(O)cs2)CCCCC1 822919918 PXFJOSFEONYCKK-UHFFFAOYSA-N 283.349 2.059 10 20 CECD CCCCN(Cc1ccccc1O)C[C@@H](C)S(C)(=O)=O 829516038 NWQXABANFLXEIE-CYBMUJFWSA-N 299.436 2.427 10 20 CECD CC[C@@H]1NCC[C@@H]1C(=O)NCCCSc1nccs1 829528620 UFACECIGFJDNMQ-QWRGUYRKSA-N 299.465 2.130 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C)[C@@](C)(CO)C2)cc1C 827700048 OTFCIXXGQNNCSZ-CZUORRHYSA-N 263.381 2.459 10 20 CECD Cc1nc([C@H]2CCN(Cc3ccc(N(C)C)c(C)c3)C2)n[nH]1 839661336 MUSZAKZTLPFNSA-HNNXBMFYSA-N 299.422 2.477 10 20 CECD Cc1c(NC(=O)Cc2ccc(N)cc2)n[nH]c1C1CC1 831876116 KQCMRMLOZAOSDZ-UHFFFAOYSA-N 270.336 2.359 10 20 CECD CC[C@H](C)NC(=S)N(C)Cc1ccccc1O 749768396 XNIDSWBUGRTNQS-JTQLQIEISA-N 252.383 2.497 10 20 CECD COc1cc(Cl)cc(CN(C[C@H](C)O)C2CC2)c1O 848929458 XAZQGQVMFGMLGV-VIFPVBQESA-N 285.771 2.399 10 20 CECD COC/C=C\C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840556051 USFMYJRAABGNHL-LMVHVUTASA-N 290.407 2.311 10 20 CECD CCN(C(=O)/C=C\c1ccc(C)nc1)c1cnn(C)c1 848343434 FMPPPQNRGMJMDT-FPLPWBNLSA-N 270.336 2.190 10 20 CECD C[C@@H](NCc1cccc(F)c1O)[C@H]1CCCNC1 841032708 FNZLQYLFLNTKFS-MNOVXSKESA-N 252.333 2.009 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)c(OC)cc2O)[C@@H](C)CO1 844733765 XKZOQMQLTPQQKZ-WCQYABFASA-N 295.379 2.409 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](CN)C2)cc1 843048520 FDSFQFMWAZUSNG-HNNXBMFYSA-N 261.413 2.313 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC[C@H]1CCCC1=O 759598403 WSYCZVNZFFSWOK-HOSRBBHYSA-N 290.315 2.414 10 20 CECD CCC[C@@H](O)CC(=O)NCCCSc1nccs1 750316520 XFNMPQRMLDCAFS-SNVBAGLBSA-N 288.438 2.293 10 20 CECD Oc1ccc(Cl)c(F)c1CNCCO[C@H]1CCOC1 922940387 NFBHSTMXYPYEFO-VIFPVBQESA-N 289.734 2.080 10 20 CECD COc1ccc(O)c(CNC(=O)CC(C)(F)F)c1 760455335 PKHAOEVCKKIBAU-UHFFFAOYSA-N 259.252 2.062 10 20 CECD C[C@H](N[C@@H](CCO)C1CCOCC1)c1ccccc1O 763558445 PNICNWADXJXHPG-WFASDCNBSA-N 279.380 2.220 10 20 CECD Oc1ccccc1CN1CCCC[C@H]1C1OCCO1 770509518 BYTOOMNYNNCWNA-ZDUSSCGKSA-N 263.337 2.120 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2c(C)cccc2O)C1 876783087 ZNRNIKZDJSMMDP-HNNXBMFYSA-N 263.337 2.086 10 20 CECD c1csc(SCCCNCc2ccon2)n1 873054882 ZVOPEDOKOAXWCY-UHFFFAOYSA-N 255.368 2.403 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CC[C@@H](N)CC2)c1 870881692 GVGYFTAFSWVTDW-UTUOFQBUSA-N 292.379 2.096 10 20 CECD CC[C@@H]1C(=O)N(CC)CCN1Cc1cc(C)c(C)cc1O 779218861 VDMDCHKCTJQWEU-OAHLLOKOSA-N 290.407 2.452 10 20 CECD CC(=O)c1ccc(CC(=O)NCc2ccc(O)c(O)c2)cc1 778927294 OEQUJAHDWFFQEI-UHFFFAOYSA-N 299.326 2.159 10 20 CECD Cc1cc(S(=O)(=O)NCc2ccccc2O)c(C)o1 776306690 PXEWZSZAVNWTLZ-UHFFFAOYSA-N 281.333 2.081 10 20 CECD C[C@H](NCCCNc1ncccn1)c1c(O)cccc1F 886536559 KOKBDYHXGUXIQX-NSHDSACASA-N 290.342 2.474 10 20 CECD CCc1c(C)nc2ncnn2c1N(C)Cc1ccccc1O 893018164 FSZCIKRWSGMCPQ-UHFFFAOYSA-N 297.362 2.337 10 20 CECD COc1ccc(CNC(=O)C2CCC(OC)CC2)c(O)c1 794380708 HLLFLKISWZMACJ-UHFFFAOYSA-N 293.363 2.222 10 20 CECD COc1cccc(O)c1CN1CCC(CN(C)C)CC1 768303532 PZHWZBLHHYRMHH-UHFFFAOYSA-N 278.396 2.174 10 20 CECD CO[C@H](C(=O)N(C)Cc1ccccc1O)C(C)C 771409567 YNBYVKRVSRXBGE-ZDUSSCGKSA-N 251.326 2.022 10 20 CECD COCC[C@@H](C)N[C@H](C)c1cc(C(=O)O)ccc1O 1606852354 ITEPQQHMWBLBIH-NXEZZACHSA-N 267.325 2.166 10 20 CECD C[C@H](NC[C@]1(C)CCOC1)c1cc(C(=O)O)ccc1O 1609776537 HFWHEMJOBGFCHM-BONVTDFDSA-N 279.336 2.168 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H]2CCC[C@H]2C(=O)O)c1O 1589271153 PHBWGJPYFNWWMG-YPMHNXCESA-N 295.310 2.077 10 20 CECD CC1(C)C[C@H](NC(=O)Nc2ccc(N)cc2)CCO1 215383823 GEWXFKCCFCOACB-GFCCVEGCSA-N 263.341 2.348 10 20 CECD CCN1CCc2cc(CNc3ncc(C(=O)O)cn3)ccc21 1776877997 ILPQUQNTSBJJEP-UHFFFAOYSA-N 298.346 2.169 10 20 CECD COc1cccc(CNC(=O)c2ccc(C)cn2)c1O 151718750 GYXJCVJMNNKSMQ-UHFFFAOYSA-N 272.304 2.034 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@]3(CCOC3)C2)c1O 153729636 VJXNEIFKSOSLIL-MRXNPFEDSA-N 293.338 2.346 10 20 CECD CCCS(=O)(=O)CCN(C)c1ccc(OCC)cc1 157318720 GEQBTPILFVWZBY-UHFFFAOYSA-N 285.409 2.346 10 20 CECD CCC[C@](C)(O)CNCc1cccc(OCC)c1O 226249770 LZIWZSINSFGMOI-HNNXBMFYSA-N 267.369 2.432 10 20 CECD CC(C)C[C@@H](N)C(=O)N(C)Cc1ccc(N(C)C)cc1 37801164 JWAVHXARAPYOCF-OAHLLOKOSA-N 277.412 2.084 10 20 CECD CCCN(Cc1ccccc1O)Cc1nnc(C)n1C 170779117 GZMZDWQGAWCLQC-UHFFFAOYSA-N 274.368 2.241 10 20 CECD CCOC(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 49371338 AGBMHPRWZHELNE-NEPJUHHUSA-N 264.369 2.355 10 20 CECD CC[C@H](C)[C@@H](CNCc1cc2c(cc1O)OCO2)OC 294115514 DFXDIFZVMOOCEC-ZUZCIYMTSA-N 281.352 2.272 10 20 CECD COc1ccc(N(C)CC(=O)OC(C)(C)C)cc1 312947306 CZYNDPFHIBYHEP-UHFFFAOYSA-N 251.326 2.473 10 20 CECD C[C@H](NCCC1(CO)CC1)c1cc(F)ccc1O 395922075 DFBPQLQMDDFRGR-JTQLQIEISA-N 253.317 2.345 10 20 CECD Cc1ncc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)s1 186377887 DJZHHBBDNGOBCM-MRVPVSSYSA-N 292.360 2.224 10 20 CECD CN(C)c1ccc(CNC(=O)NCCCCCCO)cc1 180948115 FYVFTHWZTQYFJC-UHFFFAOYSA-N 293.411 2.105 10 20 CECD CC[C@@H](C)CC(=O)NCc1cccc(OC)c1O 189552817 XVVULHYWTWZJKD-SNVBAGLBSA-N 251.326 2.453 10 20 CECD COc1cccc(CNCc2cc3c(cc2O)OCO3)c1 42880173 GVVHLXZXSXQGHI-UHFFFAOYSA-N 287.315 2.419 10 20 CECD CNC[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 40591739 MYITXGBPYMUGSU-OAHLLOKOSA-N 261.413 2.184 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)CCCO)c1O 228676359 HJSZBRUPYQVGKN-VIFPVBQESA-N 273.760 2.305 10 20 CECD COC(=O)C1CCC(NCc2cccc(OC)c2O)CC1 264408799 OBQOHJKMXQDKEZ-UHFFFAOYSA-N 293.363 2.222 10 20 CECD CC1(C)[C@H](NC(=O)Cc2ccc(N)cc2)[C@H]2CCCO[C@H]21 369761840 WCQDGKPFYFDYPK-FVQBIDKESA-N 288.391 2.131 10 20 CECD Cc1ncc2c(n1)CC[C@H](NCc1ccc3c(c1)CCO3)C2 363917692 MYCJXVNOCDNWJX-INIZCTEOSA-N 295.386 2.367 10 20 CECD Cn1nncc1CNCc1cc(-c2ccccc2)ccc1O 808437029 WPRBQOIDFNTRNV-UHFFFAOYSA-N 294.358 2.478 10 20 CECD CCOc1ccc(O)c(CN2CCOCC(F)(F)C2)c1 290193983 OZDKGEIHJXGQSQ-UHFFFAOYSA-N 287.306 2.258 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCNC(=O)CC2)cc1 396704323 KBFDDQXHCRLDCT-OAHLLOKOSA-N 289.423 2.291 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@](C)(OC)C2CC2)c1 812497672 ANRHCCHUPLKBEW-HWPZZCPQSA-N 293.363 2.393 10 20 CECD Cc1cc(CN2CCC[C@H]2CCO)ccc1N(C)C 815095609 FDMROOMTJKHSFJ-HNNXBMFYSA-N 262.397 2.408 10 20 CECD CC1(C)C[C@H]1CNC(=O)c1c(F)ccc(O)c1O 825818743 GZDCWTCAHNQLOC-ZETCQYMHSA-N 253.273 2.013 10 20 CECD CCOc1ccc(CN[C@H]2CCC[C@H]2C(=O)OC)c(O)c1 824702525 NBTKPCDMEGVYBO-KGLIPLIRSA-N 293.363 2.222 10 20 CECD O=C(O)CCCCNCc1c(O)cccc1Cl 821521313 AZRKAAIATXIRSY-UHFFFAOYSA-N 257.717 2.390 10 20 CECD CN(C)C(=O)c1cccc(CNCCc2ccc(N)cc2)c1 904352818 CAEPYQOLQCIXSE-UHFFFAOYSA-N 297.402 2.303 10 20 CECD CCOc1ccc(N(CC)CCN2CCOCC2)cc1 732198907 BHXCNEVRFFEITB-UHFFFAOYSA-N 278.396 2.244 10 20 CECD O=C(NC1CCN(CC2CC2)CC1)c1cc(O)cs1 732274533 QKIUCTYACOEREB-UHFFFAOYSA-N 280.393 2.058 10 20 CECD O=C(NCC1CCSCC1)c1cc(O)cs1 733366136 MMHWFGXCQIPLOM-UHFFFAOYSA-N 257.380 2.327 10 20 CECD C[C@@H](Cn1cncn1)NCc1ccc(N2CCCC2)cc1 731451393 YIMQTXFKOXRXHU-AWEZNQCLSA-N 285.395 2.057 10 20 CECD CO[C@H]1C[C@H](NCc2cc3c(cc2O)OCO3)C12CCC2 839182686 PAXABGJZFBMALA-GJZGRUSLSA-N 291.347 2.168 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCC[C@@H]1CCOC1 838714948 CVGYDMKUWWSWEC-CYBMUJFWSA-N 292.379 2.350 10 20 CECD COc1cccc([C@H](C)NC[C@@H](CO)C(C)C)c1O 846169869 GNMFGKWGFYTXKV-RYUDHWBXSA-N 267.369 2.316 10 20 CECD CCOC[C@@H](NCc1ccc(N(CC)CC)cc1)C(=O)O 841817926 NJLSSXVHIDHMAZ-OAHLLOKOSA-N 294.395 2.112 10 20 CECD C[C@@H]1NCCN(Cc2c(O)ccc(Cl)c2F)[C@@H]1C 843057173 GHXKWJUPQYQTHZ-DTWKUNHWSA-N 272.751 2.367 10 20 CECD CC[C@@H](CN[C@@H](C)c1cccc(OC)c1O)OC 846172894 PIJJUATYLYNYLW-QWRGUYRKSA-N 253.342 2.476 10 20 CECD CCOC(=O)[C@H](C)NCc1ccc(N(C)C)cc1C 840941632 FNPLAEYVDJOBLS-LBPRGKRZSA-N 264.369 2.102 10 20 CECD CC(C)NC(=O)[C@@H](C)NCc1cc(Cl)c(F)cc1O 840974602 LTZZOUNMOROADN-MRVPVSSYSA-N 288.750 2.187 10 20 CECD C[C@H]1C[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CCN1 841060718 BLOIJMGDTSCYFY-KWQFWETISA-N 299.758 2.184 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CS[C@@H](C)C2)c1 840297141 FYURVIHUBMHNKV-ONGXEEELSA-N 296.392 2.094 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@](C)(O)C(C)C)c1 185433901 FUOUVSUCZGVEPM-IAQYHMDHSA-N 267.369 2.458 10 20 CECD COc1cc(O)c(CN2CCCC[C@H]2[C@H](C)N)cc1OC 843044717 GHEHQPMUJDQNGN-AAEUAGOBSA-N 294.395 2.111 10 20 CECD COc1cccc(CN2C[C@@H](N)Cc3ccccc32)c1O 841106262 IOPQJVDKYWGOHY-AWEZNQCLSA-N 284.359 2.291 10 20 CECD CCN(C)c1ccc(CN[C@@H](C)[C@@H](C)C(=O)O)cc1 846229385 TXLGZMUSFPDYMO-NEPJUHHUSA-N 264.369 2.342 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1cc(Cl)c(F)cc1O 840805076 LZQLAQRRDPIHGK-ZDUSSCGKSA-N 286.734 2.415 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCNCC2(C)C)c1 841073481 VCVLENMQHUAACL-OAHLLOKOSA-N 278.396 2.269 10 20 CECD O=C(CCc1ccncn1)NCc1cc(Cl)ccc1O 857548042 BCIAEAZKNGVOIQ-UHFFFAOYSA-N 291.738 2.085 10 20 CECD CN(C)CC(C)(C)NCc1cc(F)c(N(C)C)cc1F 858175754 UKZIVBHYDLTUGL-UHFFFAOYSA-N 285.382 2.461 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](C)[C@@H](CO)C2)c1O 856792237 LOTUOEOQUJTUAY-GXFFZTMASA-N 295.354 2.184 10 20 CECD Oc1ccc(F)cc1CNC[C@@H]1CCCN1CC(F)F 862469137 ZNHSVMVIXGIBKB-LBPRGKRZSA-N 288.313 2.350 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1cccc(Cl)c1O 761222470 JCJPYBZWUSGKCB-STQMWFEESA-N 285.771 2.329 10 20 CECD C[C@H](CC(N)=O)NCc1cc(-c2ccccc2)ccc1O 765791431 RIXGLCICHNIFLC-GFCCVEGCSA-N 284.359 2.413 10 20 CECD CCC[C@@H](CCO)NCc1ccc(N2CCOCC2)cc1 865662611 BVUMHDPQTMYGBF-INIZCTEOSA-N 292.423 2.164 10 20 CECD Cc1ccc(CN2CCN(C3CCC3)CC2)c(O)c1 876734078 OOTZFMNQCAZFRK-UHFFFAOYSA-N 260.381 2.371 10 20 CECD CCN(C)c1ccc(CN[C@]2(CCOC)CCOC2)cc1 773943153 LSHQTQDNCSLJOF-QGZVFWFLSA-N 292.423 2.428 10 20 CECD CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@@H](C)S1(=O)=O 877522085 MMCWFQRIZFFTRU-CHWSQXEVSA-N 297.420 2.098 10 20 CECD Cc1cccc(O)c1CN1CC[C@H](n2cccn2)C1 877543735 FXWJYBKSBLVQDB-ZDUSSCGKSA-N 257.337 2.344 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](CCO)C(F)(F)F 894849351 CHZZVXZGZLYOQW-ZDUSSCGKSA-N 290.329 2.464 10 20 CECD CCOc1cccc(CNCc2ccc(OC)cc2O)n1 793388149 NHYRSPNUPRQEAC-UHFFFAOYSA-N 288.347 2.484 10 20 CECD CCCOc1ccc(CN2CC[C@@H](N(C)C)C2)c(O)c1 134182877 CPMYTTYPZADFOK-CQSZACIVSA-N 278.396 2.317 10 20 CECD C[C@@H](N[C@H](C)c1ncnn1C)c1ccc(N(C)C)cc1 276592874 JKYVVSXEUHZQDE-VXGBXAGGSA-N 273.384 2.293 10 20 CECD CSCCCCCNC(=O)c1cccc(O)c1O 280492742 OYLOITPFLMPSBZ-UHFFFAOYSA-N 269.366 2.361 10 20 CECD CCOCCC(=O)Nc1c(Cl)ccc2nonc12 1320979102 YWDRHACUOWDPPJ-UHFFFAOYSA-N 269.688 2.241 10 20 CECD C[C@H]1CN(Cc2cc(F)ccc2O)[C@H](C)CN1C 775988550 YRJYZZSSQILFQT-WDEREUQCSA-N 252.333 2.056 10 20 CECD C[C@H]1C[C@H](C)CN(S(=O)(=O)Nc2ccc(O)cc2)C1 776743893 BFSYOGAPDDRUEU-QWRGUYRKSA-N 284.381 2.027 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H]1C[C@H]1F 1262801103 JDRXCWAYPNFPFD-NILFDRSVSA-N 278.371 2.466 10 20 CECD O=C(O)c1cnc(S[C@H]2CCCCC2=O)s1 1602537441 UPOQBLMMWXPPJB-ZETCQYMHSA-N 257.336 2.445 10 20 CECD CC(C)n1ccc(CNCc2ccc(C(=O)O)cc2O)n1 1776393776 KIEWWAMPPCJOJR-UHFFFAOYSA-N 289.335 2.158 10 20 CECD Cc1nc(C)c(CNCc2ccc(C(=O)O)cc2O)s1 1777492020 ULPFSYPFTSGQLN-UHFFFAOYSA-N 292.360 2.454 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCc1ccc(O)cc1 13515184 VSHUQLRHTJOKTA-YWEYNIOJSA-N 299.326 2.176 10 20 CECD biogenic,in-vitro CCN1CCN(c2ccc(CNC(C)C)cc2F)CC1 34824225 KDPOQSVYMRXAAY-UHFFFAOYSA-N 279.403 2.466 10 20 CECD CONC(=O)NCc1ccc(N2CCC(C)CC2)cc1 108444155 KHKHMHWURVLWSE-UHFFFAOYSA-N 277.368 2.284 10 20 CECD CCOc1ccc(C(=O)N(C)Cc2ccccc2O)cn1 53916525 ICCUYQCITTZHPZ-UHFFFAOYSA-N 286.331 2.458 10 20 CECD COC(=O)CCN(Cc1cc(OC)ccc1O)CC(C)C 179764302 PWQQAPBYFQHTFY-UHFFFAOYSA-N 295.379 2.422 10 20 CECD C[C@@H](NCCCCCO)c1ccc(N2CCOCC2)cc1 181256225 BJBLEVAMBKCGHG-OAHLLOKOSA-N 292.423 2.336 10 20 CECD CCOCCNC(=O)N(CC)Cc1ccc(N(C)C)cc1 45644242 BWDPZQQBCVOBAY-UHFFFAOYSA-N 293.411 2.321 10 20 CECD CN(C)c1ccc(CN2CC[C@@H]3CC[C@H](C2)N3C)cc1 93614634 DLDIAVJYYLSVCL-DLBZAZTESA-N 273.424 2.421 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@H](C)O[C@H](C)[C@@H]2C)c(O)c1 529228374 NHZKEKPGQARFRF-DDIVZENXSA-N 293.363 2.077 10 20 CECD CC(C)CS(=O)(=O)NCc1ccc2c(c1)CCCN2C 263687299 OBDXPYXPSQAZLP-UHFFFAOYSA-N 296.436 2.144 10 20 CECD CN1CCCc2cc(CNC(=O)c3ccn(C)c3)ccc21 268613731 MUHLKBGNNNVMSP-UHFFFAOYSA-N 283.375 2.338 10 20 CECD C[C@@H](NC[C@@H]1CCOC1)c1ccc(F)c(F)c1O 276916163 LRQWYRVTDLAYJQ-BDAKNGLRSA-N 257.280 2.358 10 20 CECD COc1ccc(O)c(CN[C@@H](C2CC2)C(C)(C)CO)c1 290986792 UQSJAAGHSHVJSR-HNNXBMFYSA-N 279.380 2.288 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCC(C)(C)CO)c1 296262361 DIXHCLAOSCAEFO-NSHDSACASA-N 295.379 2.238 10 20 CECD CC(C)COCCCNC(=O)NCc1ccccc1O 299478299 GEHXGZTWPJUKTP-UHFFFAOYSA-N 280.368 2.254 10 20 CECD C[C@H](NCCN1CCCOCC1)c1ccc(N(C)C)cc1 812835080 LFGMWDFZGVNZOX-HNNXBMFYSA-N 291.439 2.126 10 20 CECD CNCCN[C@H](C)c1ccc(Br)cc1O 817952160 OFJURJXXBYFYOQ-MRVPVSSYSA-N 273.174 2.025 10 20 CECD C[C@H](N[C@H]1CC[C@H](CN)C1)c1cc([N+](=O)[O-])ccc1O 817981676 MIJGVPSZPHRYOB-DCAQKATOSA-N 279.340 2.078 10 20 CECD COC(=O)[C@@H]1CCN(Cc2c(O)cccc2OC)C[C@@H]1C 827545070 SDQGNIMEJPXEQE-NWDGAFQWSA-N 293.363 2.032 10 20 CECD CCCC[C@H](COC)NC(=O)c1cc(O)cs1 736694870 IXFGBBDAGQSJSJ-SECBINFHSA-N 257.355 2.389 10 20 CECD CCOCc1cc(CN[C@H](C(=O)O)C2CC2)ccc1OC 901475947 ATUGWYAFNOYIEP-HNNXBMFYSA-N 293.363 2.185 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCC[C@H]2OC)c1 834886894 QCLVHKYNFRZWJL-PSOPSSQASA-N 293.363 2.397 10 20 CECD CCN(C)c1ccc(Cn2cccc([N+](=O)[O-])c2=O)cc1 747808125 CICKTFBENOWADU-UHFFFAOYSA-N 287.319 2.261 10 20 CECD CCCCNC(=O)[C@@H](C)N1CCCc2cc(CN)ccc21 843349894 LTRQHECFAXIOSQ-CYBMUJFWSA-N 289.423 2.203 10 20 CECD COc1cccc([C@H](C)NC[C@@H]2CCCN(C)C2)c1O 846147748 VIPDQCYIWSDLIL-STQMWFEESA-N 278.396 2.393 10 20 CECD NC[C@@H]1CC[C@H](NCc2cc(Cl)ccc2O)C1 841085214 XBATVYFPUSDYIF-SKDRFNHKSA-N 254.761 2.263 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2CCN(C(C)C)C2=O)c1O 846152879 VGNNQNRUNDFKQD-DGCLKSJQSA-N 292.379 2.061 10 20 CECD C[C@H]1COCC[C@H]1CNC(=O)Nc1ccc(N)cc1 841300648 YPJBWOKBOXEVML-QWRGUYRKSA-N 263.341 2.063 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCNCC2)cc1F 841058587 TYVVRHWYNYRDSA-CYBMUJFWSA-N 265.376 2.123 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCCC[C@H]2F)c1 840298826 WREBWIHANQPYPL-CHWSQXEVSA-N 296.342 2.481 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@H]2O)C1CC(C)(C)C1 840162950 BJRAWOYQSLBZKJ-CQSZACIVSA-N 277.364 2.438 10 20 CECD C[C@@H](N)C1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 843052531 NBZDGSDMIGPOKU-GFCCVEGCSA-N 279.403 2.451 10 20 CECD Cc1noc(CN(C)Cc2c(O)ccc3ccncc23)n1 848503951 WHSDIODSMXOVCL-UHFFFAOYSA-N 284.319 2.264 10 20 CECD CCc1cccc(CN2CCN(C(C)C)C(=O)C2)c1O 848902224 MENITLKDZUKRLS-UHFFFAOYSA-N 276.380 2.007 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)N1CCCc2cc(CN)ccc21 843350687 WQSNDNQNIVGUBS-CHWSQXEVSA-N 289.423 2.201 10 20 CECD Cc1cc(CN2C[C@H]3CCC[C@]3(N)C2)ccc1N(C)C 923398932 OSHCPQQPELHNPU-WBVHZDCISA-N 273.424 2.374 10 20 CECD O=C(OCC(F)(F)C(F)F)c1cccc(O)c1O 758560196 VPQZJEOHSWDHGE-UHFFFAOYSA-N 268.162 2.155 10 20 CECD O=C(O[C@H]1Cc2ccccc2C1=O)c1cccc(O)c1O 758548223 QGULFPGOOQEMMH-ZDUSSCGKSA-N 284.267 2.062 10 20 CECD O[C@@H](CNCc1ccc(N2CC=CC2)cc1)c1ccccn1 853100229 AEBOCZKVKTZLOJ-SFHVURJKSA-N 295.386 2.281 10 20 CECD c1cc(N2CCCC2)ccc1CNCCN1CCC1 697430229 PUJPDAPVPSTMRI-UHFFFAOYSA-N 259.397 2.082 10 20 CECD CCOC(=O)C[C@H](O)CSc1ncc(Cl)s1 863348016 NPZNJBAIQTZWFM-LURJTMIESA-N 281.786 2.203 10 20 CECD C[C@@H](NC(=O)NOCC(F)(F)F)c1ccccc1O 868416986 HSCYUIUKXHPBIR-SSDOTTSWSA-N 278.230 2.246 10 20 CECD CN(Cc1ccccc1O)C(=O)c1c2c(nn1C)CCCC2 767881163 HRTWIBZTFVTMIN-UHFFFAOYSA-N 299.374 2.277 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](OC)C(C)C)c1 771416034 CEQSXDHCUOUVOJ-IINYFYTJSA-N 281.352 2.249 10 20 CECD CCN(Cc1cnn(C)c1)Cc1c(C)cccc1O 876634746 AUCLUGMIDBOVLY-UHFFFAOYSA-N 259.353 2.456 10 20 CECD OC1CCN(c2ccc(CN[C@@H]3C=CCC3)cc2)CC1 877624841 TYHKOLRBSYRDRI-OAHLLOKOSA-N 272.392 2.456 10 20 CECD CC(C)(C)n1nnc(CCSc2nccs2)n1 1118474657 OBRRZCULUAAUKD-UHFFFAOYSA-N 269.399 2.219 10 20 CECD Cc1cc(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n[nH]1 773022625 HSQPOHFFILSJDV-LBPRGKRZSA-N 286.379 2.204 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@@H](C)c1c(O)cccc1F 886627151 UTAPDQWLLBVQIM-VHSXEESVSA-N 268.332 2.095 10 20 CECD CN(Cc1ccccn1)C(=O)/C=C\c1ccc(O)c(O)c1 779479088 JDHQAQUVLRDXKG-VURMDHGXSA-N 284.315 2.165 10 20 CECD COC[C@H](N[C@@H](C)c1c(O)cccc1F)[C@@H]1CCCO1 886602968 DNRBXESNBKAYJT-JKOKRWQUSA-N 283.343 2.376 10 20 CECD COc1cc(C)cc(CNC2(CO)CCCC2)c1O 894396061 IVCDEBOLJFADTB-UHFFFAOYSA-N 265.353 2.104 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@@H](C2OCCO2)C1 896384560 MYPKIUMTRWBQST-SNVBAGLBSA-N 283.755 2.240 10 20 CECD CC[C@](C)(CN)C(=O)NCCCSc1nccs1 1576947976 DRFLSCPLBOPPCN-GFCCVEGCSA-N 287.454 2.117 10 20 CECD COc1ccc(CNCc2ccc(N(C)C)cc2)cn1 20185958 JHRUCMVIVOGWRP-UHFFFAOYSA-N 271.364 2.446 10 20 CECD COc1ccc(N(C)CC(=O)NCc2ccco2)cc1 844353063 FLHNPXFSTKARLO-UHFFFAOYSA-N 274.320 2.041 10 20 CECD CCN(CC)c1ccc(CNCC2(CO)CC2)cc1 118906968 GRSIYRMKVQFRCD-UHFFFAOYSA-N 262.397 2.395 10 20 CECD C[C@@H]1NC[C@H](C)N(Cc2ccc(N(C)C)cc2)[C@H]1C 401219579 DZHWHHIREFVQCZ-IHRRRGAJSA-N 261.413 2.323 10 20 CECD Oc1ccc(Cl)cc1CNC[C@H](O)C1CCC1 316653300 WEDAOYCYECFGLP-ZDUSSCGKSA-N 255.745 2.296 10 20 CECD C[C@@H](NCCCCS(C)(=O)=O)c1ccc(F)cc1O 818348859 AFILIHZMVHMHBF-SNVBAGLBSA-N 289.372 2.007 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2CCO)c1O 50132855 LTYRZVRHTCEYEZ-AWEZNQCLSA-N 295.354 2.471 10 20 CECD O=C1CN(Cc2ccccc2)[C@@H](c2cc(F)ccc2O)N1 112368773 GXDLEEWGZALOMT-INIZCTEOSA-N 286.306 2.162 10 20 CECD COc1cccc(CN[C@H](CO)Cc2ccccc2)c1O 63218261 KLTPEWAMGLCSOO-HNNXBMFYSA-N 287.359 2.094 10 20 CECD COC(=O)COc1ccc(N(C)CC[C@@H]2CCCO2)cc1 189925601 QFZJLXJZXUFNCR-AWEZNQCLSA-N 293.363 2.244 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Cc2cc(C)on2)c1 172328037 HRJTYQWGFALRTE-SNVBAGLBSA-N 290.319 2.117 10 20 CECD COC(=O)CN(Cc1cc(F)cc(C(C)=O)c1O)C(C)C 175596729 UCLGODAVCJRFRI-UHFFFAOYSA-N 297.326 2.117 10 20 CECD CC[C@@]1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CCNC1 62894668 PQNLPUNIHHDIKH-QGZVFWFLSA-N 289.423 2.101 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H](C(=O)O)C2)c1O 229118057 FDRSPHAVGHFRCV-VIFPVBQESA-N 299.754 2.351 10 20 CECD CC(=O)N1CCC(CN[C@@H](C)c2cc(F)ccc2O)CC1 185377555 MHSSGGWKKNWKNK-NSHDSACASA-N 294.370 2.440 10 20 CECD CC(=O)N1CCC(N[C@@H](C)c2ccc(N(C)C)cc2)CC1 37317962 AQECYWBDUUVLBC-ZDUSSCGKSA-N 289.423 2.414 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1ccc2c(c1)CCN2C 182333993 PTEHGECPCYXADU-KRWDZBQOSA-N 287.407 2.300 10 20 CECD CN(Cc1nccs1)Cc1cc2c(cc1O)OCO2 74724242 POUNCIWHMPGLGH-UHFFFAOYSA-N 278.333 2.209 10 20 CECD C[C@@H](NCC1(N(C)C)CCOCC1)c1ccc(F)cc1O 185449765 USZSRYXOQXHWML-GFCCVEGCSA-N 296.386 2.293 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CC[C@@H]1CCNC1 134511610 MNXFEWYLPJOICQ-CQSZACIVSA-N 289.423 2.101 10 20 CECD C[C@@H](NCC(F)(F)CO)c1ccc(N(C)C)cc1 184691057 VESFMYXIBNZSGO-SNVBAGLBSA-N 258.312 2.031 10 20 CECD CCN1CCN(Cc2cc(F)ccc2O)[C@@H](C)C1 289186234 AOGHHHPUTGLORB-NSHDSACASA-N 252.333 2.057 10 20 CECD CN(Cc1cccc(Cl)c1O)CC1CC(O)C1 191160203 PQJHGKUBRBTAHW-UHFFFAOYSA-N 255.745 2.248 10 20 CECD Oc1c(Cl)cccc1CN1CCOC2(CCOCC2)C1 180699440 PYEWFWNPFRIYOA-UHFFFAOYSA-N 297.782 2.427 10 20 CECD COc1cccc(CN[C@@H]2C[C@]2(C)OC(C)C)c1O 527800917 QQCYYAYQKQDRSZ-HIFRSBDPSA-N 265.353 2.446 10 20 CECD COC[C@@](C)(O)CN[C@H](C)c1cc(Cl)cc(C)c1O 808695274 KHFCEKWXMUNOJD-YGRLFVJLSA-N 287.787 2.402 10 20 CECD COC[C@H](N[C@H]1CCc2cccc(O)c21)[C@@H]1CCCO1 296591191 WVTQBFHEPPNXDO-YDHLFZDLSA-N 277.364 2.163 10 20 CECD CCCOc1ccc(CN(CC)[C@@H](C)CO)c(O)c1 293715763 SUCWVVFRKDKOJU-LBPRGKRZSA-N 267.369 2.384 10 20 CECD CC[C@@H](N[C@H]1COC[C@@H]1OC)c1ccc(C)cc1O 290117168 JACBOJSUWBZUGS-IPYPFGDCSA-N 265.353 2.155 10 20 CECD CCCN1C[C@@H](CNCc2cccc(C)c2O)CC1=O 817410887 JJXNWKQJQWQODC-CYBMUJFWSA-N 276.380 2.049 10 20 CECD COc1ccc(CNC(=O)[C@]2(C)CC2(F)F)c(O)c1 817601411 ZHBAKRINDCGCHG-LBPRGKRZSA-N 271.263 2.062 10 20 CECD COCC1(NCc2cc(OC)ccc2O)CCCC1 826834249 OLZKNFXJHWDUSA-UHFFFAOYSA-N 265.353 2.450 10 20 CECD C[C@@H](NC(=O)c1ncn(C(C)(C)C)n1)c1ccccc1O 827946724 QNQCKUHBAWDKJJ-SNVBAGLBSA-N 288.351 2.230 10 20 CECD CN(CC(F)(F)F)C(=O)/C=C\c1ccc(O)c(O)c1 588406246 ZMOPYNXYTWJNEX-HYXAFXHYSA-N 275.226 2.132 10 20 CECD O=C(NCCSc1ncc(Cl)s1)C1CC1 901583586 VBMKYILLZHDFIU-UHFFFAOYSA-N 262.787 2.415 10 20 CECD CCC[C@@H](C)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832292279 DWYKYKAALPVDGL-DOMZBBRYSA-N 277.412 2.305 10 20 CECD C[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)c1cnccn1 905449365 TVOWDQAGGVNGCC-CYBMUJFWSA-N 298.390 2.305 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)CCC2(C)CC2)cc1 911667714 QYCKHFARLKBUBR-HNNXBMFYSA-N 289.423 2.449 10 20 CECD COc1cccc(CN[C@H](C)C2(OC)CCC2)c1O 840970131 PZCZGSSNEAUXNF-LLVKDONJSA-N 265.353 2.448 10 20 CECD CO[C@@](C)(C1CC1)[C@@H](C)NC(=O)NCc1ccccc1O 840276387 JNUMPOWESPUYHQ-BDJLRTHQSA-N 292.379 2.395 10 20 CECD CC(=O)N1CCN(Cc2ccc(N(C)C)cc2C)[C@@H](C)C1 840918599 WPBKPSXKEPMMQE-AWEZNQCLSA-N 289.423 2.114 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)[C@@H](C)CN1 843119872 JGECMKXRZFMLDL-UWVGGRQHSA-N 254.761 2.228 10 20 CECD C[C@H](N)[C@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843052446 UEPDNEDXDGHJQW-JSGCOSHPSA-N 279.403 2.451 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)Cc1cn(CC)nn1 929228339 LYFZGJHMXPAHKH-UHFFFAOYSA-N 287.411 2.386 10 20 CECD CC1(C)CCC[C@@H]1CNC(=O)C(=O)Nc1ccc(N)cc1 841135256 GWICITLDLFBZQP-LLVKDONJSA-N 289.379 2.150 10 20 CECD CCCN(Cc1ccccc1O)C[C@H](O)CN1CCCC1 743869827 BRROQKFUYWNFOL-MRXNPFEDSA-N 292.423 2.061 10 20 CECD CCCN(Cc1cc(F)ccc1O)C1CCNCC1 843044070 CDQHJALJPCEHQF-UHFFFAOYSA-N 266.360 2.495 10 20 CECD CSC1(CNC(=O)c2cc(O)cs2)CCOCC1 743701417 UDGQLLQQADFZMP-UHFFFAOYSA-N 287.406 2.096 10 20 CECD CON(C)CCN[C@H](C)c1c(C)cc(C)cc1O 850478676 WMLYFHSUNBHPCN-GFCCVEGCSA-N 252.358 2.153 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@H]2CCCNC2=O)cc1 840827275 GMTTUONEVDIXRV-ZFWWWQNUSA-N 289.423 2.320 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H](O)C(F)(F)F)cc1C 865712242 YKZVYGXPLAGWPT-JOYOIKCWSA-N 277.286 2.405 10 20 CECD CC[C@H](N[C@@H]1CCN(C(C)=O)C1)c1ccc(C)cc1O 857084526 UQAJKLREQJJUKF-HIFRSBDPSA-N 276.380 2.362 10 20 CECD FC(F)CN1CC[C@@H](NCc2ccc3c(c2)CCCO3)C1 922191386 FCCJRLWLSVWMID-CQSZACIVSA-N 296.361 2.441 10 20 CECD Cc1ccc(NCc2ccc(N3CCC(O)CC3)cc2)nn1 853955699 VJDZELIPTUNODZ-UHFFFAOYSA-N 298.390 2.358 10 20 CECD COC[C@@H](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 755084643 FSGVLKBTOSLTSJ-ZDUSSCGKSA-N 278.396 2.384 10 20 CECD CCN(CC)CCOCCNCc1ccc2c(c1)CCO2 757945874 JATRBBPNLSNQSB-UHFFFAOYSA-N 292.423 2.070 10 20 CECD CO[C@H]1C[C@H](N[C@@H](C)c2cc([N+](=O)[O-])ccc2O)C1 858584887 XKFQOZKSDJFOJA-QXEWZRGKSA-N 266.297 2.128 10 20 CECD C[C@@H](NC[C@]1(O)CCSC1)c1cc(F)cc(F)c1O 756639192 YUJFATKZMUCNSH-AMIZOPFISA-N 289.347 2.189 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C)[C@H](CO)C2)c1 857061142 KPPBDYZPACLYJW-OCCSQVGLSA-N 279.380 2.241 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H]2COC[C@@H]2C)c1O 932495593 DEZPXGNVJCWWKD-ISVAXAHUSA-N 283.755 2.373 10 20 CECD CO[C@@H](C)CCC(=O)NCc1cc(C)ccc1O 862757571 YUPKCJLSWJYOPA-NSHDSACASA-N 251.326 2.132 10 20 CECD CN(Cc1cc(Br)ccc1O)C1CC(O)C1 761223239 OCDIBWFXZIGOES-UHFFFAOYSA-N 286.169 2.110 10 20 CECD Cc1ccc(CNCCCc2nc(C)no2)c(O)c1 877023729 CFPYZINWAPBTPX-UHFFFAOYSA-N 261.325 2.114 10 20 CECD COc1ccc(CNCCSC)cc1Cn1cccn1 873007562 VBIPFLLUQMYZMK-UHFFFAOYSA-N 291.420 2.393 10 20 CECD C[C@H](OC(=O)c1cccc(O)c1O)c1nc(C2CC2)no1 776282469 RVAHMRQYURCHEV-ZETCQYMHSA-N 290.275 2.276 10 20 CECD COCCCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773615906 ZMDMIUVBDLEKAE-GFCCVEGCSA-N 279.384 2.149 10 20 CECD CCCN(CCO)Cc1cc(Cl)cc(F)c1O 775644008 ZNMBOBQVTRNDTC-UHFFFAOYSA-N 261.724 2.389 10 20 CECD CCOC(=O)[C@@H]1CSCCN1Cc1cc(F)ccc1O 778995580 ZIMALEMDPQGMSL-LBPRGKRZSA-N 299.367 2.012 10 20 CECD FC[C@@H]1CCN(Cc2ccc(N3CCOCC3)c(F)c2)C1 895575929 WEDRBWMNRKJBQZ-AWEZNQCLSA-N 296.361 2.454 10 20 CECD CN(C)c1ccc(CNCc2nc(C(F)F)no2)cc1 895729397 ORFUGNRHSHGXCT-UHFFFAOYSA-N 282.294 2.363 10 20 CECD COc1cc(C)cc(CNC[C@H](C)C[C@H](C)O)c1O 894291816 FLPJJUQKRJTDMK-NEPJUHHUSA-N 267.369 2.206 10 20 CECD Cc1[nH]ccc(=NC(=O)c2cccc(O)c2O)c1Cl 790927537 IXOCZGFVZGCHDI-UHFFFAOYSA-N 278.695 2.129 10 20 CECD OC[C@H]1C[C@H](NCc2cc(Cl)cc(F)c2O)C1 897358191 UIQJYGHVHBJYJZ-GVJMRKKJSA-N 259.708 2.045 10 20 CECD CC[C@@](C)(OC)C(=O)N[C@@H](C)c1cc(OC)ccc1O 795080919 NGMIPCZWNOBQFR-ZUZCIYMTSA-N 281.352 2.393 10 20 CECD COC(=O)C(C)(C)CCNCc1c(O)cccc1OC 796455837 ZQQLRJWTVOXNAO-UHFFFAOYSA-N 281.352 2.080 10 20 CECD CN(C(=O)c1ncoc1C1CC1)c1ccc(N)cc1 1342238452 DGSCFOMYSDPHHZ-UHFFFAOYSA-N 257.293 2.411 10 20 CECD COc1ccccc1CNC(=O)Cc1ccc(N)cc1 19399323 BBKIXZUMUYCIJL-UHFFFAOYSA-N 270.332 2.136 10 20 CECD CCc1cccc(CNCc2cc(C)nn2C)c1O 691439543 ZGQLAMUXUFRDAM-UHFFFAOYSA-N 259.353 2.286 10 20 CECD COC1(CN[C@H](C)c2ccc(F)cc2O)CCOCC1 186146871 MPMKVFIENROLLH-LLVKDONJSA-N 283.343 2.378 10 20 CECD C[C@H](CCCC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1320748951 QGYUOZSCWHSJIM-SECBINFHSA-N 282.296 2.033 10 20 CECD C[C@H](CCO)CNCc1c(O)cccc1Br 706872010 WMYBLMBBANSYED-SECBINFHSA-N 288.185 2.263 10 20 CECD C[C@H](CSCCNCc1ccc(N(C)C)cc1)C(=O)O 1326259849 LPQLFZAYLOQPBM-GFCCVEGCSA-N 296.436 2.296 10 20 CECD CN(Cc1ccccc1O)Cc1cccnc1N(C)C 1325600046 LTSKKZVRHBVVNJ-UHFFFAOYSA-N 271.364 2.485 10 20 CECD C[C@H]1CCCN1c1nnc(-c2sccc2O)n1C 1339452585 ARSLLMLHLRTACJ-QMMMGPOBSA-N 264.354 2.238 10 20 CECD COc1cccc(O)c1CN[C@H]1CCO[C@H](C)C1 769710560 NCEJNOWWMOYAQI-MNOVXSKESA-N 251.326 2.058 10 20 CECD O=C(NCc1cccc(Cl)c1O)[C@H]1CC[C@@H](C(=O)O)C1 1601541080 DRIYWYCNRHGCEQ-DTWKUNHWSA-N 297.738 2.163 10 20 CECD O=C(O)C1=CC[C@H](NCc2cc(Cl)c(F)cc2O)C1 1608586906 QYSGRXHVWAVBQX-VIFPVBQESA-N 285.702 2.448 10 20 CECD CCc1cccc(CNCC[C@@H]2CNC[C@H]2C)c1O 1578266825 TZTLMSDHJZJIOZ-TZMCWYRMSA-N 262.397 2.290 10 20 CECD CC(C)(CN)CC(=O)NCc1cccc(Cl)c1O 1575310881 QCJVCWAWFVREOT-UHFFFAOYSA-N 270.760 2.037 10 20 CECD CCN(CC)c1ccc(CNCCC[S@@](C)=O)cc1 116920070 LQGVBZMICGMZLH-IBGZPJMESA-N 282.453 2.391 10 20 CECD CCOc1cccc(CN2CC[C@@H](N)C[C@H]2C)c1O 252687390 LDKVJQVRXNNYJJ-DGCLKSJQSA-N 264.369 2.103 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)CC[S@@](C)=O)c1 168840162 RCYJNUVGLHCXJD-ADWYPQAOSA-N 285.409 2.209 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1C[C@H]1C1CCC1 845833616 NBSPFWOSRIYGJE-QWHCGFSZSA-N 275.348 2.193 10 20 CECD Cn1nnnc1-c1cccc(NCc2ccccc2O)c1 36973901 JACAHWTZWQADOS-UHFFFAOYSA-N 281.319 2.195 10 20 CECD COC[C@@H](O)CNCc1cc(C)n(-c2ccccc2)c1C 71263818 FTTNODWOTYFZCO-KRWDZBQOSA-N 288.391 2.191 10 20 CECD Cc1nc(CC(=O)NCc2ccc(O)c(O)c2)c(C)s1 182530999 KWINHMFCGHQGEV-UHFFFAOYSA-N 292.360 2.030 10 20 CECD C[C@H](NCCN1CCCC1)c1cc(F)ccc1O 94616869 MQFIOHKQKDSXEU-NSHDSACASA-N 252.333 2.278 10 20 CECD Cc1cc(O)c(CN(CCS(C)(=O)=O)C(C)C)cc1C 93707729 YMIAHWBLTAGBPO-UHFFFAOYSA-N 299.436 2.264 10 20 CECD CN(C)c1ccc(CN2CCO[C@@H]([C@@H]3CCCO3)C2)cc1 91925928 OSTWOFGMMULVDC-DLBZAZTESA-N 290.407 2.132 10 20 CECD C(=C\c1ccncn1)\c1ccc(N2CCOCC2)cc1 255331041 BRGWSQRPPDPNTK-RJRFIUFISA-N 267.332 2.484 10 20 CECD COc1cccc(CN[C@H]2CCc3nc(C)ncc3C2)c1O 360256281 YJOBPNREOFXUAW-AWEZNQCLSA-N 299.374 2.146 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)CC[S@](=O)C1 375950186 ZWZBSUYJWDCDMM-YPMLDQLKSA-N 287.812 2.246 10 20 CECD CNC(=O)CN(CCC(C)C)c1ccc(OC)cc1 280299491 FSICGHGNQXXJRU-UHFFFAOYSA-N 264.369 2.294 10 20 CECD O=C(O)C1(NCc2cc(Cl)cc(Cl)c2O)CC1 283783226 DPTLQQVMQAAIAS-UHFFFAOYSA-N 276.119 2.406 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NOCCCOC 288074679 RDLJAIXWKGYPFK-UHFFFAOYSA-N 296.367 2.282 10 20 CECD O=C(N[C@@H]1CCCC12CCOCC2)c1cccc(O)c1O 282466520 LAJJIUJZMZEBQK-CYBMUJFWSA-N 291.347 2.177 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)c1[nH]nnc1C 801549259 ICLNVZPCPOJBDF-UHFFFAOYSA-N 288.351 2.261 10 20 CECD CNCCN[C@H](C)c1ccc(N2CCOCC2)cc1Cl 817954386 YSZDRVYUPNUNBC-GFCCVEGCSA-N 297.830 2.047 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](CN)CC(C)C)c1 817959147 PTWPTJPZAROCHO-NWDGAFQWSA-N 266.385 2.425 10 20 CECD Cc1cc([C@H](C)NC[C@H](N)c2ccc(N(C)C)cc2)no1 817944318 ZCLSPZQGXWHMER-WFASDCNBSA-N 288.395 2.400 10 20 CECD Cc1cc(CNC2(C(N)=O)CC2)ccc1N1CCCCC1 828742343 DMONPQQCMRZNQP-UHFFFAOYSA-N 287.407 2.093 10 20 CECD COc1ccc(CNC[C@@H]2CCOC[C@@H]2OC)cc1C 824708360 FNBFCSKWEKKRQW-HOCLYGCPSA-N 279.380 2.145 10 20 CECD CCOC(=O)[C@H](C(=O)NCc1cc(C)ccc1O)C(C)C 824904547 QSUOISGMBRCHRW-AWEZNQCLSA-N 293.363 2.152 10 20 CECD CC[C@H](NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1)[C@@H](C)O 838560010 SDZYIBXIPSWZFM-ZOWXZIJZSA-N 293.411 2.272 10 20 CECD C[C@@H]1C[C@@H](NC[C@H]2CCN2C)c2c(O)ccc(F)c21 903317400 KGGHHEVWHDIFNG-CKYFFXLPSA-N 264.344 2.373 10 20 CECD O=C(c1cc(O)cs1)N1CCC(n2ccnc2)CC1 731872826 SALLKMMQUYDBKJ-UHFFFAOYSA-N 277.349 2.128 10 20 CECD O=C1Cc2cc(NC(=O)c3cc(O)cs3)ccc2N1 733807486 WXALYEZRNIDGBZ-UHFFFAOYSA-N 274.301 2.201 10 20 CECD CCn1cc([C@H](C)NC(=O)c2cc(O)cs2)cn1 839788360 BCHAVEHMOXVMEK-QMMMGPOBSA-N 265.338 2.161 10 20 CECD CCCCN(CCCO)C(=O)Nc1ccc(N)cc1 841295703 CYMQZTNWYBVFII-UHFFFAOYSA-N 265.357 2.285 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@@H]1CN 841101391 VSBSIARERROASK-OCCSQVGLSA-N 279.403 2.308 10 20 CECD COc1cccc([C@H](C)NCc2c[nH]nc2C)c1O 846154785 MZVSWLHJCXSQEP-JTQLQIEISA-N 261.325 2.283 10 20 CECD Nc1ccc(CCNC(=O)N2CCC3(CCC3)C2)cc1 841957502 CBLXVXPLTAXKKM-UHFFFAOYSA-N 273.380 2.397 10 20 CECD C[C@H](Cc1cnccn1)NCc1ccc(N(C)C)cc1 742724488 SBFIBSJNQBWZTO-CYBMUJFWSA-N 270.380 2.263 10 20 CECD CCc1cccc(CN2CCC3(CC2)COC(=O)N3)c1O 848902448 NXVRNEXZXATKMC-UHFFFAOYSA-N 290.363 2.029 10 20 CECD COc1cccc([C@@H](C)NCC[C@H](C)CCO)c1O 846169659 JLHFLOGIMWUNEF-NWDGAFQWSA-N 267.369 2.460 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C1(CN)CCC1 843125605 YONTUEMKGIGQKO-UHFFFAOYSA-N 261.413 2.374 10 20 CECD CC[C@@H](C)C[C@@H](C)NC(=O)C(=O)Nc1ccc(N)cc1 841049567 LHIYKLBIIZTRIN-GHMZBOCLSA-N 277.368 2.148 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 756732543 JCGCIAWPGMKELQ-UWVGGRQHSA-N 289.322 2.373 10 20 CECD C[C@@H]1SCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@@H]1C 768447251 NSLHLZGKBNIORS-ISTVAULSSA-N 295.404 2.144 10 20 CECD Cc1ccc(O)c(CNC(=O)CCc2ccc(O)nc2)c1 862756517 ZOPYHOFXGIFPGA-UHFFFAOYSA-N 286.331 2.050 10 20 CECD COc1ccc(N2CCN(Cc3ccns3)CC2)cc1 876527720 DGHJRPPJJLOZJS-UHFFFAOYSA-N 289.404 2.474 10 20 CECD O=C1CC(C(=O)NCc2ccc(N3CCCCC3)cc2)C1 778505300 XJLQEYAGURFSOO-UHFFFAOYSA-N 286.375 2.272 10 20 CECD CC(C)[C@H]1CCN1C(=O)/C=C\c1ccc(O)c(O)c1 779545301 RKHRNESKQAIIPM-TXNVCOODSA-N 261.321 2.368 10 20 CECD N[C@H]1CC=C(C(=O)N2CCCc3cc(F)ccc32)C1 876586449 FFTFRMVGJMLCGN-ZDUSSCGKSA-N 260.312 2.152 10 20 CECD C[C@@H](NCc1ccc(N2CCN(C)CC2)cc1)C1CC1 771823805 SSWKVGVFQNUSQO-CQSZACIVSA-N 273.424 2.327 10 20 CECD Cc1cc(O)c(C(C)C)cc1NS(=O)(=O)c1ncc[nH]1 882709270 WXXGFSMQQOSVNK-UHFFFAOYSA-N 295.364 2.348 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCCCO2)c1O 894204212 JQMHTTCAUYWGRN-ZDUSSCGKSA-N 265.353 2.368 10 20 CECD COc1ccc(CNC[C@H]2CCC[C@@H]2OC)c(O)c1OC 893285378 NATCHUWBJIPYSX-YPMHNXCESA-N 295.379 2.314 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2cc(C)ccc2O)C1 792199328 DFWGVWFHVLDHDZ-YPMHNXCESA-N 263.337 2.132 10 20 CECD COc1ccc(O)c(CN(CCO)[C@H]2C[C@H]3CC[C@H]2C3)c1 793324837 WDGYOLIFWGCIBW-XEZPLFJOSA-N 291.391 2.384 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)CCO)cc1 96811587 USLCISWXLXYHIT-CYBMUJFWSA-N 250.386 2.393 10 20 CECD [N-]=[N+]=NC1CN(C(=O)Cc2ccc(Cl)cc2)C1 409422856 JLECJLXUGHTRKZ-UHFFFAOYSA-N 250.689 2.404 10 20 CECD CC[C@@H](NCc1cc(F)cc(F)c1O)C(C)(C)O 708505016 WMSXTIBLGRNAQC-LLVKDONJSA-N 259.296 2.310 10 20 CECD COC(=O)N1CC(N[C@@H]2C[C@H](C)c3c(C)ccc(O)c32)C1 1343304508 CRIQHYYJBQMIGM-CMPLNLGQSA-N 290.363 2.289 10 20 CECD Cc1ccc(CN(CCC(=O)O)C2CCOCC2)c(O)c1 1600410881 PCOVVLVDYLLJNB-UHFFFAOYSA-N 293.363 2.156 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H]2C(=O)O)cc1 1607766127 NHNOFXVHFMIOFB-OAHLLOKOSA-N 298.342 2.393 10 20 CECD Cc1cccc(F)c1S(=O)(=O)Oc1ccc(N)cc1 1579766996 JZZIZIDRALYZMS-UHFFFAOYSA-N 281.308 2.484 10 20 CECD Cc1ccc(C(=O)Nc2ccc3c(c2)CNCC3)c(O)c1O 1579664626 WGEGJVIYYLKTMW-UHFFFAOYSA-N 298.342 2.304 10 20 CECD CN(C)c1ccc(CNC(=O)NO[C@@H]2CCCCO2)cc1 152826207 NROCBQFZIOVPOF-CQSZACIVSA-N 293.367 2.010 10 20 CECD COc1cccc(CNC(=O)/C=C/c2cccc(O)c2)c1O 156401565 LONHVIQTWNJERO-CMDGGOBGSA-N 299.326 2.436 10 20 CECD COCCOCCCCNCc1cc(F)ccc1O 226589394 VDELCKOBOZBSIX-UHFFFAOYSA-N 271.332 2.064 10 20 CECD COc1ccc(O)c([C@@H](C)NCC[C@H]2CCOC2)c1 230672496 AWKNSDHXVJRQOJ-NEPJUHHUSA-N 265.353 2.478 10 20 CECD COC(=O)CCCN[C@@H](C)c1cc(OC)ccc1O 37416898 IBSPRCDUNNOARY-JTQLQIEISA-N 267.325 2.005 10 20 CECD COCCOCCCCNCc1cccc(C)c1O 164476810 PRBVZFYRRLXPDS-UHFFFAOYSA-N 267.369 2.233 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccnc(F)c2)cc1 41040249 FCPKCDHXYFLWTJ-UHFFFAOYSA-N 273.311 2.217 10 20 CECD COCCOCCCCN[C@H](C)c1ccccc1O 167443021 LNXAJKJBWANROG-CYBMUJFWSA-N 267.369 2.486 10 20 CECD CC[C@H](CO)NCc1cc(Br)ccc1O 133627978 WKGGRXJTFDGYAW-SNVBAGLBSA-N 274.158 2.015 10 20 CECD Oc1ccccc1CN1CCC(n2ccnc2)CC1 179564881 IVTICMGUHAKXJI-UHFFFAOYSA-N 257.337 2.426 10 20 CECD O=C(NC1CC1)[C@H]1CCCN1Cc1cc(Cl)ccc1O 179488239 JFCXRGTWHOJLSZ-CYBMUJFWSA-N 294.782 2.289 10 20 CECD Cc1ccc(NC(=O)c2ccc(C)c(O)c2O)nc1 177661867 ZAZXKOQZBRKGAQ-UHFFFAOYSA-N 258.277 2.362 10 20 CECD CN(C)c1ccc(CNCCCOC[C@@H]2CCCO2)cc1 20146501 RUHQBSXNWZYZGW-KRWDZBQOSA-N 292.423 2.428 10 20 CECD COc1ccc(N(C)CCC2OCCO2)cc1F 124642991 LWHDZPPZYUWNME-UHFFFAOYSA-N 255.289 2.034 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCC[C@@H]2CCO)c1 189958867 RBFISSNDQXNUTJ-DOMZBBRYSA-N 279.380 2.432 10 20 CECD CN(Cc1ccccc1O)C(=O)Nc1cccnc1 47565091 JMWHLHZZYZNRSN-UHFFFAOYSA-N 257.293 2.451 10 20 CECD Cc1nc(NC(=O)NCCc2ccc(O)c(O)c2)oc1C 265159730 FDLWDCXPAWHGAP-UHFFFAOYSA-N 291.307 2.067 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H]2CCSC2)c1 273460489 IBIXVVKUFSEVKB-KOLCDFICSA-N 281.377 2.335 10 20 CECD COC(=O)[C@H]1C[C@H](C)CCN1Cc1cccc(OC)c1O 274850743 BFXARDMUJPGGKI-DGCLKSJQSA-N 293.363 2.174 10 20 CECD C[C@@H]1OCC[C@]12CN(Cc1cccc(Cl)c1O)CCO2 279702517 RITZWNCYFBFARK-NHYWBVRUSA-N 297.782 2.425 10 20 CECD CCOc1ccc(O)c(CNCc2cc(C)nn2C)c1 283870942 IRZAVYPMGONVEB-UHFFFAOYSA-N 275.352 2.123 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1ncc[nH]1 286294902 WISVFJGGDHKIRP-SNVBAGLBSA-N 262.332 2.466 10 20 CECD C[C@H](N)CN[C@@H](C)c1ccc(Br)cc1O 817974165 ZUIYUXLDBOVXGS-YUMQZZPRSA-N 273.174 2.153 10 20 CECD C[C@@H]1C[C@H](CO)CN(Cc2ccc(N(C)C)cc2)C1 817280912 FEWJYFDGQFSARK-HIFRSBDPSA-N 262.397 2.203 10 20 CECD C[C@@H]1CC[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1 829680865 GSKLEENOMXHZJI-HTQZYQBOSA-N 253.273 2.155 10 20 CECD C/C=C/[C@@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 900404856 OSKOVCVIDNZBPB-BAXHPOPBSA-N 288.391 2.230 10 20 CECD CC[C@@H](NC(=O)NCc1ccc(OC)cc1O)C(F)F 836511896 MLPSFYHTZWMKJH-SNVBAGLBSA-N 288.294 2.244 10 20 CECD CCC[C@@H]1C[C@H](C(=O)NCc2ccc(O)cc2O)CCO1 910948801 ANMNSXDOOIUMDB-BXUZGUMPSA-N 293.363 2.309 10 20 CECD CCN[C@H](C)CNCc1ccc(OC)c(COCC)c1 841064588 CHZPKJWLDTVMEK-CYBMUJFWSA-N 280.412 2.319 10 20 CECD C[C@@H](NC[C@@H](O)C1CCOCC1)c1ccc(Cl)cc1O 841749092 NEGSDDAYPPTWBW-MEBBXXQBSA-N 299.798 2.484 10 20 CECD CC[C@@H](COC)N[C@H](C)c1cccc(OC)c1O 846147489 VUZDTHZVUJAPIQ-MNOVXSKESA-N 253.342 2.476 10 20 CECD COc1cccc([C@@H](C)NCc2cc(C)nn2C)c1O 846168116 QZCGNPVJVSSJHW-LLVKDONJSA-N 275.352 2.294 10 20 CECD CCc1cccc(CN[C@H]2CCCN(C(=O)OC)C2)c1O 848894610 LKPMPFHJGORRSU-AWEZNQCLSA-N 292.379 2.275 10 20 CECD O=C(CSc1ncc(Cl)s1)NCC1CC1 849999835 ZRTGYRPUIQGGBH-UHFFFAOYSA-N 262.787 2.415 10 20 CECD COCC[C@H]1COCCN1Cc1ccc(N(C)C)cc1C 840948519 UZFAGIZYWPKYPV-KRWDZBQOSA-N 292.423 2.298 10 20 CECD CC[C@H](NC[C@@H]1CC(=O)N(CC)C1)c1ccc(F)cc1O 846208403 JNJXOGZPONGAFF-FZMZJTMJSA-N 294.370 2.440 10 20 CECD Cc1cc(C)cc(NC(=O)C(=O)NCc2ccccc2O)c1 748484937 AJNHNOBMZBSGNP-UHFFFAOYSA-N 298.342 2.264 10 20 CECD CO[C@@H](CNC(=O)c1cc(O)cs1)CC(C)C 842264694 BNFXUWFHYVRIJG-SNVBAGLBSA-N 257.355 2.245 10 20 CECD C[C@@H](Cn1cccn1)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 756672287 MVFCSAMZFHPILS-WDEREUQCSA-N 290.323 2.236 10 20 CECD COC(=O)N(C)CCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 850548536 UVCUXHXHNYTAJS-GXSJLCMTSA-N 296.342 2.367 10 20 CECD COc1ccc(O)c(CNc2cncc(N(C)C)c2)c1 877667737 KGCIQLPVFXRAGY-UHFFFAOYSA-N 273.336 2.474 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CC=CC[C@H]3C1)[C@@H](O)CO2 872713168 LICZAQDQQGYWFG-OZVIIMIRSA-N 287.359 2.216 10 20 CECD CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@@H](C)S1(=O)=O 877521653 GFUDVHXVJNGHAM-TZMCWYRMSA-N 297.420 2.098 10 20 CECD Cc1ccccc1[C@@H]1C(=O)NCCN1Cc1ccc(N)cc1 1120268496 GHJKCQAKPXCVJA-QGZVFWFLSA-N 295.386 2.250 10 20 CECD C[C@@H](N[C@@H]1CCCC[C@H]1O)c1c(O)cccc1F 886594775 UHMSQVZWKSZHBM-YUSALJHKSA-N 253.317 2.485 10 20 CECD CN(Cc1cc(F)cc(F)c1O)CC1(O)CCCC1 894034255 NPBQKICPVBMQOI-UHFFFAOYSA-N 271.307 2.407 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1 896956031 NUDYKBLGIWZGLU-SECBINFHSA-N 285.290 2.055 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCOC[C@H]2C)c1O 894749793 KSYHIDOOIWRDDC-OLZOCXBDSA-N 279.380 2.471 10 20 CECD Cc1cccc(CNCCO[C@@H]2CCCCO2)c1O 894801649 XFPXEPBTYZNICI-CQSZACIVSA-N 265.353 2.333 10 20 CECD CN(C)c1ccc([C@@H](CNC(=O)C(C)(C)F)N(C)C)cc1 891249560 UQYKIQHVIADVHY-CQSZACIVSA-N 295.402 2.220 10 20 CECD OCCN(Cc1cc(Cl)cc(F)c1O)CC(F)F 793307296 MFGCDUNWJMWZKD-UHFFFAOYSA-N 283.677 2.244 10 20 CECD CCOc1cccc(CN[C@H](C)[C@H]2CCOC2)c1O 135213519 MFLDAFWLCXNSQP-YPMHNXCESA-N 265.353 2.306 10 20 CECD O=C1CC2(CCN(Cc3cccc(Cl)c3O)CC2)CN1 271743109 AIXOQZYMTNJTTA-UHFFFAOYSA-N 294.782 2.148 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)C(=O)NC(C)(C)C 708393907 LRPNPOZTSCNIQV-QMMMGPOBSA-N 286.322 2.063 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@H](C)c1ccc(F)cc1O 62747750 UTXBIPZCMVBGJW-WDEREUQCSA-N 280.343 2.193 10 20 CECD Nc1ccc(CCNC(=O)N[C@H]2CCC[C@@H](F)C2)cc1 1332141848 JVOZMJTWTLZSMM-OCCSQVGLSA-N 279.359 2.391 10 20 CECD COc1cc(C)cc(CNCC2(N(C)C)CCC2)c1O 1334367736 PSCUEWNKMYMBOB-UHFFFAOYSA-N 278.396 2.283 10 20 CECD COC(=O)CCC(C)(C)NCc1ccc(N)cc1 1345159790 LQRIDOOGQPUUIA-UHFFFAOYSA-N 250.342 2.090 10 20 CECD O=C(O)c1cccc(NC(=O)N2Cc3cccc(O)c3C2)n1 1602446220 OLUBDSHASPAMKD-UHFFFAOYSA-N 299.286 2.033 10 20 CECD Cc1ncsc1CN(C)C(=O)Cc1ccc(N)cc1 104441877 VLEOZPSCDQZIKR-UHFFFAOYSA-N 275.377 2.235 10 20 CECD C/C=C/C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 1594676333 GNUPRCKEISJPQZ-NSCUHMNNSA-N 283.711 2.035 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H]1[C@H](C(=O)O)C1(F)F 1599628309 MPZXVSWQYFPRTC-WCQYABFASA-N 297.301 2.414 10 20 CECD COc1cc(NC(=O)Cc2ccc(N)cc2)cc(OC)c1 19270798 CPNWJYAEQSNXNB-UHFFFAOYSA-N 286.331 2.467 10 20 CECD CN(CCn1cc(Cl)cn1)Cc1ccccc1O 838893567 DOFGAZQKCNPUJV-UHFFFAOYSA-N 265.744 2.374 10 20 CECD CN(C)c1ccc(CN[C@H](C(=O)O)C2(C)CC2)cc1 1777039700 QPYARDVMHQQUDS-CYBMUJFWSA-N 262.353 2.096 10 20 CECD Cc1csc([C@H](C)NC(=O)Cc2ccc(N)cc2)n1 80255493 XZHRNJLIXTUCIC-JTQLQIEISA-N 275.377 2.454 10 20 CECD Cc1ccc([C@H](C)NCCCn2cncn2)c(O)c1 381677151 IVUCKRVKTQPJHE-LBPRGKRZSA-N 260.341 2.033 10 20 CECD CN(c1ccccc1)S(=O)(=O)c1cccc2nonc12 8660896 CLPVFXBDFKRWIG-UHFFFAOYSA-N 289.316 2.048 10 20 CECD CC1(C)CN(C(=O)NCc2ccc(N)cc2)CCS1 1353539870 PFUQGMIBGSQQDM-UHFFFAOYSA-N 279.409 2.306 10 20 CECD COC(=O)COc1ccc(N(C)CCOC(C)(C)C)cc1 183801248 OYMYCFGWEQMDSW-UHFFFAOYSA-N 295.379 2.490 10 20 CECD COCCC1(C(=O)N[C@H](C)c2cc(OC)ccc2O)CC1 127039444 HWGWOSSRAJZYIC-LLVKDONJSA-N 293.363 2.395 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C1[C@H]2CCC[C@@H]12 183432025 MZONBJUEBUWWNN-JURLDLKRSA-N 275.348 2.191 10 20 CECD COc1ccc(CNC[C@H](O)c2ccco2)cc1C 78879397 JHEKZLKLDBQBOX-ZDUSSCGKSA-N 261.321 2.420 10 20 CECD COc1ccc(N(CCOCCO)[C@@H](C)C2CC2)cc1 133024595 DESLUIHURUVYGL-ZDUSSCGKSA-N 279.380 2.309 10 20 CECD CC(C)(C)S(=O)(=O)CCN[C@H]1CCc2cccc(O)c21 296833116 MPFMPRSRYPGWAX-LBPRGKRZSA-N 297.420 2.182 10 20 CECD C[C@H](NCC1(C(N)=O)CCCC1)c1ccc(F)c(F)c1O 276877348 FPTRWMOEZXSFAK-VIFPVBQESA-N 298.333 2.367 10 20 CECD Cc1ccc(C(=O)NOC2CCCC2)c(O)c1O 272889271 ANQNLHMVGMXYBU-UHFFFAOYSA-N 251.282 2.010 10 20 CECD COC[C@H](C)N(C)Cc1ccc(N(C)C)c(F)c1 271122793 KZQAUZQUMVAZFW-NSHDSACASA-N 254.349 2.358 10 20 CECD CCOc1cccc(CN[C@@H]2C[C@@H](OCC)[C@H]2OC)c1O 274965501 VFQNHEVUTMQPNM-XPKDYRNWSA-N 295.379 2.073 10 20 CECD CN(C)c1ccc(CN(C)C(C)(C)CC(=O)O)cc1 1331934615 SMYRSLLWMWSJMZ-UHFFFAOYSA-N 264.369 2.438 10 20 CECD C[C@H](N[C@@H]1CC[C@H](CN)C1)c1ccc(F)cc1O 817981273 IIAJVUFNKRPNBL-JBLDHEPKSA-N 252.333 2.309 10 20 CECD Cc1cc(C(=O)NCc2ccccc2O)c2c(C)n[nH]c2n1 725895285 CIPDHCMHYHGTNN-UHFFFAOYSA-N 296.330 2.210 10 20 CECD COC(=O)N(C)CCCC(=O)N[C@H](C)c1ccccc1O 827937038 IVNPOFPLSFMZBC-LLVKDONJSA-N 294.351 2.048 10 20 CECD CN(C)c1ccc(CNC(=O)CCCF)cc1F 824670092 VWBRVYWRXYOSRB-UHFFFAOYSA-N 256.296 2.258 10 20 CECD N[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)C1CCC1 827007734 AIDCXKYITMHEBK-MRXNPFEDSA-N 287.407 2.030 10 20 CECD CCCN[C@H](C)C(=O)NCCCSc1nccs1 829527741 DPBREMRDWLTKPA-SNVBAGLBSA-N 287.454 2.130 10 20 CECD O=C(Nc1cccc2c1OCCO2)c1cc(O)cs1 732275566 LGDDVNIYOZAZEG-UHFFFAOYSA-N 277.301 2.477 10 20 CECD C[C@H](NC(=O)NC(CF)CF)c1ccc(N(C)C)cc1 836405272 BRVNSLQRZCWKQM-JTQLQIEISA-N 285.338 2.420 10 20 CECD Cc1nn(CC(=O)NCc2ccc(N)cc2)c(C)c1Cl 837302909 MFVQUVUMKWQKPB-UHFFFAOYSA-N 292.770 2.052 10 20 CECD CC1(C(=O)NCc2ccc(O)cc2O)CC(F)(F)C1 910955453 FLQLJTZIQCDHLZ-UHFFFAOYSA-N 271.263 2.149 10 20 CECD Cc1cc(Br)c(O)c(CNC[C@H]2CCCN2)c1 841035700 KDJSMSPZTBQVQX-LLVKDONJSA-N 299.212 2.305 10 20 CECD CCN(C[C@H](O)C(F)(F)F)C(=O)Nc1ccc(N)cc1 841296190 QGOAVTRPNMYJBS-JTQLQIEISA-N 291.273 2.046 10 20 CECD C[C@H](NC[C@@H]1COCCO1)c1ccc(Cl)cc1O 841746162 VVEOTQJJGBNYKU-GXSJLCMTSA-N 271.744 2.112 10 20 CECD CC[C@@H](CSC)NC(=O)NCCc1ccc(N)cc1 841866784 JJSVCYJCGPVNPL-ZDUSSCGKSA-N 281.425 2.252 10 20 CECD CC[C@H](C[C@@H](C)CO)NC(=O)Nc1ccc(N)cc1 841299755 JLPPAQJEZJXWTD-ZYHUDNBSSA-N 265.357 2.187 10 20 CECD C[C@@H](N[C@@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 756770118 RTKOJPYYWDOGSD-MWLCHTKSSA-N 280.324 2.112 10 20 CECD C[C@@H](NC/C=C/CO)c1ccc(Br)cc1O 850507906 IXKQIKFBZNZGSM-GKQMSVHHSA-N 286.169 2.354 10 20 CECD CC1CC(CN2C(=O)CN(Cc3ccccc3O)C2=O)C1 857228557 PYWFCOPGQCCMJC-UHFFFAOYSA-N 288.347 2.203 10 20 CECD Cc1ccc([C@H](C)Nc2cnn(CCO)c2)c(O)c1 756854620 GAZZIJIWCMKWBC-NSHDSACASA-N 261.325 2.063 10 20 CECD Nc1ccc(NC(=O)c2cnn(CC3CC3)c2)cc1 867966604 RVJQTCAJPQYHJO-UHFFFAOYSA-N 256.309 2.128 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H]1C1CC1)[C@H](O)CO2 768452751 SJDYXEHMSAXQGJ-DZGCQCFKSA-N 275.348 2.192 10 20 CECD CC[C@@H](NC[C@@H]1COCCO1)c1ccc(N(C)C)cc1 765250308 JCCMBIGQXUVDHI-HZPDHXFCSA-N 278.396 2.209 10 20 CECD CC[C@@H](NCc1ccc(C)cc1O)[C@H](O)C(F)(F)F 877126082 FFGWCWVDCUYFCR-PWSUYJOCSA-N 277.286 2.492 10 20 CECD CCOc1ccc(CN2CCO[C@H](CC)C2)c(O)c1 768239471 WLVVQIUYECNGLJ-CYBMUJFWSA-N 265.353 2.402 10 20 CECD C[C@@H](NC(=O)[C@@H]1C[C@H]1C1CCNCC1)c1ccccc1O 870988670 WKCSNMFZBVQOSR-BYCMXARLSA-N 288.391 2.205 10 20 CECD Cc1ccc(CN(C2CC2)[C@@H](C)CS(C)(=O)=O)c(O)c1 876736628 MDNYLYJKSQGEQZ-LBPRGKRZSA-N 297.420 2.098 10 20 CECD CCN(CC)c1ccc(CN(C)CC2OCCO2)cc1 777541517 OHQOOCXFWMFRFL-UHFFFAOYSA-N 278.396 2.338 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCCOCC1 775656366 RQUKHGDFNQCIIG-UHFFFAOYSA-N 259.708 2.407 10 20 CECD CN(C)c1ccc(CN2C(=O)NC3(CCCC3)C2=O)cc1 777557818 PHUQAPMJGUAFJT-UHFFFAOYSA-N 287.363 2.117 10 20 CECD CCN(C)c1ccc(CN2C[C@@H](COC)O[C@H](C)C2)cc1 773888789 OJMUBHAPMJHAIH-PBHICJAKSA-N 292.423 2.378 10 20 CECD Cc1cccc(O)c1CN1CCCC[C@H](S(C)(=O)=O)C1 877480736 GJLZRNPNXWEPRG-ZDUSSCGKSA-N 297.420 2.100 10 20 CECD O=C(NCc1cccc(O)c1O)C12CCC(CC1)C2 1123888818 LSNSKAPLNXOVIM-UHFFFAOYSA-N 261.321 2.294 10 20 CECD CCOc1cccc(CN2CCC[C@H]([C@@H](C)O)C2)c1O 780892561 LMXJPXRDSUUMQH-OLZOCXBDSA-N 279.380 2.384 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN3CCCC[C@H]23)c1O 894181067 PAACHJLQFBUVAO-LSDHHAIUSA-N 290.407 2.426 10 20 CECD c1ncc(CNCc2ccc(N3CCSCC3)cc2)[nH]1 894191283 HZJOGZYASNSMDN-UHFFFAOYSA-N 288.420 2.253 10 20 CECD COc1cc(O)c(CNC[C@H]2CCC=CO2)cc1OC 783704119 AFNCRWHRXFWMMZ-GFCCVEGCSA-N 279.336 2.192 10 20 CECD CC1(C)CN(Cc2cc(Cl)ccc2O)C[C@@H]1O 790938546 WZKNTPIQJSPKRH-LBPRGKRZSA-N 255.745 2.248 10 20 CECD O=C(NCC1Cc2ccccc2C1)c1cccc(O)c1O 790732169 AVIWROIFDQXDMJ-UHFFFAOYSA-N 283.327 2.243 10 20 CECD Cc1cc(O)nc(NCc2ccc(N(C)C)cc2)n1 1336453145 KWARSTQFBRAMOW-UHFFFAOYSA-N 258.325 2.169 10 20 CECD C[C@@H]1CCN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1319702178 PCIBHYBDOVQQQB-CQSZACIVSA-N 291.414 2.419 10 20 CECD OC[C@H]1CC[C@H](NCc2cc(F)ccc2O)CC1 272388277 IQEXAGJHIWXRSQ-MJHDQNEOSA-N 253.317 2.172 10 20 CECD C[C@@H]1O[C@H](C)[C@H](C(=O)N(C)c2ccc(N)cc2)[C@@H]1C 87205562 BAPKSDHTGHROAH-FBKDDSFISA-N 262.353 2.291 10 20 CECD CN(Cc1ccc(N)cc1)[C@@H]1CCCC[C@H]1S(C)(=O)=O 1356083502 QBKQDISWONBABU-HUUCEWRRSA-N 296.436 2.056 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C(=O)O)[C@H]2C)c1 1605696753 QSJGZRWBZPLGPO-ZWNOBZJWSA-N 279.336 2.086 10 20 CECD O=C1OCC[C@@H]1NCc1cc(Cl)cc(Cl)c1O 19876559 ZVMZNBOVXQXQPF-VIFPVBQESA-N 276.119 2.104 10 20 CECD O=S(=O)(NCc1ccccc1O)c1cccc(F)c1 158580428 GGUPGWZDVZFQBL-UHFFFAOYSA-N 281.308 2.010 10 20 CECD CCCC[C@@H](COC)NC(=O)Cc1ccc(N)cc1 159649135 IGSXBDSCIRKJRB-AWEZNQCLSA-N 264.369 2.133 10 20 CECD COc1ccc(O)c(CN(C)CCN2CCCCC2)c1 846115739 ZREXGYOSLDMJSO-UHFFFAOYSA-N 278.396 2.319 10 20 CECD CCC[C@@H](CCO)CNCc1cc2c(cc1O)OCO2 231383962 XODOOUREIXQZEP-NSHDSACASA-N 281.352 2.009 10 20 CECD C[C@@H](C(=O)O)N(C)Cc1cc(Br)ccc1O 235492178 PHLUJJJVMLCUKV-ZETCQYMHSA-N 288.141 2.060 10 20 CECD CN(Cc1cc(=O)n2ccccc2n1)Cc1ccccc1O 109772867 ZYSLATKOFWTDIO-UHFFFAOYSA-N 295.342 2.032 10 20 CECD COc1cc(O)c(CN2CCCO[C@@H](C)C2)cc1OC 179443882 PVFCWCDHFHUHCZ-NSHDSACASA-N 281.352 2.020 10 20 CECD COC(=O)C[C@H]1CCCN1Cc1cc(OC)c(C)cc1O 179447768 CPQZMNQAVGRELS-CYBMUJFWSA-N 293.363 2.237 10 20 CECD C[C@@H](O)CNCc1cc(Cl)cc(Cl)c1O 35601758 CCVJLHZVJCVBFG-ZCFIWIBFSA-N 250.125 2.169 10 20 CECD CCOCCN(C)Cc1cc(OCC)ccc1O 181483120 XOZTWQRJFZWVAV-UHFFFAOYSA-N 253.342 2.259 10 20 CECD COc1cccc(CN[C@@]2(CO)CCc3ccccc32)c1O 135910261 HJNWXXLIIMQERX-GOSISDBHSA-N 299.370 2.324 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@@H]2CCCS2)cc1 134075261 LGANRUATFPHWTJ-AWEZNQCLSA-N 293.436 2.447 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)[C@@H](C)N 192026913 DFRKFSOZBAYXEJ-VXGBXAGGSA-N 264.369 2.114 10 20 CECD COC[C@H](CN[C@@H](C)c1cc(C)ccc1O)OC 230672149 JXJSSYPIJARHBM-RYUDHWBXSA-N 253.342 2.013 10 20 CECD CCOc1ccc(O)c(CNC[C@H]2CCCO2)c1 237048890 LDWUZZJETLUGTC-CYBMUJFWSA-N 251.326 2.060 10 20 CECD CC[C@@H](C)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264694972 DRXYFEJCFFBLRM-VIIAAUOXSA-N 288.391 2.451 10 20 CECD Cc1ccnc(NCc2ccc(N3CCOCC3)cc2)n1 265512744 KTWKRNWWGIGIAI-UHFFFAOYSA-N 284.363 2.234 10 20 CECD CC(=O)CC(C)(C)CC(=O)NCc1ccccc1O 276589618 ZZUYRNKESXTUOW-UHFFFAOYSA-N 263.337 2.404 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](O)CN2CCCC2)c(O)c1C 273418189 RLJHUVCDEZGGNN-HUUCEWRRSA-N 292.423 2.116 10 20 CECD Cc1cc(NS(=O)(=O)N(C)C(C)C)c(C)c(C)c1O 274831757 UOCKZBGHOHQOBA-UHFFFAOYSA-N 286.397 2.314 10 20 CECD Nc1ccc(NC(=O)[C@H]2CCC[C@H](C(=O)O)C2)cc1 388880101 HENODYRPCRXEFD-UWVGGRQHSA-N 262.309 2.098 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](OC)C2CC2)c1 293647297 HOKXJVVQKBVGHV-BONVTDFDSA-N 293.363 2.254 10 20 CECD NC(=O)C[C@@H](NCc1ccc2c(c1)CCO2)c1ccccc1 293207821 YCZZNTRUDBZEIT-MRXNPFEDSA-N 296.370 2.328 10 20 CECD CN(Cc1ccc2c(c1)oc(=O)n2C)Cc1ccccc1O 816493156 RGOUGFWJGIOEIP-UHFFFAOYSA-N 298.342 2.469 10 20 CECD C[C@H](NC(=O)NCc1ccccc1O)c1ccccn1 726248742 SYJFBZGIXNLKDW-NSHDSACASA-N 271.320 2.348 10 20 CECD Cc1cccc(CN2CCC(N3CCOC3=O)CC2)c1O 827740999 LENSLNITIBWXTA-UHFFFAOYSA-N 290.363 2.117 10 20 CECD COc1ccc(O)c(CN(CCO)C2CCSCC2)c1 825133697 KUZRCYCELMXDMF-UHFFFAOYSA-N 297.420 2.091 10 20 CECD Cc1cccc(CN[C@@H]2CCC[C@@H]([S@@](C)=O)C2)c1O 826911111 RZYHCWRDEMVMMP-PJIJBLCYSA-N 281.421 2.480 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](O)CC(C)(C)C1 825091317 YCKDWEKJUFHGHV-GFCCVEGCSA-N 279.380 2.384 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCOCC1CCC1 842086970 HUNOTSBZDMDWRN-FNORWQNLSA-N 292.331 2.471 10 20 CECD COCCN1CC[C@H](N[C@@H](C)c2ccc(Cl)cc2O)C1 841764824 RUUDZDDBEJNAOF-AAEUAGOBSA-N 298.814 2.417 10 20 CECD Nc1ccc(NC(=O)N(CCO)[C@H]2C[C@H]3CC[C@H]2C3)cc1 841297022 KTIAFBRKDWBOFM-HUBLWGQQSA-N 289.379 2.284 10 20 CECD CCNCCNCc1cc(C)cc(Br)c1O 841037199 PYDIJZNORBTOCR-UHFFFAOYSA-N 287.201 2.162 10 20 CECD CCOc1ccc(CN2CCC3(CCNCC3)C2)c(O)c1 843120180 MYVGYPVZZRULCT-UHFFFAOYSA-N 290.407 2.366 10 20 CECD CC[C@@H](C)[C@@H](C)C(=O)N(CC(=O)O)Cc1ccccc1O 911491684 PKVXVJISTXAYPD-VXGBXAGGSA-N 293.363 2.488 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CCN)C2)cc1F 843113606 YMNRZWZEMCHKPY-ZDUSSCGKSA-N 279.403 2.453 10 20 CECD COc1cccc([C@H](C)NCCn2ccnc2C)c1O 846141749 NHWUIQQNXSLPHZ-NSHDSACASA-N 275.352 2.257 10 20 CECD C[C@@H](Cc1ccco1)NC(=O)NCCc1ccc(N)cc1 841702614 XNHCRSDNSKBFRQ-LBPRGKRZSA-N 287.363 2.335 10 20 CECD COc1cccc([C@@H](C)NC[C@H](OC)C2CC2)c1O 846171457 SUSNBBBUXMYOIB-YGRLFVJLSA-N 265.353 2.476 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@@H]1CC12CCNCC2 841079237 KGZBFHRLGNFYBT-GFCCVEGCSA-N 284.762 2.416 10 20 CECD COc1cccc([C@H](C)NCCCn2ccnc2)c1O 846136049 GSQPHUDBADYILH-LBPRGKRZSA-N 275.352 2.338 10 20 CECD C[C@H](N[C@H](C)c1ccn(C)n1)c1cc([N+](=O)[O-])ccc1O 840816786 PXZCGLSNEVYDRZ-VHSXEESVSA-N 290.323 2.446 10 20 CECD CCn1ccc(C(=O)NCc2ccc(N(C)C)cc2C)n1 843550895 NZJWBNJZPWZWQP-UHFFFAOYSA-N 286.379 2.207 10 20 CECD CC[C@H](C)NC(=O)[C@@H](C)NCc1ccc2c(c1)CCCO2 921618577 JHLPKBXBAWOVQL-QWHCGFSZSA-N 290.407 2.404 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CCS1 754872655 OBGCQBJWNZYXLB-QMTHXVAHSA-N 295.404 2.145 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CC1(Cl)Cl 769364688 JQZQYVRTPMHTPY-MRVPVSSYSA-N 260.120 2.202 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1CSC1 869147802 WZVNRPGMUJKCMP-UHFFFAOYSA-N 257.742 2.025 10 20 CECD CCOC(=O)C1(C)CC(NCc2ccccc2O)C1 866252931 BAAXITVBECNCGP-UHFFFAOYSA-N 263.337 2.214 10 20 CECD CN(Cc1cccc(Br)c1O)C1CC(O)C1 761223343 POYXSZRGUHKCQK-UHFFFAOYSA-N 286.169 2.110 10 20 CECD COc1cc(O)c(CNCC2(C)CC2)cc1OC 776232395 XEIPYERULMXVKD-UHFFFAOYSA-N 251.326 2.299 10 20 CECD C[C@H](NC(=O)C1=COCC1)c1ccc(N(C)C)cc1 773018330 VAZWXUVBXQERFZ-NSHDSACASA-N 260.337 2.234 10 20 CECD CCN(C)c1ccc(CN2CCc3c[nH]nc3C2)cc1 773798060 RCTOICVUYGPHEJ-UHFFFAOYSA-N 270.380 2.424 10 20 CECD CCN(C)c1ccc(CN2CCCC3(C2)OCCO3)cc1 773792671 LMPUWGMOKKYZBJ-UHFFFAOYSA-N 290.407 2.482 10 20 CECD CC[C@@]1(C)COCCN1C(=O)/C=C/c1ccc(O)c(O)c1 779548122 QAKWYDLDWOEGEE-YERXGYGTSA-N 291.347 2.139 10 20 CECD C[C@@H](CCS(C)(=O)=O)N[C@H](C)c1c(O)cccc1F 886541184 ROTGVAPVXGNQTF-VHSXEESVSA-N 289.372 2.005 10 20 CECD COc1cc(N2CC=CCC2)c([N+](=O)[O-])cc1OC 778591729 NODVBVHBNDUOMJ-UHFFFAOYSA-N 264.281 2.378 10 20 CECD CC(C)OC[C@@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 775834083 JYAFTWUEWDHDMV-BBRMVZONSA-N 280.412 2.189 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@]1(C)CCCOC1 781161699 YKWFGXIUNYHMCP-QGZVFWFLSA-N 290.407 2.494 10 20 CECD Cc1cc(C)c2c(N)c(C(=O)OC[C@@H](C)O)sc2n1 787608882 YQCMGCPCGYOOJV-MRVPVSSYSA-N 280.349 2.033 10 20 CECD NC(=O)CC[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 893980464 MCBZCPSJEQCMMB-SNVBAGLBSA-N 298.333 2.148 10 20 CECD Oc1c(F)cc(F)cc1CN1CC[C@H](n2cccn2)C1 894816837 WTYIKXYJDVLTNK-LBPRGKRZSA-N 279.290 2.314 10 20 CECD COc1ccc(CN(C)[C@@H](CO)C(C)(C)C)c(O)c1OC 892178619 GQEJBEKDYHCAGO-ZDUSSCGKSA-N 297.395 2.248 10 20 CECD CCOc1ccc(CN(CCO)C2CCC2)c(O)c1 784671147 FMWMSKQAAIVFGS-UHFFFAOYSA-N 265.353 2.138 10 20 CECD Cc1nnc(NC[C@H](c2ccc(N(C)C)cc2)N(C)C)o1 897520940 AZMHVQQDNXCDTP-CQSZACIVSA-N 289.383 2.159 10 20 CECD CC[C@](C)(OC)C(=O)N[C@H](C)c1cc(OC)ccc1O 795080914 NGMIPCZWNOBQFR-BMIGLBTASA-N 281.352 2.393 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)N(C)Cc1ccccc1O 793656817 MRBGORLDAWYZNJ-SMDDNHRTSA-N 265.353 2.412 10 20 CECD CCn1ncnc1CN[C@@H](C)c1ccc(C)c(C)c1O 794838825 ATTWEGFZVLKZKU-LBPRGKRZSA-N 274.368 2.471 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)c1ccco1 790415435 FTEMDAMDOCZMJY-UHFFFAOYSA-N 267.306 2.348 10 20 CECD C[C@H](CCCO)NCc1cccc(Br)c1O 87358189 LNFZNLDCFOTFRS-SECBINFHSA-N 288.185 2.405 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)CCS(C)(=O)=O)c1 185790528 IUADWTQVBIBVQW-VXGBXAGGSA-N 285.409 2.174 10 20 CECD CNC[C@@H](C)CNCc1cc(Br)ccc1O 1331420667 YHRKPKCHVMJBIO-SECBINFHSA-N 287.201 2.100 10 20 CECD CCc1cccc(CN[C@H](C[C@H]2CCCO2)C(=O)O)c1O 1597586820 LJFKFDNNBJKFBT-ZIAGYGMSSA-N 293.363 2.067 10 20 CECD Cc1cc(C(=O)N2CCC[C@@H](N)C2)c(C)n1-c1ccccn1 158314613 VYRKXOXJHNQQOS-CQSZACIVSA-N 298.390 2.052 10 20 CECD CCCSCC(=O)NCCc1ccc(N)cc1 152522122 CRECVTIBDURXLS-UHFFFAOYSA-N 252.383 2.071 10 20 CECD CCOC1CC(C(=O)N[C@H](C)c2ccccc2O)C1 827946514 KQVFMZFGGVPYDH-VOMCLLRMSA-N 263.337 2.385 10 20 CECD COCCC1(CNC(=O)Nc2ccc(N)cc2)CC1 234812188 OXKAEGOKCSVKHN-UHFFFAOYSA-N 263.341 2.207 10 20 CECD C[C@H](N[C@H](C)c1ncn(C)n1)c1ccc(N(C)C)cc1 275700223 KPQWOARCLNKIKC-NWDGAFQWSA-N 273.384 2.293 10 20 CECD CC(C)NC(=O)CCN[C@H](C)c1ccc(F)cc1O 181270532 NMLCLKQQWWGBBO-SNVBAGLBSA-N 268.332 2.097 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CO[C@@H](C)C2)c1O 402008571 RIYOXBRVZOEFBJ-GZMMTYOYSA-N 271.744 2.321 10 20 CECD NC[C@]12CCC[C@H]1CN(Cc1cc(F)ccc1O)C2 381928106 WFTSTMKFPCCEJP-WFASDCNBSA-N 264.344 2.092 10 20 CECD Cc1cc(O)c(CNCCN2CCOC(C)(C)C2)cc1C 174353113 BFCOZDCPQIBBOT-UHFFFAOYSA-N 292.423 2.209 10 20 CECD O=c1ccc([N+](=O)[O-])cn1CCSc1nccs1 121902827 AEKYMLBOWGOULX-UHFFFAOYSA-N 283.334 2.005 10 20 CECD C[C@H]1SCC[C@H]1NCc1cc2c(cc1O)OCO2 381036920 UUDQIDPWVNUDRK-PSASIEDQSA-N 267.350 2.105 10 20 CECD COc1ccc(N2CCN(CCOC(C)C)CC2)cc1F 84866654 UGKHCMUOSBFBQJ-UHFFFAOYSA-N 296.386 2.381 10 20 CECD CCCOc1ccc(CNCC2(C)OCCCO2)c(O)c1 192251097 ZCEIMYBZZYLWGR-UHFFFAOYSA-N 295.379 2.424 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCN[C@@H]1C 92954119 BKFQCUQWGSKQFQ-CZUORRHYSA-N 289.423 2.099 10 20 CECD CCOC1(C)CCN(C(=O)c2cccc(O)c2O)CC1 293673523 NWCRJIGKWIIRRU-UHFFFAOYSA-N 279.336 2.129 10 20 CECD COCCC[C@@H](C)C(=O)NCc1ccccc1O 272439786 ZWGVVSICRSNSKE-LLVKDONJSA-N 251.326 2.071 10 20 CECD CCCCN(CCOC)C(=O)/C=C/c1ccc(O)c(O)c1 272369960 DEUGJZIZJFBKGM-SOFGYWHQSA-N 293.363 2.386 10 20 CECD Cc1cccc(CNC[C@@](C)(O)c2ccco2)c1O 271846877 RZAVVLPKPVTNCM-OAHLLOKOSA-N 261.321 2.291 10 20 CECD COC[C@@H](C)NC1CCN(c2ccc(OC)cc2)CC1 371796191 LINIHIHSULBFTC-CYBMUJFWSA-N 278.396 2.289 10 20 CECD COc1cccc(CN(CC2CCC2)[C@H](C)CO)c1O 289347217 IPOMDWJPEOVSLL-GFCCVEGCSA-N 279.380 2.384 10 20 CECD CCN(CC)C1CCN(C(=O)c2cccc(O)c2O)CC1 384226504 ADYDRZSLYAOVLQ-UHFFFAOYSA-N 292.379 2.044 10 20 CECD CCCN(Cc1nn(CC)nc1C)c1ccc(CN)cc1 296700171 IDLIVMJVOBSMFD-UHFFFAOYSA-N 287.411 2.482 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](n3cc(C)cn3)C2)c1 291014683 XEFMTEUUWSBPAW-CQSZACIVSA-N 287.363 2.353 10 20 CECD CCOc1cccc(CN2CCOCC(F)(F)C2)c1O 290215917 RBRPYKHSAMDCHZ-UHFFFAOYSA-N 287.306 2.258 10 20 CECD C[C@H]1CC[C@@H](CCC(=O)NCc2ccc(N)cc2)O1 297264641 RZKDCHCVFTZUNH-FZMZJTMJSA-N 262.353 2.233 10 20 CECD Nc1ccc(NC(=O)C2CCN(C3CC3)CC2)cc1 818556235 DBADMESEWTZSKJ-UHFFFAOYSA-N 259.353 2.082 10 20 CECD CC[C@H](CS(=O)(=O)Nc1ccc(O)c(Cl)c1)OC 817356951 ZPOZMPSHGJXPKC-SECBINFHSA-N 293.772 2.212 10 20 CECD O=C1NCCN(Cc2ccccc2O)c2ccccc21 811508385 OBBJDZKSEHXFHD-UHFFFAOYSA-N 268.316 2.142 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](n2cc(C)cn2)C1 811518133 HNPHALSOLYVZGV-CYBMUJFWSA-N 287.363 2.353 10 20 CECD Cc1ncc2n1CC[C@H](C(=O)N[C@H](C)c1ccccc1O)C2 827946460 IOFRUYDBVNYJAY-YPMHNXCESA-N 299.374 2.337 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1ccco1 588432739 KZUNTMACJZYSNS-JPVGGKMYSA-N 287.315 2.451 10 20 CECD COc1cccc([C@@H](C)NCC2CCOCC2)c1O 846142715 VRZKYHYUPHWOCG-LLVKDONJSA-N 265.353 2.478 10 20 CECD CN(C)c1ccc(CN2CCC(C)(N)CC2)cc1F 843108107 RLGYZYYLLXHVGA-UHFFFAOYSA-N 265.376 2.205 10 20 CECD C[C@]1(CNC(=O)NCCc2ccc(N)cc2)CCCS1 841861130 STXVHHUOSYVUDT-OAHLLOKOSA-N 293.436 2.396 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)[C@H]2CCCNC2)c1 841033733 VEPZQUCIUWJKCM-OLZOCXBDSA-N 278.396 2.269 10 20 CECD CC(C)N1CCC[C@@H](OC(=O)c2cc(O)cs2)C1=O 748191691 SOYLFRQGXNRNMV-SNVBAGLBSA-N 283.349 2.010 10 20 CECD CCOc1cccc(CNC2(C)CCNCC2)c1O 841064390 FTQLHVJKSMOMBM-UHFFFAOYSA-N 264.369 2.023 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@@H](C)N1 843049199 JDWNVFMQFWRKHM-DTORHVGOSA-N 272.751 2.367 10 20 CECD CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@H](CC)CO1 846373853 FYPCBRCAESRBBO-VXGBXAGGSA-N 293.363 2.436 10 20 CECD CCc1cccc(CN2C[C@@H](C)S(=O)[C@H](C)C2)c1O 848905469 IBKUNVIVORYZJV-VXGBXAGGSA-N 281.421 2.296 10 20 CECD CC[C@H](NCCN1CCCC1=O)c1ccc(F)cc1O 846206589 QILIWYFYXOEWHF-ZDUSSCGKSA-N 280.343 2.194 10 20 CECD COc1cccc(CNCc2cc(C3CC3)n(C)n2)c1O 922957428 WXDQMEWELZVXFP-UHFFFAOYSA-N 287.363 2.302 10 20 CECD Nc1ccc(CCNC(=O)Nc2ccc(C3CC3)nn2)cc1 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276.384 2.074 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCN2CCC[C@@H]2C1 708480834 MMVBBCIELRXWNJ-CHWSQXEVSA-N 282.334 2.387 10 20 CECD CCC[C@H](CNC(=O)Nc1ccc(N)cc1)OC 378687440 FZJFNUOHXBODGE-GFCCVEGCSA-N 251.330 2.205 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](O)C[C@H]2C)c1O 384957719 RCWKPYKVBCRYOH-PELKAZGASA-N 283.755 2.203 10 20 CECD COc1ccc(O)c(CNC(=O)CC[C@H]2CC[C@H](C)O2)c1 173579394 PCESSTIRBWTKBV-WCQYABFASA-N 293.363 2.365 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CCc3[nH]ncc3C2)c1 186115134 ZVOMIEFVOHYSTR-PWSUYJOCSA-N 287.363 2.332 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccccc1O 183447235 OABZPUZUQYWSTC-SNVBAGLBSA-N 287.315 2.164 10 20 CECD C[C@H](NCCCCN1CCC[C@@H]1CO)c1ccccc1O 183506377 ZCZQCRCPATTXBT-LSDHHAIUSA-N 292.423 2.280 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1ccc(C)cc1O 185511762 PLIVAYKIDZMTGZ-UHIISALHSA-N 269.410 2.464 10 20 CECD Oc1ccccc1CN1CCC(O)(C(F)(F)F)CC1 136855316 FHKZUOIINYBFMS-UHFFFAOYSA-N 275.270 2.281 10 20 CECD Oc1ccc(Cl)c(F)c1CNc1nc2ncccn2n1 195035037 SFALPMDBAFKVAR-UHFFFAOYSA-N 293.689 2.235 10 20 CECD C[C@@H](CCNC(=O)c1cccc(O)c1O)N1CCCCC1 193161583 TYPWODWUFYWFIS-LBPRGKRZSA-N 292.379 2.092 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H](O)C2)cc1 266886453 CFIOPYIPMFNOED-MRXNPFEDSA-N 284.359 2.301 10 20 CECD CCC(O)(CC)CCNC(=O)/C=C/c1ccc(O)c(O)c1 276418068 ITAIVQWOUXIRLD-SOFGYWHQSA-N 293.363 2.168 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCCC[C@H]2O)c1 273359367 AEBBDKCEVHSEHU-PSOPSSQASA-N 293.363 2.133 10 20 CECD Cc1nnc(CN(C)c2ccc3c(c2)OCO3)s1 271539159 JRWRYWBQIICQJB-UHFFFAOYSA-N 263.322 2.212 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)CC(C)C)c1O 278240719 NTAUZURTBRVEKO-UHFFFAOYSA-N 268.313 2.397 10 20 CECD CCOc1ccc(O)c(CNCCC(C)(C)CO)c1 294878793 VIGBXVCXPKXGDN-UHFFFAOYSA-N 267.369 2.289 10 20 CECD O=C(NCc1ccccc1O)c1ccc2oc(O)nc2c1 806717339 GNMGVJRHNZTABM-UHFFFAOYSA-N 284.271 2.169 10 20 CECD CCn1ccnc1[C@H](C)NCc1c(O)cccc1OC 825006204 ZZBOJJDQXDAWNI-NSHDSACASA-N 275.352 2.468 10 20 CECD COc1cc(O)c(CN[C@@H](C)[C@@H](OC)C2CC2)cc1OC 825099085 UKZKLCOWMGNQOW-MGPLVRAMSA-N 295.379 2.313 10 20 CECD CCOc1ccc(O)c(CN[C@H](CC)[C@H](C)O)c1 824921613 OGKPWJUAWNVUQG-GXFFZTMASA-N 253.342 2.040 10 20 CECD CN(C(=O)/C=C\c1cnn(C)c1)c1ccc(Cl)cn1 736482430 SELXEGIJNIKYTL-UTCJRWHESA-N 276.727 2.145 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCC[C@H]1O)c1ccc(N(C)C)cc1 838560243 VFROEEXBDTZGHJ-KCPJHIHWSA-N 291.395 2.026 10 20 CECD C[C@]1(CCCO)CCCN1C(=O)c1cc(O)cs1 831544522 YQRRQBIYJSQARK-CYBMUJFWSA-N 269.366 2.221 10 20 CECD COc1cc(O)c(CNCCC[C@H]2CCCN2)cc1OC 841072422 JYCDKQIKFXQFPX-ZDUSSCGKSA-N 294.395 2.031 10 20 CECD Oc1c(Cl)cccc1CNCC[C@@]1(O)CCCOC1 846110280 XSMANXQRFUYMHA-AWEZNQCLSA-N 285.771 2.067 10 20 CECD Cc1cccc(CN2C[C@@H]3CCC[C@]3(CN)C2)c1O 844902926 XTVVHSWATQJQNQ-HOCLYGCPSA-N 260.381 2.261 10 20 CECD CSCCCN(C)c1ccc(OCC(=O)O)cc1 846280222 VJRCWSQCXGUUQB-UHFFFAOYSA-N 269.366 2.339 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H](C)C(=O)O 848585389 LJCDIMURNHLOCH-NSHDSACASA-N 294.351 2.035 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)CC(C)(C)N 849350538 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COc1ccc(N(CC2CC2)C[C@@H]2CN(C)C(=O)O2)cc1 1117761555 WVEUBVYNIURZBF-HNNXBMFYSA-N 290.363 2.362 10 20 CECD CO[C@H](C)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773012098 FWGJZRSBMQAZBF-NEPJUHHUSA-N 264.369 2.355 10 20 CECD Cc1ccc(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)c(O)c1 877473621 NWHFMBHXZOGYPS-FVGIMDHTSA-N 267.394 2.042 10 20 CECD CC(=O)N1CCC(CN[C@@H](C)c2c(O)cccc2F)CC1 886524757 QFWUNWAFSAAIHK-NSHDSACASA-N 294.370 2.440 10 20 CECD C[C@H](N[C@H]1C[C@H]2CCCCN2C1=O)c1c(O)cccc1F 886623314 ARNSBIDPOSIYCK-LOWVWBTDSA-N 292.354 2.335 10 20 CECD Cc1nc(C(=O)NCc2ccccc2O)sc1C 770322914 SCVGBSKTMXMHBV-UHFFFAOYSA-N 262.334 2.396 10 20 CECD COC(=O)C[C@H](NCc1ccc(N(C)C)cc1)C1CC1 785791672 HWEMWVWSLVOBLG-HNNXBMFYSA-N 276.380 2.184 10 20 CECD COCC1CN(Cc2cccc(Br)c2O)C1 895971832 USHRFUROEDFYPT-UHFFFAOYSA-N 286.169 2.233 10 20 CECD C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)C(F)(F)F 783922549 HZRDURGRWJDLQK-LURJTMIESA-N 292.209 2.022 10 20 CECD CCO[C@H]1CCN(c2cc(OC)c(OC)cc2[N+](=O)[O-])C1 896406173 ZVNUUXISZLTOJL-JTQLQIEISA-N 296.323 2.227 10 20 CECD CCOC(=O)[C@@H](NCc1cc(OCC)ccc1O)C1CC1 1326220247 UWDFIDPJMJPXCL-HNNXBMFYSA-N 293.363 2.222 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccsc2C1 712276473 HVSJAIXYUGGGQI-UHFFFAOYSA-N 275.329 2.358 10 20 CECD O=C(O)CCCCCNCc1ccc2c(c1)CCO2 756299324 WQKHRWRHMLZZES-UHFFFAOYSA-N 263.337 2.356 10 20 CECD COc1cc(Cl)cc(CN[C@@H](CO)CC2CC2)c1O 761216616 UVNIGWBQEXOAPG-GFCCVEGCSA-N 285.771 2.305 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)CCC(F)(F)F)c1 1331572565 APPVDKMMKQVMCP-UHFFFAOYSA-N 297.298 2.072 10 20 CECD C[C@H]1C[C@H]1c1nnc(N(C)Cc2ccccc2O)n1C 1355655253 ZBWCGZJDLATZLN-CMPLNLGQSA-N 272.352 2.281 10 20 CECD Cc1cc(CNCc2c(O)cccc2F)oc1C(=O)O 1600208321 AYZXOYMAKXQCLE-UHFFFAOYSA-N 279.267 2.421 10 20 CECD C[C@H](CN[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 1589067279 GXCRBNCGCYKYPS-GHMZBOCLSA-N 250.342 2.124 10 20 CECD C[C@H](N[C@@H]1COC(C)(C)C1)c1cc(C(=O)O)ccc1O 1593232833 PHHJOKKXHDJKRH-ONGXEEELSA-N 279.336 2.309 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2nncn2C)cc1 159163371 QQWWXKJTXYYTOG-UHFFFAOYSA-N 295.346 2.475 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)c1cnn(C)c1 44495342 NRFKHBXXEQWOAV-LBPRGKRZSA-N 258.369 2.337 10 20 CECD COc1ccc(CN[C@@H](C)C(=O)NC(C)(C)C)cc1C 67502550 NLSZLFAIFSLDHF-LBPRGKRZSA-N 278.396 2.396 10 20 CECD COCc1ccccc1C(=O)NCc1ccccc1O 701130668 IKAYFKIEZNFLJB-UHFFFAOYSA-N 271.316 2.469 10 20 CECD CCC1(NCc2cc3c(cc2O)OCO3)CCOCC1 389367064 YNCDNXHXJUPTDU-UHFFFAOYSA-N 279.336 2.170 10 20 CECD O=C(O)CCC(=O)NCc1c(O)ccc2ccccc12 8021154 JQKLVUDPAZDMPQ-UHFFFAOYSA-N 273.288 2.026 10 20 CECD CCCCNCc1ccc(N2CCN(C)CC2)cc1 107797369 JNJGTFGSZBUUDJ-UHFFFAOYSA-N 261.413 2.328 10 20 CECD CCN(CC)c1ccc(CNC(=O)CNCC2CC2)cc1 178712297 DINXUKJXLAMSEH-UHFFFAOYSA-N 289.423 2.149 10 20 CECD COCCCCN(C)Cc1ccc(N2CCOCC2)cc1 118000225 YDSRFVNHKLONDE-UHFFFAOYSA-N 292.423 2.382 10 20 CECD O=C(c1cccc(O)c1O)N1CCOc2cc(F)ccc21 185688018 MPTZNBJBNSCGQD-UHFFFAOYSA-N 289.262 2.276 10 20 CECD CCOC(=O)[C@@H](C)[C@H](C)NCc1ccccc1O 185220131 NDLZYQDUEIZHKD-QWRGUYRKSA-N 251.326 2.070 10 20 CECD CC[C@H](N[C@@H](C)C(=O)N(C)C)c1ccc(N(C)C)cc1 188995760 LFPGBGPENBMODQ-WFASDCNBSA-N 277.412 2.270 10 20 CECD Cc1nccn1C[C@H](C)CNCc1cc(F)ccc1O 180427911 MYAHBZVLZZHNHI-LLVKDONJSA-N 277.343 2.462 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccoc1 180705459 IYKPDRFVCSZVQW-DUXPYHPUSA-N 259.261 2.020 10 20 CECD Oc1ccccc1CNC[C@H](O)COc1ccc(F)cc1 134227649 FJQLWOMGRIGMQI-AWEZNQCLSA-N 291.322 2.061 10 20 CECD C[C@@H](CO)N[C@@H](C)c1cc(Br)c(F)cc1O 134925975 SHKGBUCMWJMMOY-BQBZGAKWSA-N 292.148 2.325 10 20 CECD COc1ccc(O)c(CNC[C@@]2(O)CCCC2(C)C)c1 293696882 REAJYKFENPSUEE-INIZCTEOSA-N 279.380 2.432 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@H]2CC[C@H]1O2 264985627 AANGISWAUKIYHS-OWCLPIDISA-N 288.391 2.279 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](O)C2)c(C(F)(F)F)c1 279546514 DDOZRRLGTUOAJP-GFCCVEGCSA-N 288.313 2.338 10 20 CECD CC[C@H](NC[C@H](COC)OC)c1ccc(C)cc1O 280269073 XSTPRBNEUPVDIO-OCCSQVGLSA-N 267.369 2.403 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCC[C@@H](C(=O)O)C1 386498820 PUKSGFDTCIFEJK-NWDGAFQWSA-N 291.347 2.242 10 20 CECD CCOc1ccc(O)c(CN(C)CCCN(C)C)c1 809729881 QVNXPLPXFRNBFB-UHFFFAOYSA-N 266.385 2.174 10 20 CECD CCOc1cccc(CN2CCC[C@H](CO)CC2)c1O 293868075 CJMJTZHRUUPYCS-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD FCCOCCNCc1ccc2c(c1)CCCO2 922267149 LTKFWFOBOZTILG-UHFFFAOYSA-N 253.317 2.087 10 20 CECD Cc1ccc([C@@H](C)NCC2(CC(N)=O)CC2)c(O)c1C 817585786 IABJJIXBBCILIE-GFCCVEGCSA-N 276.380 2.315 10 20 CECD CCNCCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 817952018 MVESDTPSQWGSNJ-GXSJLCMTSA-N 252.333 2.279 10 20 CECD CCOC(CSc1ncc(C(=O)OC)s1)OCC 829678065 XYDDDDXCAWXQOZ-UHFFFAOYSA-N 291.394 2.421 10 20 CECD COCc1cc(Sc2ncc(C(=O)OC)s2)ncn1 828429539 XWVMCVAXMDHTBX-UHFFFAOYSA-N 297.361 2.017 10 20 CECD CC(C)CCC(=O)NCC(=O)N[C@H](C)c1ccccc1O 827931099 XXLKNFFFOSPETN-GFCCVEGCSA-N 292.379 2.122 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)C(C)(C)CN)cc1 826019829 LCWLFAWLIPGWRD-UHFFFAOYSA-N 291.439 2.476 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](OC(=O)N(C)C)C2)c1 824615214 CACDUTZFKCWTKX-AWEZNQCLSA-N 292.379 2.363 10 20 CECD C[C@H](NC[C@H]1CCN1C)c1cc(F)cc(F)c1O 903319430 ZFEUBZNZJCAFFE-WCBMZHEXSA-N 256.296 2.025 10 20 CECD CCOc1ccc(O)c(CNC2(CC(=O)O)CCC2)c1 833662614 HZELGIZXRGLAEB-UHFFFAOYSA-N 279.336 2.278 10 20 CECD Cc1csc(CCNC(=O)c2cc(O)cs2)n1 732267160 CJQNTROPGUZKKS-UHFFFAOYSA-N 268.363 2.191 10 20 CECD O=C(c1cc(O)cs1)N1CCn2c1nc1ccccc12 732268942 TXIGGZFYBHZTLZ-UHFFFAOYSA-N 285.328 2.464 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnc[nH]1 839917448 DEBOLWPHSHKQRU-GFCCVEGCSA-N 286.379 2.145 10 20 CECD O=C(O)C1(C(=O)NCc2cc(Cl)ccc2O)CCCC1 911332743 YNBIPFHOLYIQRN-UHFFFAOYSA-N 297.738 2.307 10 20 CECD C[C@@H](NCCN1CCCC1=O)c1ccc(Cl)cc1O 846206915 VSKBRBYDWIONNT-SNVBAGLBSA-N 282.771 2.319 10 20 CECD CSCCCCC(=O)NCc1ccc(O)cc1O 910950541 HGUHFHHKLYOXKC-UHFFFAOYSA-N 269.366 2.247 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C)C[C@@H]1C(N)=O 840939059 KFBUKRQVGVKLLK-BLLLJJGKSA-N 289.423 2.147 10 20 CECD C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)Nc1ccc(N)cc1 841299621 LNDKCTQRFHWYGR-WFASDCNBSA-N 288.395 2.359 10 20 CECD NC[C@H]1CC[C@H](NCc2cc(Cl)cc(F)c2O)C1 841084653 MNQSMHHSVMEDJH-KWQFWETISA-N 272.751 2.402 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1ccc2c(c1)CCCO2 921996794 IHAUCGGDDIVJBJ-NVXWUHKLSA-N 291.391 2.295 10 20 CECD C[C@]1(CNCc2ccc3c(c2)CCO3)CCCNC1 841057957 UCPMTYXFDDQOLR-INIZCTEOSA-N 260.381 2.101 10 20 CECD CC[C@H](COC)NC(=O)NCc1cc(Cl)ccc1O 845003716 PGTPTUJXKYBQJT-LLVKDONJSA-N 286.759 2.270 10 20 CECD C[C@H](NCC1(N)CCCC1)c1ccc(F)cc1O 854222686 KHCRNLWBJKECKU-JTQLQIEISA-N 252.333 2.453 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(=O)NCC(C)(C)C)c1 859233955 ZSVXSFNAEZKYKQ-LLVKDONJSA-N 294.395 2.214 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1ccc(OC)c(C)c1 759173562 QBOWMISSNDHGEC-GOEBONIOSA-N 279.380 2.287 10 20 CECD CCOc1ccc(CN2CC[C@H](C)[S@](=O)CC2)c(O)c1 763489595 WGYGJDZCQCTKPD-FKIZINRSSA-N 297.420 2.134 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCSC2)cc1 761837032 VFBIJIUETALAFY-GFCCVEGCSA-N 264.394 2.122 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1cscn1 935945291 RYNWJIFMVUGERR-UHFFFAOYSA-N 297.376 2.193 10 20 CECD CN(Cc1cccc(O)c1)C(=O)/C=C\c1ccc(O)c(O)c1 779530869 IGBCJRGCZKJMCT-VURMDHGXSA-N 299.326 2.475 10 20 CECD COC(=O)[C@@H]1CN(Cc2c(C)cccc2O)C[C@H]1C1CC1 877616171 FECQFKMEFPKMJO-LSDHHAIUSA-N 289.375 2.332 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCn3ccnc3C2)c1 778190570 ZXQOJYIXJYRJNF-ZDUSSCGKSA-N 287.363 2.092 10 20 CECD CCC1=C(C(=O)NCc2cccc(O)c2O)CCCO1 1123978616 VRALNHBWLFNNRZ-UHFFFAOYSA-N 277.320 2.189 10 20 CECD CCN(C)c1ccc(CN2C[C@H](C)S(=O)[C@@H](C)C2)cc1 773887627 GFZFLPFDHYJZJE-KBPBESRZSA-N 294.464 2.484 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@H]2C=CCC2)c1O 895528676 ZZTATENOQSOKHN-JTQLQIEISA-N 278.308 2.365 10 20 CECD COc1ccc(CNC(=O)CC(C)(C)C)c(O)c1 794381862 PSTRLFIBBNXECG-UHFFFAOYSA-N 251.326 2.453 10 20 CECD Cc1nnc(NCc2c(O)ccc(Cl)c2F)n1C 790245528 LYOAOMAPJVKXHE-UHFFFAOYSA-N 270.695 2.234 10 20 CECD CC[C@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(C)cc1O 794819666 XBGHBDVXSJFHAL-YPMHNXCESA-N 285.409 2.174 10 20 CECD CCOc1cccc(CNC[C@@H](C)COC)c1O 45656371 BVOPIQQUBUYVEG-LLVKDONJSA-N 253.342 2.163 10 20 CECD CCC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)OC 83459575 HKNWQODMLGZQDE-CYBMUJFWSA-N 263.337 2.053 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCC[C@H]2C(=O)OC)c1 1320838542 XOOBIILUXIDZOH-ZIAGYGMSSA-N 293.363 2.222 10 20 CECD Cn1ccnc1[C@@H]1CCCN(Cc2ccc(N)cc2)C1 1335287803 BLXQCJJVJYWYNK-CQSZACIVSA-N 270.380 2.382 10 20 CECD CCN(Cc1c(O)cccc1OC)C[C@@H]1CCCO1 769030966 ZBRQSRWLOSLRPU-LBPRGKRZSA-N 265.353 2.402 10 20 CECD COC(=O)[C@]12CCC[C@H]1CN(Cc1ccc(N)cc1)C2 1334774780 NUGOZTSAEVMHOP-BBRMVZONSA-N 274.364 2.044 10 20 CECD CN(C)c1cc(F)c(CNC2CC(CC(=O)O)C2)cc1F 1332493232 PCGNNBBJSJPSNU-UHFFFAOYSA-N 298.333 2.374 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCC[C@H](F)C2)c(O)c1 1349078221 YEUWXDDGZZZTLN-NWDGAFQWSA-N 296.342 2.481 10 20 CECD Oc1cc(F)c(Cl)cc1CN[C@H]1C[C@H]2CC[C@@H]1N2 1580888717 WVLZCCIMFPPASU-ZHAHWJHGSA-N 270.735 2.167 10 20 CECD CC1CC(CN[C@H](C)c2cccc(-c3nn[nH]n3)c2O)C1 1590194174 QGXHOCRVWJNFPF-HSOILSAZSA-N 287.367 2.269 10 20 CECD C[C@@](O)(CSc1ncc(C(=O)O)s1)C(F)(F)F 1593419472 KZFZARHTHILMTF-SSDOTTSWSA-N 287.284 2.247 10 20 CECD CN1CCN(c2ccc(NCc3ccccc3O)cn2)CC1 162920762 HJUKKHOFNSSIEO-UHFFFAOYSA-N 298.390 2.151 10 20 CECD O[C@H](CNCc1ccc2c(c1)CCO2)CC(F)(F)F 818996268 CYJIXTSZBBJWHC-NSHDSACASA-N 275.270 2.024 10 20 CECD C[C@@H]1C[C@H](C(=O)N[C@H](C)c2ccccc2O)CCO1 827940942 LINNASZYZQSTHM-IJLUTSLNSA-N 263.337 2.385 10 20 CECD COc1ccc(N(C)Cc2nnn(C(C)(C)C)n2)cc1 847010065 TVXJKSOEOGEYAY-UHFFFAOYSA-N 275.356 2.073 10 20 CECD COc1cc(NC(=O)c2cccc(O)c2O)ccc1F 160406884 AMOYMQHXSUHKKH-UHFFFAOYSA-N 277.251 2.498 10 20 CECD C[C@H](N[C@H](C)c1nncn1C)c1ccc(N(C)C)cc1 37293642 KVZYSNHQQIYQLY-NWDGAFQWSA-N 273.384 2.293 10 20 CECD C[C@@H](N[C@H](C)c1ccc(F)cc1O)c1ncn(C)n1 275802446 YNGJADDUCWSGBN-RKDXNWHRSA-N 264.304 2.072 10 20 CECD CC[C@@H](CNCc1ccc(N2CCOCC2)cc1)OC 313519912 LNYQQOKZYXVWKV-INIZCTEOSA-N 278.396 2.038 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@H]1C(=O)O 383286500 UIARZGKNIBWYNO-IUODEOHRSA-N 276.380 2.295 10 20 CECD Oc1c(Cl)cccc1CNCCc1cnccn1 390072581 VJKVCLZDIXTTLJ-UHFFFAOYSA-N 263.728 2.168 10 20 CECD C[C@@H]1C[C@@H](C)CN(C(=O)CN(C)Cc2ccccc2O)C1 111236503 NGMNSPGTJYXLGY-ZIAGYGMSSA-N 290.407 2.329 10 20 CECD COc1cccc(CNC(=O)Nc2ccnc(C)c2)c1O 119241202 ZHYFTMXOJWYCMK-UHFFFAOYSA-N 287.319 2.426 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccncc1 173191332 HSOBJWMCJRLVRD-UHFFFAOYSA-N 283.331 2.187 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NOCC(C)C 128009175 WHGCESUTGZUCJZ-UHFFFAOYSA-N 279.384 2.448 10 20 CECD C[C@H](NC[C@]1(O)CCSC1)c1ccc(F)c(F)c1O 187744902 QJKVNZLEHFXMHY-ISVAXAHUSA-N 289.347 2.189 10 20 CECD CCOC1CC(C(=O)N(C)Cc2ccccc2O)C1 287363544 ZBLZPLCJRKZKGN-UHFFFAOYSA-N 263.337 2.166 10 20 CECD CC[C@H](C)N(CC(=O)O)Cc1ccc(N(C)C)cc1 86752182 LLJNPCKVFLHMEK-LBPRGKRZSA-N 264.369 2.438 10 20 CECD COc1ccc(O)c(CNC[C@]2(O)CCCC2(C)C)c1 293696884 REAJYKFENPSUEE-MRXNPFEDSA-N 279.380 2.432 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]2CC[C@H]1C2 246531805 GCVXZSCVSOLBPQ-ZMLRMANQSA-N 261.321 2.150 10 20 CECD C[C@@]1(CNC(=O)NCc2ccccc2O)CCCS1 268207991 JMJXBNACMIJDTP-AWEZNQCLSA-N 280.393 2.477 10 20 CECD COc1ccc(O)c(CN[C@H](CO)c2ccc(F)cc2)c1 271798418 IIMDSONRZDQSOP-OAHLLOKOSA-N 291.322 2.363 10 20 CECD Cc1ccc([C@@H](O)CNCc2cc(F)ccc2O)o1 272366171 FXWOOCTVCDDYRT-ZDUSSCGKSA-N 265.284 2.256 10 20 CECD CO[C@@H]1CCC[C@H](CC(=O)NCc2ccc(O)c(O)c2)C1 279940750 OMYPOIMPFLCWAF-WCQYABFASA-N 293.363 2.309 10 20 CECD C[C@H](NC[C@]1(N(C)C)CCSC1)c1ccccc1O 272931967 ZQRYRUNWPUVEKW-SWLSCSKDSA-N 280.437 2.480 10 20 CECD C[C@H](N[C@@H]1C[C@@H](O)C1(C)C)c1cc([N+](=O)[O-])ccc1O 275335897 NVPXGEDFJHARPQ-ZEGGKSINSA-N 280.324 2.110 10 20 CECD COc1ccc(O)c(CNCC2(CCO)CCCC2)c1 271767564 ASLBLCMKWWSVIN-UHFFFAOYSA-N 279.380 2.433 10 20 CECD C[C@H]1C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CCO1 271206690 KKMDBDRXSILWOZ-JSGCOSHPSA-N 291.395 2.119 10 20 CECD Cc1ccc(C(=O)N2CCC[C@H]2c2ncc[nH]2)c(O)c1O 373311382 PZAQWKLVDAOFME-NSHDSACASA-N 287.319 2.107 10 20 CECD C[C@H](NC(=O)NC(C)(C)CCN)c1ccc(N(C)C)cc1 817875900 BCUBXFGGCLWFKH-LBPRGKRZSA-N 292.427 2.240 10 20 CECD C[C@@H]1C[C@@H](C(=O)O)CN(Cc2ccc(N(C)C)c(F)c2)C1 817881618 MFPGKOGRSYSQRM-DGCLKSJQSA-N 294.370 2.434 10 20 CECD C[C@@H](CCCN)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 817977287 GSBQWPLCSUFZEM-UWVGGRQHSA-N 267.329 2.078 10 20 CECD C[C@@H](CCCN)N[C@H](C)c1cc(F)cc(F)c1O 817977253 FQCVEMUFUAJRFJ-DTWKUNHWSA-N 258.312 2.448 10 20 CECD CN(Cc1cnc[nH]1)Cc1cc(Cl)cc([N+](=O)[O-])c1O 826769781 RFZWREOVQAMVLM-UHFFFAOYSA-N 296.714 2.309 10 20 CECD CCC(CC)(CO)C(=O)N[C@H](C)c1ccccc1O 827952125 GXGYVVCJCHPYHX-LLVKDONJSA-N 265.353 2.368 10 20 CECD C[C@@H](NCCCON)c1ccc(Br)cc1O 902422983 IAJWTJVXHXIZTB-MRVPVSSYSA-N 289.173 2.086 10 20 CECD Cc1cc(O)c(CN2CCC(CC(N)=O)CC2)cc1Cl 824575976 WEKITRMXFDDMPK-UHFFFAOYSA-N 296.798 2.441 10 20 CECD C[C@@H]1CCC[C@@H](C)N1C(=O)COC(=O)c1cc(O)cs1 731909623 GKSJEZQWNXRTQR-NXEZZACHSA-N 297.376 2.400 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)[C@@H](C(=O)O)C2)cc1C 832899467 OIIPGVAGBLLPGV-AAEUAGOBSA-N 263.337 2.162 10 20 CECD CCc1cc(C(=O)NCc2ccc(N(C)C)cc2C)n[nH]1 734467773 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Cc1cc(N(C)C)ccc1CN[C@@H](CO)CC(F)(F)F 840938035 YUUYPJPARQHVBU-GFCCVEGCSA-N 290.329 2.464 10 20 CECD COc1ccc(O)c(CNC[C@H](N)c2ccccc2)c1 841034110 ALMFMWMMNQMCHB-HNNXBMFYSA-N 272.348 2.190 10 20 CECD COC[C@H](C)CC(=O)NCc1cc(Cl)ccc1O 846477562 UYAABEYWFPGBKZ-SECBINFHSA-N 271.744 2.334 10 20 CECD CC(C)(C)n1nnc(CNCc2cccc(Cl)c2O)n1 848924171 WGMFKWVNAYTQCU-UHFFFAOYSA-N 295.774 2.077 10 20 CECD CCC/C=C/C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 852792483 XEVIEDZPDUWBHC-LQYUOIDQSA-N 275.396 2.225 10 20 CECD Cc1ccc(CCNC(=O)NCc2cc(C)ccc2O)nc1 858530127 VXQUTOASCYIHSK-UHFFFAOYSA-N 299.374 2.446 10 20 CECD CN(C)c1cc(F)c(CNCCOCCF)cc1F 858195862 DOYAUODYSNDIPK-UHFFFAOYSA-N 276.302 2.107 10 20 CECD Cc1nccnc1CN(C)c1ccc2c(c1)OCO2 857038017 FFSNZHLZAABELN-UHFFFAOYSA-N 257.293 2.150 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@@](C)(O)C1CC1 755907302 YCLPBSYAXYVULR-QGZVFWFLSA-N 290.407 2.228 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCC1(O)CCC1 865905154 YUILAEQRRNBLCO-UHFFFAOYSA-N 290.407 2.372 10 20 CECD C[C@@H](NC(=O)/C=C/c1cn(C)cn1)c1ccc(N(C)C)cc1 935465363 QJRRJRGOVPKAEJ-UTSBKAFOSA-N 298.390 2.377 10 20 CECD CCCCN(CC)Cc1cc2c(cc1O)OC[C@@H]2O 768441275 IRQCWBQAUQNRQB-AWEZNQCLSA-N 265.353 2.440 10 20 CECD CN(C)c1ccc(CN[C@]2(C)CC(C)(C)OC2=O)cc1 930872511 MEUKQYLITICWEV-MRXNPFEDSA-N 276.380 2.326 10 20 CECD COc1ccc(CNC2CC(OC(C)C)C2)c(O)c1 769937687 QLWUNCIWBTWQBM-UHFFFAOYSA-N 265.353 2.446 10 20 CECD Oc1ccc(F)cc1CNC[C@H]1CCCN1CC(F)F 862469136 ZNHSVMVIXGIBKB-GFCCVEGCSA-N 288.313 2.350 10 20 CECD CCCS(=O)(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773083917 LTNOINICTMZBGY-NSHDSACASA-N 270.398 2.143 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C)[S@](=O)CC2)cc1 773888644 LEHUWWJCMCMIRO-VBKZILBWSA-N 294.464 2.486 10 20 CECD CCOC(=O)C1(CNCc2cccc(Cl)c2O)CC1 770666238 WRMSQLDGPOLFIC-UHFFFAOYSA-N 283.755 2.479 10 20 CECD O=C1N[C@@H](c2cccc(F)c2O)N2CCc3ccccc3[C@H]12 877856653 TVLZBNVGOAZZQK-GDBMZVCRSA-N 298.317 2.259 10 20 CECD C[C@@H](NCC1(CS(C)(=O)=O)CCC1)c1ccccc1O 775131917 ZBZFPGAZWMYBNI-GFCCVEGCSA-N 297.420 2.258 10 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2.123 10 20 CECD C[C@H](NC(=O)c1cc(N)ccn1)c1ccc(N(C)C)cc1 1521335070 LKMCVSPIZINONV-NSHDSACASA-N 284.363 2.221 10 20 CECD CC(C)(C)OC(=O)N[C@@H]1C[C@@H]1C(=O)Nc1ccc(N)cc1 1575233585 TUKGYEVWJXRGRT-NWDGAFQWSA-N 291.351 2.121 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1c(C)cc(OC)cc1O 1589441067 IXLUNIGMTXOMMI-LBPRGKRZSA-N 267.325 2.004 10 20 CECD CN(C)c1ccc(/C=C/c2ncncc2C(=O)O)cc1 1598314559 XUICAZAHNUSIAU-VMPITWQZSA-N 269.304 2.411 10 20 CECD COc1cc(O)c(CN(C)C[C@H]2CCCOC2)cc1OC 160162932 QEMLRAJTALPQJB-GFCCVEGCSA-N 295.379 2.268 10 20 CECD CCOCCN(CC)Cc1cccc(OC)c1O 156022666 JKYQKMAHPINQHI-UHFFFAOYSA-N 253.342 2.259 10 20 CECD Cc1cc(C(=O)N[C@@]2(C)CCOC2)c(C)n1-c1ccccn1 156763486 WPGHRVQZYMBICI-KRWDZBQOSA-N 299.374 2.398 10 20 CECD Cc1cncc(NCc2cc3c(cc2O)OCO3)c1 227604052 ULBBBGMTUCYXOQ-UHFFFAOYSA-N 258.277 2.436 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](C)CN(C)C)c1 293692560 NVTLINWRVQMVHU-RYUDHWBXSA-N 266.385 2.249 10 20 CECD OC[C@@H](CC(F)F)NCc1cc(Cl)ccc1O 717712096 BNEYIDYLMHBSBX-SECBINFHSA-N 265.687 2.151 10 20 CECD CC[C@]1(C(=O)NCCCSc2nccs2)CCNC1 119487958 IPXBQNRLCWPNDO-ZDUSSCGKSA-N 299.465 2.131 10 20 CECD COc1cccc(CNC(=O)COc2ccccc2)c1O 68488636 TYOLGIMIXSDXMW-UHFFFAOYSA-N 287.315 2.096 10 20 CECD COc1ccc(N(C)CCCCS(C)(=O)=O)cc1F 119997859 AZVNKSXJZSHDBH-UHFFFAOYSA-N 289.372 2.095 10 20 CECD C[C@@H](CC(=O)c1ccco1)NC(=O)c1cccc(O)c1O 185840557 NEIAHEWCDBUMEU-VIFPVBQESA-N 289.287 2.082 10 20 CECD CC[C@H]1CN(Cc2cc(F)ccc2O)CC[C@H]1N 300417253 NXKITIPZQWGPLB-GXFFZTMASA-N 252.333 2.091 10 20 CECD COC(=O)COc1ccc(N(C)Cc2ncc(C)o2)cc1 183811120 BKNKHPIEKIYUBT-UHFFFAOYSA-N 290.319 2.171 10 20 CECD Cc1n[nH]c(C)c1[C@@H](C)C(=O)N(C)Cc1ccccc1O 183550594 UNRWLULAZZILTO-SNVBAGLBSA-N 287.363 2.494 10 20 CECD CCN(CC)c1ccc(CNC[C@]2(OC)CCOC2)cc1 122997820 HAPOXFSVDVWTIK-QGZVFWFLSA-N 292.423 2.428 10 20 CECD Oc1ccc(F)cc1CN1CCS[C@@H]2COCC[C@@H]21 180254013 UCFLJPKMCILRFK-GXTWGEPZSA-N 283.368 2.238 10 20 CECD Cc1ncsc1/C=C/C(=O)N1CCOc2ncccc21 186712578 MIZKFPYIYPAKPV-SNAWJCMRSA-N 287.344 2.285 10 20 CECD COCCN1[C@@H](C)CN(Cc2cccc(C)c2O)C[C@H]1C 180299935 LIFCZIAHYRSGGL-GASCZTMLSA-N 292.423 2.242 10 20 CECD C[C@H](CC(=O)c1ccccc1)NC(=O)c1cccc(O)c1O 185838658 VQZIBCUEERTCCP-LLVKDONJSA-N 299.326 2.489 10 20 CECD Cc1nc(NCc2ccc(N(C)C)cc2)cc2nncn12 266061570 ZFOMTWHECNBHAH-UHFFFAOYSA-N 282.351 2.111 10 20 CECD Cc1nnc([C@H](C)NC(=O)c2ccc(C)c(O)c2O)s1 274277783 YEJYTNZYQZQXEH-ZETCQYMHSA-N 293.348 2.057 10 20 CECD COc1cc(O)c(CN[C@@H]2CCO[C@H]2C2CC2)cc1OC 362240330 VEDDMMDRWNNPNZ-WBMJQRKESA-N 293.363 2.067 10 20 CECD Cc1cccc(CNCC2(O)CCN(C(C)C)CC2)c1O 271856062 UVFMVAQWBVUJMO-UHFFFAOYSA-N 292.423 2.026 10 20 CECD Cc1ccc(C(=O)N[C@]2(C)CCO[C@H]2C2CC2)c(O)c1O 273446253 GROCJZPAMUGHEW-GOEBONIOSA-N 291.347 2.094 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@H]2C1 295638116 QLAXDYPSLKEREB-XWLWVQCSSA-N 291.322 2.355 10 20 CECD C[C@H](NCc1cc2c(cc1O)OCO2)c1ccnc(O)c1 815148478 XDKCYSTYUNOGKJ-VIFPVBQESA-N 288.303 2.072 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](CN)CC(C)C)c1 817959797 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COc1cc(O)c(CN2CCC[C@H](CO)[C@H]2C)cc1OC 840979897 VKSDWLJPABONDV-VXGBXAGGSA-N 295.379 2.002 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)[C@H](C)CN1 843120075 UKUVOLBLIZZSTL-NWDGAFQWSA-N 265.376 2.074 10 20 CECD Cc1noc(C)c1CNC[C@H](N)c1ccc(N(C)C)cc1 841044843 YZRIPNWWLVGWPJ-INIZCTEOSA-N 288.395 2.147 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)CCCO)c1O 846150471 POCPKWMVJCFMJZ-QWRGUYRKSA-N 253.342 2.212 10 20 CECD Oc1ccc(Cl)cc1CNC[C@H]1CCCCN1 841032621 IDEFCBNQKZZKAR-GFCCVEGCSA-N 254.761 2.277 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1[C@H]1CCCOC1 843929501 VKNMBCOYEVQIPM-AAEUAGOBSA-N 291.347 2.129 10 20 CECD CC(C)(C)N1CC[C@H](NC(=O)c2cc(O)cs2)C1 855286722 WJODBGOKNOIVLZ-VIFPVBQESA-N 268.382 2.056 10 20 CECD CN1CCCc2cc(CN[C@H]3CCNC3(C)C)ccc21 925531745 NEGGSCYXPIYJMI-INIZCTEOSA-N 273.424 2.299 10 20 CECD CC(=O)NCCCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756371785 MHDORTMMNUIRTA-JOYOIKCWSA-N 280.343 2.195 10 20 CECD CCN(C(=O)/C=C\c1cn(C)cn1)c1ccccc1OC 931085885 DHGCELZYWMKESU-KTKRTIGZSA-N 285.347 2.495 10 20 CECD CC[C@H](C)[C@H](C(=O)O)N(C)Cc1ccccc1O 1604921930 CXNDKCQOKOTKJJ-GXFFZTMASA-N 251.326 2.323 10 20 CECD COc1ccc(O)c(CNc2ncc(C)c(C)n2)c1 764151044 UPVYXEMOOOKPFZ-UHFFFAOYSA-N 259.309 2.420 10 20 CECD CC(=O)C1=NN(c2ccc(C)cc2Cl)C(=O)C1 871947560 DRXRPMCQLDXLMC-UHFFFAOYSA-N 250.685 2.330 10 20 CECD CCc1nc(CC(=O)N(C)c2ccc(N)cc2)cs1 877077696 RHDWHIDRRDVPPB-UHFFFAOYSA-N 275.377 2.493 10 20 CECD C[C@H](Cc1ccncc1)NC(=O)/C=C\c1ccc(O)c(O)c1 779529408 PPGBBCBOCNTAAS-KTLBGCOUSA-N 298.342 2.253 10 20 CECD C[C@H](NCCC1(CO)CC1)c1c(O)cccc1F 886620097 BRFZUATTYPNQDT-JTQLQIEISA-N 253.317 2.345 10 20 CECD Cc1ccc(CO)cc1NC(=O)c1ccc(C)c(O)c1O 780985668 ULHDQCNRACGSKZ-UHFFFAOYSA-N 287.315 2.459 10 20 CECD COC(=O)[C@H](CC(F)F)NCc1ccc2c(c1)CCCO2 893955201 BFOGVFAOYJTEAB-LBPRGKRZSA-N 299.317 2.298 10 20 CECD COc1ccc(CN2CC(C(C)C)C2)c(O)c1OC 894134595 NPYHQHNQKUACJZ-UHFFFAOYSA-N 265.353 2.497 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H]1c1ncccn1 898967479 RLOWSRFBALYXLA-JTQLQIEISA-N 275.333 2.221 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@@H]2C2CC2)c(O)c1 794387513 KDPRMSLVFBESLB-CHWSQXEVSA-N 261.321 2.063 10 20 CECD COc1ccc(O)c(CNC(=O)C(C)(C)C(F)F)c1 792238315 PARJZPQBASEFED-UHFFFAOYSA-N 273.279 2.308 10 20 CECD COc1ccc(CNC(=O)[C@H](C)C(F)(F)F)c(O)c1 794381222 MVEUZHPONCQPFP-ZETCQYMHSA-N 277.242 2.215 10 20 CECD OC[C@H]1C[C@H](NCc2ccc(N3CCCC3)cc2)C1 1335190345 PGOQWOQZIJLHDS-SHTZXODSSA-N 260.381 2.147 10 20 CECD C[C@@H]1CC[C@@H](NCCc2ccc(N)cc2)[C@H](n2cncn2)C1 1327841087 VDQTUYZGLUFUKF-KBRIMQKVSA-N 299.422 2.422 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@@H]1CCCNC1=O 1325575033 SXNVKONDHZPLPR-FRRDWIJNSA-N 288.391 2.365 10 20 CECD Cc1nnc(CN[C@H](C)c2ccc(N(C)C)cc2)o1 718865211 DILXZNXISNTXQW-SNVBAGLBSA-N 260.341 2.295 10 20 CECD Nc1ccc(CN2CCn3c(cnc3C(F)(F)F)C2)cc1 1334774054 DEKSQLAMDJPRQF-UHFFFAOYSA-N 296.296 2.500 10 20 CECD CN(C)c1cc(F)c(CNC[C@@H]2CC[C@H](O)C2)cc1F 1261813903 JUWSIGBBIIQNJY-PWSUYJOCSA-N 284.350 2.281 10 20 CECD C[C@H](Nc1ccc(C(N)=O)cn1)c1ccc(N(C)C)cc1 1342817536 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C[C@@H](CN1CCCC1=O)NCc1c(O)cccc1Cl 83552027 PIWDASFPYXCWBL-JTQLQIEISA-N 282.771 2.146 10 20 CECD C[C@@H](NCCCn1cncn1)c1ccc(N(C)C)cc1 381798135 PEJSORKMPLNQDU-CYBMUJFWSA-N 273.384 2.085 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)NCc1c(O)ccc2c1CCCC2 174519705 ACKGHCDMUAPIMZ-XJKSGUPXSA-N 289.375 2.312 10 20 CECD CC[C@@H](C)OCC(=O)N(C)Cc1ccccc1O 124583286 NLEQJJGJAYJKLX-LLVKDONJSA-N 251.326 2.166 10 20 CECD C[C@H](NCCCCCO)c1ccc(N2CCOCC2)cc1 181256208 BJBLEVAMBKCGHG-HNNXBMFYSA-N 292.423 2.336 10 20 CECD Cc1cc(O)c(CN(C)CCS(C)(=O)=O)cc1C(C)C 76265714 SJLXMBXBYQKZBU-UHFFFAOYSA-N 299.436 2.300 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1nccs1 80044646 RWCOTPRTNCFZKV-UHFFFAOYSA-N 277.349 2.190 10 20 CECD O=C(/C=C\c1cncc(F)c1)N1CCOc2ccncc21 255843325 JKEBBIQULZFIJN-UPHRSURJSA-N 285.278 2.055 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H]2CC(=O)N(C)C2)cc1 268899180 ZPUMCZSUWPLJEP-JSGCOSHPSA-N 275.396 2.024 10 20 CECD NC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1Cc1cccc(Cl)c1O 368974798 PEHTXSIPDAVFJP-GAFUQQFSSA-N 294.782 2.131 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCC[C@H](C)CO)c1 273458021 HMOCWVUVROLPPV-RYUDHWBXSA-N 295.379 2.238 10 20 CECD CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(C)c(C)c1O 273414882 QPWVFEVMCXYDGC-VXGBXAGGSA-N 264.369 2.184 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@H]2CCSC2)c1O 279884467 SARGKKKIIZWZBU-SECBINFHSA-N 298.364 2.152 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)C(F)(F)F 287407029 FAAUMOSTUFSGBK-SSDOTTSWSA-N 262.231 2.142 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H]1[C@@H]1CCCO1)OCO2 284025518 IFRGIFZBKWDIBU-JSGCOSHPSA-N 291.347 2.264 10 20 CECD COC(=O)[C@]12CCC[C@H]1CN(Cc1cc(F)ccc1O)C2 374678424 KFDNKOJGIMEFCV-LRDDRELGSA-N 293.338 2.306 10 20 CECD CO[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)C1CC1 281606949 OWOKQPBHDFGRPY-INIZCTEOSA-N 289.375 2.312 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1cc(C)on1 808095587 KPUSKVPUYHOBLS-UHFFFAOYSA-N 295.335 2.033 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1C[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1 295972937 ORHNGBMJYZRDAB-INECAMKWSA-N 297.354 2.392 10 20 CECD CC[C@@H](CNC(=O)NCc1ccc(N(C)C)c(F)c1)OC 290826984 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831190923 LHDKIWNDGMDTOL-BDAKNGLRSA-N 267.300 2.403 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H]2CC(=O)O)c1O 833401449 UKBMUNMSFBGIFR-LBPRGKRZSA-N 295.310 2.173 10 20 CECD CCc1cccc(CNC[C@H](CO)C(C)C)c1O 691452708 MHCZXOHIUZNZFL-CQSZACIVSA-N 251.370 2.309 10 20 CECD CC[C@H](NC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 844150648 SNMKCQNAWNQKFM-VIFPVBQESA-N 285.365 2.304 10 20 CECD CCCC[C@H](C)N(C)C(=O)C(=O)Nc1ccc(N)cc1 841132212 LYTGZIYFQPWSSS-NSHDSACASA-N 277.368 2.244 10 20 CECD CC[C@H](C)C[C@@H](CO)NCc1cc([N+](=O)[O-])ccc1O 842755005 VLUSKMZQXZXQMB-JQWIXIFHSA-N 282.340 2.187 10 20 CECD C[C@@H]1NCCN(Cc2ccc(N(C)C)c(F)c2)[C@@H]1C 843056962 DHSDGMYJKUTSHS-NWDGAFQWSA-N 265.376 2.074 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]([C@@H](C)N)C2)c1O 843353955 RUQGEWPQYLFFLR-ZYHUDNBSSA-N 294.370 2.293 10 20 CECD COc1cccc([C@H](C)NC[C@@](C)(O)C2CC2)c1O 846148262 YUUDXNJBGPZWAO-ZUZCIYMTSA-N 265.353 2.212 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)[C@@H]2CCCNC2)c1 841033732 VEPZQUCIUWJKCM-CHWSQXEVSA-N 278.396 2.269 10 20 CECD C[C@@H](Cc1cnc[nH]1)C(=O)NCc1cc(Cl)ccc1O 848242439 GJOBKTXHIUXQRK-VIFPVBQESA-N 293.754 2.264 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H](O)C(C)C 840553995 BCBXSCLMKXHILW-XJKSGUPXSA-N 292.423 2.125 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CC[C@H](O)CC2)c1 756771448 WYOIFSGJYPTTAT-DRZSPHRISA-N 293.363 2.133 10 20 CECD Cc1cccc(OC[C@H](O)CN(C)c2ccc(N)cc2)c1 923399798 GDNISFYUKCLGPW-MRXNPFEDSA-N 286.375 2.453 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCc2ccon2)c1 756639295 ZWPQQFZAXWNQCM-VIFPVBQESA-N 276.292 2.018 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](C2CC2)N(C)C)c1 756433540 PWWHHUMLOBZVFJ-ABAIWWIYSA-N 278.396 2.392 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)N(C)C[C@@H]2C)c1O 768762653 FDJCPGBKPWYUIV-MNOVXSKESA-N 294.370 2.258 10 20 CECD Cc1ccc(O)c(CNC(=O)CCc2ccnc(C)n2)c1 862755711 WVHFPBFSKXZMFI-UHFFFAOYSA-N 285.347 2.048 10 20 CECD CCN(CCN)Cc1ccc(N2CCCCC2)cc1 863644668 FRFCNQJOXKWXBB-UHFFFAOYSA-N 261.413 2.458 10 20 CECD CC(C)(C)[C@@H](O)C(=O)NCc1c(O)ccc2c1CCCC2 765177591 OYRIJHMUPWTUSR-HNNXBMFYSA-N 291.391 2.294 10 20 CECD COc1cc(Cl)cc(CN(C)C2CC(O)C2)c1O 761218919 MBXWXZMLQGITNU-UHFFFAOYSA-N 271.744 2.009 10 20 CECD CO[C@]1(CNCc2cc(Cl)cc(F)c2O)CCOC1 764680844 BYPTYAYRVAAJMB-ZDUSSCGKSA-N 289.734 2.080 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCO[C@@]2(CCOC2)C1 877132958 SBUOCHRJQMMWKE-CJNGLKHVSA-N 277.364 2.128 10 20 CECD CCO[C@@H]1C[C@H](NCc2cc(C)c(C)cc2O)[C@@H]1OC 775979233 SUZRPPOKZBISCK-IMJJTQAJSA-N 279.380 2.291 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CC[C@@H](C)C2)c1 776477702 UOUKQJZBXQVLHS-GHMZBOCLSA-N 263.337 2.453 10 20 CECD Nc1ccc(CNC(=O)[C@@H]2CCOC3(CCC3)C2)cc1 886920647 FQOYWOBFRCNYDN-CYBMUJFWSA-N 274.364 2.234 10 20 CECD C[C@H](N[C@H]1C[C@@H]2CCCCN2C1=O)c1c(O)cccc1F 886623313 ARNSBIDPOSIYCK-GVXVVHGQSA-N 292.354 2.335 10 20 CECD COc1ccc(CN[C@H](C)CSC)c(O)c1OC 893004455 HXCQFMMVMJUDOP-SECBINFHSA-N 271.382 2.251 10 20 CECD COc1cc(C)cc(CN2CCC(CCO)CC2)c1O 893921416 LTMNHDNSIITBEF-UHFFFAOYSA-N 279.380 2.304 10 20 CECD CC[C@@H](C)[C@@H](OC)C(=O)NCc1cc(OC)ccc1O 793690689 XGBLXKSMHBSMHT-QMTHXVAHSA-N 281.352 2.078 10 20 CECD COc1cccc(CN(C)CC[C@H](N)C(C)C)c1O 133338570 MUJPZSWHKQUZNB-ZDUSSCGKSA-N 266.385 2.206 10 20 CECD CN(Cc1ccccc1O)Cc1occc1C(=O)O 737494704 YXMHEFPZMKYNNC-UHFFFAOYSA-N 261.277 2.315 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CO)CC(F)(F)F)c1 717809901 FYAHQGDXHDCUGK-BDAKNGLRSA-N 293.285 2.365 10 20 CECD COc1ccc(N(C)C[C@@H]2CN(C)C(=O)O2)cc1Cl 1261237129 IHGVIJHHWSSNCR-SNVBAGLBSA-N 284.743 2.235 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)CN(C)C)c1 168599332 NYTHQVRSKGVLDB-QWRGUYRKSA-N 252.358 2.002 10 20 CECD O=C(NC1(C(=O)O)CCCCCC1)c1cc(O)cs1 1601430593 JSWAOWKCKNTGPS-UHFFFAOYSA-N 283.349 2.361 10 20 CECD C[C@@H]1CCN(Cc2ccc(F)c(F)c2O)C[C@H]1C(=O)O 1589355117 NAQQDAAAJVLRNR-PSASIEDQSA-N 285.290 2.213 10 20 CECD CN(C)c1ccc(OC[C@@H]2C[C@H]3CC[C@H]2O3)cc1C(=O)O 1598328072 DEVYNBSFHFGITL-JVLSTEMRSA-N 291.347 2.397 10 20 CECD CC[C@H](NCc1ccc2c(c1)CCN2CC)C(=O)O 1776722101 JOBQUJBOLJHHQL-ZDUSSCGKSA-N 262.353 2.022 10 20 CECD CCN(C)c1ccc(CN2CC=C(C(=O)O)CC2)cc1 1776855624 UCTHJIZJCFITTO-UHFFFAOYSA-N 274.364 2.359 10 20 CECD CCNC(=O)CN(C)Cc1ccc(N2CCCCC2)cc1 15571557 PWVPQHGNCGBVOD-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COc1cc(Cl)cc(CN2CCO[C@H](CF)C2)c1O 840954147 HJBJYGGWIMHTLH-LLVKDONJSA-N 289.734 2.225 10 20 CECD COc1cccc(F)c1C(=O)NCc1ccccc1O 125599309 NLFBFEHZZPVNEC-UHFFFAOYSA-N 275.279 2.470 10 20 CECD Cc1nn(C)c(C)c1CCC(=O)Nc1ccc(N)cc1 237690800 UOWHMIORGNUHAV-UHFFFAOYSA-N 272.352 2.190 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)c1ccc(F)cc1 38109194 LRIYNWMAIRPZBP-UHFFFAOYSA-N 295.335 2.352 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC(O)(C(C)C)C2)c1O 383951541 BNQRLYYWAHPTQG-UHFFFAOYSA-N 297.782 2.451 10 20 CECD COc1cc(Cl)cc(CNCc2csnn2)c1O 398236989 AMDGCFGDRRSMKJ-UHFFFAOYSA-N 285.756 2.196 10 20 CECD O=C1[C@H](Sc2nccs2)CCN1CC(F)(F)F 109717764 OCCYOKLLOMSNJY-ZCFIWIBFSA-N 282.312 2.398 10 20 CECD CN(C)c1ccc(CNC(=O)CCc2ccccn2)cc1 62865769 WAXXNLGXTVLJFM-UHFFFAOYSA-N 283.375 2.397 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)OC)cc1F 66841304 SETHVVZSFMEHNZ-LLVKDONJSA-N 282.359 2.323 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1ccco1 183481159 KZUNTMACJZYSNS-OKPNEXGHSA-N 287.315 2.451 10 20 CECD C[C@@H](N[C@@H]1CCc2[nH]ncc2C1)c1ccccc1O 183618735 VPSKQOYSNMYJQB-ZYHUDNBSSA-N 257.337 2.323 10 20 CECD COc1ccc(N2CCN(C[C@H]3CC[C@@H](C)O3)CC2)cc1 188535270 NOIMNTOFLLAMJY-RHSMWYFYSA-N 290.407 2.385 10 20 CECD CC1CC(NC(=O)NCc2ccc(N(C)C)cc2)C1 83061295 IRYATLJUWIDISJ-UHFFFAOYSA-N 261.369 2.350 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H]2CCCOC2)c1 193596269 DJYGYJJSSFUJNA-RYUDHWBXSA-N 293.363 2.395 10 20 CECD Nc1ccc(NC(=O)CCCc2nc(C3CC3)no2)cc1 237972414 DJIUEJCFFYFWGQ-UHFFFAOYSA-N 286.335 2.491 10 20 CECD Cn1nncc1CN(Cc1ccccc1O)C1CCCC1 93319221 DIRMKQIIFKJPCM-UHFFFAOYSA-N 286.379 2.466 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H]2CN3CCC[C@H]3CO2)c1 252566747 ZVOGOFMNQMJISF-SOUVJXGZSA-N 290.407 2.214 10 20 CECD CCOc1cccc(CN[C@@H]2C[C@H]3CC[C@H]2NC3)c1O 530247291 ZPJFCGNCAAZCEC-MRVWCRGKSA-N 276.380 2.021 10 20 CECD Nc1ccc(CNC(=O)c2cc(Br)c[nH]2)cc1 159400762 NHFKZICZKXQKRS-UHFFFAOYSA-N 294.152 2.289 10 20 CECD COCC[C@@H](C)N[C@@H](C)c1cc(C(=O)OC)ccc1O 273604644 SVGAFULAYKMZBN-MNOVXSKESA-N 281.352 2.254 10 20 CECD COCC1(CN[C@H]2CCc3cccc(O)c32)CCOCC1 297453365 XGGIRYLYINILBW-AWEZNQCLSA-N 291.391 2.412 10 20 CECD CC(C)[C@H]1NCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 290158714 LTMAFXWMRVIMGF-JKSUJKDBSA-N 289.423 2.003 10 20 CECD COc1ccc(O)c(CNC(=O)NCCSC(C)C)c1 806811258 SGYBTAUWWXLKHH-UHFFFAOYSA-N 298.408 2.342 10 20 CECD CCOc1ccc(O)c(CN[C@H](CC(C)C)C(=O)O)c1 818244809 UWCAKPDCQMZQAQ-CYBMUJFWSA-N 281.352 2.380 10 20 CECD Cc1occc1CNCc1cc2c(cc1O)OCO2 725848787 ILOREMZCSVWQCR-UHFFFAOYSA-N 261.277 2.312 10 20 CECD CN1CCN(c2ccc(CN3CC[C@@H]4C[C@H]4C3)cc2)CC1 827507686 YVXCVMHBMJQALA-SJORKVTESA-N 285.435 2.280 10 20 CECD Cc1cc(C(=O)Nc2ccnn2C)c(C)n1-c1ccccn1 726532823 LUEDRNSLJNBXDW-UHFFFAOYSA-N 295.346 2.475 10 20 CECD C[C@]1(C(=O)O)CCCN1Cc1cccc(Cl)c1O 903697989 OEMLKOALKKFMBN-CYBMUJFWSA-N 269.728 2.485 10 20 CECD C[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@H]1C(=O)O 833629510 JZDGFHNYRUZIIH-SCZZXKLOSA-N 269.728 2.198 10 20 CECD Cc1ccc(C(=O)NCC[C@@H](O)C2CCCC2)c(O)c1O 831381217 CCCMLPDGSGQENQ-CYBMUJFWSA-N 293.363 2.077 10 20 CECD CC[C@@H](C)[C@](C)(O)CNCc1c(O)cccc1OC 732820586 LVPQROYIDYPNMT-IAQYHMDHSA-N 267.369 2.288 10 20 CECD CCN(CC(=O)NCCc1ccc(N)cc1)c1ccccc1 832659161 OZSPUDMNOPWMIX-UHFFFAOYSA-N 297.402 2.454 10 20 CECD O=C(O)c1cncc(NCc2ccc(N3CCCC3)cc2)n1 833340845 CTABZDIPCOUAIW-UHFFFAOYSA-N 298.346 2.387 10 20 CECD O=C(NCc1ccc(O)cc1O)c1c[nH]cc1C1CC1 910958104 WWZIJHIFDPEWHX-UHFFFAOYSA-N 272.304 2.233 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)CO[C@@H]2CCOC2)c1O 846150909 SVIYNGDIBDEYIP-RWMBFGLXSA-N 295.379 2.245 10 20 CECD CCc1cccc(CN[C@@H](C)CO[C@H]2CCOC2)c1O 848898546 DWSBIVSJCWHNDT-WFASDCNBSA-N 279.380 2.238 10 20 CECD C[C@H](N)[C@@H]1CCCCN1Cc1cccc(F)c1O 843045888 LMRPJZBWUYTYPX-GWCFXTLKSA-N 252.333 2.233 10 20 CECD Cc1cccc(C(=O)OCC(=O)c2ccc(O)c(O)c2)c1 916590290 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862756191 SKLSGZLJVVXFFO-UHFFFAOYSA-N 279.361 2.312 10 20 CECD CCN(C)c1ccc(CN2CCC[C@H](C(=O)NC)C2)cc1 773756383 KTZADTBTRSJIJN-HNNXBMFYSA-N 289.423 2.101 10 20 CECD O=C(NCc1ccc(O)c(F)c1)c1c(F)ccc(O)c1O 789995174 FTSBREVJTKOKFO-UHFFFAOYSA-N 295.241 2.012 10 20 CECD COC(=O)[C@H]1CCN(Cc2c(O)cccc2Cl)[C@H]1C 787420629 JRIPXIHIUUBXCV-UWVGGRQHSA-N 283.755 2.429 10 20 CECD CCC[C@@H](NCc1cc(Cl)ccc1O)C(=O)OC 897835525 LVYDPUDRYLMIAX-LLVKDONJSA-N 271.744 2.477 10 20 CECD CC[C@H](C)[C@H](OC)C(=O)NCc1cccc(OC)c1O 793689083 JCXBTSKXBZCKDY-HZMBPMFUSA-N 281.352 2.078 10 20 CECD Cn1c(-c2ccccc2)cnc1SC[C@H]1CNC(=O)C1 1327515972 FRKRHFKUEQSIRD-LLVKDONJSA-N 287.388 2.315 10 20 CECD CC[C@@H](CCO)NCc1ccc(Br)cc1O 691455402 OXGYAXYLDQZKEJ-NSHDSACASA-N 288.185 2.405 10 20 CECD CN(C)[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 708398585 HVWMITMLBWFGQJ-LBPRGKRZSA-N 270.323 2.196 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2cc(C)nc(CO)n2)c1 1323107939 VWYINIJGCPZTSJ-SNVBAGLBSA-N 289.335 2.165 10 20 CECD CCc1cccc(CNC[C@H]2CCCCS2(=O)=O)c1O 694587928 FIWCFJWQUORNGJ-CQSZACIVSA-N 297.420 2.012 10 20 CECD C[C@H]1C[C@@H](C)N(c2nnc(-c3sccc3O)n2C)C1 1338086842 JHAKSDGIBPFCPY-DTWKUNHWSA-N 278.381 2.484 10 20 CECD C[C@H](NCC(C)(C)CCO)c1cc(C(=O)O)ccc1O 1604332807 LUXOMRZYJQBTKR-JTQLQIEISA-N 281.352 2.150 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H]2CCNC[C@H]2C1 1579617095 LYASGWXSDVBRHI-CVEARBPZSA-N 273.424 2.102 10 20 CECD CN1CCC(CCNCc2ccc3c(c2)CCO3)CC1 105454200 LJQVOGYBIIWYIS-UHFFFAOYSA-N 274.408 2.443 10 20 CECD CC(C)C[C@@H](CN)N[C@@H](C)c1cc(C(=O)O)ccc1O 1591144636 RXJPUMLDWIKOGR-JQWIXIFHSA-N 280.368 2.114 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cccnn2)c1 152096363 NNZVGSDLEWOWAD-SECBINFHSA-N 288.307 2.074 10 20 CECD C[C@H]1[C@@H](C)SCCN1C(=O)Cc1ccc(N)cc1 157076860 OWGHZLDLSDXSLB-WDEREUQCSA-N 264.394 2.164 10 20 CECD COc1ccc(N(C)C[C@H]2CCCNC2)cc1OC 258948080 IITBJIJHLKAETL-LBPRGKRZSA-N 264.369 2.140 10 20 CECD O[C@H]1CCC[C@H](CNCc2ccc3c(c2)CCO3)C1 230666714 AEVQLIIHGPPYIQ-WFASDCNBSA-N 261.365 2.262 10 20 CECD CCO[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)C1 155423796 AFOCDRLIGYESEB-LBPRGKRZSA-N 279.336 2.122 10 20 CECD CN1CC=C(CNCc2ccc(N(C)C)cc2)CC1 271848588 SNJVFHOSGJQARD-UHFFFAOYSA-N 259.397 2.104 10 20 CECD CN(C)c1ccc(CNCCc2cccnc2)cc1 37502590 UQXXFMVGUYIZSX-UHFFFAOYSA-N 255.365 2.480 10 20 CECD CCC[C@]1(NCc2cc(OC)ccc2O)CCOC1 289828428 UFEXZOAMHRYZJW-HNNXBMFYSA-N 265.353 2.450 10 20 CECD COc1ccc(O)c(CN(C)[C@H]2CCCOC2)c1 401586843 TYUWIXSMTOQBDP-LBPRGKRZSA-N 251.326 2.012 10 20 CECD O=C(NC[C@@H]1C[C@H]2C=C[C@H]1CC2)c1cccc(O)c1O 402765555 LLANVZWZXZGGAK-SRVKXCTJSA-N 273.332 2.430 10 20 CECD CN1CC[C@H]1CNCc1ccc(N2CCCC2)cc1 712572000 LCSXVZXSSVECPF-INIZCTEOSA-N 259.397 2.081 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCOC1 171026309 ICFIZUWXVHFCKG-CQSZACIVSA-N 276.380 2.138 10 20 CECD COCCCN(C)CCN[C@@H](C)c1cc(OC)ccc1O 185553814 GQOJFIGGGHJSGP-ZDUSSCGKSA-N 296.411 2.020 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCOCC1CC1 175029235 TXOXHVJHMIYQCI-UHFFFAOYSA-N 276.380 2.378 10 20 CECD C[C@H]1CN(CCN(C)Cc2cc(F)ccc2O)C[C@@H](C)O1 193399550 GTGRVIKEBUAGBY-BETUJISGSA-N 296.386 2.072 10 20 CECD CC(C)[C@H]1OCCC[C@@H]1CNC(=O)Cc1ccc(N)cc1 236611329 LMTVWYHHXJJYDA-RHSMWYFYSA-N 290.407 2.379 10 20 CECD COCC(C)(C)N(C)Cc1cc(OC)ccc1O 292781242 LLBBTGQADCKPQE-UHFFFAOYSA-N 253.342 2.258 10 20 CECD COC[C@@H](CN[C@@H](C)c1cc(C)ccc1O)OC 230672145 JXJSSYPIJARHBM-NWDGAFQWSA-N 253.342 2.013 10 20 CECD C[C@@H]1O[C@H](C)[C@H](C(=O)N(C)Cc2ccccc2O)[C@@H]1C 383981625 SESPYOXHGMUYBY-NWJSVONSSA-N 277.364 2.410 10 20 CECD Cc1cc(C)c(C(=O)NCCc2ccc(N)cc2)o1 237803529 DHIFOFJEMBGDCG-UHFFFAOYSA-N 258.321 2.451 10 20 CECD COc1cc(O)c(CNCC2CC=CC2)cc1OC 529641175 NXLXVYHLZFWKJW-UHFFFAOYSA-N 263.337 2.465 10 20 CECD CN(C)c1ccc(CN[C@@H]2[C@H]3CC[C@@H](C3)[C@H]2C(=O)O)cc1 250357704 PXVSSDRTSUZZOU-WMHQRMGPSA-N 288.391 2.342 10 20 CECD CC[C@@H](C(=O)NCCc1ccc(N)cc1)N(CC)CC 269154468 ZWJJLWWAJRASJW-HNNXBMFYSA-N 277.412 2.048 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@H]2CCN(C)C2=O)cc1 265649061 NCKOLLBFMQWVRR-MRXNPFEDSA-N 289.423 2.195 10 20 CECD CCC[C@](C)(O)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273565232 JFLZTFVEAHPLOS-BZNIZROVSA-N 295.379 2.381 10 20 CECD COc1cccc(CN2CCN(C3CCC3)CC2)c1O 271189085 ONIYSLSUAJVVMY-UHFFFAOYSA-N 276.380 2.071 10 20 CECD COc1ccc(O)c(CN2CCN(C3CCC3)CC2)c1 271823382 NRLCEWKADSQVAM-UHFFFAOYSA-N 276.380 2.071 10 20 CECD CCn1cnnc1CN[C@H](C)c1ccc(C)c(C)c1O 273395078 LUNSUSWIZUVSBZ-GFCCVEGCSA-N 274.368 2.471 10 20 CECD Cc1cc[nH]c1C(=O)NCc1ccc(N(C)C)cc1 280668679 YEVDZKGZBUDXCK-UHFFFAOYSA-N 257.337 2.319 10 20 CECD C[C@@H]1C[C@@H](C)[C@@H](C(=O)N(C)Cc2ccccc2O)O1 282558099 SMGVPBBDKRAVNN-GYSYKLTISA-N 263.337 2.164 10 20 CECD C[C@H](N[C@@H]1CCCN(CCCO)C1)c1cc(F)ccc1O 297368730 QJWOIDKDPUYRDD-GXTWGEPZSA-N 296.386 2.029 10 20 CECD Cc1cc(O)c(CN2CCC(F)(F)[C@@H](CO)C2)cc1C 291022849 AMZLUFXKZJQYQP-CYBMUJFWSA-N 285.334 2.459 10 20 CECD COCCO[C@@H]1CCCN(Cc2c(O)cccc2OC)C1 802653570 YXOJTTWFPCIKIX-CYBMUJFWSA-N 295.379 2.028 10 20 CECD OCC1([C@@H](NCc2ccccc2O)C2CC2)CCOCC1 293518890 AWTIVCZJLYDYNT-INIZCTEOSA-N 291.391 2.050 10 20 CECD Oc1ccc(F)cc1CNc1ccc(C2(O)COC2)cc1 809780885 MTZIIAKWRHHTBH-UHFFFAOYSA-N 289.306 2.361 10 20 CECD CC[C@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCN1 817902042 HHJUVHZOMGAHTG-GJZGRUSLSA-N 260.381 2.242 10 20 CECD CN(C)c1ccc(CNC(=O)C2(C)CCOCC2)cc1F 726756007 SOFPJLCKKNACRP-UHFFFAOYSA-N 294.370 2.325 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CC[C@H](C(N)=O)C2)cc1 825278925 LHORKVKXGOUPHE-LSDHHAIUSA-N 289.423 2.276 10 20 CECD Cc1ccc(CNC(=O)N(C)Cc2ccccc2O)nc1 827876650 IQHQRJYTAXKGPW-UHFFFAOYSA-N 285.347 2.437 10 20 CECD CC[C@H](NC(=O)NCc1ccc(OC)cc1O)C(F)F 836511895 MLPSFYHTZWMKJH-JTQLQIEISA-N 288.294 2.244 10 20 CECD Oc1c(F)cc(F)cc1CNc1nc2n(n1)CCCC2 905414397 LLTQFDGRSSIAQB-UHFFFAOYSA-N 280.278 2.210 10 20 CECD CCOc1ccc(CN[C@@H]2CCO[C@H]2CC)c(O)c1 839192578 RVTQPIDTIPGNTD-HIFRSBDPSA-N 265.353 2.448 10 20 CECD O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccc(Cl)nc1 748999328 VKBPAIYFUIKGND-XYOKQWHBSA-N 299.717 2.196 10 20 CECD CC[C@@H](NC(=O)Nc1ccc(N)cc1)[C@@H](O)C(F)(F)F 841297528 FRWXETYJEORBHU-NXEZZACHSA-N 291.273 2.092 10 20 CECD C[C@@H]1C[C@H](CN2CCCc3cc(CN)ccc32)CCN1 843058193 OFRIANREGZQVIK-UKRRQHHQSA-N 273.424 2.286 10 20 CECD C[C@H](N[C@H]1CCCN(C)C1=O)c1ccc(Cl)cc1O 841755104 NLZMGRSKSJWNDZ-CABZTGNLSA-N 282.771 2.317 10 20 CECD COc1cccc([C@H](C)NCCN2CC=CCC2)c1O 846166613 BAIYIIBECZQYIO-ZDUSSCGKSA-N 276.380 2.313 10 20 CECD CCOc1ccc(CN[C@H](C)CCCCN)c(O)c1 841081093 UBSLJXAVZLAUIZ-GFCCVEGCSA-N 266.385 2.398 10 20 CECD C[C@H]1CCSCCN1C(=O)NCCc1ccc(N)cc1 841959947 SOMPWOXTKATLDN-LBPRGKRZSA-N 293.436 2.348 10 20 CECD Cc1cc(N(C)C)ccc1CNCCC1(O)CCOCC1 840947762 FIRNOJGLLLRVHU-UHFFFAOYSA-N 292.423 2.082 10 20 CECD C[C@H](CCO)N(C)Cc1ccc(N(C)C)c(F)c1 846109103 CYDUVHKQCKOAQZ-LLVKDONJSA-N 254.349 2.094 10 20 CECD COc1cccc([C@H](C)NCCN2CCCC2)c1O 846138988 ZHBOEHZPRZZZEG-LBPRGKRZSA-N 264.369 2.147 10 20 CECD COC(=O)/C=C(/C)CN(C)c1ccc(OC)c(OC)c1 929348234 OMBKTOURKCENSR-FLIBITNWSA-N 279.336 2.259 10 20 CECD Cc1nnc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)s1 757637424 HUJLYPSYJUJYPS-SSDOTTSWSA-N 294.336 2.311 10 20 CECD CN(C)c1cc(F)c(CNC[C@@H](O)c2ccco2)cc1F 858092564 FTKBYMSFBIGFFX-CQSZACIVSA-N 296.317 2.447 10 20 CECD O=C(O)C1(CNCc2c(O)cccc2Cl)CCC1 854244331 ADNRZOOFORJXRM-UHFFFAOYSA-N 269.728 2.390 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1CO 857061204 LXPZOBDMRFAHNT-OCCSQVGLSA-N 280.387 2.342 10 20 CECD COc1cc(C)cc(CN2CCCO[C@H](C)C2)c1O 754732657 SOYXJZLGWSYMBN-GFCCVEGCSA-N 265.353 2.320 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)COC(F)(F)F)c1 934940487 NDBRZLAZYZJSLD-ZETCQYMHSA-N 293.241 2.114 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCSC2)c1 862758026 MJDSMDDKEZXYSS-SNVBAGLBSA-N 251.351 2.070 10 20 CECD CC[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@@H]1O 862253782 SNIDHYFQROJIMU-BONVTDFDSA-N 284.350 2.234 10 20 CECD COc1cccc(CNC(=O)NCCC(C)(C)OC)c1O 876077326 GGDAQOACBHHOCR-UHFFFAOYSA-N 296.367 2.015 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)NCc1ccc(C)cc1O 877145744 BJHYLUPLBJQXKU-RYUDHWBXSA-N 264.369 2.093 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CC12CCC2 876426585 POHKYLDVPTXIBU-ZDUSSCGKSA-N 260.337 2.476 10 20 CECD Cc1ncc([C@H](C)NC(=O)Cc2ccc(N)cc2)s1 877193444 DFYKLCOOUZPTAC-VIFPVBQESA-N 275.377 2.454 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2C=CCC2)c1 883784315 QWBXRKBQBKUQOC-GFCCVEGCSA-N 260.337 2.466 10 20 CECD CO[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 783635752 KRGRKJBMGFUYTQ-VGVVRCBHSA-N 291.347 2.139 10 20 CECD COc1ccc(CNCC(C)(C)C(C)(C)O)c(O)c1OC 894772878 FGDCFCMTUHHVRE-UHFFFAOYSA-N 297.395 2.296 10 20 CECD COc1ccc(CNC[C@@]2(C)CCCO2)c(O)c1OC 893148167 LQOXKRUSIPKWQY-OAHLLOKOSA-N 281.352 2.068 10 20 CECD COc1cc(C)cc(CN2CC(OC(F)F)C2)c1O 797821558 ZDYGJURMMMMDNJ-UHFFFAOYSA-N 273.279 2.133 10 20 CECD COc1ccc(CNc2ncnc3ccncc23)c(O)c1 794865809 SESLDEQLGRJXSY-UHFFFAOYSA-N 282.303 2.351 10 20 CECD C[C@@H]1CN(C(=O)c2ccc(CN=[N+]=[N-])o2)C[C@@H](C)O1 1537963004 OBKRJWPLGHLLLZ-RKDXNWHRSA-N 264.285 2.339 10 20 CECD Oc1cccc(Br)c1CNC[C@@H]1CCOC1 706863886 XIYZKCSZCXCYTC-VIFPVBQESA-N 286.169 2.281 10 20 CECD CCN(C(=O)c1cccc2c1CCN2)c1cnn(C)c1 1342083991 AMMYWYNSICGGLZ-UHFFFAOYSA-N 270.336 2.055 10 20 CECD O=C(O)Cc1cccc(NCc2ccccc2O)n1 1602140506 DIOSAEKBAITBFV-UHFFFAOYSA-N 258.277 2.026 10 20 CECD CCCN(CC(=O)O)Cc1cccc(CC)c1O 1589669706 VPRRZKKEOPUADG-UHFFFAOYSA-N 251.326 2.251 10 20 CECD CCc1nocc1CNCc1cc(OC)ccc1O 815125935 DCCRTPVNOMFRCN-UHFFFAOYSA-N 262.309 2.241 10 20 CECD COc1cccc(O)c1CNC[C@@H]1C[C@@H](C)O[C@@H]1C 840964409 RYHODUVXCVJQNV-UTUOFQBUSA-N 265.353 2.304 10 20 CECD CC(=O)NCC1CCN(Cc2c(O)cccc2Cl)CC1 219487966 WXYDVBWLZFSUTJ-UHFFFAOYSA-N 296.798 2.394 10 20 CECD CCN(Cc1cc(OC)ccc1O)C[C@H](C)OC 291083600 OAEABHLBBXYZDW-NSHDSACASA-N 253.342 2.258 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](OC)CC2)c1 378629536 DTORVONDRJNJRP-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD OCC[C@@H](NCc1cc(F)cc(F)c1O)C(F)(F)F 886369695 MMSQAKKEYLWQIF-SECBINFHSA-N 285.212 2.073 10 20 CECD C[C@H](O)CN[C@@H](C)c1ccc(Br)cc1O 134899562 AUKPKTLUXGEFII-YUMQZZPRSA-N 274.158 2.186 10 20 CECD Cc1ccc(CNC(=O)CN(C)Cc2ccccc2O)cc1 109773398 GUXPBHHRMCGSPV-UHFFFAOYSA-N 298.386 2.449 10 20 CECD Cc1ccc(O)c(CN2CCOCC3(CCOCC3)C2)c1 183272693 FWJKJNCBYTUJRV-UHFFFAOYSA-N 291.391 2.330 10 20 CECD CN(C)c1ccc(CNC(=O)CC2CCOCC2)cc1 117125299 QUYNSYCJTLZDPJ-UHFFFAOYSA-N 276.380 2.186 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2c2ccco2)c1 114543345 WIQQZZRLXYFORE-CHWSQXEVSA-N 287.315 2.414 10 20 CECD CCOCCO[C@H]1CCN(Cc2cc(OC)ccc2O)C1 180769620 GLNYWEQIHVVUJZ-HNNXBMFYSA-N 295.379 2.028 10 20 CECD C[C@@H]1CN(Cc2cc(Br)ccc2O)CC[C@H]1N 300417047 IZVLXPOCYRRLKS-BXKDBHETSA-N 299.212 2.324 10 20 CECD OCC1(NCc2cc(Br)ccc2O)CCC1 124480430 MPGGLPQQDXEKFE-UHFFFAOYSA-N 286.169 2.159 10 20 CECD C[C@@H](N)[C@H]1CCCN(Cc2cc(F)ccc2O)C1 220210877 PQRUVNYRNFZSGE-MNOVXSKESA-N 252.333 2.091 10 20 CECD CN(C)c1ccc(OCC(=O)c2cccn2C)cc1 289447454 ULHBCTQGMCXBFW-UHFFFAOYSA-N 258.321 2.353 10 20 CECD Cc1noc(C)c1/C=C1\SC(=S)N(C)C1=O 192690026 BRRKVGWTHNCTCE-YWEYNIOJSA-N 254.336 2.122 10 20 CECD COCCCCCNC(=O)NCc1ccccc1O 263762577 RSNUOIDSGCTEIT-UHFFFAOYSA-N 266.341 2.008 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cocn2)cc1 264252900 NPLTVDQESCHEPD-UHFFFAOYSA-N 273.336 2.451 10 20 CECD CC(C)[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCS1 276590299 MYSTYSQTRHEETD-NSHDSACASA-N 299.367 2.451 10 20 CECD CN(C)c1ccc(CN2CCCC[C@H]2CCO)cc1 270997752 KFLZULXQIRONMG-INIZCTEOSA-N 262.397 2.490 10 20 CECD CC(C)NC(=O)CN(Cc1ccc(N(C)C)cc1)C1CC1 298747280 ZUADSMGHOQWAFP-UHFFFAOYSA-N 289.423 2.242 10 20 CECD CCOc1cccc(CN[C@H]2CC[C@@H](CO)C2)c1O 295099594 SNNOBDUABSKFRB-YPMHNXCESA-N 265.353 2.042 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CO)CC2)cc1 293232100 SGZVKCPUOIPCTI-HNNXBMFYSA-N 262.397 2.347 10 20 CECD Cc1nonc1CNCc1cc(Cl)cc(F)c1O 809744004 QBOHOLSPMNQSBY-UHFFFAOYSA-N 271.679 2.166 10 20 CECD COC[C@H](O)CCN[C@H](C)c1c(C)cc(C)cc1O 294650395 GSYYZPOKPBDWCJ-CHWSQXEVSA-N 267.369 2.057 10 20 CECD CC(C)(C)c1cc(O)c(O)c(CN2CC[C@H](C(=O)O)C2)c1 817818274 YGFGLNRDHTUPKU-JTQLQIEISA-N 293.363 2.302 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@H]1CCCN1 817895039 SZDASKODWMCHAM-XJKSGUPXSA-N 261.413 2.291 10 20 CECD CCCNC(=O)CCCC(=O)N[C@H](C)c1ccccc1O 827930934 VPTFDUURIUOXPZ-GFCCVEGCSA-N 292.379 2.266 10 20 CECD Nc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)nc1 827005771 YGNUSNFQAGWNLL-UHFFFAOYSA-N 296.374 2.194 10 20 CECD NCc1ccc(CNCCc2ccc(N)cc2)cc1 904353178 HTIVUKQNVPFFEK-UHFFFAOYSA-N 255.365 2.060 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@@H](C)c1ccc(F)cc1O 834880644 MHNYGWNRXHRSBA-ZIBATOQPSA-N 283.343 2.233 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C1(C)COC1 839921221 XVVLVZRLONASMX-ZDUSSCGKSA-N 290.407 2.145 10 20 CECD CCO[C@H]1C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)C1 837379229 GTDWAUTXEJWEGU-OTVXOJSOSA-N 291.395 2.119 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)NCCCSc1nccs1 733974488 VBEISZDJSHTNJK-NXEZZACHSA-N 286.422 2.167 10 20 CECD Nc1ccc(NC(=O)Nc2cc([C@@H]3CCCO3)[nH]n2)cc1 841297497 RMOISVHNUXEHSM-LBPRGKRZSA-N 287.323 2.487 10 20 CECD C[C@@H](C(=O)NCc1ccc(O)cc1O)C(C)(F)F 910943755 GPEBESXEOYZRPP-ZETCQYMHSA-N 259.252 2.005 10 20 CECD Cc1nc(CNC(=O)c2cc(O)cs2)sc1C 743813608 COWZSPUSXNZRSV-UHFFFAOYSA-N 268.363 2.457 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CS[C@@H](C)C2)c(O)c1 840413290 GQBVRTYWPVSFRV-GXSJLCMTSA-N 296.392 2.094 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCC(=O)C1 843800889 XBJDGPIBUIMBAJ-GFCCVEGCSA-N 274.364 2.046 10 20 CECD CN(CC(=O)O)Cc1ccc(N(C)C)cc1C(F)(F)F 840995151 PQOFZPGAMAUBJY-UHFFFAOYSA-N 290.285 2.288 10 20 CECD C[C@@H](NCC1(C)COC1)c1cc(F)cc(F)c1O 756572833 IMYDVHCDFZXZAB-MRVPVSSYSA-N 257.280 2.358 10 20 CECD CN1CCC([C@H]2CCN(C(=O)c3cc(O)cs3)C2)CC1 756809266 NLNXFMHBEJCBEH-LBPRGKRZSA-N 294.420 2.258 10 20 CECD Cc1cc(CN2C[C@H]3[C@H](N(C)C)[C@H]3C2)ccc1N(C)C 931277533 LGGMJZURNMZAOC-QLPKVWCKSA-N 273.424 2.053 10 20 CECD Cc1cnc(CCNCc2c(C)cccc2O)cn1 877577162 AVPQZZYEXQEQKS-UHFFFAOYSA-N 257.337 2.131 10 20 CECD CC(=O)OC(C)(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 779846675 WVIBNGKQPYMVFN-NSHDSACASA-N 292.379 2.272 10 20 CECD Cc1ccc(F)cc1C(=O)C(=O)NCc1ccccc1O 782013872 KLGIKMPCUJBNAA-UHFFFAOYSA-N 287.290 2.339 10 20 CECD COc1ccc(CNCc2cncc(C)c2)c(O)c1OC 893249367 QCXJUYSYBIZGFH-UHFFFAOYSA-N 288.347 2.403 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)COC(C)=O)c1 894502809 UJLPJWJAZIJHLN-ZJUUUORDSA-N 267.325 2.003 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)[C@H](C)CN1C 894482274 BJVQHGVLABQZIC-NXEZZACHSA-N 270.323 2.195 10 20 CECD CCOC(=O)[C@@H](CC)N(C)Cc1ccccc1O 72629599 VGXVHQQVLZGKNA-GFCCVEGCSA-N 251.326 2.166 10 20 CECD O=C(N[C@@H]1CCCc2occc21)c1cccc(O)c1O 186882716 RWIQILIFYAWJPI-LLVKDONJSA-N 273.288 2.498 10 20 CECD Cc1ncoc1C(=O)Nc1c(Cl)ccc2nonc12 1323416092 DHIOJNMURLMWIG-UHFFFAOYSA-N 278.655 2.425 10 20 CECD CCN(Cc1ccoc1)C(=O)Cc1ccc(N)cc1 688493409 NODXQSRYNYDCIT-UHFFFAOYSA-N 258.321 2.453 10 20 CECD O=C(c1cc(O)cs1)N1CC(C(F)(F)F)C1 1261670595 QSYBRUPTPFUDFO-UHFFFAOYSA-N 251.229 2.088 10 20 CECD CO[C@H]1CCC[C@H]1C(=O)N[C@H](C)c1ccccc1O 1262636856 BYDCQIHNCPKMEW-QKCSRTOESA-N 263.337 2.385 10 20 CECD CN1CCN(c2ccc(CN3C[C@H]4C[C@H]4C3)cc2F)CC1 1348389786 WREPWADFZSECDP-GASCZTMLSA-N 289.398 2.029 10 20 CECD C[C@H]1C[C@H](C(=O)O)CN(Cc2cc(F)c(F)cc2O)C1 1603367626 FQIOJPWEEROAKT-WPRPVWTQSA-N 285.290 2.213 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1ccc(N(C)CC)cc1 1603500337 GGEWQGMMSBAEOQ-CQSZACIVSA-N 264.369 2.438 10 20 CECD Cc1cc(O)c(CN(CC(=O)O)CC(F)(F)F)cc1C 1610475689 JEWNXMUVPPWKTL-UHFFFAOYSA-N 291.269 2.458 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](CC(=O)O)C2)c1O 1776210339 UOJCEMOOSVQILL-SNVBAGLBSA-N 295.310 2.031 10 20 CECD CCCCN(CCO)Cc1cc(OCC)ccc1O 159104746 UUHGGEFJCUFEPB-UHFFFAOYSA-N 267.369 2.385 10 20 CECD COc1cccc(O)c1CNC[C@]1(O)CCC[C@H]1C 815160152 REFUBIURYZWWTE-IAQYHMDHSA-N 265.353 2.042 10 20 CECD COc1cccc(O)c1CNCc1cnccc1C 824910397 VPTGAVKFFSZPQU-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cn(C)nc2C)c1 125532200 RQCUOKAARUADGO-NSHDSACASA-N 275.352 2.294 10 20 CECD C[C@H]1CN(C(=O)Nc2ccc(N)cc2)CC(C)(C)O1 41681705 BAHULVFSUJBMJX-JTQLQIEISA-N 263.341 2.300 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cnc(C)cn2)c1 61320124 ZSIUWJOSPBYAKE-NSHDSACASA-N 273.336 2.350 10 20 CECD COc1ccc(CN[C@@H]2C[C@@H](OC)C23CCC3)c(O)c1 713480345 HRFXCZQJGRTXCJ-HUUCEWRRSA-N 277.364 2.448 10 20 CECD Cc1nc(CN[C@@H](C)c2ccc(N(C)C)cc2)n[nH]1 392379234 KLMAEHDNUQTZRI-JTQLQIEISA-N 259.357 2.030 10 20 CECD COc1ccc(CNCc2ccc(N(C)C)cc2)nc1 892475218 GVTUQCZTWGAKAX-UHFFFAOYSA-N 271.364 2.446 10 20 CECD CN1CCCc2cc(CNC(=O)CNC(C)(C)C)ccc21 51415184 YQCOWNQDLGLDQK-UHFFFAOYSA-N 289.423 2.073 10 20 CECD Cc1cc(C(=O)N2CC[C@@](C)(O)C2)c(C)n1-c1ccccn1 177336242 GPQLEJOAGWICTE-QGZVFWFLSA-N 299.374 2.086 10 20 CECD C[C@@H](N[C@H]1CCCC[C@@H]1O)c1ccc(F)cc1O 62748452 PAKIPIQDDAGNOZ-ICCXJUOJSA-N 253.317 2.485 10 20 CECD Cc1cccc(CN2CCN(Cc3ccccn3)CC2)c1O 179628083 PREAKWWMGNFNMR-UHFFFAOYSA-N 297.402 2.413 10 20 CECD Cc1ccc(C(=O)N[C@H](C)c2cccnc2)c(O)c1O 179393047 WENQFNQEZJYLLL-SNVBAGLBSA-N 272.304 2.292 10 20 CECD CCCOc1ccc(CN2CCC[C@H]2C(=O)OC)c(O)c1 124805290 NGAXPIJXJABZTO-AWEZNQCLSA-N 293.363 2.318 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CCN2CCCC2)c1O 63052473 UHVGJLNDBMADSJ-UHFFFAOYSA-N 294.370 2.262 10 20 CECD CCO[C@H]1C[C@@](CO)(NCc2cc(F)ccc2O)C1(C)C 188906123 YNZBOCBONNPOPV-HOCLYGCPSA-N 297.370 2.187 10 20 CECD CC(C)(C(=O)NCCc1ccc(O)c(O)c1)C1CC1 288048063 FNYFRYURQBQXKM-UHFFFAOYSA-N 263.337 2.193 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)CCCO)c1O 228676368 HJSZBRUPYQVGKN-SECBINFHSA-N 273.760 2.305 10 20 CECD CCCS(=O)(=O)CCN(C)c1ccc(OC)c(F)c1 131434408 HATIAWBWAAUFBJ-UHFFFAOYSA-N 289.372 2.095 10 20 CECD C[C@@H](CN[C@@H](C)c1ccc(F)cc1O)CN(C)C 293387641 ISPHMYNNJISUTK-QWRGUYRKSA-N 254.349 2.380 10 20 CECD CCOc1cccc(CN[C@H]2CCSC2)c1O 230705112 OUGAWLJRMNXZSQ-NSHDSACASA-N 253.367 2.386 10 20 CECD CNC(=O)C(C)(C)CN[C@H](C)c1ccc(N(C)C)cc1 183838122 DXGCDLANVUSYNQ-GFCCVEGCSA-N 277.412 2.175 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(O)c(O)c2)on1 269101426 PDJYEWJBCNHHPJ-UHFFFAOYSA-N 276.292 2.139 10 20 CECD CC(C)C(=O)N1CCCC[C@@H]1C(=O)Nc1ccc(N)cc1 269147364 ZWTRRMRYXRERCP-CQSZACIVSA-N 289.379 2.244 10 20 CECD Oc1cccc(Cl)c1CNCC1(N2CCOCC2)CC1 277529802 UWUIHXDRNWNLKS-UHFFFAOYSA-N 296.798 2.000 10 20 CECD CCN(CCCO)Cc1ccc(N(C)C)c(F)c1 271190654 LNUHNYNONOYYFI-UHFFFAOYSA-N 254.349 2.096 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@H](O)C2CCOCC2)c1 273484350 MXTAEFJRLUWPNH-WBMJQRKESA-N 279.380 2.139 10 20 CECD CCC(O)(CC)CCNC(=O)N(C)Cc1ccccc1O 276249766 AYYWRXRNMUHNRK-UHFFFAOYSA-N 294.395 2.475 10 20 CECD COc1cccc(CNC(=O)C2=C(C)OCCS2)c1O 287497593 DTVURCMXAMTRTN-UHFFFAOYSA-N 295.360 2.012 10 20 CECD CC[C@H](N[C@@H](C)CN1CCOCC1)c1ccc(C)cc1O 280032656 IHKLIWWUVRIUKA-HOCLYGCPSA-N 292.423 2.462 10 20 CECD Cc1ccc([C@@H](C)NCCCc2cnn(C)n2)c(O)c1C 293793325 UMEUSHLCLFAIKA-CYBMUJFWSA-N 288.395 2.421 10 20 CECD Cc1cc(CN2CCC[C@@]23CCOC3=O)ccc1N(C)C 294523967 JHMKHCXDUSOBSF-KRWDZBQOSA-N 288.391 2.343 10 20 CECD CCOc1ccc(CNC[C@H](CO)C(C)C)c(O)c1 808421872 SLADNIZAGGXPSN-CYBMUJFWSA-N 267.369 2.145 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H](O)C2CCOCC2)c(O)c1 294838150 RPPYVHGYCOUOIA-XJKSGUPXSA-N 293.407 2.447 10 20 CECD C[C@@H]1C[C@H](NCCc2ccc(N)cc2)CN1C1CC1 817955933 LTIUMFAXFLNWCA-DOMZBBRYSA-N 259.397 2.026 10 20 CECD Oc1c(CN2CCN3CCOC[C@@H]3C2)ccc2ccccc12 816568247 BCPIGCHYYPEGCL-INIZCTEOSA-N 298.386 2.062 10 20 CECD Cc1cc(C)c([C@@H](C)NCCCn2cncn2)c(O)c1 815605533 XXGITSAOVKJHSE-CYBMUJFWSA-N 274.368 2.341 10 20 CECD Cc1cc(O)c(CN2CCC(O)CC2)cc1Cl 824522514 QCJXBHFJEUIQKW-UHFFFAOYSA-N 255.745 2.311 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)c1ncc[nH]1 824261995 OVTSDRHPJNHGKN-UHFFFAOYSA-N 284.363 2.330 10 20 CECD CCOc1ccc(CN[C@@H](C)CC(C)(C)O)c(O)c1 824695749 BZELSQNMZDPCPS-NSHDSACASA-N 267.369 2.430 10 20 CECD Cc1cc(O)c(CNCCNC(=O)C(C)C)cc1Cl 825059189 VJVCOPDSCYWWCJ-UHFFFAOYSA-N 284.787 2.216 10 20 CECD CCn1nnc(C)c1CN(C)c1ccc(OC)c(F)c1 824130632 JBWWLNFNXAFTJA-UHFFFAOYSA-N 278.331 2.391 10 20 CECD CC(C)N1CCC(C(=O)Nc2ccc(N)cc2)CC1 832249908 FNXCCNXTOSRCIO-UHFFFAOYSA-N 261.369 2.328 10 20 CECD C[C@H]1CCN(S(=O)(=O)Nc2ccc(O)cc2Cl)C1 849308322 KHKMYANNDNPOHY-QMMMGPOBSA-N 290.772 2.044 10 20 CECD Cc1ccc(C(=O)N2CC[C@H](c3ccncc3)C2)c(O)c1O 848100249 AWBPVUAEWKMSME-ZDUSSCGKSA-N 298.342 2.431 10 20 CECD COCCCCc1noc(Cc2ccc(N)cc2)n1 843182555 DAMUJDRAPCQPDX-UHFFFAOYSA-N 261.325 2.212 10 20 CECD C[C@H](N[C@H]1CO[C@H](C)C1)c1cc([N+](=O)[O-])ccc1O 842929326 OWTZDUCBHKJVMD-KXUCPTDWSA-N 266.297 2.128 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCCCCCN)c1 843343358 ZRUSKTCOEFZNSU-LBPRGKRZSA-N 294.395 2.349 10 20 CECD CN(C[C@@H]1CCCC[C@@H]1O)C(=O)Nc1ccc(N)cc1 841295773 GDNQOHFXDUKFAW-FZMZJTMJSA-N 277.368 2.284 10 20 CECD COc1cccc([C@@H](C)NCCOC(C)C)c1O 846162921 JUUCQTMJLPLQIQ-LLVKDONJSA-N 253.342 2.476 10 20 CECD Cc1ccncc1CNC[C@@H](N)c1ccc(N(C)C)cc1 841042714 MQSNNCXPXVZFCI-QGZVFWFLSA-N 284.407 2.246 10 20 CECD O=C1C[C@@H](CNCc2cccc(Cl)c2O)CN1C1CC1 846071600 GUNOCMLRCDNIBR-JTQLQIEISA-N 294.782 2.146 10 20 CECD CCc1cccc(CN2C[C@@H](C)O[C@@]3(CCOC3)C2)c1O 848908081 MRKSVAVDTTWLQI-DYVFJYSZSA-N 291.391 2.334 10 20 CECD O=C(CSc1ncc(Cl)s1)NC[C@@H]1CCCO1 849999241 XFAZTORBPGQUGN-ZETCQYMHSA-N 292.813 2.184 10 20 CECD C[S@@](=O)c1ccc(CNC(=O)c2cc(O)cs2)cc1 752819709 QRKIJMKCHIHFTC-LJQANCHMSA-N 295.385 2.121 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncnc2nccnc12 752634818 KISJSUNTWTZIHP-UHFFFAOYSA-N 294.362 2.406 10 20 CECD CNC(=O)[C@H](CC(C)C)NCc1ccc2c(c1)CCCO2 921939295 XACONCDQPZOFRS-HNNXBMFYSA-N 290.407 2.262 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCCC[C@@H]1O 825036034 YTPVLARYHWMHGZ-YPMHNXCESA-N 265.353 2.042 10 20 CECD CCCOCCOC(=O)NCc1cccc(OC)c1O 859006473 OLLKNDQVPMLAOJ-UHFFFAOYSA-N 283.324 2.054 10 20 CECD CNC[C@@H](C)NCc1cc(C)cc(Br)c1O 853248629 HZGAVYPUPKEPBF-SECBINFHSA-N 287.201 2.161 10 20 CECD COc1ccc(CN[C@@H]2CC=C(C(=O)O)C2)cc1C 853040431 XKRUNNTYPJNEBC-CYBMUJFWSA-N 261.321 2.267 10 20 CECD CCCCC[C@H](NC(=O)c1cc(O)cs1)C(=O)OC 752820168 VINLAMAUJAZLSS-JTQLQIEISA-N 285.365 2.305 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnn(C)c2C(F)F)c1 862758993 SJZIIBUDJSHRLT-UHFFFAOYSA-N 295.289 2.302 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCC2(O)CCC2)c1 866764480 MYONWISMAJEITO-NSHDSACASA-N 293.363 2.273 10 20 CECD O=C(O)C[C@H](CNCc1cc(F)cc(F)c1O)C(F)F 1119550463 USRUPZIEIHNNJF-SSDOTTSWSA-N 295.232 2.116 10 20 CECD CC(C)c1cc(C(=O)N(C)c2ccc(N)cc2)n(C)n1 877078637 XRHRKMGRCHQZBT-UHFFFAOYSA-N 272.352 2.402 10 20 CECD C[C@@H](NC[C@H]1C[C@H](N)C1)c1cc(Cl)ccc1O 873256829 OXCPEWQXFFJOAW-FXPVBKGRSA-N 254.761 2.434 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@@]2(C)CCCOC2)cc1 771711777 SIMCIPZVRYCUMJ-INIZCTEOSA-N 291.395 2.121 10 20 CECD CCS(=O)(=O)CCCN[C@H](C)c1ccc(N(C)C)cc1 775834226 MDQQVQDUICWSME-CYBMUJFWSA-N 298.452 2.228 10 20 CECD C[C@@H](NC(=O)N(C)Cc1ccccc1O)[C@H]1CCCOC1 780858790 ARQULESNPIGTNZ-OCCSQVGLSA-N 292.379 2.349 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@H]1C=CCC1 883834196 ZEDORKSBFRJZKB-LBPRGKRZSA-N 260.337 2.500 10 20 CECD C[C@@H]1OCC[C@@H]1NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898449283 AJLIOLUBVPQVER-RRQGHBQHSA-N 291.439 2.122 10 20 CECD COc1cc(C)cc(CNCCc2cnc(C)cn2)c1O 894967452 PKUJDTMZKHRQSL-UHFFFAOYSA-N 287.363 2.140 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCC[C@@H]2OC)c1 1338905045 OEMWICYSCFDDOH-WBIUFABUSA-N 293.363 2.393 10 20 CECD COC[C@@H](C)CC(=O)Nc1c(Cl)ccc2nonc12 1342953220 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ONYUDSCKYKSCNW-GAJTVXKRSA-N 253.317 2.485 10 20 CECD Cc1ccc2[nH]c(CNC(=O)c3cccc(O)c3O)nc2c1 190473084 LHZVOEMNVPWQSP-UHFFFAOYSA-N 297.314 2.213 10 20 CECD C/C=C(\CC)C(=O)NCc1ccc(N2CCOCC2)cc1 276475886 QVUILQNPOMJRRB-CRKCGEKBSA-N 288.391 2.496 10 20 CECD Cc1cccnc1N(C)C(=O)/C=C/c1cnn(C)c1C 279290245 BDBGFDQQJAFTTD-BQYQJAHWSA-N 270.336 2.108 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CC[C@@H](O)C2)cc1F 276660400 JNTNBXWIBXMZGX-DGCLKSJQSA-N 266.360 2.142 10 20 CECD CCC1(CO)CCN(Cc2cc(OC)ccc2O)CC1 271776391 HCBCSXXHCHPEQY-UHFFFAOYSA-N 279.380 2.385 10 20 CECD COc1cc(O)c(CNC[C@H]2CCSC2)cc1OC 280536170 SGCNSEVAJYGILG-SNVBAGLBSA-N 283.393 2.252 10 20 CECD COCCN(C)Cc1c(O)cccc1Br 707129494 IZUKIAHZPCFXCJ-UHFFFAOYSA-N 274.158 2.233 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)C(F)(F)F 299663769 OFHLREFJQVKTCK-UHFFFAOYSA-N 272.270 2.465 10 20 CECD Nc1ccc(CNC(=O)C[C@@H]2CSCCS2)cc1 297208922 NFAACPOEUCTGSI-GFCCVEGCSA-N 282.434 2.124 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H](F)C(F)(F)F)c1 810348337 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O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCCCO1 846476207 LSSIBQYXYMLIMK-LBPRGKRZSA-N 269.728 2.231 10 20 CECD Cc1cc(O)c(CNCc2nnn(C(C)(C)C)n2)cc1C 848564157 IJTSFQHIJKWCQC-UHFFFAOYSA-N 289.383 2.040 10 20 CECD CC[C@H](C)[C@H](O)CN[C@H](C)c1cccc(OC)c1O 846143861 INJOGQQFMYYTSK-DMDPSCGWSA-N 267.369 2.458 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)N1CCCc2cc(CN)ccc21 843350690 WQSNDNQNIVGUBS-STQMWFEESA-N 289.423 2.201 10 20 CECD Cc1cc(CN2CCC[C@@H](C(=O)O)C2)ccc1N(C)C 846261564 SHFBTJSHEVVQJQ-CQSZACIVSA-N 276.380 2.358 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)[C@@H](O)C(F)(F)F 865711616 PKGWFZRXYPBRAZ-PRHODGIISA-N 275.270 2.023 10 20 CECD CC(C)(C)[C@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841086500 JWGWOJYLQPITMS-NSHDSACASA-N 289.379 2.102 10 20 CECD CCCNC(=O)CN(CCC)Cc1ccccc1O 69009950 DSLJPNZXGFHHDW-UHFFFAOYSA-N 264.369 2.130 10 20 CECD Cn1cc(/C=C/C(=O)N2CCc3c(F)cccc32)cn1 763750629 PWXSTKUXJZRKJL-AATRIKPKSA-N 271.295 2.162 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2C[C@@]23CCOC3)c1 764257352 DBTXIQRYDHLXJK-YNZJMPHRSA-N 291.347 2.005 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@H]2COCCO2)cc1 765251978 QNJDPNJXUJFXGC-XJKSGUPXSA-N 278.396 2.209 10 20 CECD C[C@@H](NC(=O)c1ncccc1O)c1ccc(N(C)C)cc1 776270466 UCXPDQRHIKKWGI-LLVKDONJSA-N 285.347 2.344 10 20 CECD CSC[C@@H](O)CN(Cc1ccc(N(C)C)cc1)C1CC1 777660190 DHPNZIMSVWSOMI-INIZCTEOSA-N 294.464 2.441 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CCO[C@@H]2C)cc1 878406797 DABGKPLZASLKIV-CHWSQXEVSA-N 293.363 2.100 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H]2COC[C@H]2C1 872266318 UNUMTNGORJOQPM-GASCZTMLSA-N 260.381 2.139 10 20 CECD C[C@H](NCCNc1cnccn1)c1c(O)cccc1F 886541587 YEOVTIRROBSPBP-JTQLQIEISA-N 276.315 2.084 10 20 CECD CCCN1CCC[C@H](C(=O)N(C)c2ccc(N)cc2)C1 1122094814 PXUWDALTTINZIH-ZDUSSCGKSA-N 275.396 2.354 10 20 CECD COc1cc(O)c(CN[C@@]2(C)CCCOC2)cc1OC 777508019 WJJUJKQKZQYHPL-HNNXBMFYSA-N 281.352 2.068 10 20 CECD C[C@H](NCCOC[C@H]1CCOC1)c1c(O)cccc1F 886525906 ASIFQOXZKRBDPG-RYUDHWBXSA-N 283.343 2.235 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCC=CO2)c1O 894530740 MAZZTXCBSPAWPO-CYBMUJFWSA-N 263.337 2.492 10 20 CECD Cc1ccc(O)c(NC(=O)/C=C\c2ccc(O)c(O)c2)n1 790072370 LEWWIFBQCLDYTL-DAXSKMNVSA-N 286.287 2.159 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](C)CO)cc1 88195050 QXQNUCZEYNLTPK-CYBMUJFWSA-N 250.386 2.251 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(C)OCCO2)c1 186211611 VBPGXQUBBNSSSB-NSHDSACASA-N 251.326 2.114 10 20 CECD CCCCN(C)CCNCc1ccc(OC)c(OC)c1O 1333670568 JWAIUNDKXGTRAH-UHFFFAOYSA-N 296.411 2.231 10 20 CECD COc1nc(Cl)c(CNCc2cc(C)ccc2O)n1C 1331793259 CCDNUODOKPRWCG-UHFFFAOYSA-N 295.770 2.386 10 20 CECD Cc1cc(NS(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)ccc1O 776747650 IPPNPEKTVDMJBS-GHMZBOCLSA-N 298.408 2.335 10 20 CECD O=C(O)CC1(NCc2cc(F)c(F)cc2O)CCC1 1608687837 KBKVPIUJAUGEBC-UHFFFAOYSA-N 271.263 2.157 10 20 CECD Cc1cc(CN[C@H](C)c2cc(C(=O)O)ccc2O)ncn1 1600203877 YCOPRJUXPDVEDJ-SNVBAGLBSA-N 287.319 2.040 10 20 CECD CC(C)(N)CCNC(=O)c1cc2cc(O)c(O)cc2s1 1575353760 AXCRCSSIPSMLPL-UHFFFAOYSA-N 294.376 2.170 10 20 CECD CC[C@H](C(=O)O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 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392226526 OJJWSTONKZKMLG-UHFFFAOYSA-N 266.772 2.397 10 20 CECD CCN(CC)c1ccc(CNC(=O)NC2CC2)cc1 55328995 JOZJQSIZCAMOHZ-UHFFFAOYSA-N 261.369 2.494 10 20 CECD CCCOCC(=O)NCc1ccc(N(C)C)cc1C 115281273 BPQPEYQCXVUSPL-UHFFFAOYSA-N 264.369 2.104 10 20 CECD C[C@H]1C[C@@H]1c1nnc(N(C)Cc2ccccc2O)n1C 1355655254 ZBWCGZJDLATZLN-JQWIXIFHSA-N 272.352 2.281 10 20 CECD Nc1ccc(CN2CCC(OC[C@@H]3CCOC3)CC2)cc1 1352788472 DVLDTODIUPLHSR-OAHLLOKOSA-N 290.407 2.286 10 20 CECD C[C@@H](NCc1cccc(C(N)=O)c1)c1ccc(F)cc1O 62745979 WAPQSGSNNDLIJG-SNVBAGLBSA-N 288.322 2.481 10 20 CECD C[C@@H](CO)NCc1cc(Cl)cc(Cl)c1O 35602838 STWLNEXZOQTOQB-LURJTMIESA-N 250.125 2.169 10 20 CECD Cc1ccc(C(=O)NCc2ccc(O)c(O)c2)c(O)c1 182533426 CWMYJYQFPUNABI-UHFFFAOYSA-N 273.288 2.042 10 20 CECD CCN(Cc1ccccc1O)C[C@@H](O)C(F)(F)F 189863877 DICRVRBMPBDWOK-LLVKDONJSA-N 263.259 2.137 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cc(F)ccc1O)CC2 185318337 XUBWENHTKWTETL-SKDRFNHKSA-N 290.342 2.097 10 20 CECD CCN(CC)c1ccc(CNC[C@]2(O)CCO[C@@H]2C)cc1 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WHMGZBFCFQCAEH-OAHLLOKOSA-N 297.402 2.297 10 20 CECD CCOc1ccc(CN2CC[C@]3(CCN(C)C3)C2)c(O)c1 814178079 BDIADBRDGCSSPR-KRWDZBQOSA-N 290.407 2.319 10 20 CECD Cc1cc(O)c(CNCCc2ccnn2C)cc1Cl 825519390 DVFSLXVMHUTIHA-UHFFFAOYSA-N 279.771 2.420 10 20 CECD C[C@@H](NCc1cccc(-c2nn[nH]n2)c1)c1ccccc1O 824616968 BVUYCBAQIHOIDC-LLVKDONJSA-N 295.346 2.423 10 20 CECD Cc1ccc(C(=O)N[C@H]2C[C@H](C)n3ccnc32)c(O)c1O 836955820 SLBFQNOXBFBXIS-ONGXEEELSA-N 287.319 2.039 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)C(C)(C)O)c1O 846162549 LEGOGUHCNGITIN-UWVGGRQHSA-N 253.342 2.211 10 20 CECD CCN1C[C@H](CN[C@H](C)c2cc(F)ccc2O)CC1=O 846207498 CFUZFEQEIJLQCJ-MNOVXSKESA-N 280.343 2.050 10 20 CECD C[C@@H]1C[C@H](N[C@H]2C[C@H](CO)C2)c2c(O)ccc(F)c21 927147013 IKSAVTGBIUBVEL-BFLSOPEQSA-N 265.328 2.440 10 20 CECD Oc1c(F)cccc1CN[C@H]1CCNC2(CCC2)C1 841089348 LSVCGJRMGSKCHG-LBPRGKRZSA-N 264.344 2.296 10 20 CECD C[C@@H](N)C1CCN(Cc2cccc(F)c2O)CC1 843048637 MLXGEJNUPFEBLJ-SNVBAGLBSA-N 252.333 2.091 10 20 CECD CCCS(=O)(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 841569011 IOGHAMDNYBZGSK-ZDUSSCGKSA-N 298.452 2.321 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@H](O)CC1 840948992 LPHMZHUFZAJMIK-MRXNPFEDSA-N 262.397 2.408 10 20 CECD CCn1cnnc1NCc1cc(F)c(N(C)C)cc1F 922661312 GRUNLUZLNNITKF-UHFFFAOYSA-N 281.310 2.254 10 20 CECD C[C@H](N[C@H](CO)CC1CC1)c1cc(F)cc(F)c1O 756768350 CZSJFVBBQRGMGH-KWQFWETISA-N 271.307 2.482 10 20 CECD Cc1ccc(O)c(CNC(=O)NOC/C=C/Cl)c1 858478238 XHMYWJHTAXJJIO-GORDUTHDSA-N 270.716 2.184 10 20 CECD CCN(C)c1ccc(CN(C)[C@H]2C[C@@H](C(=O)O)C2)cc1 851709340 LAKRTSIFBYQPKV-OTVXOJSOSA-N 276.380 2.438 10 20 CECD O=C(NCCCSc1nccs1)OCCF 858980727 OPZWWLUJIOTGAW-UHFFFAOYSA-N 264.347 2.321 10 20 CECD Cc1cc(O)c(CN(C)[C@@H]2CCC(=O)N(C)C2)cc1Cl 862428425 QBVDVKXPMSSFAO-GFCCVEGCSA-N 296.798 2.407 10 20 CECD CO[C@]1(CN[C@H]2C[C@H](C)c3c(F)ccc(O)c32)CCOC1 763570472 FEFZJCSOYIJWJQ-PKWAYOAASA-N 295.354 2.475 10 20 CECD C[C@H]1[C@H](C)N(Cc2ccc(N(C)C)c(F)c2)CCN1C 775983997 DUPKMDNQPNSEJR-STQMWFEESA-N 279.403 2.416 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](O)[C@H]2CCCC[C@H]21 871199665 ZHGBISWSDRNDGV-TUAOUCFPSA-N 281.377 2.219 10 20 CECD CC(=O)C1=NN(c2ccccc2C(F)(F)F)C(=O)C1 871939381 AUGZUEUWDWYZFW-UHFFFAOYSA-N 270.210 2.387 10 20 CECD C[C@H](NCCOCCN(C)C)c1cc(Cl)ccc1O 774380645 JTLJDLRPUBXBMH-NSHDSACASA-N 286.803 2.274 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2ccncc2C)c1 875425559 ZTBHIHFCEBORRS-UHFFFAOYSA-N 299.374 2.446 10 20 CECD C[C@@H](C(=O)NC(C)(C)C)N(C)Cc1cc(F)ccc1O 777221038 XPICREWLIYWWSX-JTQLQIEISA-N 282.359 2.266 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@H](C)c1c(O)cccc1F 886551200 DJSQZKRYLPAPMP-CLFVBBPSSA-N 273.373 2.339 10 20 CECD COc1cc(C)cc(CNCCN2CC[C@@H](C)C2)c1O 894394193 UXNXBWGYXHXFHH-GFCCVEGCSA-N 278.396 2.141 10 20 CECD COc1ccc(CN2CCSC[C@H]2C)c(O)c1OC 892046715 WRLAZUQCZBXITI-SNVBAGLBSA-N 283.393 2.347 10 20 CECD O=C(Nc1ncc(C(F)(F)F)[nH]1)c1cccc(O)c1O 790895818 MLWCWZQYOCBCMN-UHFFFAOYSA-N 287.197 2.092 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@]1(C)CO 895345510 VDRRZYLFNUUWDA-YMTOWFKASA-N 271.307 2.121 10 20 CECD COc1ccc(CNc2cccnc2OC)c(O)c1OC 893197653 IPHGUZHJBWYAPD-UHFFFAOYSA-N 290.319 2.425 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ncccc1F 792226744 WLFSBLYFYXPKKU-UHFFFAOYSA-N 274.295 2.127 10 20 CECD CC(C)(C)NC(=O)CCNCc1ccc2c(c1)CCO2 134591624 LGHPEBDAXGONMA-UHFFFAOYSA-N 276.380 2.016 10 20 CECD COc1ccc(CN[C@@H]2C[C@H](C)O[C@H](C)C2)c(O)c1 724625527 XVZHORCNWUXILT-PJXYFTJBSA-N 265.353 2.446 10 20 CECD CCc1cccc(CN[C@@H](C)c2noc(C)n2)c1O 1329982381 JVCSDRQXFYEIMM-VIFPVBQESA-N 261.325 2.497 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@H](C)c1ccc(F)cc1O 62747826 OCKIPYMGIATOOZ-GHMZBOCLSA-N 282.359 2.487 10 20 CECD COc1ccc(O)c(CNCC2(O)CCCCC2)c1 87016963 UXLIHNNCNFZKBI-UHFFFAOYSA-N 265.353 2.186 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1261482825 ZVBQIYCEELBPEB-GOEBONIOSA-N 273.424 2.456 10 20 CECD O=C(O)C1(CNCc2c(O)ccc(Cl)c2F)CC1 1608570416 MGZUFXPNQMJDNF-UHFFFAOYSA-N 273.691 2.139 10 20 CECD C[C@H](CN(C)Cc1cc(Cl)cc(F)c1O)C(=O)O 1603155310 HXOAAVISVXLMHS-SSDOTTSWSA-N 275.707 2.337 10 20 CECD C[C@H](NC[C@@H]1CCOC[C@@H]1C)c1cc(C(=O)O)ccc1O 1604337653 HZOBFGBPFVFTOU-GVXVVHGQSA-N 293.363 2.414 10 20 CECD COC1CC(NCc2ccc3c(c2)CCCN3C)C1 220902578 RGZYVCQRACATOK-UHFFFAOYSA-N 260.381 2.336 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCS[C@H]1C 842779913 SUPGQCLCSWXSHT-GXSJLCMTSA-N 253.367 2.384 10 20 CECD CCn1cncc1CN[C@H](C)c1cc(OC)ccc1O 845971877 NMGHCGNNCJDKOS-LLVKDONJSA-N 275.352 2.468 10 20 CECD COC[C@H](CN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21)OC 300419251 UGLXOUKGIBTTCV-RWMBFGLXSA-N 279.380 2.500 10 20 CECD CN(C)c1ccc(CNC[C@H]2CCCC[C@@H]2O)cc1 77204365 XJVRFIPPMPHEIT-ZBFHGGJFSA-N 262.397 2.393 10 20 CECD Oc1c(Cl)cccc1CNC[C@@H](O)C1CCC1 316562739 LAMZSBFGIOBQSY-GFCCVEGCSA-N 255.745 2.296 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)Nc1ccc(N)cc1)OC 381175104 CYACWFYXMKFRAQ-GXFFZTMASA-N 265.357 2.451 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(OC)c1O)[C@H](C)O 386742852 YVRSUHPZBSMSIU-GZMMTYOYSA-N 273.760 2.303 10 20 CECD COc1cccc(CNC(=O)COC2CCCCC2)c1O 105651309 KEFZQJXSJAOYBA-UHFFFAOYSA-N 293.363 2.366 10 20 CECD COC(C)(C)C[C@@H](C)NCc1cc2c(cc1O)OCO2 174553278 NGGANHQTTBEXQZ-SNVBAGLBSA-N 281.352 2.414 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cc(Cl)ccn1 154007993 GQVGAJKBLAQWPF-UHFFFAOYSA-N 292.722 2.119 10 20 CECD CC(C)COC[C@@H](O)CN[C@@H](C)c1cc(F)ccc1O 185117695 AKEQERDXOCAVPQ-AAEUAGOBSA-N 285.359 2.215 10 20 CECD CC(=O)N1CCN(Cc2cc(C)c(C)cc2O)C(C)(C)C1 182086864 MGINSZUTBOBWOM-UHFFFAOYSA-N 290.407 2.452 10 20 CECD O=C(O)CC1(CC(=O)NCc2ccccc2O)CCCC1 228402119 VHVDVYZQAVQXIJ-UHFFFAOYSA-N 291.347 2.434 10 20 CECD COC(=O)[C@@H]1CCCCCN1Cc1cc(F)ccc1O 360023314 YTBZVGOGYDTNPX-ZDUSSCGKSA-N 281.327 2.449 10 20 CECD Cc1cc([C@H]2CCCN2C(=O)c2cccc(O)c2O)no1 373744457 DCWUKVQUEGFWBY-GFCCVEGCSA-N 288.303 2.372 10 20 CECD CCN(CCc1ccnn1C)c1ccc(OC)cc1 284446852 QPGRHKNOHJZDAX-UHFFFAOYSA-N 259.353 2.498 10 20 CECD C[C@@H](C(=O)NCc1ccc2c(c1)CCCN2C)n1cccn1 299374057 JNGSYEDFRNJKLC-ZDUSSCGKSA-N 298.390 2.143 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H]1CF 294259263 YLCIQMFEXAITQP-DUMNWFOQSA-N 265.284 2.072 10 20 CECD Oc1cccc(Cl)c1CN1CCC[C@H](O)CC1 294242985 ZZHZFHNQHCGBPF-JTQLQIEISA-N 255.745 2.392 10 20 CECD CCCCOC(=O)CSc1ncc(C(=O)OC)s1 295309532 NCOUVRRWHUWQFJ-UHFFFAOYSA-N 289.378 2.365 10 20 CECD COc1ccc(-n2ccnc2SCC(=O)C(C)=O)cc1 808016679 SVNYYTJKUGSHRS-UHFFFAOYSA-N 290.344 2.131 10 20 CECD COc1cc(O)c(CN[C@H](C)CC(C)(C)O)cc1OC 294923290 BBJDPFWFMVWRQH-SNVBAGLBSA-N 283.368 2.049 10 20 CECD O=C(NC[C@H]1COc2ccccc21)c1cc(O)cs1 811562439 DVLGUPJLAJBWRQ-VIFPVBQESA-N 275.329 2.360 10 20 CECD C[C@H](NC[C@@H]1CCCN1)c1cc(Cl)ccc1O 817952542 RMZBOPIPBXVTON-ONGXEEELSA-N 254.761 2.448 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCN2C)[C@@H]1CCCN1 817900616 OPWNDVQHCHIXFA-CJNGLKHVSA-N 273.424 2.299 10 20 CECD COC(=O)C1(C)CN(Cc2cc(Cl)cc(OC)c2O)C1 822534415 FQPPUJSIWPCCCF-UHFFFAOYSA-N 299.754 2.049 10 20 CECD CN(C[C@H]1C[C@H]2CC[C@H]1O2)c1ccc2c(c1)OCO2 828499405 YNJKXYHEEXARCG-RAIGVLPGSA-N 261.321 2.419 10 20 CECD C[C@@H](NC(=O)c1n[nH]c2c1CCCC2)c1ccccc1O 827923208 LVMRGEQLCMUXLL-SNVBAGLBSA-N 285.347 2.485 10 20 CECD CCOC1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 588405608 AYEWGIVZSOMQBH-XQRVVYSFSA-N 291.347 2.139 10 20 CECD COc1ccc(CN[C@@H](COCC(C)C)C(=O)O)cc1C 904067248 WUHAUBKUGPQZCE-AWEZNQCLSA-N 295.379 2.219 10 20 CECD O=C1CCCCN1CCCN[C@@H]1CCc2cccc(O)c21 834571991 ZMWSKAGORDCIKU-CQSZACIVSA-N 288.391 2.372 10 20 CECD CCOc1ccc(O)c(CN2CC[C@](C)(C(=O)O)C2)c1 833662949 OEOBNNOCYFVKTO-HNNXBMFYSA-N 279.336 2.088 10 20 CECD CC[C@@H]1OCC[C@H]1NCc1cc(OC)c(OC)cc1O 839190862 AZZLVLRTIXFODZ-YPMHNXCESA-N 281.352 2.067 10 20 CECD CC[C@@H](C)CC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832278530 DSEJKEIAMDQAGW-DOMZBBRYSA-N 277.412 2.305 10 20 CECD CNCCNCc1ccc(OCc2ccccc2)cc1O 841036736 STTXYZKLJCGSLZ-UHFFFAOYSA-N 286.375 2.280 10 20 CECD Cc1cccc(CNC[C@@H](C(=O)O)C(C)C)c1O 848640063 NCGSMIYJGMGXMB-GFCCVEGCSA-N 251.326 2.147 10 20 CECD C[C@@H]1NCCN(Cc2c(O)ccc(Cl)c2F)[C@H]1C 843057175 GHXKWJUPQYQTHZ-IUCAKERBSA-N 272.751 2.367 10 20 CECD C[C@@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)[C@@H]1C 840999921 RBLVBELSIPVSLJ-GYSYKLTISA-N 289.379 2.148 10 20 CECD Cc1cc(N(C)C)ccc1CNCC[C@H]1CCNC1 841037516 UYURHSKGFQEORP-CQSZACIVSA-N 261.413 2.150 10 20 CECD Cc1ccc(C(=O)OCCOCC2CCC2)c(O)c1O 842072072 NUPILKMBUOBZNV-UHFFFAOYSA-N 280.320 2.380 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1cc(F)ccc1O 843427335 LIZNHIJEWXSQEK-ZWNOBZJWSA-N 255.333 2.418 10 20 CECD COCC[C@H](C)CNC(=O)NCc1ccc(N(C)C)cc1 840245505 WHBPDFCSMLAYHU-ZDUSSCGKSA-N 293.411 2.224 10 20 CECD COC/C=C\C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840556049 USFMYJRAABGNHL-AFNCTOJWSA-N 290.407 2.311 10 20 CECD Cc1noc([C@H](C)N(C)C(=O)Nc2ccc(N)cc2)n1 848594582 NBOOPLVFWIOFIF-QMMMGPOBSA-N 275.312 2.185 10 20 CECD COc1cccc([C@H](C)NCC2CCOCC2)c1O 846142717 VRZKYHYUPHWOCG-NSHDSACASA-N 265.353 2.478 10 20 CECD C[C@H]1CCCN1CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756617701 PGLLOPUEWBEIDH-NWDGAFQWSA-N 293.367 2.435 10 20 CECD C/C=C/C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 752152372 XGZKBRXDLCUZOR-HSVJCBRXSA-N 275.348 2.476 10 20 CECD CS/C=C\C(=O)N1CCOc2cc(N(C)C)ccc21 751585337 JFYWEZPMPDUKDX-TWGQIWQCSA-N 278.377 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CSCC(C)(C)C(=O)NCc1ccc(O)cc1O 910946798 VDUUNODZXSLSRW-UHFFFAOYSA-N 269.366 2.103 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](N)C[C@@H]1C 846703813 QLINSTAQXHMYMC-DZGCQCFKSA-N 261.413 2.373 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@@H]([C@@H](C)N)C2)cc1 843056919 CAYZIMTZWAXRTM-RHSMWYFYSA-N 291.439 2.081 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)C(C)C 840933840 IOSDNKSFDXQAAZ-OAHLLOKOSA-N 250.386 2.168 10 20 CECD CCOc1ccc(CN[C@H]2CCSC2)c(O)c1 742383072 SMGLIQXAYMGZPB-NSHDSACASA-N 253.367 2.386 10 20 CECD N=C(NCc1c(O)ccc2c1CCCC2)N1CCC1 849011053 LYKKDISNINBFGX-UHFFFAOYSA-N 259.353 2.001 10 20 CECD CCN(C(=O)C(=O)Nc1ccc(N)cc1)C1CCCCC1 841095520 XLRZZQPGLISSPB-UHFFFAOYSA-N 289.379 2.389 10 20 CECD CN(C)c1ccc(CN[C@H]2CCNC2(C)C)cc1F 841085972 JZMNKCHEGYGZRL-AWEZNQCLSA-N 265.376 2.122 10 20 CECD C[C@@H]1C[C@@H](NCCCn2cncn2)c2c(O)ccc(F)c21 756830456 QIGFVYMNBYJWOM-ZYHUDNBSSA-N 290.342 2.351 10 20 CECD CC(=O)CCCCOC(=O)/C=C\c1ccc(O)c(O)c1 759596225 OFILFVDRXAHNJX-VURMDHGXSA-N 278.304 2.414 10 20 CECD O=C(NC[C@]1(O)CCc2ccccc21)c1cc(O)cs1 752664104 OKXRZVARIWWMCP-OAHLLOKOSA-N 289.356 2.018 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCCS2)c1 862760885 XEGJXSDNDRPSOQ-GFCCVEGCSA-N 251.351 2.212 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c(C)noc1C 935946701 MQKTZHHZKCSDPL-UHFFFAOYSA-N 295.335 2.413 10 20 CECD Cc1ccc(O)c(CN(C)CC(=O)NCc2ccccc2)c1 769467618 YKQRGHIOPAIEDL-UHFFFAOYSA-N 298.386 2.449 10 20 CECD C[C@](O)(Cc1ccccc1)C(=O)NCc1ccccc1O 769361804 AMIYSYFRHVBKTJ-KRWDZBQOSA-N 285.343 2.002 10 20 CECD COc1cccc(O)c1CNC[C@H]1COC2(CCCC2)O1 773415174 LVRGYMMQOUUNBW-LBPRGKRZSA-N 293.363 2.176 10 20 CECD COCCN(Cc1ccc(N(C)C)cc1)C1CCOCC1 879709374 LWCZDQTWYYNQBX-UHFFFAOYSA-N 292.423 2.380 10 20 CECD O=C1NCCC12CCN(Cc1cc(Cl)ccc1O)CC2 877783098 CVJXWLJGYQUTKN-UHFFFAOYSA-N 294.782 2.148 10 20 CECD C[S@](=O)CCCNCc1cc(Cl)cc(F)c1O 776208366 ABZMQJWMWMKPDK-KRWDZBQOSA-N 279.764 2.043 10 20 CECD CNC(C)(C)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881377918 YDQGIYKTTICARU-UHFFFAOYSA-N 287.411 2.155 10 20 CECD COCCOCCN[C@@H](C)c1c(C)cc(C)cc1O 788564984 USUPMHNHBHARQV-ZDUSSCGKSA-N 267.369 2.323 10 20 CECD CN1CCC[C@H](CCNCc2cc(F)cc(F)c2O)C1 883145190 RGNUOSABPVTUHQ-LLVKDONJSA-N 284.350 2.492 10 20 CECD CCCN(Cc1ccccc1O)C(=O)COC(F)F 797190535 DJGSUBPFUUFJPD-UHFFFAOYSA-N 273.279 2.370 10 20 CECD CCN1CCN(C(=O)c2ccc(CN=[N+]=[N-])s2)CC1 1537963123 VMKJQXKCIQOUDG-UHFFFAOYSA-N 279.369 2.336 10 20 CECD CC[C@@H](NCc1c(O)cccc1Br)[C@@H](C)O 706831401 CKAVPEPDDAPNOQ-LDYMZIIASA-N 288.185 2.404 10 20 CECD CCn1c(-c2cnc[nH]2)nnc1N(C)Cc1ccccc1O 1339468891 BYECMNODZBVPMJ-UHFFFAOYSA-N 298.350 2.030 10 20 CECD CC[C@@](C)(CNCc1cc(F)cc(F)c1O)C(=O)O 1339241568 RSPXCWMMHQKFJV-ZDUSSCGKSA-N 273.279 2.261 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@@H](OC)C2)c1 776252575 GZEXEZBVEQXRJS-CHWSQXEVSA-N 265.353 2.448 10 20 CECD Cc1noc(C)c1[C@@H](C)NC(=O)Cc1ccc(N)cc1 92324195 HIGQNYQFSHTTEF-SECBINFHSA-N 273.336 2.294 10 20 CECD NCCc1ccc(CNCc2ccc(N)cc2)cc1 1337838246 MNBUALPWYSRDGT-UHFFFAOYSA-N 255.365 2.060 10 20 CECD COc1ccc(CNC(=O)/C=C/c2nccs2)c(O)c1 1349598048 FEWZARXOHOYDMA-SNAWJCMRSA-N 290.344 2.187 10 20 CECD Cc1ncsc1/C=C/C(=O)N1C[C@H](N)Cc2ccccc21 1353918502 PZWRFVKGMMCRNS-KTRBRXNASA-N 299.399 2.381 10 20 CECD CC1(NCc2c(O)cccc2Br)CCNCC1 1576544970 CESIXQFFNKLUMX-UHFFFAOYSA-N 299.212 2.386 10 20 CECD CN(C)c1ccc2c(c1)CN(CC1(C(=O)O)CC1)CCC2 1777041214 ORDNQUAAOSJITO-UHFFFAOYSA-N 288.391 2.366 10 20 CECD CN(Cc1cccc(Cl)c1O)Cc1nccn1C 160234196 OYFKLQRNIBTZAP-UHFFFAOYSA-N 265.744 2.411 10 20 CECD CC[C@H](NCCOCCN(C)C)c1ccccc1O 219311688 VHZYFUOHOFDFJY-AWEZNQCLSA-N 266.385 2.011 10 20 CECD O=C(NC[C@H]1C[C@H]2CC[C@H]1C2)c1cccc(O)c1O 253087984 DVKDPEQCMOMZIF-GARJFASQSA-N 261.321 2.264 10 20 CECD Nc1ccc(CCNC(=O)CC2CCSCC2)cc1 157536088 NJRHVWICRWIFJE-UHFFFAOYSA-N 278.421 2.461 10 20 CECD C[C@H](CN(C)Cc1ccc(Cl)cc1O)C(=O)O 1604158642 IPZMXBOVSZFYBO-MRVPVSSYSA-N 257.717 2.198 10 20 CECD CCNC(=O)c1cccc(NC(=O)Cc2ccc(N)cc2)c1 66153966 XAKWJISLFBIWFM-UHFFFAOYSA-N 297.358 2.200 10 20 CECD NC[C@H]1CCCN(Cc2cc(Br)ccc2O)C1 219712813 IQLCNRHJGXVSBB-SNVBAGLBSA-N 299.212 2.325 10 20 CECD C[C@H](N[C@H](C)[C@@H](C)N1CCOCC1)c1cc(F)ccc1O 185376555 YGBFPSJMJKAGQU-FRRDWIJNSA-N 296.386 2.291 10 20 CECD CN1[C@@H]2CC[C@@H]1CN(Cc1cc(F)ccc1O)CC2 180194298 YXNQLEVOUUBYSB-ZIAGYGMSSA-N 264.344 2.200 10 20 CECD C[C@H](CN[C@H](C)c1ccccc1O)CN1CCOCC1 183522733 PFXKCNJYRUBJLJ-ZIAGYGMSSA-N 278.396 2.011 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)C(=O)NC(C)(C)C)c1 135727850 YUPUEWMBZUFQRZ-GHMZBOCLSA-N 294.395 2.355 10 20 CECD COc1cccc(CN2CC[C@H](N3CCCCC3)C2)c1O 134124002 WULYKDYMQUJTIZ-HNNXBMFYSA-N 290.407 2.461 10 20 CECD CCOC[C@H](NC(=O)c1ccc(C)c(O)c1O)C(C)C 191441885 DBGUIKWKXGOLFA-LBPRGKRZSA-N 281.352 2.197 10 20 CECD C[C@@H](O)CCN(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 93481330 MNVJGLKAZYLCEE-MRVPVSSYSA-N 288.731 2.157 10 20 CECD CN(CSc1ncc(C(C)(C)C)s1)S(C)(=O)=O 271080513 ISQUVBORXQEQCX-UHFFFAOYSA-N 294.467 2.382 10 20 CECD C[C@H](NC[C@H](O)c1cnn(C)c1)c1cc(Cl)ccc1O 273464219 DIAOWOVZGVCLMI-XPTSAGLGSA-N 295.770 2.163 10 20 CECD CCO[C@@H]1C[C@H](NCc2cccc(OC)c2O)[C@@H]1SC 298198594 XQTMMHFBWKJNCI-LNSITVRQSA-N 297.420 2.399 10 20 CECD Cc1cc(CN2CCC[C@@H](CO)C2)ccc1N(C)C 815013798 YPGTZISGHBSZAO-OAHLLOKOSA-N 262.397 2.265 10 20 CECD O=C(Nc1ccc(OC(F)F)cn1)c1cccc(O)c1O 817064039 OTXJZWBLKGUQCD-UHFFFAOYSA-N 296.229 2.347 10 20 CECD Cc1cc(O)c(CNCC2(CO)CCOCC2)cc1Cl 825370330 MCFAAZNEWZRMBZ-UHFFFAOYSA-N 299.798 2.233 10 20 CECD COCCCN(CCO)Cc1cc(Cl)c(C)cc1O 825628994 OVQKYMAADMISPB-UHFFFAOYSA-N 287.787 2.185 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2c(C)noc2C)c1 734062510 QTVHUIARJIDFSV-UHFFFAOYSA-N 291.307 2.327 10 20 CECD O=C(NCC[C@H]1C[C@H]2CC[C@H]1O2)NCc1ccccc1O 838059534 BTEQBTUBLXRMFH-NJZAAPMLSA-N 290.363 2.149 10 20 CECD CC[C@H](N[C@@H](C)c1cc(F)cc(F)c1O)[C@@H](C)O 834888406 OUJUKAOTNFMWRC-SXMVTHIZSA-N 259.296 2.480 10 20 CECD C[C@H]1CC[C@H](CNC(=O)N(C)Cc2ccccc2O)O1 838741352 CNCPWPZESWCZPI-WCQYABFASA-N 278.352 2.101 10 20 CECD CCN1C[C@H](N[C@H](C)c2ccc(N(C)CC)cc2)CC1=O 834892466 VLDAIOJPGWQWFU-UKRRQHHQSA-N 289.423 2.414 10 20 CECD CC(C)CCC(=O)OCC(=O)c1ccc(O)c(O)c1 916611505 OJOFRRZGICBHDU-UHFFFAOYSA-N 266.293 2.260 10 20 CECD COc1cccc(CNCc2ccc(CN)cc2F)c1O 844904385 KAYAGWWWHPXZDU-UHFFFAOYSA-N 290.338 2.288 10 20 CECD CCOc1cccc(CN[C@H](CN)C(C)(C)C)c1O 841088092 WUUZNOXCNJJEBV-CYBMUJFWSA-N 266.385 2.254 10 20 CECD Cn1c(Sc2nccs2)nnc1-c1ccncc1 914863264 YJVCBWDODPGHTM-UHFFFAOYSA-N 275.362 2.485 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](C)CN)cc1F 841049476 RYPGRGSEPZJLIV-LBPRGKRZSA-N 267.392 2.356 10 20 CECD CCN(CC)CC(=O)NCc1cc(Cl)ccc1O 846472335 IEWLVRGBZVBRBY-UHFFFAOYSA-N 270.760 2.004 10 20 CECD Cc1cccc(CS(=O)(=O)NCc2ccccc2O)c1 751150804 LYPSDYOEFJVEHP-UHFFFAOYSA-N 291.372 2.320 10 20 CECD C[C@H](NC[C@H](O)c1ccco1)c1cc([N+](=O)[O-])ccc1O 756382689 SNHWIFFVUGEALP-ZANVPECISA-N 292.291 2.278 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1cccnc1 759587811 FELYQEVOIKJAFR-GQCTYLIASA-N 271.272 2.249 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCOC2CCC2)c1 858257473 MIFITRJNPZZASQ-UHFFFAOYSA-N 278.352 2.069 10 20 CECD CC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(C)c(C)c2O)C1 857083904 APQNZKZRMSOLNZ-GXTWGEPZSA-N 276.380 2.280 10 20 CECD CN1CC=C(CNCc2cc(F)c(N(C)C)cc2F)CC1 858155621 LIHRWDKYYSRYKJ-UHFFFAOYSA-N 295.377 2.382 10 20 CECD COc1cc(Cl)cc(CNCC[C@H](C)N(C)C)c1O 697925924 FXDSCIPOVUDLJT-JTQLQIEISA-N 286.803 2.484 10 20 CECD COCCC(C)(C)C(=O)NCc1cc(C)ccc1O 862757028 DXDKNSZGYUZHKC-UHFFFAOYSA-N 265.353 2.380 10 20 CECD CC(C)CCOC(=O)NCc1ccc(O)cc1O 867417264 PPPBMVCCHLSOES-UHFFFAOYSA-N 253.298 2.370 10 20 CECD CCN(CC)CCOCCNCc1c(C)cccc1O 877332572 DHCAJDKUWRQKTI-UHFFFAOYSA-N 280.412 2.149 10 20 CECD COCC[C@@]1(NCc2cc(C)c(C)cc2O)CCOC1 775035241 YAQQGKAVBBQDOE-MRXNPFEDSA-N 279.380 2.294 10 20 CECD COc1ccc(CNCc2ccc(C)cc2O)c(OC)n1 877543186 ZRHVBJRMUAEOTA-UHFFFAOYSA-N 288.347 2.403 10 20 CECD Cc1cc(NS(=O)(=O)N2CCCCC2)c(C)c(C)c1O 775291464 HSLPQXZIKUSZOY-UHFFFAOYSA-N 298.408 2.460 10 20 CECD OC[C@H](Cc1ccccc1)NCc1cc(F)cc(F)c1O 883003631 YGQZFPSNCRINRD-AWEZNQCLSA-N 293.313 2.364 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCCCN1C)c1ccccc1O 1123746855 NAFHYKFROSFPIO-CHWSQXEVSA-N 291.395 2.237 10 20 CECD C[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)[C@H]1CO 792181177 XPCJLWNDQXWDIH-KCJUWKMLSA-N 273.735 2.387 10 20 CECD COc1ccc(C)cc1CNC(=O)c1cccc(O)c1O 790526715 SHEDSSNSDOTXLL-UHFFFAOYSA-N 287.315 2.345 10 20 CECD O=C(O)[C@@H]1CCCN1Cc1cc(Cl)ccc1O 86725935 YAYHNFHDDJWDQK-JTQLQIEISA-N 255.701 2.095 10 20 CECD CCN[C@@H](C)C(=O)N(CC)Cc1ccc(N(C)C)cc1 707986777 RURZWGYWZNHYDJ-ZDUSSCGKSA-N 277.412 2.099 10 20 CECD C[C@H](NCCOC[C@H]1CCCO1)c1ccccc1O 775136649 NFSDTXZQOZPRAP-QWHCGFSZSA-N 265.353 2.238 10 20 CECD CCc1csc(NC(=O)c2cccc(O)c2O)n1 790653203 HROJQMTVTMCSBJ-UHFFFAOYSA-N 264.306 2.369 10 20 CECD Nc1ccc(CN2CCC[C@@H]2[C@@H](O)C(F)(F)F)cc1 1345159117 BXOYBCAIRBOXEU-VXGBXAGGSA-N 274.286 2.156 10 20 CECD CC(C)c1cc(C(=O)NCc2cccc(O)c2O)no1 1350300614 VHWALFJXKCBCLP-UHFFFAOYSA-N 276.292 2.139 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CC[C@@H](C(=O)O)C2)c1 1607277035 LYYMRWQAUDIAIK-AXFHLTTASA-N 279.336 2.305 10 20 CECD C[C@H](NC(=O)[C@]1(C(=O)O)C[C@H]1C)c1ccc(N(C)C)cc1 1603234650 RTVRTDOLGSNBHF-GDLVEWKHSA-N 290.363 2.041 10 20 CECD C[C@H](NCC[C@@H](C)F)c1cc(C(=O)O)ccc1O 1592950495 IIODPMGYWSMCSV-BDAKNGLRSA-N 255.289 2.489 10 20 CECD COC[C@H]1CCCN1Cc1cc(OC)c(OC)cc1O 160357333 FLYHMRUXDIWSQJ-GFCCVEGCSA-N 281.352 2.020 10 20 CECD C[C@H](NC[C@H]1CCCO1)c1ccc(N2CCOCC2)cc1 153050285 PFFSGGUUADISCA-WMLDXEAASA-N 290.407 2.353 10 20 CECD CC[C@@H]1C[C@@H](NCc2ccc(OC)cc2O)CCO1 824320396 HAKSOTMPBAUVTE-QWHCGFSZSA-N 265.353 2.448 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cn(C)nc2C)c1 125532452 RQCUOKAARUADGO-LLVKDONJSA-N 275.352 2.294 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1ccc(N(C)C)cc1 178371506 JTYFOKPCNGQMAY-CZUORRHYSA-N 280.412 2.191 10 20 CECD COc1ccc(O)c([C@H](C)NCCc2ccnn2C)c1 184014764 DLHKKQYAYKSPAD-NSHDSACASA-N 275.352 2.028 10 20 CECD Cc1ccc(CNCc2ccc(N(C)C)cc2)nn1 396689746 BQGWMYIMMOSMDD-UHFFFAOYSA-N 256.353 2.141 10 20 CECD OC[C@@H](C[C@@H]1CCCO1)NCc1cccc(Cl)c1O 895747913 JIYRVDLMPJOPAD-NEPJUHHUSA-N 285.771 2.065 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2CCCOC2)c1 103528325 LWIIIAICJUYIMM-MNOVXSKESA-N 279.336 2.005 10 20 CECD CCCN(CC(=O)OCC)Cc1cc(F)ccc1O 179969994 NTNGKASOYQMGOC-UHFFFAOYSA-N 269.316 2.306 10 20 CECD Cc1ccc(C(=O)NCc2ccc(N(C)C)cc2)n1C 23956922 QOYUAJLUCRIBIQ-UHFFFAOYSA-N 271.364 2.330 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)Cn2cncn2)cc1 67504947 INBFFIYSRIPGEE-AWEZNQCLSA-N 287.411 2.303 10 20 CECD CC(C)CONC(=O)N(C)Cc1ccc(N(C)C)cc1 127940240 ZFVCDUMFZFRVCG-UHFFFAOYSA-N 279.384 2.482 10 20 CECD COc1cccc(CNC[C@H]2CSCCS2)c1O 125227625 MDFNAFPLUJAHDN-NSHDSACASA-N 285.434 2.339 10 20 CECD Cc1csc(N(C)C(=O)c2ccc(C)c(O)c2O)n1 182413275 VJUGMMJSEDYVLA-UHFFFAOYSA-N 278.333 2.448 10 20 CECD Cc1cc(Br)cc(CN(C)C[C@@H](C)O)c1O 130666515 GMANEQPHLFYILW-SECBINFHSA-N 288.185 2.276 10 20 CECD CCCN(Cc1nc(C)no1)Cc1ccccc1O 130732830 CLXKWFWRHANOCI-UHFFFAOYSA-N 261.325 2.496 10 20 CECD Cc1nc(CCNC(=O)c2cccc(O)c2O)sc1C 193135830 FCLZKOVEGSEPSC-UHFFFAOYSA-N 292.360 2.144 10 20 CECD Cc1cccc(CN2CCC[C@@H]2c2ncon2)c1O 362045256 LOUCYLGMSALRCB-GFCCVEGCSA-N 259.309 2.421 10 20 CECD C[C@@H](NCc1nncn1C)c1cc2c(cc1O)CCCC2 273368732 FOHIBUOOFPWELT-LLVKDONJSA-N 286.379 2.250 10 20 CECD Oc1ccc(Cl)cc1CN1CCOC[C@H]1[C@H]1CCCO1 377707908 WIZHMHRYUQUIMP-DZGCQCFKSA-N 297.782 2.425 10 20 CECD Cc1ccc([C@H](C)NCCS(=O)(=O)C(C)C)c(O)c1C 290012612 BTRXOYIFARWUDG-ZDUSSCGKSA-N 299.436 2.483 10 20 CECD CC(C)OCc1cc(NS(=O)(=O)C2CC2)ccc1O 290532961 OIZCCKJPMKPMKB-UHFFFAOYSA-N 285.365 2.221 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CC23CCNCC3)c1 817976411 LKGVQVYXFNZXPQ-NHYWBVRUSA-N 276.380 2.194 10 20 CECD CN1CCCc2cc(CN[C@H]3CCC[C@@H]3CN)ccc21 817901866 YWHFYHJHDXSUFA-CVEARBPZSA-N 273.424 2.286 10 20 CECD Cc1cc(C)n(CCC(=O)N[C@H](C)c2ccccc2O)n1 827922900 CRDJQMLOJUSLIZ-CYBMUJFWSA-N 287.363 2.473 10 20 CECD O=C(/C=C/c1cncc(F)c1)N1C[C@H](O)Cc2ccccc21 493248997 BQOAWRVSSNMICV-LLYBFZRZSA-N 298.317 2.184 10 20 CECD Cc1cc(COC(=O)c2ccc(C)c(O)c2O)on1 727004011 KLQSNOPPLVARBK-UHFFFAOYSA-N 263.249 2.060 10 20 CECD CC[C@@H]1CC[C@@H](C(=O)N(C)Cc2ccccc2O)O1 268201647 GFAZZQDPEHWNTQ-OCCSQVGLSA-N 263.337 2.308 10 20 CECD COc1ccc(O)c(CN2[C@H]3CC[C@H]2CC(=O)C3)c1 839131966 SDRMHTHRXOYXOY-RYUDHWBXSA-N 261.321 2.097 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@@H](C)c1cc(F)ccc1O 834881027 YFPNTPITQMQABI-ZIBATOQPSA-N 283.343 2.233 10 20 CECD COC(=O)N1CCC[C@@H](N[C@H]2CCc3cccc(O)c32)C1 834559114 ZPJYWGFEJRMOBR-OLZOCXBDSA-N 290.363 2.200 10 20 CECD COc1cc(N(C)Cc2cnccn2)cc(OC)c1OC 839003575 KEMKKXZNDCFSLR-UHFFFAOYSA-N 289.335 2.139 10 20 CECD CCOc1ccc(CN[C@@H]2CO[C@@H](C)C2)c(O)c1 842776763 ZRIBUOZRXZLGSO-JQWIXIFHSA-N 251.326 2.058 10 20 CECD COCCCN(C)CCN(C)c1ccc(OC)cc1 844399774 OMOHDMJZAWXQCL-UHFFFAOYSA-N 266.385 2.100 10 20 CECD CNC[C@H]1CCN(Cc2ccc(N(C)C)cc2C)C1 843052148 HPQDHLSBQXRVHH-CQSZACIVSA-N 261.413 2.102 10 20 CECD Cc1ccc(O)c(CN2CCCc3c(cnn3C)C2)c1 840954450 IPGGCYHDXYVGNN-UHFFFAOYSA-N 271.364 2.383 10 20 CECD CCOc1ccc(CN2CC[C@@H](N)C[C@@H]2C)c(O)c1 846699699 VVZUCDTVXGHNJA-WCQYABFASA-N 264.369 2.103 10 20 CECD COCC[C@H](C)CNC(=O)N(C)Cc1ccccc1O 840403580 UVMXBUZIDOYALG-LBPRGKRZSA-N 280.368 2.206 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1cc(Cl)cc(F)c1O 844935972 GJCNCDBYWKALCX-JTQLQIEISA-N 275.707 2.480 10 20 CECD CCN(C)c1ccc(CN(CC(=O)O)C(C)C)cc1 846267250 PKWLONCHJZTQQN-UHFFFAOYSA-N 264.369 2.438 10 20 CECD Cc1ccc([C@H](C)NCCS(=O)(=O)CC2CC2)c(O)c1 756760217 IWBSZWKENLUMKT-LBPRGKRZSA-N 297.420 2.176 10 20 CECD CCC[C@H](O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756575559 HNCOPQCIYWQGPZ-ONGXEEELSA-N 268.313 2.112 10 20 CECD CC[C@@H](C(=O)NCc1cc(C)ccc1O)N(CC)CC 862759546 FWLGZYBNUNQGAB-AWEZNQCLSA-N 278.396 2.437 10 20 CECD CO[C@@]1(CN[C@@H](C)c2cc(F)cc(F)c2O)CCOC1 763574316 YSCQSOIDIQKGHH-LKFCYVNXSA-N 287.306 2.127 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)F)c1cc(F)cc(F)c1O 760036895 GIKGDAYUAPUJOC-HTRCEHHLSA-N 281.249 2.337 10 20 CECD Cc1ccc(CNCCCN2CCCO[C@H](C)C2)c(O)c1 877477405 CRURUEKZJURCSP-OAHLLOKOSA-N 292.423 2.291 10 20 CECD CNC(=O)CN(Cc1ccccc1)Cc1cc(C)ccc1O 877771741 BIIMITFYCBZYAR-UHFFFAOYSA-N 298.386 2.449 10 20 CECD Cn1nc2c(c1NC(=O)Cc1ccc(N)cc1)CCCC2 877200910 RNRFFEYTPIDMST-UHFFFAOYSA-N 284.363 2.062 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2N[C@H]1[C@@H]2CNC[C@@H]21 1118122293 STWSSBJNESLAFU-DKQGBHPVSA-N 258.365 2.056 10 20 CECD COC(=O)c1ccc(CN(C)c2ccc(OC)cc2)n1C 877610653 WGMPELCLXPHRPG-UHFFFAOYSA-N 288.347 2.457 10 20 CECD C[C@H]1COCC[C@H]1CNCc1cc(F)cc(F)c1O 883118582 ZUHNRHADHIXMHI-UWVGGRQHSA-N 271.307 2.433 10 20 CECD CN(C)c1ccc(CNCC2(CO)CCC2)cc1F 784675477 OBGVCYQQGCDGEY-UHFFFAOYSA-N 266.360 2.144 10 20 CECD CCN(C)c1ccc(Cn2cc(Cn3ccnc3)nn2)cc1 881314790 FCUCWCYXJWSKLK-UHFFFAOYSA-N 296.378 2.027 10 20 CECD CN(C)c1ccc(CNC(=O)c2ncccc2N(C)C)cc1 899982252 CPCUBKRQRQHYND-UHFFFAOYSA-N 298.390 2.144 10 20 CECD Cc1nc([C@H]2CCN(Cc3cccc(Cl)c3O)C2)n[nH]1 895006650 AGZBUDYKBJDZTH-NSHDSACASA-N 292.770 2.462 10 20 CECD COCC1CN(Cc2c(O)cccc2Br)C1 895974581 HOWKCXRZQJXYSD-UHFFFAOYSA-N 286.169 2.233 10 20 CECD Cc1cc(N(C)C)ccc1CNc1c([N+](=O)[O-])cnn1C 892564900 YJPWKPAPYUWJLD-UHFFFAOYSA-N 289.339 2.315 10 20 CECD CC[C@@H](NCCOCCN(C)C)c1ccc(C)cc1O 794814586 MEKBXEWYWLCNSW-OAHLLOKOSA-N 280.412 2.320 10 20 CECD CCCOc1cc(N2CCC(O)CC2)ccc1NC(C)=O 791247030 TVQZPVHQYPWEMW-UHFFFAOYSA-N 292.379 2.395 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c(O)c1 794373842 NBNVFWYBEBYVAY-IINYFYTJSA-N 291.347 2.022 10 20 CECD COc1ccc(CN[C@H]2CN(C(C)=O)CC2(C)C)cc1C 995304355 UCZPNZGCDLMPMV-INIZCTEOSA-N 290.407 2.350 10 20 CECD CCOc1cccc(CNCCN2CC[C@H](C)C2)c1O 744450347 RYFWBMCPJDUIHJ-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD C[C@@H](N[C@H](CO)CC(F)(F)F)c1cc(F)ccc1O 717774001 PGUCCXTYXAYOCZ-APPZFPTMSA-N 281.249 2.495 10 20 CECD CN(Cc1ccccc1O)c1ncnc2[nH]ccc12 760262421 LQTJETGVAOMELO-UHFFFAOYSA-N 254.293 2.300 10 20 CECD CCn1cc(CCOC(=O)c2cc(O)cs2)cn1 1333343023 OVXHUJGBNVIKDP-UHFFFAOYSA-N 266.322 2.070 10 20 CECD CO[C@H](CNCc1cccc(C)c1O)C(F)(F)F 776175104 UWQWUQJYFSJGKX-SNVBAGLBSA-N 263.259 2.368 10 20 CECD CC[C@H](NC[C@H](C)CNC)c1ccc(F)cc1O 1345481598 DPQJVBJVTLFKQI-MFKMUULPSA-N 254.349 2.428 10 20 CECD CCCCCCNC(=O)C(=O)N(C)Cc1ccccc1O 1340162773 HXYNDTVZNRWPHC-UHFFFAOYSA-N 292.379 2.047 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CCCC12CC2 1350299634 GUNPAWJHOKADCI-NSHDSACASA-N 261.321 2.294 10 20 CECD Cn1cc(C(=O)NCc2ccc(N)cc2)c(C(C)(C)C)n1 1515333087 MUBLGBDZFXBALN-UHFFFAOYSA-N 286.379 2.230 10 20 CECD C/C(=C/CN[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 1609503418 NRSBNNREVJBDSC-UCQJPZFISA-N 262.353 2.434 10 20 CECD CCN(C)c1ccc(CNC[C@@H](C)C(=O)O)c(C)c1 1776856787 LNJGXDZOBJCEKW-GFCCVEGCSA-N 264.369 2.261 10 20 CECD O=C(O)[C@@H](CC1CCC1)NCc1cc([N+](=O)[O-])ccc1O 1777572810 XOOJPZKKKCHSKV-GFCCVEGCSA-N 294.307 2.033 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccc(CN)o1 154143455 RJXZUHSVQXPFQT-UHFFFAOYSA-N 288.347 2.496 10 20 CECD CCN(CCNCc1ccc(N(C)C)cc1)C1CC1 101932108 WWHAHMASFJAQIG-UHFFFAOYSA-N 261.413 2.327 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCSCC2)c1 230661623 ZKOJGQVFYWJKMJ-CYBMUJFWSA-N 280.437 2.400 10 20 CECD COC(=O)[C@@H](CC(C)C)NCc1cccc(C)c1O 158700897 WVWXYFDDXYTENG-CYBMUJFWSA-N 265.353 2.378 10 20 CECD CCCNC(=O)CN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 36780975 YPFZORUNNFCUJL-NWDGAFQWSA-N 276.380 2.365 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCN(C)C2)cc1 49084094 XQPOWHJZNAZKFX-HNNXBMFYSA-N 261.413 2.327 10 20 CECD Cn1cncc1CCNCc1c(O)cccc1Cl 401675365 OAFLURAAZPPCLI-UHFFFAOYSA-N 265.744 2.111 10 20 CECD CC(C)O[C@H]1CCCN(C(=O)c2cccc(O)c2O)C1 404530249 MTVFVZMGPVKYAF-NSHDSACASA-N 279.336 2.127 10 20 CECD Nc1ccc(NC(=O)NCCCOC(F)F)cc1 398203929 DZFQAAPDFZZGIQ-UHFFFAOYSA-N 259.256 2.020 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cccc(O)c1 26276303 TUCRGTOIEKYIRD-FNORWQNLSA-N 271.272 2.455 10 20 CECD CNCC1CCN(Cc2ccc(N(C)C)cc2)CC1 63158910 XFGOCHKPQXNIEO-UHFFFAOYSA-N 261.413 2.184 10 20 CECD C[C@@H](c1ccccc1)N(CC(N)=O)Cc1ccccc1O 176673367 JTHDASFCMNZKMF-ZDUSSCGKSA-N 284.359 2.441 10 20 CECD CCOC(=O)N[C@H]1CCCN(Cc2cccc(C)c2O)C1 179691924 GUFJJHAILZHUBJ-AWEZNQCLSA-N 292.379 2.411 10 20 CECD CCN(CC)c1ccc([C@@H]2NC(=O)CN2CC)cc1F 189884718 DKNIDDZSDLSALT-OAHLLOKOSA-N 279.359 2.122 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)C[C@H]1CCCC[C@@H]1O 181098952 AWYQHKDAWBDOJP-YPMHNXCESA-N 293.363 2.104 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2cncs2)cc1 188037225 ZPYVFHNIGAXKKU-UHFFFAOYSA-N 275.377 2.068 10 20 CECD CN(Cc1ccccc1O)C(=O)COc1ccc(C=O)cc1 120282107 NDXISHFSRCJUKR-UHFFFAOYSA-N 299.326 2.242 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCO[C@@H]2CCOC2)c1 182391985 PUCSOOFZWJBXFE-TZMCWYRMSA-N 295.379 2.247 10 20 CECD O=C(Nc1cc(-c2cccnc2)n[nH]1)c1cccc(O)c1O 192992953 FIGZTSDETGKORW-UHFFFAOYSA-N 296.286 2.135 10 20 CECD Oc1c(Br)cccc1CN[C@@H]1CCOC1 87783487 YIESPUJMRBEYSB-SECBINFHSA-N 272.142 2.033 10 20 CECD CC[C@H](C)N(C)CCNCc1cc(F)ccc1O 226590706 IFEUMPBWLUBVEG-NSHDSACASA-N 254.349 2.351 10 20 CECD COc1ccc(O)c(CN2CC[C@H]3OCCC[C@@H]3C2)c1 180316410 NDCJJSOAEMAPBU-MLGOLLRUSA-N 277.364 2.402 10 20 CECD COc1cccc(CNc2cc(C)nc(C)n2)c1O 91479151 DHTINNPDBOEXMZ-UHFFFAOYSA-N 259.309 2.420 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2CO)c1O 50152210 JWRQGFYTPPBHKA-ZDUSSCGKSA-N 281.327 2.081 10 20 CECD COCc1nsc(NCc2cccc(OC)c2O)n1 91479278 NPFWIEGLRWJXQI-UHFFFAOYSA-N 281.337 2.011 10 20 CECD CC(C)[C@H](O)CNCc1ccc(Br)cc1O 691452064 CAQWVVBXIFRHGS-GFCCVEGCSA-N 288.185 2.261 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCc2cc(C)no2)c1 273595918 QNUDNXRGQVQUCH-SNVBAGLBSA-N 290.319 2.326 10 20 CECD OCCN(Cc1c(O)cccc1Cl)CC(F)F 279786884 LWTMNJHLFOUNCV-UHFFFAOYSA-N 265.687 2.105 10 20 CECD Cc1cc(O)c(CNC[C@@](C)(O)C(F)(F)F)cc1C 270460569 FNDSYJKUCPTQFV-GFCCVEGCSA-N 277.286 2.412 10 20 CECD Cc1cc(CN2CC[C@H](O)C[C@@H]2C)ccc1N(C)C 293639436 RPDOMFIDBMYZFK-ZFWWWQNUSA-N 262.397 2.406 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CNC1CC1 818608220 UCLRDVBZJAVAOX-UHFFFAOYSA-N 289.423 2.242 10 20 CECD CSC[C@H](O)CNCc1ccc(N2CCCC2)cc1 818954537 UUEDVUUPMJMOAK-OAHLLOKOSA-N 280.437 2.100 10 20 CECD Cc1cc(COC(=O)c2ccc(C)c(O)c2O)no1 727004991 BSLMJECWYUFVEH-UHFFFAOYSA-N 263.249 2.060 10 20 CECD COc1cccnc1CNCc1c(O)cccc1OC 825249306 AYBKTNOIANXXNU-UHFFFAOYSA-N 274.320 2.094 10 20 CECD C[C@H]1C[C@@H](CCNC(=O)c2c(F)ccc(O)c2O)CCO1 828292756 GZZHDQNEEPUFOF-UWVGGRQHSA-N 297.326 2.172 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@@H](C)N(C)C 823663888 RLCYDGWMOKCEPN-UONOGXRCSA-N 291.439 2.058 10 20 CECD O=C(CCCF)NCc1ccc(N2CCOCC2)c(F)c1 822688165 LQHQCOFLMIRNNM-UHFFFAOYSA-N 298.333 2.028 10 20 CECD CO[C@H]1C[C@@H](NC(=O)c2cc(O)cs2)C12CCC2 839796896 FUTSQNGWAJYVRG-MNOVXSKESA-N 267.350 2.141 10 20 CECD O=Cc1nc(/C=C\c2ccc(N3CCOCC3)cc2)c[nH]1 901554666 AWNMPVLBMQYNMZ-RJRFIUFISA-N 283.331 2.229 10 20 CECD CCc1noc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 902667182 AELGBQARSCFWGV-JTQLQIEISA-N 288.351 2.189 10 20 CECD COc1ccc(O)c(CNC(=O)C2CC3(CC3)C2)c1 830544697 SSSFKDFHYNGOSH-UHFFFAOYSA-N 261.321 2.207 10 20 CECD C[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)CCS1 588406808 XSQCMWFMGIAGPV-TZGMSPROSA-N 279.361 2.075 10 20 CECD CO[C@H](C)C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 839919111 PLVZEEWKGUJOME-QWHCGFSZSA-N 278.396 2.143 10 20 CECD C[C@@]1(NC(=O)Nc2ccc(N)cc2)CCO[C@H]1C1CC1 841295569 BLTIKVFVMHCVSZ-DZGCQCFKSA-N 275.352 2.348 10 20 CECD CC(C)[C@H](N)CNCc1cc(Cl)cc(F)c1O 841030528 MKMCBXPARPOERB-LLVKDONJSA-N 260.740 2.258 10 20 CECD CCn1nc(C)c(COc2ccc(N(C)C)cc2)n1 842042953 CLQDNORAKFTBAR-UHFFFAOYSA-N 260.341 2.251 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C(=O)NC(C)(C)C 840931230 VFXCNRQKEHITFY-ZDUSSCGKSA-N 291.439 2.454 10 20 CECD CCC(C)(C)OCCNC(=O)NCCc1ccc(N)cc1 841916049 WSYOQXBPIHBXOD-UHFFFAOYSA-N 293.411 2.316 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)[C@@H](CO)SC)c1O 846144740 LWOROYHUDVINPI-OUJBWJOFSA-N 285.409 2.164 10 20 CECD COC(=O)N1CCC[C@@H](N[C@@H](C)c2ccc(F)cc2O)C1 756526067 FHFUHPJQTOYGGO-CMPLNLGQSA-N 296.342 2.413 10 20 CECD CO[C@@]1(C)C[C@H]1NC(=O)NCc1cc(Cl)ccc1O 852686237 ROMMAQDHOMKOHN-YPMHNXCESA-N 284.743 2.022 10 20 CECD CCOc1cccc(CN2C[C@@H]3CCC[C@@]3(N)C2)c1O 857226155 GARGZGROZNAPFC-XJKSGUPXSA-N 276.380 2.104 10 20 CECD CN(C)c1cc(F)c(CNCc2cc[nH]n2)cc1F 858128367 KTTSUNYFFUNYJC-UHFFFAOYSA-N 266.295 2.044 10 20 CECD CCOC(=O)/C=C\CN(C)c1ccc(OC)cc1OC 930076116 DCQVOKSDVCTSFF-SREVYHEPSA-N 279.336 2.259 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(C(F)F)n(C)n1 934705090 OPRDWVCWYVOEGY-UHFFFAOYSA-N 295.289 2.336 10 20 CECD C[C@@H](NC(=O)NCc1cccn1C)c1ccccc1O 868324515 LNBIRLZQRVMLKR-LLVKDONJSA-N 273.336 2.291 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnn(CC2CC2)c1 866597434 SLNFWGUUNUDBCJ-UHFFFAOYSA-N 285.347 2.271 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H]2CCO)cc1F 779202272 MFZHQSFRKOQQES-CYBMUJFWSA-N 266.360 2.239 10 20 CECD C[C@H](NC(=O)N1CCOC[C@@H]1C)c1ccc(N(C)C)cc1 773621784 PLYATYYSXNQOTL-STQMWFEESA-N 291.395 2.244 10 20 CECD CO[C@H]1CCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 774830828 DKEJNKXDYZSUGI-HZMBPMFUSA-N 280.324 2.205 10 20 CECD Cc1nnc(NCc2ccc(N(C)C)c(F)c2)nc1C 775457090 ABKXDOWDWOTZEO-UHFFFAOYSA-N 275.331 2.306 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1cc(OC)ccc1O 775997073 BFOLWVYQZHUHKZ-RISCZKNCSA-N 293.363 2.174 10 20 CECD C[C@@H]1CN(Cc2ccc3ccccc3c2O)C[C@@H]1O 897681185 YRUSVPLOFDNCNC-ABAIWWIYSA-N 257.333 2.358 10 20 CECD CN(Cc1cnc[nH]1)Cc1cc(F)cc(F)c1O 895224942 MYRVWFAXRKJFCW-UHFFFAOYSA-N 253.252 2.026 10 20 CECD CC1=NO[C@@H](CNCc2ccc(N(C)C)cc2C)C1 895300878 WJYLGAAWFYLJEE-OAHLLOKOSA-N 261.369 2.315 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2ccc3c(c2)CCCO3)C1 896127072 WMMJXHQCCFHOCB-CABCVRRESA-N 289.375 2.443 10 20 CECD COc1cc(C)cc(CN(C)C[C@H]2CCC[C@@H]2O)c1O 894089337 RRHRAZKVPZNUHY-OCCSQVGLSA-N 279.380 2.302 10 20 CECD Oc1cc2c(cc1CN1CCC(C3CC3)CC1)[C@H](O)CO2 793631578 OZFMSGQHYPELPR-MRXNPFEDSA-N 289.375 2.440 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H](C)[S@]1=O 792192766 PZVQJSHNUOKZRV-DBWKPXFBSA-N 280.437 2.094 10 20 CECD CCc1cccc(CN[C@H]2CCN(C3CC3)C2)c1O 691528500 YGMPGULOOKENNZ-AWEZNQCLSA-N 260.381 2.281 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)cc1O)c1ncnn1C 276642047 OWOAHINPMHRDGC-BDAKNGLRSA-N 264.304 2.072 10 20 CECD COc1ccc(CN[C@@H]2CCCSC2)c(O)c1OC 1335050183 FJTUKMMMLFPPPM-LLVKDONJSA-N 283.393 2.395 10 20 CECD CCN(Cc1c(O)cccc1OC)C[C@@H](C)OC 812807701 ICRBTQCTTOEZFR-LLVKDONJSA-N 253.342 2.258 10 20 CECD COc1cccc(O)c1CN1C[C@H]2CC[C@H]1[C@H](C(=O)O)C2 1599680480 SUKLUJTYNZUBTI-LOWVWBTDSA-N 291.347 2.086 10 20 CECD CC[C@@H](NCc1ccco1)c1cccc(-c2nn[nH]n2)c1O 1590467660 AUKJGYVSSMMSCQ-CYBMUJFWSA-N 299.334 2.406 10 20 CECD COc1ccc(O)c([C@H](C)NCCC(C)(C)CO)c1 294936378 ZWBOMEQHKUNYIW-NSHDSACASA-N 267.369 2.460 10 20 CECD CN(C)C1(CNCc2ccc(Br)cc2O)CC1 691406456 IJODLKGUZCQMPJ-UHFFFAOYSA-N 299.212 2.339 10 20 CECD CN(CCC(C)(C)C(=O)O)Cc1ccccc1O 1598472269 PNANZBLJQBPPHS-UHFFFAOYSA-N 251.326 2.325 10 20 CECD CCCCO[C@@H](C)C(=O)NCc1cccc(OC)c1O 105649354 PRAWRAMCGSSMQO-NSHDSACASA-N 281.352 2.222 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCCO2)cc1F 66841315 RBFIBTXDXQOLRL-OAHLLOKOSA-N 294.370 2.467 10 20 CECD COCCCCCNCc1ccc(N2CCOCC2)cc1 69629367 RSAHFIWOKSXTJA-UHFFFAOYSA-N 292.423 2.430 10 20 CECD COCCc1noc(CN(C)c2ccc(OC)c(F)c2)n1 121822082 XCDCHQTVTKYNOG-UHFFFAOYSA-N 295.314 2.043 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@](C)(CO)C2)c1O 305231344 SGNOXBOOGZTSDN-MRXNPFEDSA-N 295.354 2.328 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@H]1CCCCO1 186423354 QMACMSRWQIDCDS-WCQYABFASA-N 293.363 2.104 10 20 CECD O=C(O)c1ccc2c(c1)N(C(=O)/C=C\c1cccnc1)CC2 317177004 VGIVMFJZQOZMOB-UTCJRWHESA-N 294.310 2.382 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C(=O)O)C(C)C)c1 43429886 JETWWPCCXFINQV-RNCFNFMXSA-N 267.325 2.161 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H]2CN3CCC[C@@H]3CO2)c1 91662377 ZVOGOFMNQMJISF-RRFJBIMHSA-N 290.407 2.214 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cccc(C)c2O)C1 180550042 TVGIUINRMFJJTQ-CQSZACIVSA-N 262.397 2.474 10 20 CECD CC[C@](C)(CCO)NCc1ccc(N(C)C)cc1 230222227 RUNZNESEMBBJPM-OAHLLOKOSA-N 250.386 2.393 10 20 CECD O=C1Nc2ccccc2C[C@H]1NCc1ccc2c(c1)CCO2 527799109 JWVCIJCMOSLILW-MRXNPFEDSA-N 294.354 2.275 10 20 CECD Cc1nc(C(C)(C)NCc2ccc(N(C)C)cc2)no1 264383138 KRHDRQPVHSSMQR-UHFFFAOYSA-N 274.368 2.469 10 20 CECD COc1ccc(O)c(CN[C@H]2CCc3nc(C)ncc3C2)c1 361991434 NYFJDSORELUJEK-AWEZNQCLSA-N 299.374 2.146 10 20 CECD Cc1cc(NS(=O)(=O)N2CCCC2)c(C)c(C)c1O 274738087 CFAHXOSOPTYOIT-UHFFFAOYSA-N 284.381 2.070 10 20 CECD CC[C@@]1(CO)CCCN(C(=O)c2ccc(C)c(O)c2O)C1 275159433 BBASPOHDLARBOW-MRXNPFEDSA-N 293.363 2.031 10 20 CECD Cc1ccc(CN[C@H](C)c2cc(F)ccc2O)c(=O)n1C 279513633 NTQARQARFLSHBD-LLVKDONJSA-N 290.338 2.389 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[S@](=O)C1 277434135 JRAZDKYESPOOOZ-ODXCJYRJSA-N 298.427 2.092 10 20 CECD Cc1cc(O)c(CNCC2([S@](C)=O)CCC2)cc1C 280739176 WPTNBAFHEIGQFC-IBGZPJMESA-N 281.421 2.400 10 20 CECD C[C@H]1CN(Cc2cc(F)ccc2O)CCN(C2CC2)C1 294657118 ADOMATJLXLHOHZ-LBPRGKRZSA-N 278.371 2.447 10 20 CECD Cn1cc(CCNCc2cc(Cl)c(F)cc2O)cn1 816537051 QZUFARMQUANOMO-UHFFFAOYSA-N 283.734 2.251 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)C(C)(C)n1cncn1 810214772 IQSVHGHIGMJCOE-GFCCVEGCSA-N 286.379 2.126 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)c2nc(C)no2)c1 729684200 LTLRCQRXLAMGJD-SECBINFHSA-N 277.324 2.333 10 20 CECD COC(=O)[C@@H](NCc1cc(Cl)c(C)cc1O)C1CC1 825666439 JVBXNHCXBXPVBV-ZDUSSCGKSA-N 283.755 2.395 10 20 CECD Cc1cc(O)c(CN[C@H](C)C[S@](C)=O)cc1Cl 825498105 VJEXKPKCKMDXFQ-XLFHBGCDSA-N 275.801 2.211 10 20 CECD CO[C@@H]1CCC[C@@H]([C@@H](NCc2ccccc2O)C(=O)O)C1 901762762 QKENKDVIPPODKQ-UXIGCNINSA-N 293.363 2.140 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](CCN)C2)cc1F 904406753 VPRWPFANIRHMFS-GFCCVEGCSA-N 265.376 2.062 10 20 CECD CCC1CN(Cc2ccc([N+](=O)[O-])c(OC)c2O)C1 835075642 XQDNRKHPYXDJMC-UHFFFAOYSA-N 266.297 2.151 10 20 CECD C[C@@H]1O[C@H](C)C[C@@H]1CNC(=O)/C=C\c1ccc(O)c(O)c1 840514058 CVRMMAIQCXPMNX-WJLZEHGJSA-N 291.347 2.041 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1 840127940 GKKGWJVVMBMATM-QKPAOTATSA-N 271.360 2.394 10 20 CECD C[C@@H](c1cnccn1)N1CCCc2cc(CN)ccc21 843350641 RQILQZOMDYGFRC-LBPRGKRZSA-N 268.364 2.449 10 20 CECD CCN(C(=O)/C=C\c1cnn(C)c1)c1cccc(OC)c1 914528744 CXWQVYWKKATZFV-HJWRWDBZSA-N 285.347 2.495 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@H](C)CCN)cc1 841719224 GPRHFDZFUORNCK-CYBMUJFWSA-N 292.427 2.069 10 20 CECD Cc1nonc1[C@@H](C)NCc1ccc(N(C)C)c(F)c1 924860657 DQEWATRJPUQAIV-SECBINFHSA-N 278.331 2.434 10 20 CECD Oc1ccccc1CN[C@@H]1CCCN2CCCC[C@H]12 848575652 URHHWBSKPCTISU-HUUCEWRRSA-N 260.381 2.499 10 20 CECD C[C@@H]1C[C@H](N[C@H](CO)CCF)c2c(O)ccc(F)c21 846208772 KYMFSHUSDDSEOP-YWVKMMECSA-N 271.307 2.390 10 20 CECD CN(C[C@@H](O)COc1ccccc1F)c1ccc(N)cc1 923400587 MFWWZQJDSBGGFB-CQSZACIVSA-N 290.338 2.284 10 20 CECD CO[C@H](C)C(=O)Nc1c(-c2ccccn2)nc2ccccn12 751299482 MMILOZBCZHRSPK-LLVKDONJSA-N 296.330 2.370 10 20 CECD O=C(N[C@H](c1ccccn1)C1CC1)c1cccc(O)c1O 928619076 PBTJRFBBELGUBK-AWEZNQCLSA-N 284.315 2.374 10 20 CECD COC[C@@H]1CCCN1Cc1cc2c(cc1O)CCC2 751950143 PMLWEMGCAXHVPR-HNNXBMFYSA-N 261.365 2.492 10 20 CECD O=[N+]([O-])CCN(Cc1ccco1)Cc1ccccc1O 929969456 ALWUQPSNMNSDCO-UHFFFAOYSA-N 276.292 2.264 10 20 CECD O=C(Cc1c[nH]c2ncccc12)NCc1ccccc1O 757380506 IMFXJVJYCLHYHA-UHFFFAOYSA-N 281.315 2.127 10 20 CECD C[C@H](O)C[C@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 757654146 CCJGQAMFOMALLM-GUBZILKMSA-N 268.313 2.110 10 20 CECD COC(=O)N(C)CCN[C@@H](C)c1cc(F)cc(F)c1O 850548442 RLPRULVRYNMTPG-QMMMGPOBSA-N 288.294 2.019 10 20 CECD Cc1ccc(O)c(CNC(=O)CC2(O)CCCC2)c1 862760785 VDNODLCAKBCXCY-UHFFFAOYSA-N 263.337 2.012 10 20 CECD CN(Cc1c(O)cccc1Br)C1CC(O)C1 862326863 VATGKEADHSLUEJ-UHFFFAOYSA-N 286.169 2.110 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1c(O)cccc1Cl 765796553 OJPDYWQJHXJIJM-BXKDBHETSA-N 282.771 2.050 10 20 CECD C[C@@]1(O)CCN(Cc2c(O)cccc2Br)C1 862249957 BGXDRNGFXJWIHV-GFCCVEGCSA-N 286.169 2.111 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1csc(O)n1 769674592 AHBHMRAXVRMIKL-UHFFFAOYSA-N 291.376 2.187 10 20 CECD Cc1ccc(CNC[C@@H](O)c2ccc(C)o2)c(O)c1 877060233 VQPUUWLPWXOIGV-CQSZACIVSA-N 261.321 2.425 10 20 CECD COc1ccc(N(C)C[C@H]2CC3(CC3)C(=O)O2)cc1F 763699775 PXSHHFLCOPUDDD-LLVKDONJSA-N 279.311 2.366 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1CCCOC1 1116836978 NFPZYAMHBNLBDL-SSDOTTSWSA-N 281.699 2.241 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H](C)C[S@](C)=O)cc1 773839840 OATVSKHYQQVQAI-DJJJIMSYSA-N 282.453 2.342 10 20 CECD COc1ccc(O)c([C@@H](C)NCCOC[C@@H]2CCCO2)c1 775369990 JQEPAPUWHBEDMP-OCCSQVGLSA-N 295.379 2.247 10 20 CECD COc1ccc(N2CCC(NCC(C)(C)CO)CC2)cc1 773072971 QLNPQVAZDAJJOS-UHFFFAOYSA-N 292.423 2.272 10 20 CECD CS(=O)(=O)c1ccc(CNCc2ccccc2O)s1 786825891 BIBZYKLHSPSRDN-UHFFFAOYSA-N 297.401 2.147 10 20 CECD Cc1nc([C@@H]2CCN(Cc3cccc(C)c3O)C2)n[nH]1 895008278 UVIZERBQCNFEOW-CYBMUJFWSA-N 272.352 2.117 10 20 CECD CCC1CN(Cc2ccc(OC)c(OC)c2O)C1 894812689 GMCIYYHRZBRHSV-UHFFFAOYSA-N 251.326 2.251 10 20 CECD Oc1ccccc1CN1CCC(NC2CCC2)CC1 897981378 KVODFIHLLCDFMY-UHFFFAOYSA-N 260.381 2.499 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@H](c2ccccn2)C1 799065321 FCSFSQCPPGPWPL-NSHDSACASA-N 284.315 2.123 10 20 CECD COc1ccc(CN2[C@H]3CC[C@H]2CC(=O)C3)c(O)c1OC 894819338 IFDXZJJVNLIDLT-RYUDHWBXSA-N 291.347 2.105 10 20 CECD COCC1(NCc2cc(OC)c(OC)cc2O)CCC1 793620368 OHTJYSZYQQLHTI-UHFFFAOYSA-N 281.352 2.068 10 20 CECD C[C@H]1CSCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 792724736 DCTGVPFECBYCFP-QMTHXVAHSA-N 295.404 2.003 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)CCS(C)(=O)=O)c(O)c1 185791333 ZNTZQFOTXADCFR-NEPJUHHUSA-N 285.409 2.174 10 20 CECD Cc1ncc(C(=O)N(C)Cc2ccccc2O)s1 195444440 QEROVTJIINPXFF-UHFFFAOYSA-N 262.334 2.429 10 20 CECD COc1cccc(O)c1CN1CC[C@H]2CC[C@@H](C1)N2C 769477917 BSJNIXLDUQVDEW-OLZOCXBDSA-N 276.380 2.069 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CCn2ccnc2C1 778188551 HSVQDFXBWNDJMI-JTQLQIEISA-N 277.755 2.347 10 20 CECD Nc1ccc(CNC(=O)c2ocnc2C2CC2)cc1 1341922901 GTZXWPCFMIGPLH-UHFFFAOYSA-N 257.293 2.064 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1CCOC2(CCC2)C1 1521852505 WODJHTVSCDOUGB-NSHDSACASA-N 291.347 2.063 10 20 CECD O=C(O)C(=O)CCCSc1ncc(Cl)s1 1608530823 HDVNAIHKJDFLPA-UHFFFAOYSA-N 265.743 2.323 10 20 CECD O=C(O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1cc(F)c(F)cc1O)C2 1608615857 KKOOTSAXUHUWNR-ZDSQKVDBSA-N 297.301 2.356 10 20 CECD COCCN(C(=O)/C=C/[C@H]1CCCNC1)c1ccccc1 1579026997 MBQYTGPFWZMADD-BOLDSZDNSA-N 288.391 2.222 10 20 CECD O=C(O)[C@@H]1CCCCN1Cc1cc(F)c(F)cc1O 1574842088 BJQMSIIJVDBAQR-NSHDSACASA-N 271.263 2.110 10 20 CECD C[C@H]1CCn2cc(C(=O)Oc3ccc(N)cc3)nc2C1 1576760354 OQCXIHWLRNXZCJ-JTQLQIEISA-N 271.320 2.267 10 20 CECD CCN1CCc2cc(CN[C@@H](C)CC(=O)O)ccc21 1776884757 QYIRZSJWWUAYOZ-NSHDSACASA-N 262.353 2.022 10 20 CECD CCN(Cc1cc(OC)c(OC)cc1O)C[C@@H]1CCCO1 159923619 VHVPLBLZZPLSFC-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD Cc1cccc(CN[C@H]2CCNC3(CCC3)C2)c1O 841089613 OUNBQLFSOHXYSQ-AWEZNQCLSA-N 260.381 2.465 10 20 CECD C[C@H](NCC1([S@](C)=O)CC1)c1ccc(F)cc1O 282315545 NIKIGVWDMILYGB-YYSFKGJASA-N 271.357 2.093 10 20 CECD CCN(Cc1cc(OC)ccc1O)C[C@@H](C)OC 291083598 OAEABHLBBXYZDW-LLVKDONJSA-N 253.342 2.258 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](C)CN(C)C)c1 293692558 NVTLINWRVQMVHU-NWDGAFQWSA-N 266.385 2.249 10 20 CECD CCCCC(=O)NCc1ccc(N2CCOCC2)c(F)c1 55522612 QTPLMHBGKYRBFZ-UHFFFAOYSA-N 294.370 2.469 10 20 CECD COCCCN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 20551033 OHRMMYACKIEWNK-ZDUSSCGKSA-N 296.386 2.349 10 20 CECD CN(Cc1ccccc1O)c1ncnn1CC1CC1 1354140151 LZTOKNSFVGZUGR-UHFFFAOYSA-N 258.325 2.030 10 20 CECD COc1ccnc(NCc2ccc(N(C)C)cc2C)n1 301259524 FDSRUBHBEVJCKJ-UHFFFAOYSA-N 272.352 2.472 10 20 CECD CCOCCOCCN(C)Cc1cc(F)ccc1O 191570185 UIMAHGZMZHFKPM-UHFFFAOYSA-N 271.332 2.016 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@H]1CCCOC1 193536416 COUDNKSJPGLQFU-GFCCVEGCSA-N 263.337 2.167 10 20 CECD Cn1ccc(CCNCc2ccc(N3CCCC3)cc2)n1 230880291 GWTRIIXUKCBVGU-UHFFFAOYSA-N 284.407 2.353 10 20 CECD O=C1NC(=S)S/C1=C/c1cn2cc(Cl)ccc2n1 255556852 BPUONJKXQCASMX-FPYGCLRLSA-N 295.776 2.477 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@@H]2CCCSC2)cc1 267348020 QWQFGADKHSXAKN-CYBMUJFWSA-N 293.436 2.447 10 20 CECD C[C@H](N[C@H](C)c1ncnn1C)c1ccc(F)c(F)c1O 276638281 OLDWWKVVJGZBAD-JGVFFNPUSA-N 282.294 2.211 10 20 CECD C[C@H](O)C(=O)NCc1ccc(N(C)C2CCCCC2)cc1 270834581 ULKCBUOTXGPHRL-ZDUSSCGKSA-N 290.407 2.453 10 20 CECD COC[C@@H](CO)N[C@@H](C)c1ccc(Cl)c(Cl)c1O 280840392 AMUACHAAKABINP-JGVFFNPUSA-N 294.178 2.357 10 20 CECD CN(Cc1cc(Cl)ccc1O)C[C@@H](O)C1CC1 809752418 RSFQVOLPLZQKCL-CYBMUJFWSA-N 255.745 2.248 10 20 CECD Cc1cc(CN(C)[C@H](C)C[S@](C)=O)ccc1N(C)C 294751511 XRDAQTIXPXUOCJ-YJYMSZOUSA-N 282.453 2.260 10 20 CECD CCCCO[C@@H](C)C(=O)NCc1ccccc1O 299555739 MFANKIGLAPWKIF-NSHDSACASA-N 251.326 2.214 10 20 CECD CCSCCCNC(=O)NCc1cc(OC)ccc1O 800707340 PFFUJSMPCMHMPN-UHFFFAOYSA-N 298.408 2.343 10 20 CECD COC[C@@H](CO)N[C@@H](C)c1cc(Cl)cc(C)c1O 808718541 NRIMWCRNCKAJRQ-GXSJLCMTSA-N 273.760 2.012 10 20 CECD Cc1noc([C@H]2CCCN2C(=O)c2cc(O)cs2)n1 807767538 MYQXFNJXAJVHOI-SECBINFHSA-N 279.321 2.122 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](C(C)C)[C@@H](C)N)c1 817996426 FFTIYWKOCAIGRS-JRPNMDOOSA-N 294.395 2.197 10 20 CECD Cc1cc(O)c(CN2CCN(C)C(=O)[C@@H]2C)cc1Cl 825567650 LDRAZUVECSAIAK-JTQLQIEISA-N 282.771 2.017 10 20 CECD CC(C)N(CC(=O)O)Cc1cc(Cl)cc(F)c1O 820014843 CAMGQRJPMCNVJZ-UHFFFAOYSA-N 275.707 2.480 10 20 CECD C[C@H]1SCC[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 825602874 OHJWREXXECQWIX-BXUZGUMPSA-N 293.436 2.446 10 20 CECD Cc1cc(O)c(CNCC2(C)OCCO2)cc1Cl 825380285 ZTTVXNIDAVPRKZ-UHFFFAOYSA-N 271.744 2.207 10 20 CECD COc1ccc(O)c(CN(C)CC2=CCCOC2)c1 827189676 MHFAJDDXQBZAFK-UHFFFAOYSA-N 263.337 2.179 10 20 CECD COCCC1(C(=O)NCc2ccc(O)cc2O)CCCC1 910951535 SDUYNMCNKNIBTK-UHFFFAOYSA-N 293.363 2.311 10 20 CECD C[C@H](NC(=O)NC[C@H](C)N(C)C)c1ccc(N(C)C)cc1 836405863 MWEXLOADJKMDGH-STQMWFEESA-N 292.427 2.063 10 20 CECD C[C@@H]1SCCN(C(=O)NCCc2ccc(N)cc2)[C@@H]1C 841954416 METJDAKMIICELV-NEPJUHHUSA-N 293.436 2.347 10 20 CECD CCS(=O)(=O)CCCN[C@@H](C)c1ccc(C)cc1O 840888167 BTCPNDJJWZEUQC-LBPRGKRZSA-N 285.409 2.176 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCCCO 840940947 ORJFRFROFBNFSR-UHFFFAOYSA-N 250.386 2.313 10 20 CECD O=C(N[C@H]1CCc2ncsc2C1)c1cc(O)cs1 910842901 MPYUXWDYPMMTRN-ZETCQYMHSA-N 280.374 2.198 10 20 CECD CCc1cccc(CN[C@@H](CC(C)C)C(=O)NC)c1O 691437281 WYJNTZWVOHHNPD-AWEZNQCLSA-N 278.396 2.205 10 20 CECD C[C@@H](NCc1cn(C)nn1)c1ccc(Cl)cc1O 841754409 QXVZHGNXTWNLAZ-MRVPVSSYSA-N 266.732 2.025 10 20 CECD C[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)CC[C@H]1C 841958960 IXLLTHDTAQQWNT-CHWSQXEVSA-N 275.396 2.499 10 20 CECD COC[C@H](C)CNC(=O)NCc1cc(Cl)ccc1O 845006322 WQJMSRUBZDJZRH-SECBINFHSA-N 286.759 2.127 10 20 CECD C[C@H](COCC1CC1)NC(=O)/C=C\c1ccc(O)c(O)c1 846528597 NTWQIZLRDDEGAN-JPVGGKMYSA-N 291.347 2.042 10 20 CECD CCOc1cccc(CN[C@H]2CCOC[C@@H]2OCC)c1O 759172223 DRASEBJLHSPZQV-ZFWWWQNUSA-N 295.379 2.075 10 20 CECD O=C(NCc1ccccc1O)c1cnc2n1CCCCC2 857094559 XWJBNMOJHIMENY-UHFFFAOYSA-N 285.347 2.245 10 20 CECD COCC[C@@H](C)CNC(=O)NCc1cc(C)ccc1O 858535669 FESMVVMNGFFCGP-GFCCVEGCSA-N 280.368 2.172 10 20 CECD CC(C)C[C@@H](O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756497621 RHDZYVWVOCMHBC-CMPLNLGQSA-N 282.340 2.358 10 20 CECD CCN(CCNC(=O)NCc1cc(C)ccc1O)C(C)C 858195420 VZWFEUQKLWMZIT-UHFFFAOYSA-N 293.411 2.230 10 20 CECD CC[C@H](O)CCCN[C@H](C)c1cc(C(=O)OC)ccc1O 756731602 CJJLEMOQPOKARN-YPMHNXCESA-N 295.379 2.381 10 20 CECD CCC[C@H](CCO)N[C@@H](C)c1cc(C(=O)OC)ccc1O 866415599 ZMFFCQAHLCMVIH-WCQYABFASA-N 295.379 2.381 10 20 CECD C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)[C@@H](C)N(C)C1=O 761578835 XIFKBWDHGAPXOK-WDEREUQCSA-N 275.352 2.096 10 20 CECD C[C@H](NC(=O)N[C@H]1CCC[C@@H]1O)c1ccc(N(C)C)cc1 875508159 VFROEEXBDTZGHJ-CQDKDKBSSA-N 291.395 2.026 10 20 CECD Cc1noc([C@@H](C)N2CCOc3cc(N(C)C)ccc32)n1 774754696 XBLCCJWRAUGCHT-SNVBAGLBSA-N 288.351 2.404 10 20 CECD COC1CCC(CC(=O)NCc2ccc(O)c(O)c2)CC1 778917074 VGNHXBOUNXCRIK-UHFFFAOYSA-N 293.363 2.309 10 20 CECD COCC[C@@]1(NCc2ccc(N(C)C)cc2)CCOC1 775032246 GRAIACUNXUDRRN-MRXNPFEDSA-N 278.396 2.038 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1ccc(F)cn1 787748282 QBWNZVNXTFVSCW-KXFIGUGUSA-N 289.262 2.389 10 20 CECD COC(=O)[C@@H]1CC(F)(F)CN1Cc1ccc(N(C)C)cc1 880331509 DLYOVAQFHUEJBX-ZDUSSCGKSA-N 298.333 2.135 10 20 CECD C[C@H](NC(=O)N1C[C@H]2C[C@@H]2C1)c1ccc(N(C)C)cc1 888830583 WKOWLBOOLAOWQQ-IACUBPJLSA-N 273.380 2.475 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CC[C@H]1CO 889134561 JTUTXABGLVZAGH-LBPRGKRZSA-N 290.388 2.362 10 20 CECD Cc1nc([C@@H]2CCN(Cc3cccc(Cl)c3O)C2)n[nH]1 895006649 AGZBUDYKBJDZTH-LLVKDONJSA-N 292.770 2.462 10 20 CECD COc1cc(C)cc(CN2CCCCC[C@@H]2CO)c1O 895151311 SKYAXBZWXDIKCC-CQSZACIVSA-N 279.380 2.446 10 20 CECD CSC1(C(=O)NCCc2ccc(O)c(O)c2)CCC1 787445448 LMJCEBMPDRISOE-UHFFFAOYSA-N 281.377 2.042 10 20 CECD COc1ccc(CNCc2ccnc(C)c2)c(O)c1OC 894679304 LQULOKMFYPJVKM-UHFFFAOYSA-N 288.347 2.403 10 20 CECD C[C@@H](Nc1cc(N)ncn1)c1ccc(N2CCOCC2)cc1 1318519656 QQGVYTZIHCIFIZ-GFCCVEGCSA-N 299.378 2.069 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@@H](O)C2CC2)c1O 79770707 ZPZPAAAJYFZCAB-CQSZACIVSA-N 297.782 2.451 10 20 CECD Cc1nnc(CN[C@H]2C[C@H](C)c3c(F)ccc(O)c32)n1C 1321022049 AXHXVTIKRVQFPP-KWQFWETISA-N 290.342 2.306 10 20 CECD Cc1cc(CNCc2cc(Cl)ccc2O)n(C)n1 688934061 SDXGCKBCHBPIMG-UHFFFAOYSA-N 265.744 2.377 10 20 CECD CN[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1329427009 IRUOJGJYIUGLLC-HNNXBMFYSA-N 259.397 2.081 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](CO)CC(F)(F)F)c1 717809906 FYAHQGDXHDCUGK-RKDXNWHRSA-N 293.285 2.365 10 20 CECD Cc1ccc(CNCCC(=O)N2CCC[C@@H](C)C2)c(O)c1 1330626801 SAZBWMUAULLSOG-CQSZACIVSA-N 290.407 2.439 10 20 CECD C[C@@H](CC(=O)OC(C)(C)C)NC(=O)c1cc(O)cs1 1347323663 SGOWVZRENWNFOM-QMMMGPOBSA-N 285.365 2.304 10 20 CECD C[C@H](N[C@@H]1CCCC[C@@H]1CN)c1cc(C(=O)O)ccc1O 1609778126 MWRNWHYHSAQTKD-ZKYQVNSYSA-N 292.379 2.259 10 20 CECD Cc1cc(C)c(O)c(CN2CCSC[C@H]2CC(=O)O)c1 1607620872 MZEZXOKODVLHEL-CYBMUJFWSA-N 295.404 2.401 10 20 CECD CCOCCCN[C@@H](C)c1cc(C(=O)O)ccc1O 1610032614 FQSXRMJSZAKJOE-JTQLQIEISA-N 267.325 2.168 10 20 CECD Oc1c(Cl)cccc1CNC[C@@H]1CC(F)(F)CN1 1580885544 DNZXZEHKIBSCCW-VIFPVBQESA-N 276.714 2.132 10 20 CECD C[C@H](N[C@H]1CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589974563 YSBYJHRDYKNGHO-KWQFWETISA-N 273.340 2.021 10 20 CECD C[C@H](N[C@H](C)[C@H]1CCCNC1)c1cc(C(=O)O)ccc1O 1593196369 HMFRZCSYTSPGQV-MDZLAQPJSA-N 292.379 2.129 10 20 CECD Nc1ccc(CC(=O)NC[C@H]2C[C@H]3CC[C@H]2C3)cc1 250243683 JIWDUGXWRPLLEL-MELADBBJSA-N 258.365 2.364 10 20 CECD C[C@@H](CC[S@@](C)=O)NCc1cccc(Cl)c1O 164759146 DXRRTDYVHJKGJT-XYZCENFISA-N 275.801 2.292 10 20 CECD CC[C@@H](NCCN(C)CCOC)c1ccc(N(C)C)cc1 159366286 CUEBYEKQPJJLFV-QGZVFWFLSA-N 293.455 2.372 10 20 CECD CC[C@@H](N[C@H](C)CN1CCOCC1)c1ccccc1O 36932892 RSRDIOIWMBTULR-UKRRQHHQSA-N 278.396 2.154 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2=CCN(C)CC2)c1 273472223 JZGBHMLBYYKNSL-GFCCVEGCSA-N 276.380 2.313 10 20 CECD Cc1nnc(NCCCSc2nccs2)o1 309716958 UGKWMUNKCRDQJG-UHFFFAOYSA-N 256.356 2.429 10 20 CECD Oc1cc(OCc2ccccc2)ccc1CN1CCNCC1 843046183 VJBWPIBZELGMAO-UHFFFAOYSA-N 298.386 2.376 10 20 CECD CCN(CC)C(=O)CN(C)c1ccc(OC)c(OC)c1 63616773 DWDPCBUIXNDCQV-UHFFFAOYSA-N 280.368 2.008 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC2(O)CCCC2)c1 118785850 RZDINIRETJKCLE-LLVKDONJSA-N 293.363 2.273 10 20 CECD COCCc1nsc(Sc2nccs2)n1 302798974 BKHGFCXMOJCSTN-UHFFFAOYSA-N 259.381 2.335 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2c(O)cccc2Cl)C1 126802246 SNLQXCVZMLVHCW-ZJUUUORDSA-N 254.761 2.215 10 20 CECD COC(=O)c1cccc(NC(=O)c2cccc(O)c2O)c1 126731508 HYFBAZVRDDUXPK-UHFFFAOYSA-N 287.271 2.137 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](C)N[C@H](C)C2)c1O 229103686 MBSIPGWCCVEZFG-NXEZZACHSA-N 284.787 2.236 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)[C@H](C)CN1 83407780 VJFTZCWYIRDLBS-NXEZZACHSA-N 254.761 2.228 10 20 CECD CN(C)[C@@H](CNC(=O)Cc1ccc(N)cc1)c1ccccc1 237139455 KUVCEPVVTPMWCL-KRWDZBQOSA-N 297.402 2.230 10 20 CECD CC(C)C(=O)N1CCCC[C@H]1C(=O)Nc1ccc(N)cc1 269147363 ZWTRRMRYXRERCP-AWEZNQCLSA-N 289.379 2.244 10 20 CECD CCOc1ccc(O)c(CN2CCN(C3CCC3)CC2)c1 271174682 KATUMRGZFAUEQF-UHFFFAOYSA-N 290.407 2.461 10 20 CECD CCN(C)C(=O)CN(C)c1ccc(OC(C)C)cc1 277182182 LHPUJVFGTZICQS-UHFFFAOYSA-N 264.369 2.388 10 20 CECD COc1cccc(/C=C2\SC(=S)N(C3CC3)C2=O)n1 276687446 MAVWITUHGPUTRP-YFHOEESVSA-N 292.385 2.454 10 20 CECD CCN(CC)CCN[C@@H](C)c1cc(C(=O)OC)ccc1O 273402580 NNXLFPFXYMZTTI-LBPRGKRZSA-N 294.395 2.171 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC(C)(C)CCO)c1 273566864 JUFQTBHZABRLNK-LLVKDONJSA-N 295.379 2.238 10 20 CECD CO[C@@H](C)CN(C)Cc1ccc(N(C)C)c(F)c1 289591477 KMITUAPIKZGEFU-NSHDSACASA-N 254.349 2.358 10 20 CECD COc1ccc(CNc2ccc(Cl)nn2)c(O)c1 819929074 BUWNQIAGCQHINM-UHFFFAOYSA-N 265.700 2.456 10 20 CECD CC(C)(O)C(C)(C)CNCc1cc([N+](=O)[O-])ccc1O 825202325 QVZCTDOMGWWIOG-UHFFFAOYSA-N 282.340 2.187 10 20 CECD CN(C)c1ccc(CN(C)C2(CO)CCC2)cc1F 827903523 JIKUVJYDPWCPEJ-UHFFFAOYSA-N 266.360 2.239 10 20 CECD COC(=O)C[C@@H]1CCCCN1C(=O)c1cc(O)cs1 823317313 MMVFGWHBBWJNNV-VIFPVBQESA-N 283.349 2.012 10 20 CECD CCc1cc(C(=O)N[C@H](C)c2ccccc2O)n(C)n1 827915524 ANVNFXLFHJCLRU-SNVBAGLBSA-N 273.336 2.179 10 20 CECD NCC[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 904405485 JXPROXVPLZSDSJ-SNVBAGLBSA-N 254.761 2.216 10 20 CECD CCCN(C)CC(=O)N(CC)Cc1ccc(N(C)C)cc1 730098470 HANRZDUSFYPANS-UHFFFAOYSA-N 291.439 2.443 10 20 CECD CC[C@H](NCCN1CCCOCC1)c1ccc(C)cc1O 903226530 GZGBOTCGRCJFLL-INIZCTEOSA-N 292.423 2.464 10 20 CECD CCOc1ccc(CNC2(CO)CCSCC2)c(O)c1 839177789 QHOABVDQLXOLLV-UHFFFAOYSA-N 297.420 2.139 10 20 CECD COc1ccc(N(CC[S@@](C)=O)CC2CC2)cc1 831587460 AMBXQEYHTOKIPU-GOSISDBHSA-N 267.394 2.290 10 20 CECD Cc1ccncc1CNC(=O)N(C)Cc1ccccc1O 838676009 LTAYTZXLZXKSOC-UHFFFAOYSA-N 285.347 2.437 10 20 CECD 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Cn1cc(CCCN[C@@H]2CCc3cccc(O)c32)cn1 297625535 JBLKIXVNRHNMTB-CQSZACIVSA-N 271.364 2.335 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@H]1CCOC1 271174337 GWADSLGJEBZXKI-CYBMUJFWSA-N 266.360 2.360 10 20 CECD Cc1nc2ccc(NCc3ccc(N(C)C)cc3)nn2n1 286013229 FGJAFIDIHCLBMZ-UHFFFAOYSA-N 282.351 2.111 10 20 CECD CC(C)[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCCO1 294147458 VFXFLUUFLPTUMO-INIZCTEOSA-N 293.363 2.368 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](N2CCCC2)[C@H]1C 809724185 GBPSQPZUAYCSQL-UKRRQHHQSA-N 290.407 2.459 10 20 CECD Cc1cc(CN2CCn3cnnc3[C@H]2C)ccc1N(C)C 294572274 MEHZVDAYZJYKSP-CYBMUJFWSA-N 285.395 2.229 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1cc(F)ccc1O 293798659 DCALDHUNJXIHOU-LLVKDONJSA-N 282.359 2.173 10 20 CECD COc1cc(O)c(CN[C@@H]2CSC[C@@H]2C)cc1OC 809702967 KUKPTVQOXKQUQH-GXSJLCMTSA-N 283.393 2.251 10 20 CECD CCOC1CC(COC(=O)/C=C/c2ccc(O)c(O)c2)C1 803400479 ZTTGEEMFMHPWAO-GQCTYLIASA-N 292.331 2.469 10 20 CECD Cc1cccc(CN(C)C[C@@H](O)C(F)(F)F)c1O 809751621 UKNYGRWWJTYNSS-SNVBAGLBSA-N 263.259 2.056 10 20 CECD CCOc1cccc(CN2C[C@@H](CO)C[C@@H](C)C2)c1O 817413144 USJZTTXQUZTGMT-OLZOCXBDSA-N 279.380 2.241 10 20 CECD O=C(Cc1cnccc1Cl)NCc1ccccc1O 816912062 JBBNSURMOZKLLK-UHFFFAOYSA-N 276.723 2.300 10 20 CECD CCOc1ccc(CN2CCOC[C@H]2CCOC)c(O)c1 812786386 IPOQAPXMELDIDI-CQSZACIVSA-N 295.379 2.028 10 20 CECD CCOc1ccc(CNC[C@H]2CCCOC2)c(O)c1 725847151 DHLPNJHBPUCEOP-GFCCVEGCSA-N 265.353 2.307 10 20 CECD Cc1cccc(CN2CCn3c(nnc3C(F)F)C2)c1O 827897966 DOTFNWUYYKCQDG-UHFFFAOYSA-N 294.305 2.246 10 20 CECD CCCCNCc1ccc(N2CCC(C(N)=O)CC2)cc1 906537619 DVFSUNWMWLWYKA-UHFFFAOYSA-N 289.423 2.278 10 20 CECD CN(Cc1cnc2n1CCC2)c1ccc2c(c1)OCO2 825468274 IIWVLEHGDUZWPH-UHFFFAOYSA-N 271.320 2.194 10 20 CECD CC[C@H](NC(COC)COC)c1ccc(N(C)C)cc1 834893807 XTVQVMKYBSTOCA-INIZCTEOSA-N 280.412 2.455 10 20 CECD COc1ccc(N(C)Cc2ccc(C)nn2)cc1OC 840938919 ILBVIFCQQFZXSM-UHFFFAOYSA-N 273.336 2.439 10 20 CECD C[C@@H](N)C[C@@H](C)NCc1cc(Br)ccc1O 843130092 WQZBNPNPYYFOEL-RKDXNWHRSA-N 287.201 2.370 10 20 CECD COc1cccc(O)c1CNC[C@H]1NCCc2ccccc21 841068638 FREPNCBLFZSBHM-MRXNPFEDSA-N 298.386 2.377 10 20 CECD CC[C@@H](NCc1c(O)cccc1OC)[C@H](O)C(C)C 840966476 GBWDDXLGQGAIQW-IUODEOHRSA-N 267.369 2.286 10 20 CECD COc1ccc(N(C)CCN(C)c2cc(C)ncn2)cc1 845672570 LDKAVZMKVXZFMV-UHFFFAOYSA-N 286.379 2.366 10 20 CECD Cc1cnccc1CNC(=O)NCCc1ccc(N)cc1 841881763 IEOCTHSPFCBMOF-UHFFFAOYSA-N 284.363 2.014 10 20 CECD CC[C@@H](C)CN(C)C(=O)NCCc1ccc(N)cc1 841955541 GFVJSFDAWCIVSP-GFCCVEGCSA-N 263.385 2.499 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=N)NC1CCC1 849009295 SVKPCNYASKONLZ-UHFFFAOYSA-N 260.385 2.227 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](NC)C2)cc1 843045768 VXMRHBAAIFZRIS-HNNXBMFYSA-N 261.413 2.327 10 20 CECD CSCCNC(=S)N(C)Cc1ccccc1O 752745874 GPTYUQPXORTBLR-UHFFFAOYSA-N 270.423 2.062 10 20 CECD CC[C@H](NCCO[C@H]1CCOC1)c1ccc(F)cc1O 927080137 HIAKOXDSDKFPRE-JSGCOSHPSA-N 283.343 2.378 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@]2(C)CCCO2)c1 756645402 JDIWHSTWPFQIOR-BZNIZROVSA-N 293.363 2.399 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1nccs1 759598291 VRPNKIVCILDBOJ-DUXPYHPUSA-N 277.301 2.311 10 20 CECD CC(C)[C@@H](CO)N[C@@H](C)c1cc(F)cc(F)c1O 756642310 MMIBKTMCRZEVPG-QPUJVOFHSA-N 259.296 2.338 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)c2nc(C)no2)c1O 754685955 LSGLZGFNEOYHJS-SSDOTTSWSA-N 293.298 2.276 10 20 CECD CC[C@H](O)CCN[C@H](C)c1cc(F)cc(F)c1O 756657202 BGPXOWIDUJLTRN-SCZZXKLOSA-N 259.296 2.482 10 20 CECD Cc1ccc(O)c(CNC(=O)CCn2nc(C)cc2C)c1 862759964 OFJXCWUUSZHQCM-UHFFFAOYSA-N 287.363 2.220 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(C(C)C)COC1 932943626 NXKMZKOGVJQCRL-UHFFFAOYSA-N 290.407 2.350 10 20 CECD CCC[C@H](OCC)C(=O)NCc1cc(OC)ccc1O 860242788 WVZFXIUXXIBTBT-AWEZNQCLSA-N 281.352 2.222 10 20 CECD CN1CCc2cc(/C=C\c3cc(C(=O)O)ncn3)ccc21 761207433 VARKYBOEXGOYCZ-RQOWECAXSA-N 281.315 2.338 10 20 CECD COCCN(Cc1cccnc1)C(=O)c1cc(O)cs1 762559191 XDWXYIGLPQNAFU-UHFFFAOYSA-N 292.360 2.138 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCCS2)c1 862760886 XEGJXSDNDRPSOQ-LBPRGKRZSA-N 251.351 2.212 10 20 CECD CC(=O)c1cc(O)ccc1NS(=O)(=O)CCC1CC1 766047918 NLQVPERDNQZTBU-UHFFFAOYSA-N 283.349 2.137 10 20 CECD CN1CCC[C@@H]2CN(C(=O)c3cc(O)cs3)CC[C@@H]21 768265635 VKWYNLKSQNWGLC-PWSUYJOCSA-N 280.393 2.010 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCC[C@]1(C)N)c1ccccc1O 870988476 QPFKKVBWPMONMD-FFSVYQOJSA-N 276.380 2.477 10 20 CECD OC[C@H]1C[C@@H](NCc2cc(Cl)cc(F)c2O)C1 877668069 UIQJYGHVHBJYJZ-WKFQBHICSA-N 259.708 2.045 10 20 CECD COCCOC(=O)N[C@H](C)c1ccc(N(C)C)cc1 885115882 JDSBWZZYOZLVLE-LLVKDONJSA-N 266.341 2.186 10 20 CECD CN(C)c1ccc(Cn2cc(CN3CCCCC3)nn2)cc1 881272499 XUDDLUCDLSMGNP-UHFFFAOYSA-N 299.422 2.378 10 20 CECD C[C@@H]1C[C@@H](O)CN1Cc1cc(Br)ccc1O 788269416 NITHILVXFLXPDM-LDYMZIIASA-N 286.169 2.110 10 20 CECD CC[C@H]1CN(Cc2cccc(OC)c2O)C[C@@H](C)O1 245560683 MZLCGXNSFACEQF-YPMHNXCESA-N 265.353 2.400 10 20 CECD COc1cccc(CN2CCCN3CCC[C@@H]3C2)c1O 134200937 WBUKAOPZWUWUKI-CQSZACIVSA-N 276.380 2.071 10 20 CECD COc1ccc(N2CCN(CC(F)(F)F)CC2)cc1 74232834 OPFJOORBEDVGSR-UHFFFAOYSA-N 274.286 2.380 10 20 CECD O=C(O)c1ccc(CNCc2ccc3c(c2)CCO3)o1 740132082 BZCHXHQQCORJTL-UHFFFAOYSA-N 273.288 2.203 10 20 CECD CCc1cccc(CN2CCC[C@H](N(C)C)C2)c1O 692129338 JSZUYGXKPRXWIC-HNNXBMFYSA-N 262.397 2.481 10 20 CECD CCc1cccc(CNCCC2(C)OCCO2)c1O 716047117 JIOQOIXFUIGBHD-UHFFFAOYSA-N 265.353 2.197 10 20 CECD O=C1N[C@H](c2cc(O)ccc2O)Nc2cc(F)c(F)cc21 1331091299 KNWTUVOCSQHFTD-CYBMUJFWSA-N 292.241 2.230 10 20 CECD CCOc1cccc(CN2CCC[C@@H]2CC(=O)O)c1O 86791887 TWCUQTUJQHUSHU-GFCCVEGCSA-N 279.336 2.230 10 20 CECD C[C@H]1[C@@H](C)NCCN1Cc1ccc(N2CCCC2)cc1 1345942499 BADIHXWRZXOKIO-CABCVRRESA-N 273.424 2.469 10 20 CECD O=C(O)c1cnc(SC[C@H]2CC3(CCC3)C(=O)O2)s1 1610862977 NHLABGGIFIGGDQ-SSDOTTSWSA-N 299.373 2.419 10 20 CECD Cc1ccc(O)c(CNCc2c(Cl)cnn2C)c1 858238744 CLQRWTDTWGXOMW-UHFFFAOYSA-N 265.744 2.377 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1c(C)cc(OC)cc1O 1589441061 IXLUNIGMTXOMMI-GFCCVEGCSA-N 267.325 2.004 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CC=C(C(=O)O)C2)c1 1597130206 MLMVUEKRYQGHGS-LBPRGKRZSA-N 277.320 2.054 10 20 CECD CC[C@@H](N[C@@H](C)C1CC1)c1cccc(-c2nn[nH]n2)c1O 1590471364 CZBQKPFQDLHYIH-TVQRCGJNSA-N 287.367 2.412 10 20 CECD CCOCCOCCN[C@@H](CC)c1ccccc1O 927085572 ASDFADOATCIQPD-AWEZNQCLSA-N 267.369 2.486 10 20 CECD CNC[C@@H]1CCCN1Cc1cc(Cl)cc(OC)c1O 229104798 PRRKVWWNHXXOPJ-LBPRGKRZSA-N 284.787 2.238 10 20 CECD Oc1c(F)cc(F)cc1CNCCCN1CCCC1 708504722 VEXMCTLNPGJZHE-UHFFFAOYSA-N 270.323 2.246 10 20 CECD COc1ccc(O)c([C@H](C)NCc2ccc(C)nn2)c1 396576851 PZCOLNLVHSYLTM-NSHDSACASA-N 273.336 2.350 10 20 CECD CN(Cc1ccccc1O)C(=O)NOCCC(F)(F)F 119712177 IOXURUBGZAJVRV-UHFFFAOYSA-N 292.257 2.418 10 20 CECD Oc1ccccc1CN[C@H]1CCOC2(CCOCC2)C1 133965020 CMCCUNZCMHRFMW-AWEZNQCLSA-N 277.364 2.210 10 20 CECD CCOc1cncc(N(C)Cc2ccccc2O)n1 302613376 FJLUKQCUDZLJSM-UHFFFAOYSA-N 259.309 2.217 10 20 CECD C[C@]1(NCc2cccc(Br)c2O)CCOC1 120150984 AMANCBARPMJRDA-LBPRGKRZSA-N 286.169 2.423 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccccc2OC)c1 78726246 WJAFMQSBMSABPH-UHFFFAOYSA-N 287.315 2.339 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)c1c[nH]nn1 193721314 MTPDXTIHXVJPMN-UHFFFAOYSA-N 299.378 2.067 10 20 CECD CCCN(Cc1cc(C)ccc1O)[C@H]1CCS(=O)(=O)C1 161108384 AGKYYIADHZOXHU-AWEZNQCLSA-N 297.420 2.100 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H]2CCCOC2)cc1F 193007255 FRUDVKHDHOSIRK-ZDUSSCGKSA-N 294.370 2.325 10 20 CECD CCN(CC)c1ccc(CN2CCC[C@H]2CO)cc1 92456030 GFPBKJGKHQRQTN-INIZCTEOSA-N 262.397 2.490 10 20 CECD COc1cc(Cl)cc(CN2CCOCC23CC3)c1O 802658479 DQBOWJONIBWITD-UHFFFAOYSA-N 283.755 2.419 10 20 CECD CCCCOCCOC(=O)c1cccc(O)c1O 805533128 ZRRCRZLDRVLALU-UHFFFAOYSA-N 254.282 2.071 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)C[C@@H](C)N)CC2)cc1 817903503 QBESFDDPOUIGSD-KGLIPLIRSA-N 291.439 2.379 10 20 CECD CC(C)OCC[C@H](O)CNCc1ccc(N(C)C)c(F)c1 818984873 IPKMDWOWIXOEPM-AWEZNQCLSA-N 298.402 2.157 10 20 CECD COC(=O)[C@@H]1CCC[C@@H](C(=O)Nc2ccc(N)cc2)C1 818556525 YQBUAZCZGWEPHB-GHMZBOCLSA-N 276.336 2.187 10 20 CECD C[C@@H](NC(=O)CN(C)[C@@H]1CCSC1)c1ccccc1O 827941707 WWDQULZGVCACOF-VXGBXAGGSA-N 294.420 2.007 10 20 CECD COC(=O)c1cnc(SCc2nccc(C)n2)s1 829681473 XBBJWISOUGSDSB-UHFFFAOYSA-N 281.362 2.320 10 20 CECD CCOc1ccc(O)c(CN2CCCC[C@@H]2C(=O)O)c1 820387399 NYAMJSMFOYDWAF-CYBMUJFWSA-N 279.336 2.230 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)c1 825841129 ZZLMLDLKTNVENX-COPLHBTASA-N 275.348 2.453 10 20 CECD Cc1csc([C@@H](C)CNC(=O)Cc2ccc(N)cc2)n1 831952559 JSGJEMBFGXKXMG-JTQLQIEISA-N 289.404 2.496 10 20 CECD CN1CC[C@@H](N(C)Cc2c(O)ccc3ccccc23)C1=O 738265528 HPMWQFVFEYQNGW-OAHLLOKOSA-N 284.359 2.208 10 20 CECD COc1cccc(O)c1CNC[C@@](C)(O)c1ccccc1 734005141 XMQTUSKADZAKMP-QGZVFWFLSA-N 287.359 2.398 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)c1nc(C(=O)O)co1 910340065 ORDMYFBXIIWQAJ-UHFFFAOYSA-N 289.335 2.465 10 20 CECD CNC(=O)[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1C 840910030 JSKZQELFUINKPB-INIZCTEOSA-N 289.423 2.162 10 20 CECD CCOc1cccc(CN2CCC[C@H](CO)[C@@H]2C)c1O 840980354 XHJROWMCZUYIHR-GXTWGEPZSA-N 279.380 2.384 10 20 CECD CCS(=O)(=O)CCCN[C@@H](C)c1c(C)cc(C)cc1O 840890174 YPNUPAMFXOAXHZ-ZDUSSCGKSA-N 299.436 2.484 10 20 CECD CN(CCOC(C)(C)C)C(=O)NCCc1ccc(N)cc1 841960697 VGUMQIPXAXHCEM-UHFFFAOYSA-N 293.411 2.268 10 20 CECD Cc1cc(N(C)C)ccc1CNc1nnc(C(C)(C)O)o1 840883108 DMBAIZFXWYFKPB-UHFFFAOYSA-N 290.367 2.284 10 20 CECD CCc1cccc(CNCCN2CCOC(C)(C)C2)c1O 848893967 BFWSTZPAMSHONM-UHFFFAOYSA-N 292.423 2.155 10 20 CECD CC1(C)CC[C@@H](OC(=O)/C=C\c2ccc(O)c(O)c2)C1=O 840336886 USIVWWVXEGEOHS-RYWCDNDXSA-N 290.315 2.412 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)c1cc(CO)on1 924575686 ZZXIQGLPVJNCHF-NSHDSACASA-N 275.352 2.084 10 20 CECD CO[C@@H]1CCCC[C@H]1NC(=O)/C=C\c1ccc(O)c(O)c1 846454705 ZNRQJLQVFQMVLR-AXYMLXJTSA-N 291.347 2.185 10 20 CECD Cc1ccc(C(=O)OCc2nc(C(C)C)no2)c(O)c1O 750620867 JRLDJZUYOSQPQT-UHFFFAOYSA-N 292.291 2.270 10 20 CECD CCC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 1018375059 FBOJRKDOLIEXTE-AWEZNQCLSA-N 276.380 2.104 10 20 CECD CCn1ncc(C)c1NC(=O)c1cc(O)cs1 855751708 WMSATUNDGDKPBL-UHFFFAOYSA-N 251.311 2.231 10 20 CECD COc1ccc(N2CCC(NC[C@H]3C[C@@H](O)C3)CC2)cc1 858295060 UJEMBQPVICMDFI-AKAXFMLLSA-N 290.407 2.025 10 20 CECD COc1ccc(N(C)C[C@H]2COC(C)(C)O2)cc1OC 851734364 GBAQJHRTEVAPOX-LBPRGKRZSA-N 281.352 2.292 10 20 CECD CN(Cc1ccc2c(c1)nnn2C)c1ccc2c(c1)OCO2 756654027 ASJWQXLMTUMLPB-UHFFFAOYSA-N 296.330 2.333 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC1SCCS1 856161848 CDCHYSJDNBJLHH-DUXPYHPUSA-N 297.401 2.033 10 20 CECD CCOc1ccc(CN(CC(N)=O)C2CCCC2)c(O)c1 768256234 ACQXCBVZOMRXGF-UHFFFAOYSA-N 292.379 2.021 10 20 CECD CC[C@@H](NCc1cccc(OC)c1O)[C@H](O)C(F)(F)F 765785709 CRXVBHNQZJMXNA-SKDRFNHKSA-N 293.285 2.192 10 20 CECD C[C@H](OC(=O)c1cc(O)cs1)C(=O)OC(C)(C)C 762824623 RYAFKGZYNURNAM-ZETCQYMHSA-N 272.322 2.341 10 20 CECD CCCOc1ccc(CNCC(=O)NCC2CC2)cc1C 873103773 XBCDUIRJMYWNSP-UHFFFAOYSA-N 290.407 2.400 10 20 CECD Cc1ccc(C(=O)N(C)c2c(C)noc2C)c(O)c1O 770500397 CURLMCFWSNOLNM-UHFFFAOYSA-N 276.292 2.288 10 20 CECD Oc1c(CNC[C@H]2C[C@H](O)C2)ccc2ccccc12 877811470 LJKAEFAPFVAXQG-YEORSEQZSA-N 257.333 2.406 10 20 CECD CC(C)CN1CCN(Cc2cc(Cl)ccc2O)CC1=O 779199893 MELMQVFVNCUVNZ-UHFFFAOYSA-N 296.798 2.346 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2c(C)cccc2O)C1 876783088 ZNRNIKZDJSMMDP-OAHLLOKOSA-N 263.337 2.086 10 20 CECD C[C@@H](NC[C@H](O)c1ccccn1)c1ccccc1O 879649771 GTLCKECKKZMDSG-ABAIWWIYSA-N 258.321 2.171 10 20 CECD COCC1(NCc2cc(Cl)cc(F)c2O)CC1 776251607 OBPPKLUDMWDXEB-UHFFFAOYSA-N 259.708 2.453 10 20 CECD O=C(N[C@@H]1C[C@H]1C(F)(F)F)c1cc(O)cs1 871208754 ZPNUVXQFDDSZFP-PHDIDXHHSA-N 251.229 2.134 10 20 CECD C[C@@H](N[C@H](CO)CC1CC1)c1c(O)cccc1F 886554925 GZSMCJXMCJPRCA-KOLCDFICSA-N 253.317 2.343 10 20 CECD Cc1ccc(C(=O)OC[C@H]2CC[C@H](C)O2)c(O)c1O 789042617 OBDGJWBTPGPZFW-VHSXEESVSA-N 266.293 2.131 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC(C)(C)O)c1 271818706 NLLUBSFCRRTFNZ-SNVBAGLBSA-N 253.342 2.212 10 20 CECD CCOc1ccc(CN2CCC[C@@](C)(CO)C2)c(O)c1 1319707177 KNLWXOQWMSZBRH-MRXNPFEDSA-N 279.380 2.385 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)NCC2CCOCC2)o1 1537962272 BSENGBPUMZVSJO-UHFFFAOYSA-N 264.285 2.246 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)CCS(C)(=O)=O)c1 185790546 IUADWTQVBIBVQW-NEPJUHHUSA-N 285.409 2.174 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)c2ncnn2C)c(O)c1 276696579 VJSYLONPISXSBX-QWRGUYRKSA-N 260.341 2.241 10 20 CECD CCCN(C[C@]1(OC)CCOC1)c1ccc(CN)cc1 692493638 DBMSZGAGHCIONW-MRXNPFEDSA-N 278.396 2.167 10 20 CECD COc1ccc(CNCCC2CC2)c(O)c1OC 1335471104 LWPMEKQYULQTOT-UHFFFAOYSA-N 251.326 2.299 10 20 CECD CCn1cncc1CNCc1ccc(N(C)C)cc1 90170036 QALHCWJKYZPSLF-UHFFFAOYSA-N 258.369 2.259 10 20 CECD Cc1cc(Cl)cc(CN2CC[C@](F)(C(=O)O)C2)c1O 1607656492 ZRPFHJAGOVQBRF-CYBMUJFWSA-N 287.718 2.353 10 20 CECD CN(C)c1ccc(CNCCc2ccccn2)cc1 4781819 ZVNDQPIRGWCLNU-UHFFFAOYSA-N 255.365 2.480 10 20 CECD C[C@H]1C[C@@H](NCCC(=O)O)c2c(O)ccc(F)c21 1589291816 UVZMALAIRCLGFC-IONNQARKSA-N 253.273 2.144 10 20 CECD Oc1cc(Cl)ccc1CN[C@@]12CCC[C@H]1NCC2 1580888564 QDPBSEDNOCMJBY-ZIAGYGMSSA-N 266.772 2.420 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C(C)(C)F)c1 155987938 PARRJELGXNDOJI-QMMMGPOBSA-N 255.289 2.326 10 20 CECD Cc1cc(C(=O)N[C@]2(C)CCOC2)c(C)n1-c1ccccn1 156763350 WPGHRVQZYMBICI-QGZVFWFLSA-N 299.374 2.398 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)[C@@H](C)C(=O)O 707940620 KYEGLZVFGXINNU-NSHDSACASA-N 250.342 2.048 10 20 CECD COCCCN(C)CCN[C@@H](C)c1cc(C)ccc1O 185553733 NDSSJVKDYUQFFB-AWEZNQCLSA-N 280.412 2.320 10 20 CECD C[C@@H](CO[C@@H]1CCOC1)N[C@@H](C)c1cc(F)ccc1O 185674113 YSKWLTZHDGPNJF-GMXVVIOVSA-N 283.343 2.376 10 20 CECD CN(CCOCC(F)F)c1ccc2c(c1)OCO2 189760730 NXZWNWNEUVIXQW-UHFFFAOYSA-N 259.252 2.133 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@H](C)c1ccc(F)c(F)c1O 191215204 QDYJKTWPJSHELR-VHSXEESVSA-N 298.333 2.332 10 20 CECD Cc1ccc(O)c(CN2CCN(CC(C)C)C(=O)C2)c1 190103438 IQIIJAARNLROET-UHFFFAOYSA-N 276.380 2.001 10 20 CECD CCCN(CC(=O)OC)Cc1c(O)cccc1Cl 269375928 VXCQTARVLPGRTC-UHFFFAOYSA-N 271.744 2.431 10 20 CECD COCCCCCN(C)c1ccc(OCC(=O)OC)cc1 273078791 KUZXKSOJYDECIT-UHFFFAOYSA-N 295.379 2.491 10 20 CECD Nc1ccc(CC(=O)NCc2cccc3c2CCCN3)cc1 367996881 JXADHBFXLGUAOO-UHFFFAOYSA-N 295.386 2.486 10 20 CECD CC[C@H](NCCC(=O)N(C)C)c1ccc(F)cc1O 286161802 PWIYTNLFRQLHAE-LBPRGKRZSA-N 268.332 2.050 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1c(C)cc(C)cc1O 294657404 HDTMNAWOOVPSDG-STQMWFEESA-N 299.436 2.483 10 20 CECD O=C1O[C@H]2C[C@H]1N(Cc1ccc(N3CCCCC3)cc1)C2 294664573 AKHQNQCDVBPRQO-JKSUJKDBSA-N 286.375 2.177 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](CN)CC(C)C)c1 817959799 VGBJZVWMZMMJDC-DGCLKSJQSA-N 294.395 2.203 10 20 CECD CCOc1cccc(CN2CCN(C)C[C@H]2CC)c1O 816660343 ACGIDDYOKBOPTQ-CQSZACIVSA-N 278.396 2.317 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cccc(CN)c1 829763964 DUXRLIPACMRUHH-UHFFFAOYSA-N 297.402 2.450 10 20 CECD CC(C)(CNCc1cc(F)ccc1O)[C@]1(O)CCCOC1 827595182 MDZWPFIMJXLQMD-INIZCTEOSA-N 297.370 2.189 10 20 CECD CCCN[C@H](C)C(=O)NCc1ccc(N(C)C)cc1C 829764527 NXSXTPWGTVHIOG-CYBMUJFWSA-N 277.412 2.065 10 20 CECD CCC[C@](C)(N)C(=O)NCc1ccc2c(c1)CCCN2C 827913694 HIDGHRWWHFVNQH-KRWDZBQOSA-N 289.423 2.203 10 20 CECD C[C@H](CN1CCCCC1)NC(=O)c1cc(O)cs1 732271616 LSSCMWGEUCSZLI-SNVBAGLBSA-N 268.382 2.058 10 20 CECD CC/C(C)=C\C(=O)OCC(=O)c1ccc(O)c(O)c1 838040381 IWVSXTMKBWXHCF-TWGQIWQCSA-N 264.277 2.180 10 20 CECD CC[C@H](O)[C@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 912125198 MHWNFBGHXQHWJX-OLZOCXBDSA-N 293.363 2.172 10 20 CECD COc1cc2c(c(OC)c1)N(Cc1cnn(C)c1)CCC2 839656447 LSJNADVORBMFBM-UHFFFAOYSA-N 287.363 2.390 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1CCNC2(CCC2)C1 841090452 YCVPTPUGUWRDIO-CYBMUJFWSA-N 264.344 2.296 10 20 CECD CCOc1ccc(CN2CCC[C@@H](CO)[C@@H]2C)c(O)c1 840977468 IHIGSUCJVVZIRP-JSGCOSHPSA-N 279.380 2.384 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CCCNCC1 841056929 FZPRZFFOGBJNLY-SNVBAGLBSA-N 254.761 2.277 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCN(C)[C@H](C)C2)c1 742375640 SYJDIBKYHXZXSP-TZMCWYRMSA-N 278.396 2.363 10 20 CECD Cc1cc(O)c(CN(C)CC(=O)O)cc1C(C)C 740089835 YOKHUITUFNFDJC-UHFFFAOYSA-N 251.326 2.340 10 20 CECD Nc1ccc(CCNC(=O)N[C@H]2CCCSC2)cc1 841850236 GAEXFCVERPNXMR-ZDUSSCGKSA-N 279.409 2.006 10 20 CECD COc1cccc([C@H](C)NCC2(C(N)=O)CCCC2)c1O 846148381 YJZJBAACEJLVLH-NSHDSACASA-N 292.379 2.097 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H]([C@H](C)N)C1 843057382 JSRZCHFPANMWJY-ZFWWWQNUSA-N 261.413 2.230 10 20 CECD CC(=O)c1cc(F)cc(CN(CC(=O)O)C2CCC2)c1O 848600139 YKJBUCNVFDIKBU-UHFFFAOYSA-N 295.310 2.173 10 20 CECD Cc1cc(Br)c(O)c(CN2CCNC[C@@H]2C)c1 843046877 CYXDRDNLPQYBPJ-JTQLQIEISA-N 299.212 2.257 10 20 CECD CCn1nncc1CN[C@H](C)c1cc(F)cc(F)c1O 858440271 PENBPANJKZSNBB-MRVPVSSYSA-N 282.294 2.133 10 20 CECD CC(C)(F)CCNC(=O)/C=C\c1ccc(O)c(O)c1 855746090 RDLCHDPRJFICGH-XQRVVYSFSA-N 267.300 2.365 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 858588234 XNBBJGTUWVJCSB-NGZCFLSTSA-N 296.342 2.078 10 20 CECD Cc1cnc([C@@H](C)OC(=O)c2cccc(O)c2O)o1 758560151 VELWMLVAQKFNED-MRVPVSSYSA-N 263.249 2.312 10 20 CECD O=C1CN(Cc2cc(Cl)cc(Cl)c2O)CCCN1 769116032 SAWBSAOOFHZTKA-UHFFFAOYSA-N 289.162 2.021 10 20 CECD C[C@H](N[C@H]1C[C@@H](CO)C1)c1ccc(Cl)cc1O 866415722 CNIKDMUZUWQNKB-ATZCPNFKSA-N 255.745 2.467 10 20 CECD CCn1nc(C)c(C(=O)NCc2cc(C)ccc2O)c1C 862759054 TZYVRTWZDFPGSX-UHFFFAOYSA-N 287.363 2.464 10 20 CECD Cc1cccc(O)c1CNCc1ccc(N(C)C)nc1 876927118 RJTWOWUZWIOWBC-UHFFFAOYSA-N 271.364 2.451 10 20 CECD O=C(NCCC1CCOCC1)c1cc(O)cs1 1118617989 GDQFGIGTKIQVDT-UHFFFAOYSA-N 255.339 2.000 10 20 CECD COc1ccnc(NC(=O)/C=C/c2ccc(O)c(O)c2)c1 779540564 RXMDGPWDKRTBSH-HWKANZROSA-N 286.287 2.153 10 20 CECD CC[C@H](C)NC(=O)CN[C@H](C)c1ccc(N(C)C)cc1 775830166 DXOPCCZSOYDGRT-QWHCGFSZSA-N 277.412 2.318 10 20 CECD CCN(C)c1ccc(CN(CCO)C2CCOCC2)cc1 773887092 AYNHYROITWDSBH-UHFFFAOYSA-N 292.423 2.116 10 20 CECD CC[C@]1(O)CCN(Cc2c(O)cccc2Cl)C1 779219353 NZDGWSZLIXNQRR-ZDUSSCGKSA-N 255.745 2.392 10 20 CECD Cc1noc(C)c1N(C)C(=O)/C=C/c1ccc(O)c(O)c1 779489897 SVRKKYSRGZASEV-FNORWQNLSA-N 288.303 2.379 10 20 CECD C[C@H](NCCCNC(=O)C1CCC1)c1c(O)cccc1F 886549910 PBWXZYTWYCEANZ-NSHDSACASA-N 294.370 2.488 10 20 CECD C[C@@H]1C[C@@H](C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CO1 784163265 MTRNVXQGXHTVIK-YRGRVCCFSA-N 276.380 2.355 10 20 CECD O=C(/C=C\c1cccc(O)c1)NCc1ccccc1O 780930359 IISCASQQJVCUBE-HJWRWDBZSA-N 269.300 2.427 10 20 CECD CCn1cnc2c1CCN(Cc1c(O)cccc1OC)C2 897336738 NMWNBOMAFBPKFG-UHFFFAOYSA-N 287.363 2.176 10 20 CECD COc1ccc(CNC(=O)c2csnc2C)c(O)c1 794378083 PCHQIODWWRFYSK-UHFFFAOYSA-N 278.333 2.096 10 20 CECD C[C@H]1c2nncn2CCN1Cc1c(O)ccc(Cl)c1F 792185349 DGTZWGIMQCDQJR-QMMMGPOBSA-N 296.733 2.353 10 20 CECD CC1=NO[C@H](CNCc2cc(Cl)ccc2O)C1 895311044 NJJHKSZTYDVHDT-NSHDSACASA-N 254.717 2.300 10 20 CECD C[C@H](CCO)CNCc1c(O)ccc(Cl)c1F 790970497 JVKJDXXQNRHZJU-MRVPVSSYSA-N 261.724 2.293 10 20 CECD O=C(O)[C@@H]1CCCN(Cc2ccc(Cl)cc2O)C1 1606382691 GPKCZTVHEMLBAH-SNVBAGLBSA-N 269.728 2.342 10 20 CECD C[C@H](NCCC(=O)N1CCCCC1)c1ccccc1O 135719122 WRTKWCFLMSXMFB-ZDUSSCGKSA-N 276.380 2.445 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CCN(C(C)C)C2=O)c1 186047770 UQZWSFFMYJVVNK-TZMCWYRMSA-N 276.380 2.361 10 20 CECD C[C@@H]1COC[C@H]1NCc1cccc(Br)c1O 829430525 CHTHGMQSMLTLML-LDYMZIIASA-N 286.169 2.279 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2ncc(C)[nH]2)c1 693511388 IRGFHFUUEKRKCL-SNVBAGLBSA-N 261.325 2.283 10 20 CECD OC[C@H]1CN(Cc2cc(F)cc(F)c2O)CCC1(F)F 1338273246 FYUQBMKMXPYAKU-SECBINFHSA-N 293.260 2.120 10 20 CECD Cc1nc(N(C)C)sc1C(=O)NCc1ccc(N)cc1 1524009753 VIHUKFVMXLTQBO-UHFFFAOYSA-N 290.392 2.030 10 20 CECD CCC[C@@](C)(NCc1cc(F)c(F)cc1O)C(=O)O 1605199600 YXRATGAHQLEYPD-CYBMUJFWSA-N 273.279 2.403 10 20 CECD CC(C)(C)[C@H](NCc1cc(F)ccc1O)C(=O)O 1603309661 FUXQCAOQWGEUTB-LLVKDONJSA-N 255.289 2.120 10 20 CECD C[C@@H](CNCc1ccc2ccccc2c1O)C(=O)O 1589066427 GNQKILHIGWYNLF-JTQLQIEISA-N 259.305 2.356 10 20 CECD C[C@H](NCCc1ccc(N)cc1)c1ncc(C(=O)O)s1 1593274152 IFSFJKSZUQDWFD-VIFPVBQESA-N 291.376 2.317 10 20 CECD CCCOc1ccc(CN[C@@H](COC)CC(=O)O)cc1C 1776821668 GBAWFIVVTBMXLI-CQSZACIVSA-N 295.379 2.363 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CCCO2)c1 19963698 CMZGXSDLXSDVGU-ZYHUDNBSSA-N 251.326 2.230 10 20 CECD O=C(O)c1cnc(Sc2nccs2)c([N+](=O)[O-])c1 162469755 KNWKLNFHMCHYRI-UHFFFAOYSA-N 283.290 2.296 10 20 CECD CC[C@@H](C)OCC(=O)N1CCOc2cc(N(C)C)ccc21 158873806 GXADKIHFGHDGRB-GFCCVEGCSA-N 292.379 2.293 10 20 CECD COc1ccc(C(=O)NCc2ccc(O)c(O)c2)c(F)c1 158902618 ZDLGICCWCKFZTB-UHFFFAOYSA-N 291.278 2.176 10 20 CECD CC(=O)c1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1 156574356 ATLDIGXVTBLOMU-UHFFFAOYSA-N 299.326 2.273 10 20 CECD OC[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 154610514 YQPRQICFKCGCTN-SNVBAGLBSA-N 255.745 2.250 10 20 CECD CC(C)OCCCNCc1cc2c(cc1O)OCO2 42879577 YPOPWJUIXAUNNY-UHFFFAOYSA-N 267.325 2.026 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)CCN(C)C)c1 49553249 GGRPWUHBVLYWTI-RYUDHWBXSA-N 266.385 2.392 10 20 CECD COCCOCCCCN[C@H]1CCc2cccc(O)c21 312845242 PPPQSWQLZGOCHS-AWEZNQCLSA-N 279.380 2.412 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccncc2)cc1F 60214099 BUJJVVUWILORRG-UHFFFAOYSA-N 273.311 2.217 10 20 CECD COCC(C)(C)NCc1cc(Cl)cc([N+](=O)[O-])c1O 66995928 XCVAOFCJOMYWSP-UHFFFAOYSA-N 288.731 2.468 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1cc(Cl)ccc1O 186088280 XLGDHNIPKOQBBG-ONGXEEELSA-N 294.782 2.460 10 20 CECD Cn1cc(NC(=O)NCc2ccc(N3CC=CC3)cc2)cn1 133653303 QEXCMNPAUPWONP-UHFFFAOYSA-N 297.362 2.118 10 20 CECD COc1cccc(CNCc2cccc3c2OCO3)c1O 40666989 UWGFAZIWXUPFGW-UHFFFAOYSA-N 287.315 2.419 10 20 CECD CCNCC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 44651408 FODFTELFTQTNAR-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CC[C@H](C)O2)cc1 191085889 AXKCNBTVTSHWEO-SWLSCSKDSA-N 293.363 2.242 10 20 CECD Nc1ccc(NC(=O)CCc2nc(-c3ccco3)no2)cc1 237975784 BDJQCYKJWNJROJ-UHFFFAOYSA-N 298.302 2.483 10 20 CECD Nc1ccc(NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2)cc1 237998076 MCDUTFQNRRBCEI-BPNCWPANSA-N 259.353 2.128 10 20 CECD COc1ccc(CNC(=O)NCC2CC=CC2)c(O)c1 528145909 IWFSVAQROMYUEW-UHFFFAOYSA-N 276.336 2.166 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@H]1CCSC1 279328175 PWNMGSGHLWIFII-LLVKDONJSA-N 280.393 2.287 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@]2(O)CCO[C@H]2C)cc1 278932310 XPWCQUZCXOAYEZ-GRDNDAEWSA-N 292.423 2.333 10 20 CECD CC[C@@H](NC[C@@H](O)CN1CCCC1)c1ccc(F)cc1O 286334443 YBETXTIWWOIRLE-UKRRQHHQSA-N 296.386 2.029 10 20 CECD Cc1c(/C=C/C(=O)N2CCc3cc(F)ccc32)cnn1C 283495361 FKKQXBLHVIYMRK-ZZXKWVIFSA-N 285.322 2.470 10 20 CECD COc1cccc(O)c1CNc1cccc2c1CNC2=O 808420275 ZPKHLKZBZYPISP-UHFFFAOYSA-N 284.315 2.256 10 20 CECD CCOC1CC(N(C)Cc2c(O)cccc2OC)C1 809773477 DJAXYFNMBTXQFR-UHFFFAOYSA-N 265.353 2.400 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CSC1CC1 295846923 XFKNTAXFOCAMNH-SECBINFHSA-N 281.377 2.041 10 20 CECD COC(=O)c1cnc(SCc2n[nH]c(C(C)C)n2)s1 295329864 OYUNHLSJBGVNNC-UHFFFAOYSA-N 298.393 2.464 10 20 CECD CO[C@@H]1CCN(Cc2cc(Cl)c(F)cc2O)C1 816513286 LWCATZPRPJUNRX-SECBINFHSA-N 259.708 2.405 10 20 CECD COc1cccc(CNc2ccc(Cl)nn2)c1O 819915556 JZPWORHBGKBNPS-UHFFFAOYSA-N 265.700 2.456 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CCN1C1CCCC1 821055304 KPBQHGQZMSODHX-CQSZACIVSA-N 274.364 2.025 10 20 CECD Oc1cccc2c1[C@@H](NCCCOC[C@@H]1CCOC1)CC2 834598996 URDUCYUQKGKFAV-ZFWWWQNUSA-N 291.391 2.412 10 20 CECD CC1(C)C[C@H](CNC(=O)c2cc(O)cs2)CCO1 839793168 SWQPLSQJDGGNLT-SECBINFHSA-N 269.366 2.389 10 20 CECD COc1cccc(O)c1CNC[C@](C)(O)c1ccccc1 734005140 XMQTUSKADZAKMP-KRWDZBQOSA-N 287.359 2.398 10 20 CECD C[C@@H](NCCOC1CC1)c1ccc(N2CCOCC2)cc1 903170257 FNJMQDHTYKHDRR-CQSZACIVSA-N 290.407 2.353 10 20 CECD C[C@@H](CCO)N(C)Cc1cc(Cl)c(F)cc1O 846113018 XWKLHYXCTISMDT-QMMMGPOBSA-N 261.724 2.387 10 20 CECD CCc1cccc(CN2CCN(C(=O)C3CC3)CC2)c1O 848880258 MQCJPYGITSHFJG-UHFFFAOYSA-N 288.391 2.009 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)NCCF 840485706 WETHBVDYLHKFEL-LBPRGKRZSA-N 281.375 2.261 10 20 CECD Nc1ccc(NC(=O)N2C[C@@]3(CCCO3)[C@H]2C2CC2)cc1 841298750 FEURUQWLEIDYGJ-ZBFHGGJFSA-N 287.363 2.444 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2cccc(OC)c2O)n1 846170495 AFNPHDFZXUZXCA-SNVBAGLBSA-N 290.367 2.171 10 20 CECD COC[C@H](CN[C@H](C)c1ccc(Cl)cc1O)OC 841755001 XHTWKQXWUULLOT-KOLCDFICSA-N 273.760 2.358 10 20 CECD C[C@@H](CO)N(CC1CCC1)C(=O)Nc1ccc(N)cc1 841294397 BDRRBFQZHYUIDX-NSHDSACASA-N 277.368 2.284 10 20 CECD CC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)[C@H](C)CO1 846175288 YITPUCDZYZPBTM-DOMZBBRYSA-N 291.395 2.020 10 20 CECD CN(C)c1cc(F)c(CNCCCn2ccnc2)cc1F 858086198 DGCSOGYKEUZWMM-UHFFFAOYSA-N 294.349 2.407 10 20 CECD CNC[C@H](C)N[C@H](C)c1cc(Br)ccc1O 854232786 UENFLBOZJZJWPR-DTWKUNHWSA-N 287.201 2.413 10 20 CECD COC1CCN(CCN[C@H](C)c2cc(C)ccc2O)CC1 756643962 WNZHOBXHVSCWOQ-CQSZACIVSA-N 292.423 2.462 10 20 CECD O=C(c1cccc(O)c1O)N(Cc1ccccn1)C1CC1 863923820 HREKCZRRVQHKNT-UHFFFAOYSA-N 284.315 2.298 10 20 CECD Cc1cnc(CN(C)Cc2ccc(N(C)C)cc2)[nH]1 862210473 MOOSZLINHINWDT-UHFFFAOYSA-N 258.369 2.416 10 20 CECD CCOC(=O)[C@H](C)N(C)Cc1cc(F)cc(C(C)=O)c1O 761870563 FWJGGAMBBLVXES-VIFPVBQESA-N 297.326 2.117 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2C)c(C)nn1 767536204 IRRGOUWVKACHKX-UHFFFAOYSA-N 298.390 2.398 10 20 CECD CC(=O)Nc1ccc(CNCc2c(C)cccc2O)cn1 877484467 HCRLLWJCJYSGEL-UHFFFAOYSA-N 285.347 2.344 10 20 CECD COCC[C@](C)(O)CNCc1cc(Cl)cc(F)c1O 776175442 LNQYLXQTXYGAEV-ZDUSSCGKSA-N 291.750 2.062 10 20 CECD COC(=O)CCN(Cc1cc(F)cc(F)c1O)C(C)C 894020694 MIAHPXSOHFDFSS-UHFFFAOYSA-N 287.306 2.444 10 20 CECD Cc1ccc(S(=O)(=O)Nc2ccc(O)c(C)c2)cn1 788139700 NUCUDYNNNCUJTL-UHFFFAOYSA-N 278.333 2.205 10 20 CECD COc1cc(C)cc(CN[C@@H]2Cc3ccccc3[C@H]2O)c1O 898386280 IZFHZTDRFNVPSL-CRAIPNDOSA-N 299.370 2.457 10 20 CECD Cc1cc(N)nc(NCc2ccc(N(C)C)cc2C)n1 892564370 SABOZBDXCJUOKI-UHFFFAOYSA-N 271.368 2.354 10 20 CECD COc1ccc(CNCC2CC(NC(C)=O)C2)cc1C 961441618 FBGSELLDCQXWMI-UHFFFAOYSA-N 276.380 2.008 10 20 CECD CC(C)NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891402551 ZZCMBZVGHQHLON-HNNXBMFYSA-N 292.427 2.063 10 20 CECD O=C(Nc1nnc(C2CC2)s1)c1cccc(O)c1O 790513795 HFMCMLBZGLHIJH-UHFFFAOYSA-N 277.305 2.079 10 20 CECD C[C@@H]1C[C@@H]1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891257426 HBCSCXWJNPQPPY-UHOFOFEASA-N 289.423 2.128 10 20 CECD COc1cccc(C(=O)NCc2ccc(OC)cc2O)c1 794378458 IBTWNGPXGVSDPG-UHFFFAOYSA-N 287.315 2.339 10 20 CECD CC[C@@H](C)[C@H](OC)C(=O)NCc1cc(OC)ccc1O 793690692 XGBLXKSMHBSMHT-YGRLFVJLSA-N 281.352 2.078 10 20 CECD CC[C@@H](NC(=O)c1cccc(O)c1O)C1CCOCC1 790827575 UVLGULKIKFEDRI-GFCCVEGCSA-N 279.336 2.033 10 20 CECD CC[C@H](C)C[C@@H](N)C(=O)N[C@H](C)c1ccccc1O 1341541037 MNWIWLFCWVVVHB-DMDPSCGWSA-N 264.369 2.333 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](CCN)C2)c1O 723698484 HHQAPVZGYUSNLS-SNVBAGLBSA-N 284.787 2.225 10 20 CECD C[C@@H](Nc1cc(C(=O)O)ncn1)c1ccccc1O 1599842674 WIEGXXDHOJHKGF-MRVPVSSYSA-N 259.265 2.054 10 20 CECD Cc1ccc([C@H](C)NCC2(C)OCCO2)c(O)c1 186211950 ZIHMCLUNAXZFAA-NSHDSACASA-N 251.326 2.114 10 20 CECD CNC[C@H](C)CNC1CCN(c2ccc(OC)cc2)CC1 1325716606 IOACVTDZEZZCNL-AWEZNQCLSA-N 291.439 2.109 10 20 CECD Nc1ccc(CNC(=O)N2CCC[C@H]2[C@H]2CCCO2)cc1 1337070834 XSYNJLHSMDEVSD-LSDHHAIUSA-N 289.379 2.122 10 20 CECD CCC1(C(=O)NCc2ccc(N)cc2)CCOCC1 1515333481 RZIVWXOGYHVWAD-UHFFFAOYSA-N 262.353 2.092 10 20 CECD COc1cccc(O)c1CN1CCC2(CC1)C[C@@H]2C(=O)O 1607326889 VRSUCVSPPGLDEY-GFCCVEGCSA-N 291.347 2.088 10 20 CECD C[C@@H](CC(=O)NCc1cccc(O)c1O)c1cccnc1 1548791649 WSNAJXLORHKDLT-NSHDSACASA-N 286.331 2.303 10 20 CECD Cc1ccc(O)c(CNCc2cnn(C)c2Cl)c1 858240038 ZIXKAGMJNALQQX-UHFFFAOYSA-N 265.744 2.377 10 20 CECD Nc1ccc(CCNC(=O)c2cc3ncccc3o2)cc1 1580443423 DUIOKNLEKBVNNI-UHFFFAOYSA-N 281.315 2.383 10 20 CECD CN(C)c1cc(F)c(CN2CCC(C(=O)O)CC2)cc1F 1593710679 IRVQPWDOXAMHKQ-UHFFFAOYSA-N 298.333 2.327 10 20 CECD C[C@@H](Cc1cnn(C)c1)NCc1cc(Cl)ccc1O 825046019 OGIVYONZPHOXEV-JTQLQIEISA-N 279.771 2.500 10 20 CECD C[C@H](Cn1ccnc1)NCc1ccc(N(C)C)cc1 35274904 QABQXTKAYNBXEU-CYBMUJFWSA-N 258.369 2.127 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CC1)c1cc(F)ccc1O 282191889 GGPDPOONOBVHNC-DYBLOJMWSA-N 271.357 2.093 10 20 CECD CN(C)CC1(NCc2ccc(N(C)C)cc2)CCC1 282272328 PYJKQBNYNDQIAJ-UHFFFAOYSA-N 261.413 2.327 10 20 CECD CC(C)[C@H](CO)CNCc1cc(Cl)ccc1O 394067750 HKIQSIFCHGCZAY-NSHDSACASA-N 257.761 2.400 10 20 CECD COc1cccc(CNC(=O)NCCC2CC2)c1O 173304887 XSWKRIDFHSFAIX-UHFFFAOYSA-N 264.325 2.000 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](O)COCC(C)C)c(O)c1 185117404 ADBVXONTKMSKIY-UONOGXRCSA-N 281.396 2.385 10 20 CECD CCCCCN(CC(N)=O)Cc1cccc(C)c1O 180803753 XSGADWKYLDZJPM-UHFFFAOYSA-N 264.369 2.178 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2ccc(F)c(F)c2O)C1 187761257 HXFPLFGTRYUNIV-UWVGGRQHSA-N 298.333 2.332 10 20 CECD Oc1c(Cl)cccc1CNCCN1CCCC1 127869741 MHZSDYANAQLZFL-UHFFFAOYSA-N 254.761 2.231 10 20 CECD CCOCCC1(CNC(=O)c2ccc(C)c(O)c2O)CC1 182888454 ATTCJUNOCPEULS-UHFFFAOYSA-N 293.363 2.343 10 20 CECD CCOc1cccc(CN2CC[C@@H](OCCOC)C2)c1O 188812560 SIHWOYAZPNIJAZ-CQSZACIVSA-N 295.379 2.028 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)C1=CCOCC1 193373813 CREABFLNERSUFL-UHFFFAOYSA-N 286.375 2.250 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNc2cccc(CO)c2)c1 191946093 XRWAXMFBJOLBMX-UHFFFAOYSA-N 274.276 2.405 10 20 CECD CCC[C@@](C)(NCc1cc(F)ccc1O)C(=O)O 233316915 DTXHRORDVZKNGP-CYBMUJFWSA-N 255.289 2.264 10 20 CECD CO[C@H](C)CN(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 289943281 XIDVHJBIPPVPIX-MRVPVSSYSA-N 288.731 2.421 10 20 CECD CCOC(=O)[C@H](F)C1CN(Cc2cccc(C)c2O)C1 293951901 PCDGVZLJITVOOH-CYBMUJFWSA-N 281.327 2.034 10 20 CECD COC(=O)[C@H](NCc1cc(Cl)c(F)cc1O)C1CC1 816590185 SSXXFUZHAKOXLU-GFCCVEGCSA-N 287.718 2.226 10 20 CECD Oc1ccc(F)cc1CN1CCn2c(nnc2C(F)F)C1 827898985 XTZAYYNPQUUCNH-UHFFFAOYSA-N 298.268 2.076 10 20 CECD CN(C)c1ccc(CNC(=O)/C=C/[C@H]2CCOC2)cc1F 822862172 HAZTXHAZWMGWDD-FUEXJSSKSA-N 292.354 2.101 10 20 CECD COc1ccc(O)c(CN[C@H](CO)c2ccccc2)c1 62999662 UNVHTYNLWOTNTQ-OAHLLOKOSA-N 273.332 2.224 10 20 CECD CCOc1cccc(CN2CC(C)(COC)C2)c1O 839144970 FFHCJTQMFVHYBV-UHFFFAOYSA-N 265.353 2.259 10 20 CECD COc1ccc(O)c(CN[C@H]2C[C@@H](OC(C)C)C2)c1 839147733 QFVCJQRHHWAKCY-XBXGTLAGSA-N 265.353 2.446 10 20 CECD CON(C)Cc1c(O)c(C(=O)O)cc2ccccc12 737836189 MZBLWEMLORCFJZ-UHFFFAOYSA-N 261.277 2.237 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(C)cc1O 834904741 PRQQOTINSFLUJA-NJZAAPMLSA-N 265.353 2.155 10 20 CECD CN(Cc1ccccc1O)Cc1ccccc1-c1nn[nH]n1 736828048 FWLVVMDWWXCIKN-UHFFFAOYSA-N 295.346 2.204 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c(O)c1C 834906752 GXXWTSCTZOWAOR-RWMBFGLXSA-N 276.380 2.314 10 20 CECD O=C(NCCc1ccco1)NCc1ccccc1O 748463648 ZWLRVPRKERRXOK-UHFFFAOYSA-N 260.293 2.027 10 20 CECD CCC(CC)(CN)C(=O)N[C@@H](C)c1cc(OC)ccc1O 843489276 LWAVBYHJUWWTMO-NSHDSACASA-N 294.395 2.343 10 20 CECD COc1cccc([C@@H](C)NCc2cc(C)ncn2)c1O 846157957 QBANTBPXAGZACO-LLVKDONJSA-N 273.336 2.350 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@H]1CCOC1 840892576 BIMUBWNUZBFRMX-HIFRSBDPSA-N 262.397 2.371 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@@H]1CN 841101390 VSBSIARERROASK-JSGCOSHPSA-N 279.403 2.308 10 20 CECD C[C@H]1CCN(Cc2cccc(Cl)c2O)C[C@H]1CN 841101118 OJLIOPZBTSCBJZ-CMPLNLGQSA-N 268.788 2.462 10 20 CECD O=C(O)C1CCN(Cc2cc3c(cc2O)CCC3)CC1 740482173 ONDNUNFUVKGJCW-UHFFFAOYSA-N 275.348 2.178 10 20 CECD C[C@@H]1C[C@@H](NC[C@H]2CCCNC2=O)c2c(O)ccc(F)c21 840826178 RYEILTMQNIMCPC-CKYFFXLPSA-N 292.354 2.195 10 20 CECD CC[C@@H](NC(=O)NCCc1ccc(N)cc1)C(F)F 841955821 ORCOQWYJIGMMKX-LLVKDONJSA-N 271.311 2.154 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CO[C@H](C)C2)c1 842926696 AZPJHMXIDSULDZ-JFGNBEQYSA-N 279.336 2.007 10 20 CECD COC(=O)[C@@H](F)CSc1ncc(Cl)s1 849998596 GTVLNQWJSCPQCT-BYPYZUCNSA-N 255.723 2.400 10 20 CECD COCC[C@@H](Cc1ccco1)NC(=O)c1cc(O)cs1 753473957 DYHMMUASEJIVGB-JTQLQIEISA-N 295.360 2.424 10 20 CECD C[C@@H](NC[C@@H]1CCOC1)c1cc(F)cc(F)c1O 756461834 WGJDNMUFGHIZAG-BDAKNGLRSA-N 257.280 2.358 10 20 CECD O=C(NCC1=CCCC1)c1c(F)ccc(O)c1O 857328738 FUMCIDSTHGIUOL-UHFFFAOYSA-N 251.257 2.077 10 20 CECD C[C@H]1CCCN(C(=O)c2cc(O)cs2)[C@@H]1CCO 855541185 NPXTWESGSLRUIB-GXSJLCMTSA-N 269.366 2.077 10 20 CECD C[C@@H](N[C@H](CCO)C1CCOCC1)c1cc(F)ccc1O 763559097 QPGNUPFHWGBXJE-IAQYHMDHSA-N 297.370 2.360 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CC1COC1 769694283 YULZRHXIDYZIHW-UHFFFAOYSA-N 276.380 2.138 10 20 CECD Cc1ccc(CNC(C)(C)c2nc(C)no2)c(O)c1 877507867 OBPWEBQKDBZOGE-UHFFFAOYSA-N 261.325 2.417 10 20 CECD CCN(CC)c1ccc(CN2C[C@H]3CNC[C@@H]3C2)cc1F 770395470 RJJYZYDBFUNZMT-HUUCEWRRSA-N 291.414 2.323 10 20 CECD C[C@H]1C[C@H]1CNCc1ccc(N2CCN(C)CC2)cc1 775991133 KPYXNGZKLTVJSE-HOCLYGCPSA-N 273.424 2.184 10 20 CECD CC(C)[C@@H]1NC(=O)N(CCCSc2nccs2)C1=O 777649078 CUFHKXQIXIFMGM-VIFPVBQESA-N 299.421 2.202 10 20 CECD C[C@H]1CC[C@H](Cn2cc(COc3ccc(N)cc3)nn2)O1 881393071 HJCJWOPAWAOUML-XHDPSFHLSA-N 288.351 2.007 10 20 CECD C[C@@H](NCCSCCCO)c1c(O)cccc1F 886524713 PJWBNOHWKWXZGA-SNVBAGLBSA-N 273.373 2.298 10 20 CECD CC[C@]1(CO)CCCN1Cc1ccc(OC)c(OC)c1O 893909110 WPUTWJAJRCRNNC-MRXNPFEDSA-N 295.379 2.146 10 20 CECD O=C(NCCc1ccc(F)cc1)c1c(F)ccc(O)c1O 789943061 ZDOGDFNCGNXPJR-UHFFFAOYSA-N 293.269 2.349 10 20 CECD COc1ccc(CN2CCOCC23CCC3)c(O)c1OC 892069163 YIXDXXCSSPENJR-UHFFFAOYSA-N 293.363 2.164 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cccc(C)c2O)[C@@H]1C 787420884 LZZBEXWNEDRLAL-DGCLKSJQSA-N 263.337 2.084 10 20 CECD COc1ccc(CN2CCOC[C@@H]2C2CC2)c(O)c1OC 892109683 CYIKIPMSKWVNRZ-CYBMUJFWSA-N 293.363 2.020 10 20 CECD COc1cc(CN2CC[C@]3(CCN(C)C3)C2)c(O)cc1C 793763650 DYWDUURGCHGKEM-KRWDZBQOSA-N 290.407 2.237 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](c3n[nH]c(C)n3)C2)c1 895007930 PTDRBPZLNZHGMP-LBPRGKRZSA-N 272.352 2.117 10 20 CECD COc1ccc(CNc2nnc(C3CC3)o2)c(O)c1 795283576 CGLPDPUQCFVQIX-UHFFFAOYSA-N 261.281 2.273 10 20 CECD C[C@H](NCC1(S(C)(=O)=O)CCC1)c1ccccc1O 281186829 QZGLSLTUDFFUJU-NSHDSACASA-N 283.393 2.010 10 20 CECD C[C@H](CNC(=O)Nc1ccc(N)cc1)CN1CCCC1 62070013 QWMSLDJKAHFHCS-GFCCVEGCSA-N 276.384 2.122 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2cc(C)c(C)nn2)c1 1335171736 PITRWGGDMGTLIZ-UHFFFAOYSA-N 286.335 2.429 10 20 CECD CCOc1cccc(CN2C[C@H](C)N(C)C[C@H]2C)c1O 775981342 PNLOAFFFRLBDNL-QWHCGFSZSA-N 278.396 2.315 10 20 CECD C[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccccc1O 777725561 URGYJYUCXKWVKR-YNEHKIRRSA-N 297.420 2.399 10 20 CECD CO[C@@H](CN[C@H](C)c1ccccc1O)C1CCOCC1 877755881 QFRCSNIFYXWNIC-WBMJQRKESA-N 279.380 2.484 10 20 CECD Cn1cccc1[C@H]1COCCN1C(=O)c1cc(O)cs1 1347752746 UWGDUDIOMRZNPK-GFCCVEGCSA-N 292.360 2.006 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H]3C[C@H]3C2)cc1F 1350479965 MLVKIBXOVRLDKI-STQMWFEESA-N 291.370 2.443 10 20 CECD CC(C)N1CCC[C@@H](C(=O)NCc2ccc(N)cc2)C1 1575701153 WRBZENCZUILURT-CQSZACIVSA-N 275.396 2.005 10 20 CECD C[C@H](N[C@@]1(C)CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589952860 YELCEUIZONCQEX-VFZGTOFNSA-N 287.367 2.412 10 20 CECD CC(C)n1ccnc1CNCc1ccc(C(=O)O)cc1O 1776394277 FYXCTYIVFDETMT-UHFFFAOYSA-N 289.335 2.158 10 20 CECD CS(=O)(=O)CCCCSc1nccs1 162947416 CWEUQXDPVQDKDR-UHFFFAOYSA-N 251.398 2.060 10 20 CECD COc1ccccc1CC(=O)Nc1ccc(N)cc1 37295986 HMMVOWRUNIILEV-UHFFFAOYSA-N 256.305 2.459 10 20 CECD C[C@@H](NCC1CC2(C1)OCCO2)c1cc(F)ccc1O 927000805 JWONKTXPVVPXKT-SNVBAGLBSA-N 281.327 2.335 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)c1 172041006 CQRWBTGWSHZFTF-XKFJNSEWSA-N 291.347 2.146 10 20 CECD CCOc1ccc(O)c(CN2CCC(C)(O)CC2)c1 179726812 VFDVDJLEYFKESW-UHFFFAOYSA-N 265.353 2.138 10 20 CECD CCOC(=O)N1CCC(Nc2ccccc2N)CC1 20384317 CHFSPWXIDIDPTR-UHFFFAOYSA-N 263.341 2.302 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NC[C@@H](C)O)cc1 128363410 GNWIONAIOXPYDR-CYBMUJFWSA-N 272.348 2.205 10 20 CECD CN(CCn1cccn1)Cc1c(O)cccc1Cl 125294363 ONOAESITNUFUBC-UHFFFAOYSA-N 265.744 2.374 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(O)CCC2)cc1 185917071 FYBJFOCZGSINLI-UHFFFAOYSA-N 276.380 2.064 10 20 CECD CCOc1cccc(CN2CCO[C@H](CC)C2)c1O 132016759 FAGBPCMSNPYLRL-CYBMUJFWSA-N 265.353 2.402 10 20 CECD O=C(O)c1ccnc(Sc2nccs2)c1[N+](=O)[O-] 381119833 AJNNWINWPSZSLG-UHFFFAOYSA-N 283.290 2.296 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCO[C@H]2C)c1 134244026 BPCQPYGYXPKMLB-OUJBWJOFSA-N 251.326 2.229 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1cc(Cl)ccc1O 91985888 FEJAGXHXBUPGKP-SECBINFHSA-N 271.744 2.287 10 20 CECD COc1cc(CCNC(=O)Cc2ccc(N)cc2)ccc1C 237321924 KZTNDDXFNAFBKJ-UHFFFAOYSA-N 298.386 2.487 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)C[C@@H]1CCCC[C@H]1O 245879163 AWYQHKDAWBDOJP-WCQYABFASA-N 293.363 2.104 10 20 CECD O=C(/C=C\c1cncc(F)c1)N1CCOc2ncccc21 255909154 XPTLZYJZTOPNHL-ARJAWSKDSA-N 285.278 2.055 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NCC3CNC3)c2C)c1 261928881 BYMKMDFCSZONMO-UHFFFAOYSA-N 297.402 2.352 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H](CCO)COC)cc1 268995709 IHPWXTVHGRSLDK-DZGCQCFKSA-N 280.412 2.191 10 20 CECD CCN1CCC[C@H]1CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273382743 IPIVKFSLTBJCGC-YPMHNXCESA-N 293.367 2.435 10 20 CECD COc1cccc(CN2CCC[C@H](N(C)C)CC2)c1O 277442597 KECHOUQDZGDQPD-AWEZNQCLSA-N 278.396 2.317 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 298665731 QMJCIQQOHDOAQD-HUUCEWRRSA-N 276.380 2.136 10 20 CECD CCOc1cccc(CNCCc2nccnc2C)c1O 293043781 QYYFCLCZTPPOKN-UHFFFAOYSA-N 287.363 2.222 10 20 CECD COc1cc(CN2CC[C@H](n3cccn3)C2)c(O)cc1C 812296245 MIQZXRLSRHEXTF-AWEZNQCLSA-N 287.363 2.353 10 20 CECD C[C@H](N[C@H]1CC[C@H](CN)C1)c1ccc(F)cc1O 817981274 IIAJVUFNKRPNBL-NHCYSSNCSA-N 252.333 2.309 10 20 CECD C[C@H](N)CCN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 817953923 WIYPSMJBWYWPSZ-STQMWFEESA-N 295.402 2.050 10 20 CECD O=C(NCc1c(F)cc(F)cc1F)c1cccc(O)c1O 818516781 HSMAJBCZBVSFAB-UHFFFAOYSA-N 297.232 2.445 10 20 CECD Cc1cccc(CNCc2cccc(-c3nn[nH]n3)c2)c1O 826298217 JEVHLPKIITUFCM-UHFFFAOYSA-N 295.346 2.171 10 20 CECD Cc1cc(O)c(CN[C@H](C)Cc2cnn(C)c2)cc1C 825046049 OZXOXHDQHKLPDD-CYBMUJFWSA-N 273.380 2.463 10 20 CECD CCOCCC1(CNC(=O)c2c(F)ccc(O)c2O)CC1 827224956 KYLZEIZUHOPGHZ-UHFFFAOYSA-N 297.326 2.174 10 20 CECD CC[C@@H]1CCCCN1C(=O)COC(=O)c1cc(O)cs1 731910482 RVHYRIMOMOAMEP-SNVBAGLBSA-N 297.376 2.402 10 20 CECD C[C@H](N[C@H]1COC[C@@H]1C)c1ccc(N2CCOCC2)cc1 903400233 NJSRZTPBDVTWIP-ZQIUZPCESA-N 290.407 2.209 10 20 CECD Cc1nn(C)c(NC(=O)c2cc(O)cs2)c1C 732290215 SMZXIDAONDDNSS-UHFFFAOYSA-N 251.311 2.056 10 20 CECD CNC(=O)C[C@H](C)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 834901179 QRZIYUUBQPGPIZ-YWVKMMECSA-N 280.343 2.194 10 20 CECD O=C(NCC[C@H](O)C1CCCC1)c1cc(O)cs1 831397824 ZSJPBOUMCDPDSZ-NSHDSACASA-N 269.366 2.125 10 20 CECD CCC(=O)N1CCCN(Cc2cccc(CC)c2O)CC1 848882464 QHEZGFIIARYVPF-UHFFFAOYSA-N 290.407 2.399 10 20 CECD O=C(NCc1ccccc1O)Nc1cnn(CC2CC2)c1 743238858 WXPPOJYWPISKBX-UHFFFAOYSA-N 286.335 2.320 10 20 CECD CC[C@@H](NC[C@@H]1CC(=O)N(CC)C1)c1ccccc1O 846096356 GWODYRQELKZHGG-GXTWGEPZSA-N 276.380 2.301 10 20 CECD CC(C)[C@H](C)N(C)C(=O)NCCc1ccc(N)cc1 841961158 AGMOERHQRHGZBK-LBPRGKRZSA-N 263.385 2.497 10 20 CECD CCN(CCSC)C(=O)/C=C/c1ccc(O)c(O)c1 844122417 HSMASQIUIVWPJN-FNORWQNLSA-N 281.377 2.323 10 20 CECD CCOc1ccc(CNCC2(OC)CCOCC2)c(O)c1 746754472 KQZFYJSGZCIALP-UHFFFAOYSA-N 295.379 2.076 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](CN)C2)c1O 843347007 QMOWHEVKOJTNAH-NSHDSACASA-N 296.798 2.419 10 20 CECD Cc1nc(C)c(C(=O)NCc2ccc(N(C)C)cc2C)[nH]1 857126525 DSEGHWCOUDGIMH-UHFFFAOYSA-N 286.379 2.331 10 20 CECD O=C(/C=C/c1cncc(F)c1)NCc1ccccc1O 769365261 OPFWZPXPBHSRFZ-AATRIKPKSA-N 272.279 2.256 10 20 CECD C[C@@](O)(CNC(=O)c1cc(O)cs1)c1ccc(F)cc1 760857815 ZHOJGBBYEGCKJP-CQSZACIVSA-N 295.335 2.230 10 20 CECD CCOc1ccc(O)c(CN(C)C(C)(C)C(=O)OC)c1 769306279 PWKJOYOFRBPIHH-UHFFFAOYSA-N 281.352 2.174 10 20 CECD CCOc1ccc(CN[C@H]2C[C@H](O)C2(C)C)c(O)c1 778193263 VIBCJJKGGSQXTB-KBPBESRZSA-N 265.353 2.040 10 20 CECD CC[C@H](NC[C@H]1C[C@H](N)C1)c1ccc(F)cc1O 873258781 VZNGENRJGZZHRU-GAFUQQFSSA-N 252.333 2.309 10 20 CECD Oc1cc(F)c(Cl)cc1CNC[C@H]1C[C@H](O)C1 877811504 MDSWHBPPFZZODJ-XWEPSHTISA-N 259.708 2.045 10 20 CECD COc1c([N+](=O)[O-])ccc(CNc2ccccn2)c1O 774976271 KHSXYXYRNQQASP-UHFFFAOYSA-N 275.264 2.316 10 20 CECD CC(C)CCOCCNC(=O)NCc1ccc(N)cc1 1120495815 SSCJPTHDPYPHBQ-UHFFFAOYSA-N 279.384 2.131 10 20 CECD COc1ccc(CN2CCC[C@@H]2C[C@@H](C)O)c(O)c1OC 892064893 GADYYOKTUVVTOB-DGCLKSJQSA-N 295.379 2.145 10 20 CECD CSCCONC(=O)NCc1ccc(N(C)C)cc1C 793027910 VYIZISRIJJHAQZ-UHFFFAOYSA-N 297.424 2.155 10 20 CECD COc1cccc(CNCCc2nc(C)cs2)c1O 60942043 DZDKGQBHWZLSFL-UHFFFAOYSA-N 278.377 2.498 10 20 CECD C[C@H](NC(=O)[C@@H](O)c1ccccn1)c1ccc(N(C)C)cc1 1346993440 QBJDJOFJXVCLCU-LRDDRELGSA-N 299.374 2.058 10 20 CECD C[C@H](NCC1(C(=O)O)CCOCC1)c1c(O)cccc1F 1603247551 LSXGKWQZJVKADE-JTQLQIEISA-N 297.326 2.063 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@H](C(=O)O)C2)c1 1607620817 JNZGNJFFXZKCIE-LBPRGKRZSA-N 263.337 2.306 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2C(=O)O)c1O 158490038 QDLPJGWJCFYRIR-CYBMUJFWSA-N 295.310 2.173 10 20 CECD CC(C)c1cc(C(=O)Nc2ccc(N)cc2)nn1C 160374465 GVSPBLFSMCZZIL-UHFFFAOYSA-N 258.325 2.378 10 20 CECD Cc1c(CN2CCOc3cc(N(C)C)ccc32)cnn1C 163193098 HRIKCRJZEARFBE-UHFFFAOYSA-N 286.379 2.194 10 20 CECD CON(C)CCN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 1118426936 FZPRPDQBAXRAFQ-RYUDHWBXSA-N 264.369 2.332 10 20 CECD C[C@@H](NC(=O)C[C@H](N)C(C)(C)C)c1ccccc1O 1263175714 KCBYXADTFDEYQN-MFKMUULPSA-N 264.369 2.333 10 20 CECD Nc1ccc(NC(=O)c2n[nH]c3c2CCCC3)cc1 238040989 PFNQZALFXYKTEJ-UHFFFAOYSA-N 256.309 2.123 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(N)cc1 37823736 FXEYDWKBKJFUHM-UHFFFAOYSA-N 256.305 2.247 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H]1CCCO1 53508571 BVLLCMDYSCBFGI-HNNXBMFYSA-N 291.395 2.073 10 20 CECD CC(=O)N(C)C1CCN(Cc2cccc(Cl)c2O)CC1 179877446 XJNAMAIIRLVLOP-UHFFFAOYSA-N 296.798 2.488 10 20 CECD CCCN(CC(=O)OC)Cc1cc(Cl)ccc1O 171927480 WGVVGFSGNQFNFZ-UHFFFAOYSA-N 271.744 2.431 10 20 CECD CO[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)[C@@H](C)C1 282367580 QCINKKGMFFALDE-CMPLNLGQSA-N 279.336 2.120 10 20 CECD CN1CCC[C@H](CNCc2cccc(Cl)c2O)C1 124812309 HDAAJOFFMWLHLE-LLVKDONJSA-N 268.788 2.477 10 20 CECD CC[C@]1(CO)CCCN1Cc1cc(F)cc(C(C)=O)c1O 189611520 UJFDTUZSEWXJQI-MRXNPFEDSA-N 295.354 2.471 10 20 CECD COc1ccc(O)c(CN(C)Cc2nccs2)c1 180371058 HDIIOGPPHQJLIB-UHFFFAOYSA-N 264.350 2.489 10 20 CECD CC(C)N1CC[C@H](N[C@@H](C)c2ccc(F)c(F)c2O)C1=O 187784391 VREDKPUJCTVFGL-CABZTGNLSA-N 298.333 2.330 10 20 CECD O=C(O)CC[C@H]1CCCN(Cc2ccccc2O)C1 86809629 VQXVZRSXVOOLKB-GFCCVEGCSA-N 263.337 2.469 10 20 CECD COc1ccc(CN(C)Cc2ccccc2O)nc1 271886648 DAEBNBFGLYSJFF-UHFFFAOYSA-N 258.321 2.428 10 20 CECD CNC(=O)C1CCC(N[C@H](C)c2ccccc2O)CC1 272931939 ZQMLASCOSGVROP-PNESKVBLSA-N 276.380 2.348 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H](C)C2)c1O 278330414 ZEKQTCHZOMHGMA-SECBINFHSA-N 266.297 2.151 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)[C@H]2CCSC2)c1O 278205045 JNELHQREBHKARU-JTQLQIEISA-N 298.364 2.246 10 20 CECD CC1(C)CN(C(=O)c2cccc(O)c2O)[C@H]1[C@@H]1CCCO1 290610082 NTKWZBJYSXVORL-JSGCOSHPSA-N 291.347 2.127 10 20 CECD CCCN1C[C@H](CNCc2cccc(Cl)c2O)CC1=O 817410354 ATTOCLVGCGDSAG-NSHDSACASA-N 296.798 2.394 10 20 CECD OC[C@@]12C[C@H]1CN(Cc1ccc3ccccc3c1O)C2 816586592 MHKKTXYXLNSNKX-YOEHRIQHSA-N 269.344 2.360 10 20 CECD O=C(NCCNCc1ccc2ccccc2c1O)C1CC1 816529308 ODXGKRRDLMBRON-UHFFFAOYSA-N 284.359 2.161 10 20 CECD C[C@@]1(C(N)=O)CCN(Cc2ccc3ccccc3c2O)C1 816597408 QOBNTQLZDWPJMR-QGZVFWFLSA-N 284.359 2.243 10 20 CECD COc1cc(O)c(CN2CC[C@@H](OC)[C@@H](C)C2)cc1OC 824815319 LRHBUMJNLOWLKT-SMDDNHRTSA-N 295.379 2.266 10 20 CECD CCOc1ccc(CN(C)Cc2noc(C)n2)c(O)c1 827892029 PSLSBFIQNGPGBZ-UHFFFAOYSA-N 277.324 2.114 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC2COC2)cc1 900261894 XFUWCTRCGQOGHB-UHFFFAOYSA-N 276.380 2.186 10 20 CECD COc1cc2c(c(OC)c1)N(CC(OC)OC)CCC2 839656058 FAPHLFCGMWCUME-UHFFFAOYSA-N 281.352 2.075 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2C[C@H]3CC[C@H]2O3)c1 733806436 CQRWBTGWSHZFTF-ZTYOMDHBSA-N 291.347 2.146 10 20 CECD CC(C)(C)N1CCC(NC(=O)c2cc(O)cs2)CC1 732273621 FHKHALRZYUWOKC-UHFFFAOYSA-N 282.409 2.446 10 20 CECD Cc1ccoc1CC(=O)N(C)Cc1ccccc1O 830141101 MVMLUDMALINAQY-UHFFFAOYSA-N 259.305 2.495 10 20 CECD C[C@H]1CCC[C@@H](N(C)C(=O)C(=O)Nc2ccc(N)cc2)C1 841015748 LITBAEKUGQHGFE-SMDDNHRTSA-N 289.379 2.244 10 20 CECD CCn1[nH]c(C)nc1=NCc1c(O)ccc(Cl)c1F 840887592 MJDIOMLOARIXGM-UHFFFAOYSA-N 284.722 2.139 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)CC(=O)O)cc1 840995588 XPHGKUISFWVRPM-GFCCVEGCSA-N 264.369 2.486 10 20 CECD COc1ccc(N(C)C[C@@H]2CCC(=O)N2)cc1Cl 844302241 GFPPSOVRAFZUAR-VIFPVBQESA-N 268.744 2.063 10 20 CECD C[C@@H]1CCN2[C@@H](c3cc(Cl)c(F)cc3O)NC(=O)[C@H]2C1 840820224 QVWHIRDCUAEXPM-QUUYKZCZSA-N 298.745 2.414 10 20 CECD CC[C@H](C(=O)NCCCSc1nccs1)[C@@H](C)O 842232966 XNIMVAYBALZFBX-ZJUUUORDSA-N 288.438 2.149 10 20 CECD CCOCc1cc(CNC[C@@H]2CCN2C)ccc1OC 922573902 HFXSZFPZTIWEIB-HNNXBMFYSA-N 278.396 2.025 10 20 CECD c1cc2c(cc1CNCCOC[C@H]1CCOC1)CCCO2 921721443 IRFVEXKPAATITR-HNNXBMFYSA-N 291.391 2.154 10 20 CECD Cc1nnc(COC(=O)/C=C/c2ccc(O)c(O)c2)s1 759594549 GWRTXFNGZAWUEO-HWKANZROSA-N 292.316 2.014 10 20 CECD C[C@H](NCCn1cccn1)c1cc(F)cc(F)c1O 756685550 NELKFSLJCXLCRH-VIFPVBQESA-N 267.279 2.218 10 20 CECD CN(Cc1c(O)cccc1Br)CC(C)(C)O 862244745 FCBDTJUAAZQMTF-UHFFFAOYSA-N 288.185 2.357 10 20 CECD COC(=O)C[C@H](C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773007384 HZWQFSBRHLZXSS-RYUDHWBXSA-N 292.379 2.129 10 20 CECD CC[C@H](N[C@@H](C)COCCOC)c1ccccc1O 775527216 PCOVTIFEBZXSBY-JSGCOSHPSA-N 267.369 2.484 10 20 CECD CCOC(=O)N1CC[C@H](N[C@H](C)c2c(O)cccc2F)C1 886594983 YFLNAKUOHLKVPZ-MNOVXSKESA-N 296.342 2.413 10 20 CECD CC[C@H](C)Cn1cc(COc2ccc(N)cc2)nn1 881203329 HNQISPZBXNLPKD-NSHDSACASA-N 260.341 2.485 10 20 CECD C[C@@H]1C[C@@H](CNC(=O)NCc2ccccc2O)CCO1 770818841 JDWDNSVJZFUPFZ-NEPJUHHUSA-N 278.352 2.007 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCN1C(C)(C)C)c1ccccc1O 899181403 BREZCXSZXWJQSW-YPMHNXCESA-N 276.380 2.442 10 20 CECD C[C@H](O)C[C@@H]1CCCN1Cc1cc(F)cc(F)c1O 894035048 XEAGNJIJCUKALV-CABZTGNLSA-N 271.307 2.406 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1csc(O)n1 792179218 SFGQSRNGARCFOV-UHFFFAOYSA-N 291.376 2.153 10 20 CECD COC[C@@H](N[C@@H](C)c1cc(OC)ccc1O)C1CC1 186153613 GGCFXJWWWFQYMX-IINYFYTJSA-N 265.353 2.476 10 20 CECD C[C@H](CCO)NCc1c(O)cccc1Br 706846447 ITYLADOTDFWPJP-MRVPVSSYSA-N 274.158 2.015 10 20 CECD C[C@@H]1CCN(CCNCc2ccc3c(c2)CCO3)C1 744450212 WNVIOGQBIWAWGJ-CYBMUJFWSA-N 260.381 2.053 10 20 CECD CC[C@H](N[C@@H](CO)CC(F)F)c1ccccc1O 717749540 KJPQHSVBVUABLL-KOLCDFICSA-N 259.296 2.449 10 20 CECD CCN(CCC(=O)NC)Cc1ccc(N2CCCC2)cc1 1335032412 COISLXFUDBZFNK-UHFFFAOYSA-N 289.423 2.245 10 20 CECD Nc1ccc(CN2CCCC[C@H]2[C@@H]2CCCN2)cc1 1345160109 QYUMEEQPZYNTAE-HOTGVXAUSA-N 259.397 2.375 10 20 CECD O=C(O)c1cnc(SCCO[C@H]2CC2(F)F)s1 1602536683 DPLGCKVXWKQOEQ-LURJTMIESA-N 281.305 2.358 10 20 CECD COC1(CN[C@H](C)c2cc(C(=O)O)ccc2O)CCC1 1606717557 OPDNJMFLDMEVOV-SNVBAGLBSA-N 279.336 2.310 10 20 CECD CCC[C@](C)(NCc1ccc(OC)c(OC)c1O)C(=O)O 1595559469 HSGMTPYNEXJCNM-HNNXBMFYSA-N 297.351 2.142 10 20 CECD COc1cccc(O)c1CNC[C@@]1(O)CCCC1(C)C 815147655 UVNDKILZTXBYFT-INIZCTEOSA-N 279.380 2.432 10 20 CECD COCCC(C)(C)CNC(=O)Nc1ccc(N)cc1 234672012 GORBTALMQBUOMT-UHFFFAOYSA-N 265.357 2.453 10 20 CECD CC[C@@H](C)[C@H](CNCc1cc2c(cc1O)OCO2)OC 294115504 DFXDIFZVMOOCEC-BMIGLBTASA-N 281.352 2.272 10 20 CECD CN1CCC(CNCc2cc(F)cc(F)c2O)CC1 708495435 BAABHNJHGNXGKZ-UHFFFAOYSA-N 270.323 2.102 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@@H]1CC(=O)N(C)C1 380674853 XVYPNWMPHGOVIA-IJLUTSLNSA-N 274.364 2.069 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CC[C@@H](C)O2)c1 398118641 ADXOPCLWVNDLCV-MFKMUULPSA-N 251.326 2.058 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccncc2)cc1 54401545 JGNFTMQDSOMLLZ-UHFFFAOYSA-N 284.363 2.147 10 20 CECD CCC[C@@](C)(CO)NCc1cc(OCC)ccc1O 177582333 XUUOKCWJUQYDFW-HNNXBMFYSA-N 267.369 2.432 10 20 CECD COc1cccc([C@@H]2NC(=O)CN2Cc2ccccc2)c1O 112369579 WOQLPFBMZJDMQQ-QGZVFWFLSA-N 298.342 2.031 10 20 CECD Cc1ccc(O)c(CNCCCCCS(C)(=O)=O)c1 185209298 XCHWMQWGXNPSDR-UHFFFAOYSA-N 285.409 2.005 10 20 CECD CCOC(=O)/C(=C/c1scnc1C)c1nccn1C 78693875 SVXSKAGLMZZAJH-JXMROGBWSA-N 277.349 2.289 10 20 CECD CCC[C@](C)(NCc1cc(OC)ccc1O)C(=O)O 86732495 MBYNBPRFNLJOQA-AWEZNQCLSA-N 267.325 2.134 10 20 CECD CCN(C[C@H](O)COC(C)C)c1ccc(OC)cc1 269100270 REZFOVKLIJWLDR-AWEZNQCLSA-N 267.369 2.307 10 20 CECD CCOc1cccc(CN2CC[C@H](O)C(C)(C)C2)c1O 275862318 JELGDTUHUAQCFB-AWEZNQCLSA-N 279.380 2.384 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H](C)C(=O)NCCF)cc1 282650404 HZUGZOCBGPNEHY-CHWSQXEVSA-N 295.402 2.268 10 20 CECD CN(Cc1ccccc1O)c1nnc(C2CC2)n1C 290175696 KUBOOABMBBKETQ-UHFFFAOYSA-N 258.325 2.035 10 20 CECD O=Cc1c[nH]c(C(=O)NCc2c(O)ccc3c2CCCC3)c1 293616250 FRNMFNWWRBWTTA-UHFFFAOYSA-N 298.342 2.342 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cnc3cnccn23)c1 813331773 USGOJRGOGKAPTQ-LLVKDONJSA-N 298.346 2.294 10 20 CECD C/C=C(/C)C(=O)N(CC(=O)OCC)Cc1ccccc1O 819695820 ADTYNINWVIHGJF-QCDXTXTGSA-N 291.347 2.250 10 20 CECD C[C@@H](NCC1(CC(N)=O)CC1)c1ccc(Cl)cc1O 817590188 VZMXROSOCNVGTN-SECBINFHSA-N 282.771 2.352 10 20 CECD CC[C@@H](NC[C@@H]1C[C@H](F)CN1)c1ccccc1O 817975810 CHJQIYDWUOIKKX-GMXVVIOVSA-N 252.333 2.133 10 20 CECD COC(=O)c1cnc(SCc2ncc(C)cn2)s1 829677718 JFJXJKYQMLYGFO-UHFFFAOYSA-N 281.362 2.320 10 20 CECD Cc1cc(O)c(CNCC2(C)COC2)cc1Cl 825266854 NLEVOKYRJSNKFU-UHFFFAOYSA-N 255.745 2.480 10 20 CECD C[C@@H]1C[C@H](NC[C@@H]2CCN2C)c2c(O)ccc(F)c21 903317404 KGGHHEVWHDIFNG-SCVCMEIPSA-N 264.344 2.373 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1cc(C)c(C)cc1O 824703168 XKKRPVMDLKFTFI-KGLIPLIRSA-N 277.364 2.440 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(OC)cc2O)[C@@H]1SC 839067026 MCBVBZSOTKXPNL-CFVMTHIKSA-N 297.420 2.399 10 20 CECD COC(=O)[C@H]1C[C@H]2CC[C@H]1N(Cc1cc(C)ccc1O)C2 839173411 VTJMFDHBMNDXEX-VHDGCEQUSA-N 289.375 2.474 10 20 CECD Cc1ccc(CNC(=O)c2ccc(C)c(O)c2O)nc1C 837874237 AVXFUVZIFMUPDP-UHFFFAOYSA-N 286.331 2.348 10 20 CECD COC1(C)CN(Cc2ccc(N(C)C)c(F)c2)C1 839103058 VQARHJLSOXXOSH-UHFFFAOYSA-N 252.333 2.112 10 20 CECD CCc1cccc(CN2CC[C@@H](OC(=O)N(C)C)C2)c1O 848915481 IEXNAJLMDWAHGT-CQSZACIVSA-N 292.379 2.227 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2CCCN2)cc1 841035266 JLRMFPCALQHVDY-HNNXBMFYSA-N 261.413 2.374 10 20 CECD CCC1(CNC(=O)NCc2ccccc2O)CCOCC1 745789382 JWXRLQCWGLTRQM-UHFFFAOYSA-N 292.379 2.398 10 20 CECD CCn1ccc(CN[C@H](C)c2cccc(OC)c2O)n1 846169178 PTZIYOZYMGULKC-LLVKDONJSA-N 275.352 2.468 10 20 CECD CC(C)CSCCNC(=O)NCCc1ccc(N)cc1 841865561 UDOSIGWUXDVTDH-UHFFFAOYSA-N 295.452 2.500 10 20 CECD C[C@@H](CO)C1CCN(Cc2cc(F)ccc2O)CC1 846057210 DWGZDBZQNBKOMY-NSHDSACASA-N 267.344 2.372 10 20 CECD CCc1nn(C)c(CC)c1CNCCc1ccc(N)cc1 841033961 DBGVJNPRSGDXNM-UHFFFAOYSA-N 286.423 2.459 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H]1CCCNC1 841033815 ZRIZFUAUNDFCJA-VIFPVBQESA-N 272.751 2.274 10 20 CECD c1cc(N2CCOCC2)ccc1CNCCOC1CCC1 742385496 HSCKFQSOFITFCQ-UHFFFAOYSA-N 290.407 2.182 10 20 CECD CNC[C@H]1CCCN1Cc1cccc(Cl)c1O 843056162 VZGYFDPQOYPYPF-LLVKDONJSA-N 254.761 2.229 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@@H](C)N1 843049381 MOBILTUDXAGZNC-AOOOYVTPSA-N 254.761 2.228 10 20 CECD CCn1nc(C)c(CNCc2ccc3c(c2)CCCO3)n1 922195888 GFSXBBVTGIJVJF-UHFFFAOYSA-N 286.379 2.221 10 20 CECD CCn1cnc2c(NCc3ccccc3O)ncnc21 750537854 ZAGIOJSNJCNAQD-UHFFFAOYSA-N 269.308 2.164 10 20 CECD C[C@@H]1COC[C@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 922640482 FAZSVLKCNAAAOJ-GMSGAONNSA-N 286.715 2.078 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2cc(F)cc(F)c2O)C1 756656600 YVQSTACGGQTFPW-ONGXEEELSA-N 298.333 2.332 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC[C@@H](O)C2CCCC2)c1 865874846 JWALHKNEPHDDDC-OAHLLOKOSA-N 294.351 2.331 10 20 CECD CCON(CC)C(=O)NCc1ccc(N(C)C)cc1 866186642 ONQLFYSSZPITEB-UHFFFAOYSA-N 265.357 2.236 10 20 CECD Cc1ccc(CNC[C@]2(N(C)C)CCSC2)c(O)c1 877076750 UOGCCBIPOWLORS-OAHLLOKOSA-N 280.437 2.228 10 20 CECD Nc1ccc(OCc2cn(CCC3CC3)nn2)cc1 881307664 FLXMNGHHYPZEJQ-UHFFFAOYSA-N 258.325 2.239 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c(O)c1 877487037 UBSHXDBPRRLSAR-JJRVBVJISA-N 291.391 2.469 10 20 CECD Cc1ccc(CN2CCC(c3nncn3C)CC2)c(O)c1 876610866 KQMOJSFENIEZHL-UHFFFAOYSA-N 286.379 2.209 10 20 CECD C[C@H](NC(=O)c1ncccn1)c1ccc(N(C)C)cc1 773010244 RZRRHFUFJWKSDH-NSHDSACASA-N 270.336 2.034 10 20 CECD C[C@@H](N[C@H](CO)CC(F)F)c1c(O)cccc1F 886600910 FFJIXTNWKGKSBH-SFYZADRCSA-N 263.259 2.198 10 20 CECD CC(C)C(=O)NCCCN[C@@H](C)c1c(O)cccc1F 886557200 WADVICXRAIJRKV-NSHDSACASA-N 282.359 2.344 10 20 CECD OC[C@@]12C[C@@H]1CN(Cc1ccc(N3CCCCC3)cc1)C2 783745887 WXPUTUNYBDOFDU-AEFFLSMTSA-N 286.419 2.491 10 20 CECD CCOCCCN[C@H](C)c1cc(OC)ccc1O 19962992 FROAUMJTDIVXHR-LLVKDONJSA-N 253.342 2.478 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H]1C[C@H](N)C1 892578780 WIFZKEXWNKGCHO-MQMHXKEQSA-N 291.395 2.051 10 20 CECD Oc1ccc(F)cc1CN1CCC2(CC1)C[C@H](O)CCO2 897261094 WFHHDZXMNFVENU-CQSZACIVSA-N 295.354 2.037 10 20 CECD CC(C)c1n[nH]c(COC(=O)c2cc(O)cs2)n1 795401882 JTEGEMCGXCZCIK-UHFFFAOYSA-N 267.310 2.052 10 20 CECD CC[C@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(=O)OC 790913728 SHJUFGSVEFVHDX-BXUZGUMPSA-N 292.379 2.129 10 20 CECD C[C@@H]1CCSCCN1Cc1cc2c(cc1O)OC[C@H]2O 790477321 JILOWLYIWHWMBC-QMTHXVAHSA-N 295.404 2.145 10 20 CECD COc1ccc(O)c(CNCCOC2CCSCC2)c1 898440091 NLHXURLATOJYGM-UHFFFAOYSA-N 297.420 2.403 10 20 CECD C[C@H](Nc1cc(N)ncn1)c1ccc(N2CCOCC2)cc1 1318519657 QQGVYTZIHCIFIZ-LBPRGKRZSA-N 299.378 2.069 10 20 CECD CSC[C@@](C)(O)CNCc1cc(Cl)ccc1O 217866438 CPEQPRFNWGTKQK-LBPRGKRZSA-N 275.801 2.249 10 20 CECD C[C@H](N[C@@H](CO)CC(F)(F)F)c1cc(F)ccc1O 717774003 PGUCCXTYXAYOCZ-IONNQARKSA-N 281.249 2.495 10 20 CECD C[C@@H]1O[C@H](C)[C@H](C(=O)N(C)c2ccc(N)cc2)[C@H]1C 87205566 BAPKSDHTGHROAH-KZWBYHQPSA-N 262.353 2.291 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1C[C@H]1F 1354922618 JOHBHWOCZANGLI-UJURSFKZSA-N 255.636 2.173 10 20 CECD CO[C@H](C)CCN[C@@H](C)c1cc(C(=O)O)ccc1O 1599040574 TUBVAKCMDUZLNG-ZJUUUORDSA-N 267.325 2.166 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CCCCNC2=O)c1 36977561 HJHIIHJGSTVFPU-WCQYABFASA-N 262.353 2.020 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCc2n[nH]c(C)n2)c1 273435064 LVZAESWBBXWXJQ-SNVBAGLBSA-N 260.341 2.020 10 20 CECD Cc1nnc(CCNCc2cccc(F)c2O)s1 291003699 BBZJEYIXKVAMHC-UHFFFAOYSA-N 267.329 2.024 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CCO[C@H]2C)c1 300589627 DSJQRQIBLJABMN-SRVKXCTJSA-N 265.353 2.476 10 20 CECD CC[C@H](C)C[C@@H](N)C(=O)N(C)Cc1ccccc1O 400891240 HMOGLDVWEKELDP-WCQYABFASA-N 264.369 2.114 10 20 CECD Nc1ccc(CNC(=O)CC(F)(F)C(F)(F)F)cc1 713275265 ORYIQMQVFBVBTG-UHFFFAOYSA-N 282.212 2.473 10 20 CECD CO[C@@H](C1CC1)[C@@H](C)NC(=O)Nc1ccc(N)cc1 388267479 FTLNCUPGMQUNHJ-NOZJJQNGSA-N 263.341 2.204 10 20 CECD C[C@H](NCCC1(CO)CC1)c1ccc(F)cc1O 396025484 YFYYDFQPWSLAJH-JTQLQIEISA-N 253.317 2.345 10 20 CECD Cc1cccc(O)c1CNC1CN(C(=O)OC(C)(C)C)C1 877075913 SJYMIXMIHHWJHV-UHFFFAOYSA-N 292.379 2.410 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCOC(C)C)c1 103529921 BXQUEFYIDATAOT-LLVKDONJSA-N 281.352 2.393 10 20 CECD Cc1c(C(=O)NCCCSc2nccs2)cnn1C 74136580 OUUXFNGWDMAMFW-UHFFFAOYSA-N 296.421 2.097 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](C)O[C@H](CO)C2)cc1 191535578 FVYXWBZSXCELKF-YOEHRIQHSA-N 292.423 2.114 10 20 CECD CCOc1ccc(O)c(CN2CCO[C@@H](C)[C@@H]2C)c1 93418581 JRWBECZBIGKORI-RYUDHWBXSA-N 265.353 2.400 10 20 CECD Oc1cc2c(cc1CN[C@@H]1CCOC3(CCC3)C1)OCO2 268983700 SFQFMXYUOJMCAB-GFCCVEGCSA-N 291.347 2.312 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCOC1 266189856 YDSFSJJJVOPHJC-WCQYABFASA-N 266.360 2.406 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CCCSC2)c1O 278542647 XPFMMFDETBCOTF-JTQLQIEISA-N 298.364 2.294 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](CCO)C(C)C)c1 273462197 CXCWJHKHCYRTCL-SMDDNHRTSA-N 295.379 2.236 10 20 CECD CO[C@@H]1[C@@H](C)[C@@H](NC(=O)NCc2ccccc2O)C1(C)C 271979425 PVDGHFIMBQMDOU-ZLKJLUDKSA-N 292.379 2.251 10 20 CECD Cc1cccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)n1 273208785 SRWDQBNULYJWLJ-NSHDSACASA-N 286.331 2.162 10 20 CECD CN(C)[C@@H]1CCCN(Cc2cc(F)ccc2O)CC1 375943546 VSQNDTMWWZIMMZ-CQSZACIVSA-N 266.360 2.447 10 20 CECD Cc1cc(Cl)cc([C@H](C)NC[C@]2(O)CCN(C)C2)c1O 808715819 XNQXPRRAQAQMLA-XHDPSFHLSA-N 298.814 2.071 10 20 CECD C[C@H](NCCNC1CC1)c1cc(F)cc(F)c1O 817952371 FAOPWBVSJSNCMZ-QMMMGPOBSA-N 256.296 2.073 10 20 CECD CC(C)[C@@H](Cn1cccn1)NCCc1ccc(N)cc1 817957813 PHFUKABERJCOQN-MRXNPFEDSA-N 272.396 2.322 10 20 CECD CC[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cc(Cl)ccc1O 817977155 CRKANRWQITYMRB-CZXHOFHRSA-N 266.772 2.304 10 20 CECD Oc1c(Cl)cccc1CN1CCC[C@@H](n2ccnn2)C1 822503823 LSVIDWZSZWBAKF-GFCCVEGCSA-N 292.770 2.474 10 20 CECD OC[C@H](C1CC1)[C@H](NCc1cc(F)ccc1O)C1CC1 824846435 SCGIWWTUMNMUOO-GDBMZVCRSA-N 279.355 2.418 10 20 CECD CO[C@](C)(CN(C)c1ccc(OCC(=O)O)cc1)C1CC1 902015940 KNVQZJUAWRDGDL-MRXNPFEDSA-N 293.363 2.401 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@H]3CCCCN3C2=O)cc1C 835073093 KYJJEDBYRVMRGV-CABCVRRESA-N 288.391 2.252 10 20 CECD CCN1C[C@H](N[C@H]2C[C@H](C)c3c(F)ccc(O)c32)CC1=O 834888911 CXPRBYMGZVZZTN-UMNHJUIQSA-N 292.354 2.290 10 20 CECD COc1cc(Cl)cc(CNC[C@H]2CCCNC2)c1O 841033161 NWUVVSNSRPTJHU-JTQLQIEISA-N 284.787 2.143 10 20 CECD COc1cccc([C@H](C)NC[C@@H](OC)C2CC2)c1O 846171455 SUSNBBBUXMYOIB-IINYFYTJSA-N 265.353 2.476 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H]2COC[C@@H]21 839187809 OWRYLMRNJKJFPY-YPMHNXCESA-N 263.337 2.012 10 20 CECD CCCc1ccc(C=C2C(=O)N(C)C(=O)N(C)C2=O)s1 856720798 SHHDMSSUWCOOEP-UHFFFAOYSA-N 292.360 2.134 10 20 CECD COCCC[C@@H](C)C(=O)NCc1cc(C)ccc1O 862757462 VDXMIRRHVXJINX-GFCCVEGCSA-N 265.353 2.380 10 20 CECD CCC1(O)CCN(Cc2c(O)cccc2OC)CC1 769482715 DHWQLTZAKSBSMW-UHFFFAOYSA-N 265.353 2.138 10 20 CECD COCC(=O)NCc1cc(C)n(-c2ccccc2)c1C 863167184 FHIZZNGTQCYYBJ-UHFFFAOYSA-N 272.348 2.357 10 20 CECD CC1(C)CN(Cc2cccc(Br)c2O)CCN1 769191871 REXJDQAJTMSDBD-UHFFFAOYSA-N 299.212 2.339 10 20 CECD CCc1nn(C)c(OC)c1CNCc1ccc(C)cc1O 877135211 TXEZWUGGPYMMPP-UHFFFAOYSA-N 289.379 2.295 10 20 CECD Cc1c[nH]cc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773740852 PSCLKZXHOLFRAB-JTQLQIEISA-N 274.320 2.095 10 20 CECD CN1CCN(C(=O)/C=C/[C@@H]2CCCNC2)c2ccccc21 876731222 GJHBCOZWOXHRJG-VFNNOXKTSA-N 285.391 2.025 10 20 CECD CNC[C@H]1CCCN1Cc1ccc(N2CCCC2)cc1 1118242020 UULVZHSFMSBSHQ-QGZVFWFLSA-N 273.424 2.471 10 20 CECD CC(C)[C@H](N)c1cn(Cc2ccc(N(C)C)cc2)nn1 881270845 CCMYYJIYWRQRAM-HNNXBMFYSA-N 273.384 2.048 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H](C(F)(F)F)C2)c(O)c1O 888015271 IAJBXGWRVXQTPG-MRVPVSSYSA-N 289.253 2.431 10 20 CECD C[C@H](NC[C@@]1(O)CCSC1)c1c(O)cccc1F 886536987 ROODOAFWKJSCFT-ZANVPECISA-N 271.357 2.050 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCN(CC2CC2)C1 882989680 CSJXZZNCQZYBCD-ZDUSSCGKSA-N 282.334 2.244 10 20 CECD CC(C)OC(=O)[C@H](C)NCc1ccc2c(c1)CCCO2 894759173 UKIIPTAFZUFKNR-LBPRGKRZSA-N 277.364 2.441 10 20 CECD Cc1nc([C@@H](C)NCc2cc(F)c(N(C)C)cc2F)n[nH]1 894777823 NIQLKFZQFYQZNU-MRVPVSSYSA-N 295.337 2.308 10 20 CECD C[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C[C@H]1CO 895380532 ZGHYPYHGHLVFFM-KOLCDFICSA-N 271.307 2.121 10 20 CECD C[C@H](O)C[C@H]1CCCN1Cc1cc(F)cc(F)c1O 894035049 XEAGNJIJCUKALV-JOYOIKCWSA-N 271.307 2.406 10 20 CECD COc1ccc(CN[C@@H](CO)CCC(C)C)c(O)c1OC 895584805 MQZBCPCUHDDTML-CYBMUJFWSA-N 297.395 2.296 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCCCO2)c1O 894204211 JQMHTTCAUYWGRN-CYBMUJFWSA-N 265.353 2.368 10 20 CECD COCCC1(C(=O)NCc2ccc(OC)cc2O)CCC1 794388484 VWDBKUXIQMWYRF-UHFFFAOYSA-N 293.363 2.224 10 20 CECD Cc1csc(CCCNC(=O)Cc2ccc(N)cc2)n1 82699890 MCIMXTWDEVTCJE-UHFFFAOYSA-N 289.404 2.325 10 20 CECD Cc1ccc([C@H](C)NCCCCS(C)(=O)=O)c(O)c1 692842056 LDLRKGQUDSZEEH-LBPRGKRZSA-N 285.409 2.176 10 20 CECD CC(C)[C@@H](CC(=O)O)NCc1cc(F)cc(F)c1O 1331982597 LJMDFRUJXIRSBZ-LLVKDONJSA-N 273.279 2.259 10 20 CECD CCN1CCN(C(=O)/C=C/[C@H]2CCCNC2)c2ccccc21 1333335070 AUHZKTVSKLHZMI-BOLDSZDNSA-N 299.418 2.415 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C[C@H]1CCCOC1 774749066 COVUUWQJADDUKF-CYBMUJFWSA-N 276.380 2.378 10 20 CECD Nc1ccc(CNC(=O)NCCC[C@H]2CCCCO2)cc1 1335666341 QAVRVLKSHNRLSZ-OAHLLOKOSA-N 291.395 2.417 10 20 CECD CC[C@@H]1C[C@@H](CC(=O)NCc2cccc(O)c2O)CCO1 1263894555 LMUYGZNNPYIFQE-WCQYABFASA-N 293.363 2.309 10 20 CECD CCN(C)c1ccc(CN[C@@](C)(COC)CC(=O)O)cc1 1605410917 PNGOFRZSNSDJJY-MRXNPFEDSA-N 294.395 2.112 10 20 CECD C[C@@H](NCC1(C)CC1)c1cccc(-c2nn[nH]n2)c1O 1589979585 WUAIQIKRSWIEEC-SECBINFHSA-N 273.340 2.023 10 20 CECD C[C@@H](N[C@H]1COC(C)(C)C1)c1cc(C(=O)O)ccc1O 1593232832 PHHJOKKXHDJKRH-MWLCHTKSSA-N 279.336 2.309 10 20 CECD CCN1CCCc2cc(CNC[C@@H]3C[C@@H]3C(=O)O)ccc21 1776875557 PJFCQCXEOVUBEP-GJZGRUSLSA-N 288.391 2.269 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ccoc2)cc1 163643157 HEHARQBPCSMNNL-UHFFFAOYSA-N 258.321 2.205 10 20 CECD COc1cc(-c2nc3ccncc3[nH]2)cc(O)c1O 154589327 XJPOSIUUHQEOHW-UHFFFAOYSA-N 257.249 2.045 10 20 CECD C[C@H](CNC(=O)Cc1ccc(N)cc1)c1nccs1 235476667 FKGLOGUOXKXSME-SNVBAGLBSA-N 275.377 2.188 10 20 CECD CC(=O)c1cc(F)cc(CN2CCO[C@H](C)[C@H]2C)c1O 156367668 RFURAEGLFNIJKG-MWLCHTKSSA-N 281.327 2.343 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2ccc(F)cc2O)CC1 62747559 RCBNZQCOLBEWOT-SNVBAGLBSA-N 280.343 2.193 10 20 CECD COc1ccc(O)c(CNCCN(C)C2CCCC2)c1 71376792 REDRCXIIKZWBRU-UHFFFAOYSA-N 278.396 2.365 10 20 CECD COc1cc(CNCc2cc(C)ccc2O)ccn1 71409359 HJTWCHWZNWNYGT-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1cc(CNCc2ccccc2O)sn1 399218532 XTDSMLMFBQIORW-UHFFFAOYSA-N 250.323 2.147 10 20 CECD N#Cc1cccc(CNCc2cc([N+](=O)[O-])ccc2O)c1 57598410 ZFFKFVABESENFZ-UHFFFAOYSA-N 283.287 2.462 10 20 CECD CC(=O)NC[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 183379395 GOVINMVGHUJOMD-LBPRGKRZSA-N 296.798 2.394 10 20 CECD C[C@@H](NCCCNC(=O)C1CCC1)c1ccc(F)cc1O 186091629 GFFUKXHGVQBJAA-LLVKDONJSA-N 294.370 2.488 10 20 CECD Cc1cccc(C(=O)NCCc2ccc(O)c(O)c2)c1O 120416975 XALRKRJRZDLNFW-UHFFFAOYSA-N 287.315 2.084 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1nnc2n1CCC2 35255355 BTINXPSOOJDRRR-GFCCVEGCSA-N 285.395 2.141 10 20 CECD O=C(Cc1ccccc1[N+](=O)[O-])NCc1ccccc1O 133777833 PSXFSYAVHVNWMQ-UHFFFAOYSA-N 286.287 2.159 10 20 CECD O=C(Nc1cccc(-c2nnco2)c1)c1cccc(O)c1O 186998802 JSGMPJPCRKBRBR-UHFFFAOYSA-N 297.270 2.400 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCCOCC1CC1 45131329 KCFQMTJJEDXIPF-UHFFFAOYSA-N 292.379 2.350 10 20 CECD COc1cccc(CNC(=O)c2ncc(F)cc2F)c1O 192178482 LXJXSRPJEIHGIW-UHFFFAOYSA-N 294.257 2.004 10 20 CECD CCn1ccnc(NCc2ccc3c(c2)CCCN3C)c1=O 91008946 HWJJRHPCYNMSDN-UHFFFAOYSA-N 298.390 2.258 10 20 CECD COC(=O)[C@H]1CCCCCN1Cc1cc(OC)ccc1O 360021032 VOGVAKSMFAJAHF-CQSZACIVSA-N 293.363 2.318 10 20 CECD COCC[C@H](C)N[C@H](C)c1cc(C(=O)OC)ccc1O 273604653 SVGAFULAYKMZBN-WDEREUQCSA-N 281.352 2.254 10 20 CECD Oc1ccc(-c2ccccc2)cc1CNC[C@]1(O)CCOC1 270003974 SFOKLICDZZISQJ-GOSISDBHSA-N 299.370 2.300 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)CC1CC(O)C1 276777811 PEPWKFGQXKBLSX-UHFFFAOYSA-N 266.360 2.094 10 20 CECD CC(C)[C@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)CCO1 271464225 GNCIECKXRJVTSX-GXTWGEPZSA-N 293.363 2.414 10 20 CECD CC(C)OC[C@H](CO)N(C)Cc1cc(Cl)ccc1O 809768254 GJGVYTODHPIWAS-ZDUSSCGKSA-N 287.787 2.263 10 20 CECD C[C@H](NC(=O)[C@](C)(O)C1CC1)c1ccc(N(C)C)cc1 804568195 XJQKFZAJROEORI-MEDUHNTESA-N 276.380 2.091 10 20 CECD CC[C@@H](C)[C@H](CNCc1cc([N+](=O)[O-])ccc1O)OC 294919787 YOKKWHVIWIFQDD-YGRLFVJLSA-N 282.340 2.451 10 20 CECD C[C@H](N[C@@H]1CCCNCC1)c1cc(F)cc(F)c1O 817969200 RQDGZVJSTWGYBE-GXSJLCMTSA-N 270.323 2.463 10 20 CECD CC(=O)c1cc(C(=O)NCc2ccc(O)c(O)c2)cs1 815836254 WNIBAKPRZBIHSI-UHFFFAOYSA-N 291.328 2.292 10 20 CECD CCOc1ccc(CNCCC(C)(C)C(=O)O)c(O)c1 818629259 YLUGZLVHGZAYII-UHFFFAOYSA-N 281.352 2.381 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C)C[C@@H](CO)C2)cc1C 817413087 SWGOSUCSOFMMOP-SMDDNHRTSA-N 263.381 2.459 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@@]1(C)CO 827699846 MYSLQCFPNLNUAT-HZMBPMFUSA-N 269.772 2.496 10 20 CECD C[C@@H](NC(=O)[C@H]1CCc2cnn(C)c2C1)c1ccccc1O 827946225 AVNXDJDXNZXVAU-NEPJUHHUSA-N 299.374 2.108 10 20 CECD CCOc1ccc(CNCC2(CC)COC2)c(O)c1 825072126 ARIPUTPRZIBLHO-UHFFFAOYSA-N 265.353 2.307 10 20 CECD COc1cccc(O)c1CN[C@H](C1CC1)[C@@H](CO)C1CC1 824846454 SHFFLVDDQXTLDH-WMLDXEAASA-N 291.391 2.288 10 20 CECD CC(C)n1cc([C@H](C)NC(=O)Cc2ccc(N)cc2)cn1 829500898 SQENERZGEDAWSU-LBPRGKRZSA-N 286.379 2.466 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCc2cnn(C)c2C1)c1ccccc1O 827946226 AVNXDJDXNZXVAU-VXGBXAGGSA-N 299.374 2.108 10 20 CECD C[C@@H]1C[C@@H](CCNC(=O)c2c(F)ccc(O)c2O)CCO1 828292760 GZZHDQNEEPUFOF-ZJUUUORDSA-N 297.326 2.172 10 20 CECD CN(C)c1ccc(CN[C@H]2[C@@H]3CC[C@@H](C3)[C@H]2C(=O)O)cc1 901926100 PXVSSDRTSUZZOU-XNISGKROSA-N 288.391 2.342 10 20 CECD O=C(NC1CCN(C2CCC2)CC1)c1cc(O)cs1 839789095 QEMQZXPLGBXGAF-UHFFFAOYSA-N 280.393 2.200 10 20 CECD O=C(Nc1ccc(-n2nccn2)cc1)c1cc(O)cs1 732270367 PBMRNESBFUMOHC-UHFFFAOYSA-N 286.316 2.287 10 20 CECD Cc1cnn(C)c1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 839727693 BXTFEFVRCBUJHG-GFCCVEGCSA-N 286.379 2.286 10 20 CECD CC[C@H](C(=O)O)C(=O)NCc1ccc(N2CCCC2)cc1 911221411 BVJQXBKVEUTDGS-AWEZNQCLSA-N 290.363 2.014 10 20 CECD C[C@H]1C[C@H](NCc2cc(Cl)cc(F)c2O)CCN1 841062835 YHLORBPXJAURFS-GZMMTYOYSA-N 272.751 2.415 10 20 CECD Oc1c(Br)cccc1CNC[C@@H]1CCCCN1 841033619 XWTOPNCMRLHULG-NSHDSACASA-N 299.212 2.386 10 20 CECD CC1(C)CC[C@@H]1NC(=O)NCCc1ccc(N)cc1 841905616 GSWHZNOCQPKXIQ-ZDUSSCGKSA-N 261.369 2.299 10 20 CECD CO[C@@H](CNC(=O)c1c(F)ccc(O)c1O)CC(C)C 842265109 GHOQUVAKYQHBGA-SECBINFHSA-N 285.315 2.028 10 20 CECD c1cnc(NCCCNCc2ccc3c(c2)CCCO3)nc1 921820935 DEGXHPHNULJKJS-UHFFFAOYSA-N 298.390 2.393 10 20 CECD O=C(NCc1ccccc1O)c1cccc2nc(O)oc12 752129294 LTABFPCTUPGPPU-UHFFFAOYSA-N 284.271 2.169 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@H]2O)C[C@H]1CC1(C)C 853628028 LTVMIQXMYVUHIE-BXUZGUMPSA-N 277.364 2.296 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCO[C@H](C)C2)c(O)c1C 756544475 ISDYYOKZPGSMFO-UKRRQHHQSA-N 292.423 2.380 10 20 CECD COC(C)(C)CN(C)C(=O)NCc1ccc(N(C)C)cc1 758499432 QLZQBLDUASCWAG-UHFFFAOYSA-N 293.411 2.319 10 20 CECD C[S@@](=O)Cc1noc(-c2ccc(-n3cccc3)cc2)n1 762118764 FZVOCEPVHBVFSJ-HXUWFJFHSA-N 287.344 2.406 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@@H](C)[C@@H](C)O 1118090652 NHPFTURLSGYTCR-MELADBBJSA-N 264.413 2.351 10 20 CECD CN1CCN(c2ccc(CNCc3cc[nH]c3)cc2)CC1 883283454 GFWVDYLSTSPFIH-UHFFFAOYSA-N 284.407 2.056 10 20 CECD C[C@@]1(NCc2cc([N+](=O)[O-])ccc2O)CCO[C@@H]1C1CC1 784592773 MVSUWGIBYRAKFC-HUUCEWRRSA-N 292.335 2.348 10 20 CECD COC(=O)N1CCC[C@@H](N[C@@H](C)c2ccccc2O)C1 783505590 IEWZPAVOYQOPGF-NWDGAFQWSA-N 278.352 2.274 10 20 CECD COc1ccc(CNc2nc(C)ns2)c(O)c1 795283590 CZCRTOONBWNVEB-UHFFFAOYSA-N 251.311 2.173 10 20 CECD CCC[C@@H](NCc1ccc(C)cc1O)C(=O)OC 83385018 UTPWDNRJXGHLNF-GFCCVEGCSA-N 251.326 2.132 10 20 CECD CC(C)CN(CC(N)=O)Cc1ccc(N2CCCC2)cc1 1319696154 ZTWSFFWVHKVXHR-UHFFFAOYSA-N 289.423 2.230 10 20 CECD O=C(c1cccc(O)c1O)N1CCCC(F)(F)CC1 702841757 VWJCMJLOHKFJQI-UHFFFAOYSA-N 271.263 2.359 10 20 CECD CN1CCN(c2ccc(CNC/C=C/Cl)cc2F)CC1 1352111554 HLEKPPGMPJCRPC-GORDUTHDSA-N 297.805 2.420 10 20 CECD CCn1c(-c2ncc[nH]2)nnc1N(C)Cc1ccccc1O 1352429876 LAYZFPSKVDJLIR-UHFFFAOYSA-N 298.350 2.030 10 20 CECD CN(C)c1cc(F)c(CN(CC(=O)O)CC2CC2)cc1F 1604083769 WEMBYSSASASAGQ-UHFFFAOYSA-N 298.333 2.327 10 20 CECD CC[C@@H](O)CCCN[C@H](C)c1cc(C(=O)O)ccc1O 1605111947 SPYBFQDYIIJWRY-ZYHUDNBSSA-N 281.352 2.292 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCC[C@H]2CNC[C@H]21 1580888790 ZPVASXWECDPEBL-TVQRCGJNSA-N 284.762 2.369 10 20 CECD COc1cc(CN2CC[C@]3(CCOC3)C2)c(O)cc1C 160390926 JVURPNCRTQXCCJ-INIZCTEOSA-N 277.364 2.322 10 20 CECD CC[C@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1 167861129 IMAOZKZQMDTPFO-INIZCTEOSA-N 289.423 2.276 10 20 CECD NC[C@@H]1CCCC[C@H]1NCc1ccc2c(c1)CCO2 841029058 FCLNWCCFORSUBK-LSDHHAIUSA-N 260.381 2.229 10 20 CECD Oc1ccc(Cl)cc1CNCCC1(O)CCC1 397848635 REPOSLPTHAGNES-UHFFFAOYSA-N 255.745 2.440 10 20 CECD COc1ccc(O)c(CN[C@H]2CS[C@H](C)C2)c1 397962968 ISFXLPLUKNATKP-MWLCHTKSSA-N 253.367 2.384 10 20 CECD CCOC(=O)CN(CC)Cc1ccc(N(C)C)cc1 53134658 LBOFWGVVNPPJJR-UHFFFAOYSA-N 264.369 2.138 10 20 CECD C[C@@H](NCC(=O)NCCc1ccccc1)c1ccccc1O 179902236 LAVUKRVMIVSVRB-CQSZACIVSA-N 298.386 2.402 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2C[C@H]2C2CC2)c1 176146933 FATSVMMXPUVWSN-STQMWFEESA-N 261.321 2.063 10 20 CECD CCN(Cc1cc(Br)ccc1O)C[C@@H](C)O 179619008 LIFGMVFNYSNHOB-SECBINFHSA-N 288.185 2.357 10 20 CECD COc1ccc(O)c(CN(C)C[C@H]2CCCC[C@@H]2O)c1 305845604 SMFKHSYVTNXCFY-DOMZBBRYSA-N 279.380 2.384 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@@H](C)N1 125064333 XZEFIMLYNCMWGW-AOOOYVTPSA-N 254.761 2.228 10 20 CECD Cc1ocnc1C(=O)NCc1ccc(N(C)C)c(F)c1 121745857 RTDXGPJROMZSAK-UHFFFAOYSA-N 277.299 2.118 10 20 CECD COc1ccc(O)c(CN2C[C@H](C)OC[C@H]2C)c1 132188970 FASLEKXTSXJBQP-MNOVXSKESA-N 251.326 2.010 10 20 CECD OCCN(Cc1cccnc1)Cc1c(O)cccc1Cl 131796911 OZNWJEONHDWODM-UHFFFAOYSA-N 292.766 2.435 10 20 CECD CC(C)CNC(=O)NC(=O)[C@H](C)Sc1nccs1 48875596 WMTDJJYIBLSCFQ-QMMMGPOBSA-N 287.410 2.106 10 20 CECD COc1ccc(O)c(CNC[C@@]2(C)CCCO2)c1 94798389 CWBCJISLGDQTRQ-CQSZACIVSA-N 251.326 2.060 10 20 CECD CN(C(=O)/C=C\c1ccc(Cl)nc1)c1cnn(C)c1 255180436 SNQNRJDCOAQMHY-XQRVVYSFSA-N 276.727 2.145 10 20 CECD CCOc1cccc(CN2CC[C@H](C)[S@@](=O)CC2)c1O 277725612 SSPXCNRSHWQRSV-YUNKPMOVSA-N 297.420 2.134 10 20 CECD CCOCCOC1CN(Cc2cccc(Cl)c2O)C1 272428438 PVJIZRWZWAWYSY-UHFFFAOYSA-N 285.771 2.283 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c1 280574184 WCOFVRXRIBNDPG-ZQIUZPCESA-N 291.391 2.469 10 20 CECD CCn1cnnc1CN[C@@H](C)c1c(C)cc(C)cc1O 284014101 IKMXXRFCKIRBGN-LBPRGKRZSA-N 274.368 2.471 10 20 CECD CN1CC[C@]2(CCN(Cc3ccc(N(C)C)c(F)c3)C2)C1 292687975 BCWAGAMQYCTSJJ-KRWDZBQOSA-N 291.414 2.419 10 20 CECD CCn1ccnc1C(=O)NCc1c(O)ccc2c1CCCC2 292128682 KZTLRJBZRPYAJR-UHFFFAOYSA-N 299.374 2.417 10 20 CECD C[C@@H]1CC[C@@H](CCC(=O)NCc2ccc(N)cc2)O1 297264644 RZKDCHCVFTZUNH-RISCZKNCSA-N 262.353 2.233 10 20 CECD COCC[C@H]1COCCN1Cc1cccc(Cl)c1O 291162118 CPQMVNFMIBREGG-LBPRGKRZSA-N 285.771 2.283 10 20 CECD C[C@@H](N[C@H]1CCCNCC1)c1cc(F)ccc1O 817968454 JNYDPBIILHZMTD-PWSUYJOCSA-N 252.333 2.324 10 20 CECD CCn1nc(C)c(CNCc2cc(Cl)ccc2O)n1 818221678 SBNCTSHHWFYVBE-UHFFFAOYSA-N 280.759 2.255 10 20 CECD COC(=O)[C@@H](C)NCc1cc(OC)cc(C(C)(C)C)c1O 825748540 DVGMDAXNKPEQBQ-SNVBAGLBSA-N 295.379 2.349 10 20 CECD CC[C@@H](C)[C@@H](C)C(=O)NCc1ccc(O)cc1O 910948814 AXFBHRDVILEVEM-NXEZZACHSA-N 251.326 2.396 10 20 CECD CCN1C[C@H](N[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)CC1=O 834888907 CXPRBYMGZVZZTN-FOGDFJRCSA-N 292.354 2.290 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@H](C2CC2)[C@@H]1C1CC1 836884445 FWGULYOLKMTTJQ-OCCSQVGLSA-N 273.332 2.358 10 20 CECD Cc1cc(CN2CCN(C)C(=O)C2)c(O)c(C(C)(C)C)c1 844729894 WGVISJJPYQPRML-UHFFFAOYSA-N 290.407 2.272 10 20 CECD CN(CCN1CCCCC1)Cc1cc2c(cc1O)OCO2 846115283 UCFKZYWAYYVDGJ-UHFFFAOYSA-N 292.379 2.039 10 20 CECD Cc1cc(N(C)C)ccc1CNC1(CO)CCSCC1 840953290 OFKPQTCEFKRHPJ-UHFFFAOYSA-N 294.464 2.409 10 20 CECD O=C1C[C@H](CNCc2c(O)cccc2Cl)CN1C1CC1 846074990 JUUFLTRPAHFHDE-SNVBAGLBSA-N 294.782 2.146 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCCNCC 841935532 XBCQGUREVHBJNI-UHFFFAOYSA-N 293.411 2.313 10 20 CECD CCN(CC)c1ccc(CN2CCNC[C@H]2C)cc1F 843046913 DRCWDJXWPLBCMD-CYBMUJFWSA-N 279.403 2.466 10 20 CECD N[C@H]1CCC[C@@H](NCc2cccc(Cl)c2O)C1 841058062 OTOMSOCHUOZMON-WDEREUQCSA-N 254.761 2.405 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)Cn2ccnc2)c1O 846138214 AAIFZGMXNGWGCO-VXGBXAGGSA-N 275.352 2.337 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C[C@H](O)C1CC1 840949010 NWOKUHRIBFVDJP-INIZCTEOSA-N 262.397 2.264 10 20 CECD COc1cccc([C@H](C)NCCc2ccn(C)n2)c1O 846162037 FVYTVDZEHXYRKX-NSHDSACASA-N 275.352 2.028 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC(O)(C(C)C)C1 840953753 YPNOACSBCXJMPL-UHFFFAOYSA-N 262.397 2.264 10 20 CECD COc1cccc([C@@H](C)NCCN2CC=CCC2)c1O 846166612 BAIYIIBECZQYIO-CYBMUJFWSA-N 276.380 2.313 10 20 CECD COCCN(CCOC1CC1)c1ccc(OC)c(OC)c1 929996192 QSJHJDADPUNSGH-UHFFFAOYSA-N 295.379 2.336 10 20 CECD O=C(NC[C@@H]1CSCCS1)c1cc(O)cs1 755837000 BOXCUPMRNITHBI-MRVPVSSYSA-N 275.420 2.032 10 20 CECD CCSC1(CNC(=O)NCCc2ccc(N)cc2)CC1 851663476 ABOCXAWXICKPNB-UHFFFAOYSA-N 293.436 2.396 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCO2)c1nnc2n1CCC2 921521331 XMNWYBWWSXDDEH-LBPRGKRZSA-N 298.390 2.400 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@@](C)(O)C2CC2)c1 756767602 VFNMRFMZDITSMP-QLJPJBMISA-N 293.363 2.129 10 20 CECD C[C@H]1C[C@H](NCC2(C)OCCO2)c2c(O)ccc(F)c21 756779901 NSDHUPOEWPAKGD-ONGXEEELSA-N 281.327 2.432 10 20 CECD CCN(CCNC(=O)N[C@H](C)c1ccccc1O)C(C)C 868218264 CAYLZERXWDYPAW-CYBMUJFWSA-N 293.411 2.483 10 20 CECD CCOC(=O)CN(C)Cc1cc(F)c(N(C)C)cc1F 862215615 ACMXBGVKZBCHEQ-UHFFFAOYSA-N 286.322 2.026 10 20 CECD COc1ccc(O)c(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1 866297857 OCHJPWVBZGFQNC-IMJJTQAJSA-N 289.375 2.448 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1C[C@H]1C(F)(F)F 871208380 OMWGSCKXOBQHPI-HBMQMAGWSA-N 287.237 2.178 10 20 CECD COc1cc(CN2CCN(C)C(C)(C)C2)c(O)cc1C 1119330662 JOTAHDQCEVXYHI-UHFFFAOYSA-N 278.396 2.235 10 20 CECD Cc1cccnc1COC(=O)c1ccc(C)c(O)c1O 771936404 GYIBNIJKBWYXRF-UHFFFAOYSA-N 273.288 2.467 10 20 CECD OC[C@@H](Cc1ccc(F)cc1)NCc1cc(F)ccc1O 779100381 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C[C@@H](NCCCCCO)c1ccc(F)c(F)c1O 192925138 XETOFSHYBGULPB-SECBINFHSA-N 259.296 2.484 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCSC2)c1 226381178 PTBOTJBJMXVLCJ-SNVBAGLBSA-N 253.367 2.244 10 20 CECD C[C@H]1CC[C@@H](CCC(=O)NCCc2ccc(N)cc2)O1 237555557 FALJBZHXVAGNLM-WFASDCNBSA-N 276.380 2.275 10 20 CECD Nc1ccc(CCNC(=O)[C@H]2CC2(Cl)Cl)cc1 238128817 CFQUZXSEYIYWDC-SNVBAGLBSA-N 273.163 2.121 10 20 CECD Cc1cocc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 528994180 AJIHJLPTQOHLOE-JTQLQIEISA-N 275.304 2.360 10 20 CECD O=C1Nc2ccccc2C[C@@H]1NCc1ccc2c(c1)CCO2 527799105 JWVCIJCMOSLILW-INIZCTEOSA-N 294.354 2.275 10 20 CECD CCn1nncc1CN[C@@H](C)c1c(C)cc(C)cc1O 527917234 RXKWUEBQHBYBIP-LBPRGKRZSA-N 274.368 2.471 10 20 CECD CCN(CCN[C@@H]1CCc2cccc(O)c21)C1CC1 297877848 UWWXWLYGHKJGBE-CQSZACIVSA-N 260.381 2.453 10 20 CECD CCO[C@@H](C)c1noc(CN(C)c2ccc(N)cc2)n1 863557945 YFSZLSCQHLZYDW-JTQLQIEISA-N 276.340 2.386 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCCSC2)c1O 267281477 HAUFXHBESPSMSA-NSHDSACASA-N 296.392 2.096 10 20 CECD 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10 20 CECD COc1ccc(O)c([C@H](C)NCCc2cnc(C)cn2)c1 834908370 JEYTXBPDYROBQM-LBPRGKRZSA-N 287.363 2.393 10 20 CECD C[C@@H]1CC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)[C@H](C)C1 841038310 UQMTXVHGHNVUIA-JTNHKYCSSA-N 289.379 2.148 10 20 CECD C[C@H](NCC1(CO)CC1)c1ccc(Cl)cc1O 841748892 BSHCLXXHLKIQPW-VIFPVBQESA-N 255.745 2.469 10 20 CECD COc1cccc([C@H](C)N[C@H](CO)CC(F)F)c1O 846164129 FPEPPQLHZAGETC-IUCAKERBSA-N 275.295 2.068 10 20 CECD C[C@@H]1C[C@@H](N[C@@H](CO)CCF)c2c(O)ccc(F)c21 846208769 KYMFSHUSDDSEOP-FXPVBKGRSA-N 271.307 2.390 10 20 CECD CCN1C[C@H](CNCc2c(O)cccc2Cl)CC1=O 846094897 UYXPGCANXPXUFD-JTQLQIEISA-N 282.771 2.004 10 20 CECD C[C@@H](OCC1CC1)C(=O)NCc1cc(Cl)ccc1O 846473081 OGLOKSPTBHIQNE-SECBINFHSA-N 283.755 2.477 10 20 CECD C[C@@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(Cl)cc1O 841752975 DHIWAEPOJAKDHW-WCABBAIRSA-N 282.771 2.350 10 20 CECD Nc1ccc(CCNC(=O)c2ccc3c(c2)CCOC3)cc1 851632925 YMJAGPZPDMNOCA-UHFFFAOYSA-N 296.370 2.314 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](N3CCOC3=O)C2)c1 853541101 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C[C@H](NC[C@H]1CCCN1C)c1c(O)cccc1F 886513189 WDPZIKQVOBIMKG-WDEREUQCSA-N 252.333 2.276 10 20 CECD CCc1ncoc1C(=O)N(C)Cc1ccccc1O 1120706884 FIEUBCZIQVVECD-UHFFFAOYSA-N 260.293 2.215 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCc2sccc2C1 789946657 LJPBEGYWGCZRJX-UHFFFAOYSA-N 293.319 2.497 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](N)CC1CC1 884113139 HGUGHTSCSXVRSD-CQSZACIVSA-N 276.380 2.258 10 20 CECD COc1ccncc1CNCc1cc(C)cc(OC)c1O 894852480 SWLVXYBKTRMXTD-UHFFFAOYSA-N 288.347 2.403 10 20 CECD CCCN(Cc1cn(CC)nn1)Cc1ccccc1O 884003551 YYRAKMJEAUAEES-UHFFFAOYSA-N 274.368 2.416 10 20 CECD COc1cc(C)cc(CNC(C)(C)CN(C)C)c1O 894970294 YATKVKGHGFPKJH-UHFFFAOYSA-N 266.385 2.139 10 20 CECD OC[C@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1204320447 ZICMZJRCJICQKE-INIZCTEOSA-N 274.408 2.491 10 20 CECD CC[C@@H](C)[C@@H](OC)C(=O)N(C)Cc1ccccc1O 793656810 MRBGORLDAWYZNJ-BXUZGUMPSA-N 265.353 2.412 10 20 CECD CC[C@](C)(CO)NCc1ccc(Br)cc1O 701016557 WISMKHWSZKGNOG-GFCCVEGCSA-N 288.185 2.405 10 20 CECD CC(C)[C@@](C)(O)CNCc1cc(F)cc(F)c1O 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CCC[C@@](C)(N)C(=O)NCCCSc1nccs1 829527675 CAKPNCGPIZUEQP-GFCCVEGCSA-N 287.454 2.259 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@@H]1CCc2cccc(O)c21 903342013 AREQRFXZVABMNJ-LSDHHAIUSA-N 290.407 2.080 10 20 CECD CC[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@H](C)O1 732301706 GTDGNVRAKDBQDW-WCBMZHEXSA-N 255.339 2.093 10 20 CECD Cc1nc(CCC(=O)NCCc2ccc(N)cc2)cs1 832659172 QNUKEMBCJUDFKY-UHFFFAOYSA-N 289.404 2.325 10 20 CECD NC[C@@H]1CC[C@H](NCc2cccc(Br)c2O)C1 841085052 SVYIYKRXSMRIKO-KOLCDFICSA-N 299.212 2.372 10 20 CECD CC1(C)CNCCN1Cc1c(O)ccc(Cl)c1F 843054221 GXPVMRYNIXISGJ-UHFFFAOYSA-N 272.751 2.369 10 20 CECD CCOc1ccc(CN(C)C2(CN)CCC2)c(O)c1 843125446 WQTLYRJXAPJEOQ-UHFFFAOYSA-N 264.369 2.104 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCn1ccnc1 840928551 YGVJSIHBQOQNEF-UHFFFAOYSA-N 272.396 2.437 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)[C@H]2CN(C)CCO2)c1 756757754 DGCXRHKQJOHDKG-WOSRLPQWSA-N 278.396 2.070 10 20 CECD O=C(NCc1ccccc1O)c1nc[nH]c1C(F)(F)F 857472495 VNPOJXGIPNBINF-UHFFFAOYSA-N 285.225 2.064 10 20 CECD CCCNC(=O)CCN[C@H](C)c1cc(F)cc(F)c1O 756459477 NQHRGLWBCHWEPV-SECBINFHSA-N 286.322 2.237 10 20 CECD COc1ccc(O)c(CNCc2nc(C)c(C)[nH]2)c1 850137592 SQWVTDOGQATQHP-UHFFFAOYSA-N 261.325 2.031 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@@H](O)C1CC1 854374251 QZIWWVAEEWKPGP-HNNXBMFYSA-N 277.364 2.292 10 20 CECD C[C@H]1C[C@@H](NCCCOCCO)c2c(O)ccc(F)c21 757637681 MHYVOTFSJPCASI-CMPLNLGQSA-N 283.343 2.068 10 20 CECD CN(C)c1ccc(CNCCC(=O)N2CCCCC2)cc1 69715499 LZQGMJBQSPJSTB-UHFFFAOYSA-N 289.423 2.245 10 20 CECD CC[C@H](NC[C@@](C)(O)COC)c1ccc(N(C)C)cc1 765934134 AEJSOKCIPLFTOE-JKSUJKDBSA-N 280.412 2.191 10 20 CECD CC[C@H](Sc1ncc(C(=O)OC)s1)C(C)=O 871672928 BTWWDKPTZMHETH-ZETCQYMHSA-N 259.352 2.389 10 20 CECD C[C@@H](NC(=O)[C@@H]1CNCc2ccccc21)c1ccccc1O 870988278 LEGXVUSLORCYRP-MLGOLLRUSA-N 296.370 2.456 10 20 CECD OCC[C@H]1CCCN(Cc2cc(F)ccc2O)C1 779014876 QSXFAPDSZIDWIP-LLVKDONJSA-N 253.317 2.126 10 20 CECD CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@@H](C)[S@@]1=O 877517404 NQGZCDWXDMSTPB-TVZGQMOCSA-N 281.421 2.432 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H](C(=O)NC)C2)cc1 773756386 KTZADTBTRSJIJN-OAHLLOKOSA-N 289.423 2.101 10 20 CECD Cc1ccc(C(=O)N2CCc3ncsc3C2)c(O)c1O 783844096 GOFZVJNDSBOTNZ-UHFFFAOYSA-N 290.344 2.061 10 20 CECD Cc1ccc(C(=O)NC[C@H]2CC2(Cl)Cl)c(O)c1O 780879630 RSHMQEFVGLQROV-SSDOTTSWSA-N 290.146 2.330 10 20 CECD COc1ccc(CN2C[C@H](C)[C@@H](C)C2)c(O)c1OC 892067883 BRILBVAOYQUEFH-QWRGUYRKSA-N 265.353 2.497 10 20 CECD CCOc1ccc(CNC[C@H]2CC[C@H](O)C2)c(O)c1 788971053 ANOFTWQARCLTTG-AAEUAGOBSA-N 265.353 2.042 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCN2C(C)(C)C)c1 899133805 QHPYCDUHMBXEGZ-ZDUSSCGKSA-N 276.380 2.190 10 20 CECD CC1(NCc2ccc(N3CCOCC3)c(F)c2)CC1 1319832325 RAXYBRVIMUZXNP-UHFFFAOYSA-N 264.344 2.304 10 20 CECD C[C@H](CCS(C)(=O)=O)N[C@H](C)c1cc(F)ccc1O 185791842 AJFVKUYWZVEZAR-NXEZZACHSA-N 289.372 2.005 10 20 CECD CO[C@@H](C)CNCc1cccc(Br)c1O 191202249 UOUKESUWWMSXGA-QMMMGPOBSA-N 274.158 2.279 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCCC12OCCO2 708393843 KFVYHISKMMYICF-LBPRGKRZSA-N 285.290 2.056 10 20 CECD COc1cc(C)cc(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)c1O 1333847602 ROPUDTUMNKDWJO-UBHSHLNASA-N 277.364 2.054 10 20 CECD Oc1ccc(-c2csc([C@@H]3CCNC3)n2)cc1O 1331705803 JGRDJCBQEOHXMI-SECBINFHSA-N 262.334 2.298 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNCC(C)C 1261495003 NKJIECYVZMADPC-UHFFFAOYSA-N 291.439 2.347 10 20 CECD CC(C)C[C@@](C)(CN)C(=O)N(C)Cc1ccccc1O 1521254650 OFOQCKUAJBWIKP-INIZCTEOSA-N 278.396 2.362 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@@H](C(=O)O)C2)c(Cl)c1 1594326600 HFZCSVVQCKPXBD-DTORHVGOSA-N 269.728 2.307 10 20 CECD CC(C)C[C@@H](O)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1591183720 LZCZXJIZZQJARR-CMPLNLGQSA-N 281.352 2.148 10 20 CECD O=C(Cc1ccc(F)cc1)NCc1ccc(O)c(O)c1 158932429 SPEBRAOCSVTCMQ-UHFFFAOYSA-N 275.279 2.096 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccncc1 152988090 VKNUUIWWSJFPCT-JTQLQIEISA-N 287.319 2.246 10 20 CECD CC(C)(C)c1cc(C(=O)NCc2ccc(O)c(O)c2)[nH]n1 159093749 WYFAMRUFZYDBCX-UHFFFAOYSA-N 289.335 2.048 10 20 CECD CC1(C)OCC(NCc2ccc3c(c2)CCCO3)CO1 921994516 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CECD CCOc1ccc(CN2CCC[C@@H]([C@@H](C)O)C2)c(O)c1 768518949 JRIJIKBADOPYFK-CHWSQXEVSA-N 279.380 2.384 10 20 CECD Cc1ccc(CN[C@H]2COc3ccccc3[C@@H]2O)c(O)c1 877537396 KPTHPTKAZLGSIJ-YOEHRIQHSA-N 285.343 2.285 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CC[C@@H](N)CC2)cc1F 870875696 HQTRXICQWOBULK-BETUJISGSA-N 293.386 2.025 10 20 CECD Cc1csc(=O)n1CCN[C@H](C)c1ccccc1O 879647648 HFLCFMXWBGPTPR-LLVKDONJSA-N 278.377 2.275 10 20 CECD CCN(C)c1ccc(CN(C)CC(C)(C)O)cc1 773750655 DSHJCKOFPAUUFP-UHFFFAOYSA-N 250.386 2.345 10 20 CECD Cc1cccc(O)c1CNc1cnn(CCN(C)C)c1 877006871 URDIMEHZVSNZEU-UHFFFAOYSA-N 274.368 2.071 10 20 CECD Cc1cccc(O)c1CNCCCNC(=O)C1CCC1 877082068 MSPVLFNUOBXMTF-UHFFFAOYSA-N 276.380 2.097 10 20 CECD CC(C)C[C@@H]1CN(C)CCN1C(=O)c1cc(O)cs1 886597971 QQNDNTJTUPLAIU-LLVKDONJSA-N 282.409 2.256 10 20 CECD CCS(=O)(=O)CCCN[C@H](C)c1c(O)cccc1F 886626622 HHGCKBQMJNGEHJ-SNVBAGLBSA-N 289.372 2.007 10 20 CECD CCOCC(C)(C)NCc1ccc(OC)c(OC)c1O 894616929 VENBLQGQWDJYDP-UHFFFAOYSA-N 283.368 2.314 10 20 CECD CCO[C@H]1CCCN(Cc2ccc(OC)c(OC)c2O)C1 891400376 BHIYCGSPWVPBMT-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD CCCCOCCNC(=O)Nc1ccc(N)cc1 45110164 KMYYOSRDQIBOQM-UHFFFAOYSA-N 251.330 2.207 10 20 CECD COc1ccc(O)c(CNC[C@H]2CSCCS2)c1 164753509 OASACGZICDSUQA-LBPRGKRZSA-N 285.434 2.339 10 20 CECD Cc1ncc(C(=O)NCCc2ccc(N)cc2)c(C2CC2)n1 1326132248 GHZVSKIPLXEAOP-UHFFFAOYSA-N 296.374 2.217 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)CC1CC(O)C1 1321701304 KRYRJEJXZGSTGX-UHFFFAOYSA-N 274.408 2.490 10 20 CECD Cc1nc(C)c(CNC(=O)Cc2ccc(N)cc2)s1 82284216 MNDNMSMWMZVXGB-UHFFFAOYSA-N 275.377 2.201 10 20 CECD C/C=C\C(=O)N1CCN(c2ccc(OCC)cc2)CC1 1333100175 KJCDBCNFUMJVNN-HYXAFXHYSA-N 274.364 2.310 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](OC)CC1 783602136 APJYNYVCFUYQKI-LBPRGKRZSA-N 265.353 2.402 10 20 CECD CON(C)C(=O)[C@H](C)N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1351353561 RQEZRTWEWXDNLC-SDDRHHMPSA-N 292.379 2.247 10 20 CECD Cc1ccc(CN2CCC[C@H](C)[C@@H]2C(=O)O)c(O)c1 1605273099 GPDJDVLXUOGEOC-SMDDNHRTSA-N 263.337 2.386 10 20 CECD O=C(O)CC1(C(=O)NCc2cccc(Cl)c2O)CCC1 1606072061 ZZHZZMFYNWQBRL-UHFFFAOYSA-N 297.738 2.307 10 20 CECD NC1(C(=O)NCc2cccc(Cl)c2O)CC2(CCC2)C1 1580139406 RJRCHYSDZRHFOY-UHFFFAOYSA-N 294.782 2.323 10 20 CECD CN1C(=O)c2ccccc2N[C@@H]1c1cccc(O)c1O 15249442 BRKWLQUCFGRUCV-AWEZNQCLSA-N 270.288 2.294 10 20 CECD NC(=O)[C@H]1CCCN1Cc1cc(Cl)cc(Cl)c1O 160338188 NIGPPLUETDAKMF-SNVBAGLBSA-N 289.162 2.149 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2C[C@H]2c2cccnc2)cc1 152541465 FAACZYRQTFQZMK-JKSUJKDBSA-N 281.359 2.126 10 20 CECD CC[C@H](NCCNC(=O)c1ccco1)c1ccccc1O 154982350 MYFVIRLMQYLYCW-ZDUSSCGKSA-N 288.347 2.456 10 20 CECD Cc1cccc(C(=O)C(=O)c2ccc3ncccc3n2)n1 1857791330 NHZVTUKGXPSXKZ-UHFFFAOYSA-N 277.283 2.399 10 20 CECD Cc1nc(CN[C@@H](C)c2ccc(N(C)C)cc2)no1 229595933 NFABVVGZWAVFOQ-JTQLQIEISA-N 260.341 2.295 10 20 CECD CC(C)(C)c1cc(NC(=O)c2cccc(O)c2O)[nH]n1 126648896 PNNBXTPCFAVONH-UHFFFAOYSA-N 275.308 2.371 10 20 CECD CSCCCCC(=O)NCCc1ccc(N)cc1 152501886 WCUPMWYHYBMUKX-UHFFFAOYSA-N 266.410 2.461 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H](N)c1ccccc1 37823748 KEMFMWLUOHXEAY-OAHLLOKOSA-N 270.332 2.051 10 20 CECD COc1ccc(O)c(CNC[C@@H](C)N2CCCCC2)c1 38028711 PUKUQIAQMDNBRZ-CYBMUJFWSA-N 278.396 2.365 10 20 CECD CCOc1cccc(CN[C@@H]2CCCC[C@H]2O)c1O 51991430 PUKIAZBQGOQGEN-CHWSQXEVSA-N 265.353 2.184 10 20 CECD C[C@@H](NCCC1(CO)CC1)c1cc(F)ccc1O 395922077 DFBPQLQMDDFRGR-SNVBAGLBSA-N 253.317 2.345 10 20 CECD N[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 178710321 CGSJOBZRYVPEEQ-JKSUJKDBSA-N 287.407 2.030 10 20 CECD Cc1[nH]ccc1C(=O)N1CCOc2cc(N(C)C)ccc21 177658777 RJOYAZVAFAZCQX-UHFFFAOYSA-N 285.347 2.428 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)CC(C)C 179559663 FZDPAILVPPZCBP-UHFFFAOYSA-N 265.353 2.413 10 20 CECD O=C(NCc1ccccc1O)c1ccc(N2CCCC2)nc1 66081231 RFCLLYPRFQOGCR-UHFFFAOYSA-N 297.358 2.317 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCCOCC1CC1 180603697 TXOGYTWOSCWQIX-FNORWQNLSA-N 291.347 2.044 10 20 CECD CN1CCc2cc(/C=C/c3n[nH]cc3C=O)ccc21 130882614 OFBZJGGMUWXDKP-DUXPYHPUSA-N 253.305 2.385 10 20 CECD CCCN1CCC(NCc2cc3c(cc2O)OCO3)CC1 42879552 BLKGQXZLWFTSOG-UHFFFAOYSA-N 292.379 2.085 10 20 CECD C[C@H]1C[C@H](N)CCN1Cc1cc(Br)ccc1O 220332809 JYSQSSXJRKDBQP-JOYOIKCWSA-N 299.212 2.466 10 20 CECD C[C@H]1C[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)CCN1 235677342 OGBWCCIRLOTISY-ZFWWWQNUSA-N 289.423 2.099 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc(OC)c(C)c2)[C@H]1OC 274846223 AGZSXSAASOBENG-NUEKZKHPSA-N 279.380 2.286 10 20 CECD CC[C@@H](N[C@H](CCO)COC)c1ccc(C)cc1O 280018457 HECPOCHVENVTDQ-TZMCWYRMSA-N 267.369 2.139 10 20 CECD Cc1ccc(C(=O)N2CCC(CF)CC2)c(O)c1O 297011123 SIAALVYWWLGWDG-UHFFFAOYSA-N 267.300 2.228 10 20 CECD COc1ccc(O)c(CNCC[C@]2(O)C[C@H]3CC[C@H]2C3)c1 814171220 LFPDNLPJHPTLAL-JDFRZJQESA-N 291.391 2.432 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@@H](C)S(=O)(=O)[C@H](C)C2)c1 811798360 MMCIUQKJTFLBEI-CHWSQXEVSA-N 297.420 2.016 10 20 CECD C[C@H](N[C@@H]1CC[C@@H](CN)C1)c1cc([N+](=O)[O-])ccc1O 817981678 MIJGVPSZPHRYOB-HBNTYKKESA-N 279.340 2.078 10 20 CECD Cc1cc(O)c(CN(C)Cc2cn(C)nn2)cc1Cl 827305765 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CC(=O)c1cc(F)cc(CN2CCOC(C)(C)C2)c1O 37328958 KKLWUDBBIKJFAJ-UHFFFAOYSA-N 281.327 2.345 10 20 CECD O[C@H](CNCc1ccc2c(c1)CCO2)c1ccco1 78820796 VUBPAJHMHKHQAS-CYBMUJFWSA-N 259.305 2.038 10 20 CECD NC[C@H]1CN(Cc2ccccc2O)CC[C@H]1C(F)(F)F 704353288 YFWLSSSFQXNQQY-NWDGAFQWSA-N 288.313 2.351 10 20 CECD CC(C)C[C@H](O)CNCc1cc(F)cc(F)c1O 708452727 AICRETRASUEQQN-NSHDSACASA-N 259.296 2.167 10 20 CECD CCCN1CC[C@H](CNCc2cc(F)cc(F)c2O)C1 708516471 IRYOSBRJIBZBLR-LLVKDONJSA-N 284.350 2.492 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2CC=CCC2)c(O)c1O 177676651 CHGIDXCFCMWKHG-LLVKDONJSA-N 261.321 2.492 10 20 CECD COc1ccc(N2CCN(CCc3cccnc3)CC2)cc1 172152467 VKVVOHZXZZAOMC-UHFFFAOYSA-N 297.402 2.455 10 20 CECD CC(C)(C)c1cnc(SCCCS(N)(=O)=O)s1 177131074 BNSKWWOVJZZTHX-UHFFFAOYSA-N 294.467 2.211 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H](OC)C2)c1O 178886439 GMAKEAQJXHLLHM-CYBMUJFWSA-N 265.353 2.320 10 20 CECD COc1cccc(CNC(=O)CC[C@@H]2CC[C@@H](C)O2)c1O 175928800 IXXXBYKQFYVSPH-YPMHNXCESA-N 293.363 2.365 10 20 CECD Cc1cc(Cl)cc(CN2CCC[C@H]2C(=O)N(C)C)c1O 179637777 KISJMOUQZHSGOR-ZDUSSCGKSA-N 296.798 2.407 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2cc(C)nc3ncnn23)c1 301199396 OVMAZBMSVCDWLO-SNVBAGLBSA-N 299.334 2.320 10 20 CECD C[C@H](N[C@@H]1C[C@H](O)C1(C)C)c1ccc(F)cc1O 128115993 FZTFEFUXECSAGL-CKLFPEKLSA-N 253.317 2.341 10 20 CECD COc1ccc(O)c(CNCC2(OC)CCC2)c1 180792631 GOZUOCSHHAWKRB-UHFFFAOYSA-N 251.326 2.060 10 20 CECD CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@H]1CCCO1 78308817 PVRAEDSPPXCQFW-MRXNPFEDSA-N 276.380 2.280 10 20 CECD CC(C)c1nnc(NC(=O)c2cccc(O)c2O)s1 186865534 GXMAWDFZNVTYSV-UHFFFAOYSA-N 279.321 2.325 10 20 CECD COc1ccc(CN[C@@H](C)CC[S@](C)=O)cc1C 125440391 KJKXJVQYPUQIOI-KPZWWZAWSA-N 269.410 2.250 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CCCS1 75220609 JUNHFTAJHRVGJE-CQSZACIVSA-N 292.404 2.374 10 20 CECD COC(=O)c1cc(/C=C2/C(=O)Nc3ccc(F)cc32)c[nH]1 131226259 LNCNQOWOQABQDR-NYYWCZLTSA-N 286.262 2.433 10 20 CECD COc1ccc(O)c(CN2CC[C@H](N3CCCCC3)C2)c1 134121453 OLTLCDOUODBJIU-HNNXBMFYSA-N 290.407 2.461 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H](C)S(=O)(=O)CC2)c1 191317099 ZEEQWKDWDSASMN-CYBMUJFWSA-N 297.420 2.018 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)NC[C@@H](C)N)c1C 194926231 ZHTFJDIXOPUENF-GFCCVEGCSA-N 285.391 2.480 10 20 CECD Cc1c(CNC(=O)c2cnccn2)n(C)c2ccccc12 348699409 MEFODIHAHSNJMC-UHFFFAOYSA-N 280.331 2.207 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@@H]1CCc2cccc(O)c21 295826682 DRWLZKHQSCXZQI-DGCLKSJQSA-N 276.380 2.274 10 20 CECD Oc1c(F)cc(Cl)cc1CNCC12CC(CO1)C2 529663853 UOUHRRQXMAMCNA-UHFFFAOYSA-N 271.719 2.453 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@]2(C)CCNC2)cc1 269252605 PZJLBNQUWMCJNF-KRWDZBQOSA-N 289.423 2.149 10 20 CECD CCn1nc(C)c(S(=O)(=O)Nc2ccc(O)cc2)c1C 271940029 LIPGODOKBJVFKJ-UHFFFAOYSA-N 295.364 2.026 10 20 CECD CC(C)(C)N1C[C@H](N[C@@H]2CCc3cccc(O)c32)CC1=O 296275268 CARHCBOTSOTCSF-CHWSQXEVSA-N 288.391 2.369 10 20 CECD C[C@H]1C[C@@H](N[C@@H]2CCCNC2)c2c(O)ccc(F)c21 817969572 XMPJMWMKSLIYNG-HOSYDEDBSA-N 264.344 2.421 10 20 CECD O=C(CCc1cscn1)NCc1ccccc1O 725895531 IVTCEPNLJKJXLN-UHFFFAOYSA-N 262.334 2.098 10 20 CECD CC[C@@H]1NCC[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 825942565 CWTVZOOOCNSROC-HOTGVXAUSA-N 289.423 2.099 10 20 CECD CCCN[C@@H](C)C(=O)NCCCSc1nccs1 829527740 DPBREMRDWLTKPA-JTQLQIEISA-N 287.454 2.130 10 20 CECD C[C@H]1C[C@@H](C)O[C@@H]1C(=O)N[C@H](C)c1ccccc1O 827946497 KCFWZQHIKXWTBY-OXIWPEFWSA-N 263.337 2.383 10 20 CECD Oc1ccc(Br)cc1CN[C@@H]1CCC[C@H]1O 164233225 BWSMVPALEOBBMB-ZYHUDNBSSA-N 286.169 2.158 10 20 CECD CC(C)[C@@H](C)C(=O)NCc1ccc(N2CCOCC2)cc1 733140029 YLOFCDLEZILHCB-CQSZACIVSA-N 290.407 2.432 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cnccn1 839914515 UXYIVQXFEVHHAT-CYBMUJFWSA-N 298.390 2.212 10 20 CECD O=C(O)CCCc1nc(CSc2nccs2)no1 739701495 CVSWSMBMRDZTLA-UHFFFAOYSA-N 285.350 2.226 10 20 CECD C[C@H](Cc1ccncc1)NC(=O)NCCc1ccc(N)cc1 841852671 OAMOKSVLDLELTF-CYBMUJFWSA-N 298.390 2.137 10 20 CECD CCN(C[C@H]1CCCO1)C(=O)NCCc1ccc(N)cc1 841956541 GTAVDSFZMVFILY-OAHLLOKOSA-N 291.395 2.022 10 20 CECD CO[C@@H](CN(C)c1ccc(OCC(=O)O)cc1)C1CC1 846280476 XPIOLIVKJDPVCU-AWEZNQCLSA-N 279.336 2.011 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1cc(OC)c(OC)cc1O 843426819 BKEJVTOAEPWHCS-DGCLKSJQSA-N 297.395 2.296 10 20 CECD CC[C@H](SC)C(=O)NCCc1ccc(N)cc1 844164951 VLWWFFJQMROLND-LBPRGKRZSA-N 252.383 2.069 10 20 CECD O=C(NCCCSc1nccs1)O[C@@H]1CCOC1 914105793 NKUDCZFYCUIISH-SECBINFHSA-N 288.394 2.140 10 20 CECD CC[C@H](C)C[C@H](CO)NCc1cccc(OC)c1O 842754337 NWJAWHQBIGVKRI-WCQYABFASA-N 267.369 2.288 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CC[C@@H]2NCC[C@H]2C1 843126605 LPYVMLNABLLSQC-CABZTGNLSA-N 284.762 2.369 10 20 CECD CCOc1ccc(CN2CCC[C@H](CNC)C2)c(O)c1 843044596 KXFPNVPMRWPIMZ-CYBMUJFWSA-N 278.396 2.222 10 20 CECD Cc1ccc(C(=O)OCC[C@H]2CCCCN2C)c(O)c1O 840218544 BENLKRHRSSPGJT-GFCCVEGCSA-N 293.363 2.437 10 20 CECD CN1CCCc2cc(CN[C@@H]3CCNC3(C)C)ccc21 925531746 NEGGSCYXPIYJMI-MRXNPFEDSA-N 273.424 2.299 10 20 CECD Cc1cc(O)c(CN2CC[C@@H]3NC(=O)CC[C@H]3C2)cc1C 853554624 BPBZBEDQWRNISE-ZFWWWQNUSA-N 288.391 2.110 10 20 CECD Cc1cc(O)nc(/C=C\c2ccc(N3CCOCC3)cc2)n1 752880169 HLPQLDTWDDUISW-DAXSKMNVSA-N 297.358 2.498 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](O)C2CCOCC2)c(O)c1 756738304 NUMAFTSXYBUJDH-MLGOLLRUSA-N 279.380 2.139 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1cccc(O)n1 933400929 CWNRVMSHQAGGPU-UHFFFAOYSA-N 271.364 2.485 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@H](C)c1ccc(F)cc1O 756775753 SMZXVZOWZUCGDC-WQAKAFBOSA-N 280.343 2.097 10 20 CECD Cc1cc(CN2C(=O)CNC2=O)c(C)n1-c1ccccc1 863531735 BWSDATCRTGEQAV-UHFFFAOYSA-N 283.331 2.146 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3COC[C@H]3C1)CCCC2 872785931 LKAGOXUXZRWSLW-IYBDPMFKSA-N 273.376 2.349 10 20 CECD CCc1cc(O)nc(CN[C@H](C)c2ccccc2O)n1 879648810 AMRKPXSOSSMXSA-SNVBAGLBSA-N 273.336 2.301 10 20 CECD Cc1cccc(O)c1CN(CCCO)Cc1ccccn1 877527164 POSNLTZEZOXWFY-UHFFFAOYSA-N 286.375 2.480 10 20 CECD CCCN(C)Cc1ccc(N2CCC(O)CC2)cc1 876564377 RUWXRVKPHFJFCI-UHFFFAOYSA-N 262.397 2.490 10 20 CECD CC[C@H](NCCN1CCNC1=O)c1cc(Cl)ccc1O 886745340 UVBQABZIYQHLJJ-LBPRGKRZSA-N 297.786 2.112 10 20 CECD C[C@H](O)C[C@H](C)NCc1cc(Cl)cc(F)c1O 783603311 YEQAVMHVYKIVMC-YUMQZZPRSA-N 261.724 2.434 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCCCS2)c1 783590690 XRCVUNJWZJTPQV-ZDUSSCGKSA-N 281.377 2.303 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1O[C@@H](C)C[C@@H]1C 799938023 NNXPWRIDYNYKKA-HEHGZKQESA-N 290.407 2.491 10 20 CECD O=C(O)[C@H]1CCCN1Cc1cc(Cl)ccc1O 86725930 YAYHNFHDDJWDQK-SNVBAGLBSA-N 255.701 2.095 10 20 CECD C[C@@H](C[S@](C)=O)NCc1ccc(N2CCCC2)cc1 168149595 DJMOGJSPFKJJJI-ORAYPTAESA-N 280.437 2.143 10 20 CECD Oc1cnc(NCc2ccc(N3CCCC3)cc2)nc1 1515350329 CGFXXJHFFMWRGC-UHFFFAOYSA-N 270.336 2.395 10 20 CECD O=C(O)[C@H](NCc1ccc(N2CCCC2)cc1)C1CC1 1601674455 HJDNVZNVQHRVDM-OAHLLOKOSA-N 274.364 2.240 10 20 CECD COc1ccc(O)c(CN2CCCN3CCC[C@H]3C2)c1 250383085 MTPZZSPEYINCCM-AWEZNQCLSA-N 276.380 2.071 10 20 CECD C[C@H](N[C@H](C)CC[S@@](C)=O)c1ccccc1O 167467524 MTLSXTRHMBKFLG-RLFDGXBXSA-N 255.383 2.200 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)N(C)C)cc1 159827592 BSJFQCINOBEYHH-UHFFFAOYSA-N 277.412 2.053 10 20 CECD N[C@@H]1CCCCC[C@@H]1NCc1ccc2c(c1)CCO2 817901280 AQKZOKVDZOIHIH-CABCVRRESA-N 260.381 2.371 10 20 CECD CCC(CC)[C@@H](O)CNCc1cc(OC)ccc1O 224831742 HMJHOKVHYWZLEJ-HNNXBMFYSA-N 267.369 2.288 10 20 CECD COc1ccc(O)c([C@H](C)NCC2CCN(C)CC2)c1 44515556 WCPUSSZWYYQDLO-LBPRGKRZSA-N 278.396 2.393 10 20 CECD CCOCCCC(=O)N(C)Cc1ccccc1O 80133743 PORRTSWGMNUFBD-UHFFFAOYSA-N 251.326 2.167 10 20 CECD CC(C)N1CC[C@H](CNCc2cc(F)cc(F)c2O)C1 708559293 ODOUXTNIOFZLGV-LLVKDONJSA-N 284.350 2.490 10 20 CECD C[C@H]1NCCN(Cc2cc(Br)ccc2O)[C@@H]1C 379503399 YJPVVQOTXFBZKE-NXEZZACHSA-N 299.212 2.337 10 20 CECD CN(C)C(=O)[C@H]1CCCN1Cc1c(O)cccc1Cl 122696496 FAUNYSQYESKHJU-GFCCVEGCSA-N 282.771 2.098 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Nc2ccn(C)n2)c1 107054044 GANNERPRXWUCFR-VIFPVBQESA-N 290.323 2.017 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@@H]2C2CC2)c1O 176130876 JFEBKFZGBBCOOW-VXGBXAGGSA-N 261.321 2.063 10 20 CECD CC(C)(C)SCC(=O)NCCc1ccc(N)cc1 63129870 KDKJJDADGHJLHK-UHFFFAOYSA-N 266.410 2.459 10 20 CECD Cc1cc(C(=O)N[C@H]2CCOC2)c(C)n1-c1ccccn1 179200973 GARBPOGGNVUEMC-ZDUSSCGKSA-N 285.347 2.008 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCCO1 123573102 GMCHZZUIPNCGKN-OAHLLOKOSA-N 276.380 2.246 10 20 CECD CCCOc1ccc(CN[C@@H]2C[C@@H](O)C2(C)C)c(O)c1 189346638 YXXVVGSRVMLFET-HUUCEWRRSA-N 279.380 2.430 10 20 CECD CN1CCCc2cc(CNC(=O)Cc3ccncc3)ccc21 181941360 RNCSHILDFQJZAY-UHFFFAOYSA-N 295.386 2.323 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CC1CCOCC1 175027183 KINHLQXOACAANG-UHFFFAOYSA-N 276.380 2.378 10 20 CECD Cc1cccc(CN(C2CC2)[C@@H](C)CS(C)(=O)=O)c1O 180244959 JZWFZRCRWGUTCM-LBPRGKRZSA-N 297.420 2.098 10 20 CECD COCC[C@](C)(O)CNCc1ccc(N2CCCC2)cc1 227215762 QXGBXXJRHISVLR-KRWDZBQOSA-N 292.423 2.164 10 20 CECD CCOC(=O)CN(CC)Cc1cc(C)c(C)cc1O 92399520 XTRYSQPIFAQUEM-UHFFFAOYSA-N 265.353 2.394 10 20 CECD C[C@H](N[C@H]1CC[C@H](O)CC1)c1ccc(F)cc1O 252815253 UXQAPUIUUMQTJH-DLOVCJGASA-N 253.317 2.485 10 20 CECD CC1(O)CCN(Cc2c(O)cccc2Cl)CC1 271159184 CVADIUBAPRSZRC-UHFFFAOYSA-N 255.745 2.392 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)CC[S@@]1=O 277647684 OBSLSVISSMSDIC-ODXCJYRJSA-N 298.427 2.235 10 20 CECD CC(C)N1C[C@@H](N[C@H](C)c2ccccc2O)CC1=O 272910651 WNMXMAYFZNAJBN-NEPJUHHUSA-N 262.353 2.052 10 20 CECD COCC(C)(C)CNCc1ccc(N2CCOCC2)cc1 385829915 UJCYFZMDZRGEMC-UHFFFAOYSA-N 292.423 2.285 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCC(O)CC2)c(O)c1C 296078415 XDACFCXNTZZSHA-CQSZACIVSA-N 292.423 2.116 10 20 CECD CCOc1ccc(N(C)Cc2noc(CCOC)n2)cc1 809948975 UNMGSAHATZCZFN-UHFFFAOYSA-N 291.351 2.294 10 20 CECD Cc1cc(C(=O)N2CCO[C@@H]3C[C@@H]32)c(C)n1-c1ccccn1 816899223 PBHKGINOGDADIX-LSDHHAIUSA-N 297.358 2.102 10 20 CECD CC[C@@]1(O)CCN(Cc2ccc(N(C)C)c(C)c2)C1 815096991 YCMUJGJOYCDKON-MRXNPFEDSA-N 262.397 2.408 10 20 CECD CN(Cc1ccccc1O)C(=O)OC1CCOCC1 810048929 HSOZUFGZNQNKPP-UHFFFAOYSA-N 265.309 2.140 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C/[C@@H]1CCOC1 822265523 REDTUXPXSPBVST-RZIFZGNASA-N 288.391 2.304 10 20 CECD Cc1cc(O)c(CN2CCN3C(=O)CC[C@H]3C2)cc1Cl 824650914 YMVYPLVXDXHRFK-LBPRGKRZSA-N 294.782 2.161 10 20 CECD CCN1C[C@@H](NCc2ccc3ccccc3c2O)CC1=O 824893535 UYPIPGOCUXJZOO-AWEZNQCLSA-N 284.359 2.256 10 20 CECD CCCCN(Cc1ccccc1O)C[C@H](C)S(C)(=O)=O 829516039 NWQXABANFLXEIE-ZDUSSCGKSA-N 299.436 2.427 10 20 CECD C[C@@H](NCCCON)c1cc2c(cc1O)CCCC2 902424813 LVMCVLBDEMBRKM-LLVKDONJSA-N 264.369 2.202 10 20 CECD CCC(F)(F)C(=O)NCc1cc(OC)ccc1O 830543846 GPRUWHICKBZBLD-UHFFFAOYSA-N 259.252 2.062 10 20 CECD C[C@H](N[C@@H]1C[C@@H]2CCCCN2C1=O)c1ccc(F)cc1O 834916163 VRIWYWBFONDWME-VHRBIJSZSA-N 292.354 2.335 10 20 CECD CN(CCCN1CCCC1)C(=O)Nc1ccc(N)cc1 841297459 PYWUGDSVWKJCBE-UHFFFAOYSA-N 276.384 2.218 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)[C@H]2CC2(F)F)cc1 844856828 NNIJTNPQHBGVHM-CYBMUJFWSA-N 298.333 2.245 10 20 CECD CCOc1ccc(CN[C@@H]2CC[C@H](CN)C2)c(O)c1 841084466 JXFYBLWTAHDUGH-WCQYABFASA-N 264.369 2.008 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1cccc(CC)c1O 848903501 UTLMWUQELNFTBZ-CABCVRRESA-N 279.380 2.238 10 20 CECD CN(CC[C@@H]1CCCCN1C)C(=O)c1cc(O)cs1 743718245 MADJPWZLGCKFSM-NSHDSACASA-N 282.409 2.400 10 20 CECD CCOc1ccc(CNCCN2CC[C@H](C)C2)c(O)c1 744450043 JPICRHACBLDCMR-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD CCc1cccc(CN[C@@H](C)c2nc(C)no2)c1O 848906961 YULAQOBAEWVMMY-VIFPVBQESA-N 261.325 2.497 10 20 CECD CCOCc1cc(CNCC2OCCCO2)ccc1OC 922276321 FPPWQISHEUACPR-UHFFFAOYSA-N 295.379 2.084 10 20 CECD CC(C)c1ncc(S(=O)(=O)Nc2ccc(O)cc2F)[nH]1 758168518 BGDPDGLYYUVVFP-UHFFFAOYSA-N 299.327 2.179 10 20 CECD C[C@H](CCO)CN[C@H](C)c1cc(F)cc(F)c1O 756617650 JRUHXBIIIRDWKG-RKDXNWHRSA-N 259.296 2.340 10 20 CECD CNC(=O)C(C)(C)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756782065 MCNPKYNMZFZRJU-MWLCHTKSSA-N 294.370 2.441 10 20 CECD CON(C(=O)c1ccc(C)c(O)c1O)C1CCCC1 757658383 ROYVZENSPQSHEM-UHFFFAOYSA-N 265.309 2.352 10 20 CECD CC(C)(C)OCCOC(=O)/C=C\c1ccc(O)c(O)c1 759595321 PYMCWTDTVHYNKX-ALCCZGGFSA-N 280.320 2.469 10 20 CECD CC[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768464198 ODTCSGVSHMRFQT-YGRLFVJLSA-N 263.337 2.050 10 20 CECD CCOc1ccc(CN2CCC[C@](C)(O)C2)c(O)c1 769468986 RUUOXJIKSUJPLQ-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CN(C)c1ccc(CN2C(=O)N[C@@H](C(C)(C)C)C2=O)cc1 777557044 BCBXSGDBLFFNRQ-CYBMUJFWSA-N 289.379 2.219 10 20 CECD COC(=O)N1CCC[C@@H](NCc2c(C)cccc2O)C1 876996887 HHRBYYIRVKFDFM-GFCCVEGCSA-N 278.352 2.021 10 20 CECD C[C@H](N[C@@H]1C[C@H](O)C1(C)C)c1cc(F)cc(F)c1O 779065405 POLWUHLWFTZKHE-BPTDKIDVSA-N 271.307 2.480 10 20 CECD C[C@@H]1COCC[C@H]1CNCc1cc(F)cc(F)c1O 883118584 ZUHNRHADHIXMHI-ZJUUUORDSA-N 271.307 2.433 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1cc(F)cc(F)c1O 887329374 FZBLZBZYOAGNBM-AWEZNQCLSA-N 284.306 2.291 10 20 CECD COc1cc(C)cc(CN2CCCc3n[nH]cc32)c1O 894589579 CWAJWQHACOCLCJ-UHFFFAOYSA-N 273.336 2.385 10 20 CECD Cc1cnc(NC(=O)c2c(F)ccc(O)c2O)s1 789958407 FITUTGXUDXBGIG-UHFFFAOYSA-N 268.269 2.254 10 20 CECD CO[C@H]1CN(Cc2cc(Cl)c(C)cc2O)CCO1 895964883 ZLKKUHQWEYNQKC-CYBMUJFWSA-N 271.744 2.159 10 20 CECD CCC(=O)N1CCC[C@@H](NCc2ccc(OC)c(C)c2)C1 998322803 LSUMEYUWUPGIGA-OAHLLOKOSA-N 290.407 2.494 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)Cc1nc[nH]n1 1327498829 MMFRQOGPDRFEIM-UHFFFAOYSA-N 273.384 2.281 10 20 CECD COC[C@H]1CCCN(Cc2c(O)cccc2OC)C1 769402128 BGVQWBDAAMRXCY-LBPRGKRZSA-N 265.353 2.259 10 20 CECD Oc1c(Cl)cccc1CN[C@@H]1CCn2ccnc2C1 779191106 FGLPVLXWGDCIMC-LLVKDONJSA-N 277.755 2.347 10 20 CECD C[C@H](NC(=O)[C@]1(F)CCOC1)c1ccc(N(C)C)cc1 1261087331 NHVTVMPOYDYCJR-NHYWBVRUSA-N 280.343 2.058 10 20 CECD CCCC[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)O 1605247178 GRGFZRXKXLRIEF-WOLRVDTOSA-N 294.303 2.298 10 20 CECD CC(C)(CCNCc1cc(F)cc(F)c1O)C(=O)O 1588777886 OQRAEDUTRXKSLV-UHFFFAOYSA-N 273.279 2.261 10 20 CECD CO[C@@H](C)CCN[C@@H](C)c1cc(C(=O)O)ccc1O 1599040572 TUBVAKCMDUZLNG-UWVGGRQHSA-N 267.325 2.166 10 20 CECD CC[C@H](NCCc1ccn(C)n1)c1ccccc1O 229578689 DDKCLFLKVUVEJH-AWEZNQCLSA-N 259.353 2.409 10 20 CECD CC(=O)N1CCC(NCc2cc(Cl)ccc2O)CC1 37138428 ZSAKUWZRCGPWEA-UHFFFAOYSA-N 282.771 2.146 10 20 CECD O=C(O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2O)C1 86773086 YLJQNNIAIQTJNQ-GFCCVEGCSA-N 289.253 2.231 10 20 CECD CCC[C@H](CNCc1cc2c(cc1O)OCO2)OCC 705343707 NGVRTSUEHFEREL-GFCCVEGCSA-N 281.352 2.416 10 20 CECD Cc1cccc(CNC2CCC(C(=O)O)CC2)c1O 821112232 KWRCDVFGPMGDDG-UHFFFAOYSA-N 263.337 2.434 10 20 CECD COc1cccc(CNC(=O)c2cccc(Cl)n2)c1O 105650825 HNTFSVAYKALHSW-UHFFFAOYSA-N 292.722 2.379 10 20 CECD CCC[C@](C)(NCc1ccc2c(c1)CCO2)C(=O)OC 111246844 MASJVOZRLPYVNB-INIZCTEOSA-N 277.364 2.443 10 20 CECD CN1C(=O)c2ccccc2N[C@H]1c1cc([N+](=O)[O-])ccc1O 66403231 UKCNODYQYNHGMN-CQSZACIVSA-N 299.286 2.497 10 20 CECD CN(Cc1ccccc1O)[C@@H]1Cc2ccccc2[C@@H]1O 182899106 RBSQWFADHBJVNR-WBVHZDCISA-N 269.344 2.482 10 20 CECD Cc1ccc(C(=O)Nc2cc(C#N)ccc2O)c(O)c1O 182913736 LEGKQCZLDHJWFJ-UHFFFAOYSA-N 284.271 2.236 10 20 CECD C[C@H]1CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 180583564 ZRUYEIIVDFTOHG-ZRQQLDRUSA-N 261.321 2.370 10 20 CECD C[C@H](Cc1ccc(O)cc1)NC(=O)c1cccc(O)c1O 185869757 YWXFEHUNLXBLSG-SNVBAGLBSA-N 287.315 2.164 10 20 CECD COCCCN(C)CCN[C@H](C)c1ccc(F)cc1O 185553778 MANHUJHXTAXLFP-GFCCVEGCSA-N 284.375 2.150 10 20 CECD CC(=O)CSCC(=O)N(C)Cc1ccc(N(C)C)cc1 81273643 JXTCETBAECASDS-UHFFFAOYSA-N 294.420 2.033 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@@H]1CCC[C@@H]1O 91898570 GOKUTTBQEJZCTI-HOCLYGCPSA-N 262.397 2.345 10 20 CECD COC[C@H](N[C@H](C)c1cc(F)ccc1O)[C@@H]1CCCO1 278620806 CFVMYACKCUKUTE-DGFSRKRXSA-N 283.343 2.376 10 20 CECD C[C@H](N[C@@H]1CCO[C@H]1C)c1ccc(F)c(F)c1O 276894754 IGBWSPNDGRUOPH-DKCNOQQISA-N 257.280 2.498 10 20 CECD COCC[C@](C)(O)CN[C@@H](C)c1c(C)cc(C)cc1O 284277535 XGABCKVNMXJGBC-BBRMVZONSA-N 281.396 2.447 10 20 CECD CC1=C(C(=O)NCc2ccc(N(C)C)cc2)SCCO1 287107355 MBXYNDWAANGOME-UHFFFAOYSA-N 292.404 2.364 10 20 CECD CCNC(=O)[C@H](C)N[C@H](CC)c1ccc(C)cc1O 280282057 YOIBUOJHZHJGIK-WCQYABFASA-N 264.369 2.266 10 20 CECD C[C@H]1[C@@H](N2CCCC2)CCN1Cc1ccccc1O 289925668 WAPAWFKKSZUNND-ZFWWWQNUSA-N 260.381 2.451 10 20 CECD COC(=O)C1CCN(Cc2ccc(N(C)C)c(C)c2)CC1 293539614 QDOKVDOGLFBFRI-UHFFFAOYSA-N 290.407 2.446 10 20 CECD COCCO[C@H]1CCCN(Cc2cc(OC)ccc2O)C1 802652119 LZFPZMPOMFYFEP-HNNXBMFYSA-N 295.379 2.028 10 20 CECD CCCC[C@H](COC)NC(=O)c1c(F)ccc(O)c1O 295834522 MXQXODJWTNFLRF-SECBINFHSA-N 285.315 2.172 10 20 CECD CC(=O)C(=O)CSc1nccn1-c1ccccc1C 808016754 UWJUUZMXMPXOSF-UHFFFAOYSA-N 274.345 2.431 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(N(C)C)c(C)c1 815102164 MJSNFNOUTZPBOO-CABCVRRESA-N 289.423 2.065 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)c3ccc[nH]3)C2)cc1 819580372 IQSLSJKNGJKGIT-ZDUSSCGKSA-N 299.374 2.280 10 20 CECD CC[S@](=O)CCNCc1cc(Cl)c(F)cc1O 816550785 CHVYXIHUAPSNEV-KRWDZBQOSA-N 279.764 2.043 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](C(C)C)[C@H](C)N)c1 817996430 FFTIYWKOCAIGRS-ZIBATOQPSA-N 294.395 2.197 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCCc2cnn(C)n2)c1 815639542 ALLMOQGVCSPPKL-GFCCVEGCSA-N 274.368 2.113 10 20 CECD C[C@@H](NCC1(C)CCNCC1)c1cc([N+](=O)[O-])ccc1O 817965513 WJAXCZASCFWKTL-LLVKDONJSA-N 293.367 2.341 10 20 CECD CNCCN[C@@H](C)c1ccc(Br)cc1O 817952163 OFJURJXXBYFYOQ-QMMMGPOBSA-N 273.174 2.025 10 20 CECD Cc1cc(O)c(CNCCCC(=O)N(C)C)cc1Cl 825156567 YWCACVVECITJIM-UHFFFAOYSA-N 284.787 2.312 10 20 CECD CCN(C[C@H]1CCCO1)C(=O)c1cc(O)cs1 731870031 IIRVSCGQIZFWTN-SNVBAGLBSA-N 255.339 2.095 10 20 CECD CO[C@@H]1CCC[C@H]1CNC(=O)Nc1ccc(N)cc1 841295619 CSMRETHOACJJSY-GXFFZTMASA-N 263.341 2.205 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H](C3CCC3)C1)[C@H](O)CO2 840188839 MXZHIUGLPBOUNY-MLGOLLRUSA-N 289.375 2.440 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC[C@@H](F)C2)cc1 844782529 BJHLLGHFJYSPRT-CYBMUJFWSA-N 279.359 2.396 10 20 CECD COc1cccc([C@H](C)NC[C@](C)(O)C(C)C)c1O 846147424 UXSHRAYCPYYMSD-NHYWBVRUSA-N 267.369 2.458 10 20 CECD NC[C@H]1CC[C@H](NCc2cc(Cl)ccc2O)C1 841085212 XBATVYFPUSDYIF-CABZTGNLSA-N 254.761 2.263 10 20 CECD Cc1ccc([C@@H](C)NC[C@H]2CCCNC2=O)c(O)c1C 840825399 GEZJQOZQZZGQKD-CHWSQXEVSA-N 276.380 2.186 10 20 CECD C[C@@H]1CCN(C(=O)c2cc(O)cs2)CCS1 757685783 BXKVRWPXULNZPO-MRVPVSSYSA-N 257.380 2.421 10 20 CECD OCc1ccnc(NCCCSc2nccs2)n1 767193670 BWHKAIJJLNCMSE-UHFFFAOYSA-N 282.394 2.020 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1cc(Cl)ccc1O 765794496 CQYHVLIZJBJZRQ-NEPJUHHUSA-N 282.771 2.050 10 20 CECD Cc1cccc(O)c1CN1CCNC(=O)[C@@H]1CC(C)C 877461251 CHKCVNACVTTWDF-AWEZNQCLSA-N 276.380 2.047 10 20 CECD c1cc(N2CCCC2)ccc1CN1CC[C@H]2NCC[C@H]2C1 1118180541 KEDWNINYEMMZGN-FUHWJXTLSA-N 285.435 2.471 10 20 CECD CC[C@H](NCC[C@H](O)COC)c1cc(Cl)ccc1O 775526555 RXOAFLGXKSPJOM-AAEUAGOBSA-N 287.787 2.484 10 20 CECD Cn1cnc2cccc(C(=O)NCc3ccccc3O)c21 774066585 UXQLUNDQFIBLME-UHFFFAOYSA-N 281.315 2.209 10 20 CECD CCCCOCCn1cc(COc2ccc(N)cc2)nn1 881209792 KREQOHQTCSCBAH-UHFFFAOYSA-N 290.367 2.256 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@H](C)c1c(O)cccc1F 886590434 VGJCTPUNYLUZKD-SCDSUCTJSA-N 283.343 2.376 10 20 CECD C[C@H](N[C@H]1C[C@@H](O)C1(C)C)c1cc(F)cc(F)c1O 779065406 POLWUHLWFTZKHE-CQFDHEJISA-N 271.307 2.480 10 20 CECD C/C=C/C[C@@H](CO)NCc1cc(F)cc(F)c1O 883090226 FIIXJAWEGHPJLJ-VUDBWIFFSA-N 257.280 2.087 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCN2CCNC2=O)c1O 886744867 JBQXJTIAQLDAFY-JTQLQIEISA-N 297.786 2.030 10 20 CECD CC[C@H](C[C@@H](C)CO)NCc1ccc(OC)c(OC)c1O 893074141 KXWPMOAMNMHWBO-DGCLKSJQSA-N 297.395 2.296 10 20 CECD CCCN1C(=O)N(Cc2ccc(N(C)C)cc2)C(=O)[C@@H]1C 794772553 BRNYNOFQPBWRKL-LBPRGKRZSA-N 289.379 2.315 10 20 CECD COc1ccc(CNC(=O)c2cc(C3CC3)on2)c(O)c1 794369999 LAMLDFVOIUBGQX-UHFFFAOYSA-N 288.303 2.196 10 20 CECD Nc1ccoc1C(=O)NCc1ccc(N2CCCC2)cc1 1328593757 OJGXBUZZFRYIJC-UHFFFAOYSA-N 285.347 2.392 10 20 CECD CN(Cc1ccccc1O)Cc1c(Cl)cnn1C 189740241 AFDMEGMENFPSIO-UHFFFAOYSA-N 265.744 2.411 10 20 CECD CO[C@H](C)CNCc1cc(Br)ccc1O 191143169 LQKLGXQQDMWVCE-MRVPVSSYSA-N 274.158 2.279 10 20 CECD CN1C[C@H]2CN(Cc3cccc(Cl)c3O)C[C@H]2C1 194534593 AGIFJKKAQATUAD-TXEJJXNPSA-N 266.772 2.039 10 20 CECD CN1CCCc2cc(CNC[C@](C)(O)C(F)F)ccc21 698616260 LVCJWOUHHAHOIR-HNNXBMFYSA-N 284.350 2.175 10 20 CECD C[C@@H]1CN(c2nnc(-c3sccc3O)n2C)C[C@H]1C 1519508130 OXRRMTJLQDGHER-RKDXNWHRSA-N 278.381 2.341 10 20 CECD CCc1cccc(CN2CC[C@H](C(=O)O)[C@@H](C)C2)c1O 1573960969 OVTXXUBLNMHULT-FZMZJTMJSA-N 277.364 2.497 10 20 CECD CCCN(c1ccc(CN)cc1)C1CC(C(=O)O)C1 1595894527 JBUCZWUDYPTEOK-UHFFFAOYSA-N 262.353 2.225 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@H]1C[C@H]1C(=O)O 1595747786 JELQURCEQJBWRZ-QWHCGFSZSA-N 291.347 2.242 10 20 CECD CC(C)=CC[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776298699 JVMQVZDZDJGXPL-GFCCVEGCSA-N 294.307 2.200 10 20 CECD C[C@H](C(=O)NCCc1ccc(N)cc1)C(F)(F)F 818545211 PHNVULVHMRRYAB-MRVPVSSYSA-N 260.259 2.126 10 20 CECD C[C@H](Cn1ccnc1)NCc1ccc2c(c1)CCCO2 921527832 OWRPOAOQFASDLS-CYBMUJFWSA-N 271.364 2.386 10 20 CECD C[C@H]1CC(F)(F)CCN1C(=O)c1cccc(O)c1O 530008409 HTFXRPFFMOQYJV-QMMMGPOBSA-N 271.263 2.358 10 20 CECD COc1cc(O)c(CN2CCSC[C@@H]2C)cc1OC 179444582 OAIMJDFKQQEHHY-JTQLQIEISA-N 283.393 2.347 10 20 CECD C/C=C/C[C@@H](CO)NCc1cc(OCC)ccc1O 185823177 VARILYGDBGTOQW-LQPUYASZSA-N 265.353 2.208 10 20 CECD CN(C)c1ccc(CN(C)c2ncnc3[nH]ncc23)cc1 301091293 RKJVIEMHYDKUBE-UHFFFAOYSA-N 282.351 2.055 10 20 CECD CC[C@@H](NC(=O)N(C)Cc1ccccc1O)[C@H]1CCCO1 128717269 ZIHIEQOQVSJYPP-UKRRQHHQSA-N 292.379 2.491 10 20 CECD Oc1ccc(F)cc1CN1CCC(Cn2cncn2)CC1 189980452 YCUDYFRRDKBVDG-UHFFFAOYSA-N 290.342 2.035 10 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CECD CCOCCC1(C(=O)NCc2ccc(N)cc2)CCC1 297179058 KYNXSALHGSBPNT-UHFFFAOYSA-N 276.380 2.482 10 20 CECD C[C@H](NCc1cc(Cl)c(F)cc1O)C(C)(C)O 816545562 WETDOHVWIIKZOY-ZETCQYMHSA-N 261.724 2.434 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H]2C[C@H](F)CN2)c(O)c1 817976800 ULDCZUWBKWSINN-AVGNSLFASA-N 266.360 2.360 10 20 CECD CN(C)c1ccc(CN[C@@H](C(=O)O)C(C)(C)C)cc1F 901660991 KMSZOUCVLNFEHP-ZDUSSCGKSA-N 282.359 2.481 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@@H](N)CC(F)F 903873868 MWFKRSFGRDIDBV-LBPRGKRZSA-N 271.355 2.167 10 20 CECD CC[C@H](O)[C@@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 900026107 IWIYKLMESPPAPK-DOMZBBRYSA-N 278.396 2.118 10 20 CECD CCN(CC)c1ccc(CNCC2(N)CC2)cc1F 904449204 GJULOIZUKRKKRG-UHFFFAOYSA-N 265.376 2.253 10 20 CECD COc1cccc(CNC(=O)[C@@H]2C[C@H]2OC(C)(C)C)c1O 830536758 VWYAEUTUQLIAED-DGCLKSJQSA-N 293.363 2.221 10 20 CECD CC(C)OC[C@@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1 833504535 CTUBDWFHXHCMQL-HNNXBMFYSA-N 294.395 2.063 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ncccn1 839918918 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10 20 CECD COc1cccc(O)c1CN[C@@H](C)C(=O)OCC(C)C 789579411 GMCWEDLEWNKEFN-NSHDSACASA-N 281.352 2.078 10 20 CECD CCOCCOCCNCc1cc(Cl)cc(F)c1O 897203664 BHAVCNGASOGHSI-UHFFFAOYSA-N 291.750 2.327 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1 894086801 NEDSZQPFUDINPZ-LLVKDONJSA-N 284.350 2.444 10 20 CECD CC[C@@H](C)[C@H](OC)C(=O)N(C)Cc1ccccc1O 793656814 MRBGORLDAWYZNJ-RISCZKNCSA-N 265.353 2.412 10 20 CECD COc1ccc(CNC(=O)CCc2ccoc2)c(O)c1 794374410 RYSJVCKMXKLKKT-UHFFFAOYSA-N 275.304 2.243 10 20 CECD C[C@H](NC(=O)c1ccc(N=NC(N)=O)cc1)C(F)F 1161304077 NVIQAXLKEWBTOY-LURJTMIESA-N 270.239 2.232 10 20 CECD CCCC[C@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423479 UDCBYDGHVDVXDQ-AWEZNQCLSA-N 264.369 2.486 10 20 CECD C[C@@H](C[C@@H](C)O)NCc1ccc(Br)cc1O 701015869 SCZRKDKGCQIXEU-DTWKUNHWSA-N 288.185 2.404 10 20 CECD C[C@H](CC(=O)O)CC(=O)NCc1cccc(Cl)c1O 1604106747 PWSKEKJVXCNEOQ-QMMMGPOBSA-N 285.727 2.163 10 20 CECD C[C@H](N[C@H](C)c1nc(C(=O)O)co1)c1ccccc1O 1593353388 VHRJSTKOFJUAHP-DTWKUNHWSA-N 276.292 2.490 10 20 CECD N[C@H]1C[C@H](NCc2ccc3c(c2)CCCO3)C12CCC2 1580162683 DBSWMAQZDNAAJU-HOTGVXAUSA-N 272.392 2.371 10 20 CECD Oc1ccc(Br)cc1CN[C@H]1CCOC1 125866737 YOTBVSXOLDJLGW-JTQLQIEISA-N 272.142 2.033 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2cccnc2)c1 114512460 SRHJVRFBRVOGFX-UHFFFAOYSA-N 273.292 2.118 10 20 CECD COc1cccc(CNC(=O)CCc2cccnc2)c1O 105652588 DGNKERIQYJEHLM-UHFFFAOYSA-N 286.331 2.045 10 20 CECD C[C@H]1[C@@H](C)SCCN1Cc1cc2c(cc1O)OCO2 118381774 RZMFINMSBWQIDD-VHSXEESVSA-N 281.377 2.447 10 20 CECD COc1cccc(CNC(=O)c2cccc(C)n2)c1O 105651909 GWECLCKFAKJURJ-UHFFFAOYSA-N 272.304 2.034 10 20 CECD C[C@H](CN1CCCCC1)NCc1cc([N+](=O)[O-])ccc1O 101591759 ZWGMVYZZFFAIFI-GFCCVEGCSA-N 293.367 2.264 10 20 CECD C[C@H](NC(=O)c1cc[nH]c1)c1ccc(N2CCOCC2)cc1 68308135 PPNPFGQARGFSTA-ZDUSSCGKSA-N 299.374 2.342 10 20 CECD O=[N+]([O-])c1cnc(NCc2ccc(N3CC=CC3)cc2)nc1 302168769 SRSMWDGZDKHJMS-UHFFFAOYSA-N 297.318 2.373 10 20 CECD CC[C@H](NCCCNC(C)=O)c1ccc(N(C)C)cc1 121387561 UCALTFPWXWPQIC-INIZCTEOSA-N 277.412 2.320 10 20 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CN(Cc1ccc(N(C)C)cc1)C(=O)NCCC(C)(C)O 274994112 ZHTNFFXHTBJIDD-UHFFFAOYSA-N 293.411 2.055 10 20 CECD CN(Cc1ccccc1O)C(=O)C(F)(F)C1(O)CCCC1 278868006 MVKMBCAAUUNKRN-UHFFFAOYSA-N 299.317 2.291 10 20 CECD CN1CCCc2cc(CNC(=O)Nc3cncnc3)ccc21 274360168 PBVAUTISSZSDQH-UHFFFAOYSA-N 297.362 2.181 10 20 CECD CC(C)C[C@H]1OCCC[C@H]1NC(=O)c1cccc(O)c1O 280408293 HQDXGCHUOTUOAI-TZMCWYRMSA-N 293.363 2.421 10 20 CECD CCNC(=O)OC[C@@H]1CCCCN1Cc1ccccc1O 809691954 USBGSBHUGZHZGV-AWEZNQCLSA-N 292.379 2.493 10 20 CECD COc1ccc(CNCc2nc(C3CC3)n[nH]2)cc1C 294889606 WISWWUKVWJRVDA-UHFFFAOYSA-N 272.352 2.289 10 20 CECD CCOc1cccc(CN(C)[C@@H](CO)COC(C)C)c1O 809768830 YAGNXELHBAGOTP-AWEZNQCLSA-N 297.395 2.009 10 20 CECD CC[C@@H](NC[C@@]1(COC)CCCN1)c1ccccc1O 817973366 DSFRTBPRJLBPTI-GDBMZVCRSA-N 278.396 2.202 10 20 CECD O=C(NCc1ccccc1O)c1c[nH]nc1-c1ccccn1 810275971 XYPVZDHLBWHIRB-UHFFFAOYSA-N 294.314 2.107 10 20 CECD CO[C@H](C)CCNCc1ccc(N2CCOCC2)c(F)c1 727471115 YAFLYEUBNFCBHX-CYBMUJFWSA-N 296.386 2.177 10 20 CECD 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O=C(NCc1c(O)ccc2c1CCCC2)c1cccnc1O 743716859 NEWLDUXNZOLXDT-UHFFFAOYSA-N 298.342 2.302 10 20 CECD COC(=O)C1=C(C)O[C@H](CN(C)c2ccc(OC)cc2)C1 844353152 PJFCIRBPGAZJSY-AWEZNQCLSA-N 291.347 2.367 10 20 CECD CCOc1ccc(CN2CCC[C@@H](C)[C@@H]2CN)c(O)c1 843051954 NDEPWYXZZKBUHU-DOMZBBRYSA-N 278.396 2.350 10 20 CECD Nc1ccc(CC(=O)N2CC[C@@H](c3cccnc3)C2)cc1 843503270 AXKGIIIDJPBENT-OAHLLOKOSA-N 281.359 2.222 10 20 CECD CC1(C)CC(C(=O)N(CC(=O)O)Cc2ccccc2O)C1 911488788 NWOFDWPPYRTKRI-UHFFFAOYSA-N 291.347 2.242 10 20 CECD CCOC(=O)c1coc(NCc2cccc(OC)c2O)n1 842026703 JHWJJQKBWVASEY-UHFFFAOYSA-N 292.291 2.178 10 20 CECD c1cnc(NCCNCc2ccc3c(c2)CCCO3)cn1 921838399 JOQAMPVOGAKZSG-UHFFFAOYSA-N 284.363 2.003 10 20 CECD C[C@@H]1CC[C@@H](C)N1CC(=O)N(C)Cc1ccccc1O 769281467 DJJBKWJCIIGVAH-CHWSQXEVSA-N 276.380 2.223 10 20 CECD Cc1conc1C(=O)NCCCSc1nccs1 865785051 LTAWQNPASIFUTH-UHFFFAOYSA-N 283.378 2.352 10 20 CECD CO[C@@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 769445071 DHTDBLOBURARIG-SNVBAGLBSA-N 286.715 2.175 10 20 CECD C[C@@H](N[C@@H]1C[C@H]2CCCC[C@H]2NC1=O)c1ccccc1O 879648829 BIDHWXKDJJIONL-QHSBEEBCSA-N 288.391 2.490 10 20 CECD CC[C@@H](NCCCOCCO)c1cc(Cl)ccc1O 775548434 ROZJBPJJMJTZPK-CYBMUJFWSA-N 287.787 2.485 10 20 CECD COc1cc(C)cc(CN[C@H](C)c2csnn2)c1O 894998868 IGZXEXUPHCFXNO-SECBINFHSA-N 279.365 2.412 10 20 CECD COc1ccc(CNC(=O)C2(F)CCCC2)c(O)c1 794386779 AFJCSCYMUNTSMW-UHFFFAOYSA-N 267.300 2.299 10 20 CECD CC[C@@H](C(=O)NCc1ccc(OC)cc1O)N(CC)CC 794378460 ICPOTSNQCRFRDQ-AWEZNQCLSA-N 294.395 2.137 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](CCN)C2)c1O 723698483 HHQAPVZGYUSNLS-JTQLQIEISA-N 284.787 2.225 10 20 CECD CSCC[C@@H](C)NC(=O)NCc1ccc(N)cc1 1338732111 MFNFXMLKWAPIKP-SNVBAGLBSA-N 267.398 2.210 10 20 CECD CCOc1ccc(O)c(CN(C[C@@H](C)C(=O)O)C2CC2)c1 1610043097 QDDZGIIUEVCTTB-LLVKDONJSA-N 293.363 2.476 10 20 CECD N[C@@H](C(=O)NCc1cccc(Cl)c1O)c1ccccc1 1580364360 NSZATGYVPXTUGQ-CYBMUJFWSA-N 290.750 2.362 10 20 CECD O=C(CC1CCNCC1)NCCCSc1nccs1 158525084 ANAIJLNKEQVBFW-UHFFFAOYSA-N 299.465 2.131 10 20 CECD COc1cccc(CN[C@@H]2C[C@H](OC)C2(C)C)c1O 227827925 HRSSEDQWSHKVHF-OLZOCXBDSA-N 265.353 2.304 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn[nH]c1 37652664 SPHRGVMRNOYMDL-UHFFFAOYSA-N 272.352 2.138 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)c2ncn(C)n2)c1 275726734 OLTQNXVOBFZMKX-QWRGUYRKSA-N 260.341 2.241 10 20 CECD CCCNC(=O)CCN[C@@H](C)c1ccc(N(C)C)cc1 45072721 ULPIFFYKYSIRMG-ZDUSSCGKSA-N 277.412 2.320 10 20 CECD C[C@H]1CCCN(Cc2cc(F)ccc2O)[C@H]1CN 300417628 WACQIORMFRQBBX-GWCFXTLKSA-N 252.333 2.091 10 20 CECD CCOCCN(CCOC)c1ccc(OC)c(OC)c1 177130727 INVMSBJPJUWIGB-UHFFFAOYSA-N 283.368 2.193 10 20 CECD CCOCC(=O)NCc1ccc(N(CC)CC)c(F)c1 66841230 ZYYZKAZVPIBJLI-UHFFFAOYSA-N 282.359 2.325 10 20 CECD COC(=O)N1CCC([C@@H](C)NCc2ccccc2O)CC1 186354759 RHXWIZRSYHBEQV-GFCCVEGCSA-N 292.379 2.349 10 20 CECD Cc1ccc(C(=O)NCC(C)(C)[C@H](O)C(C)C)c(O)c1O 182899981 TXDJASFXCIIBGB-CQSZACIVSA-N 295.379 2.179 10 20 CECD Nc1ccc(NC(=O)N[C@H]2CCCSC2)cc1 136435097 QQSADTGHPWNMSK-NSHDSACASA-N 251.355 2.286 10 20 CECD COc1cccc(CNCc2c(Cl)cnn2C)c1O 289562160 YSQUDFSSWKGULH-UHFFFAOYSA-N 281.743 2.078 10 20 CECD CC(C)c1nnsc1C(=O)Nc1ccc(N)cc1 87441326 LCRWOPBCSSDGEZ-UHFFFAOYSA-N 262.338 2.496 10 20 CECD C[C@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 263678955 HUVSDNYHEUCGRZ-AWEZNQCLSA-N 289.423 2.053 10 20 CECD Cc1nccc(NCc2ccc(N3CCOCC3)cc2)n1 266106658 JCFVZXHBIRYNPN-UHFFFAOYSA-N 284.363 2.234 10 20 CECD C[C@@H](NCCc1cnn(C)c1)c1ccc(F)c(F)c1O 276852725 BEPSZNRAQINZFZ-SECBINFHSA-N 281.306 2.297 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2ccc(N(C)C)c(F)c2)C1 279440108 PDKAACPCZFSMGZ-QWHCGFSZSA-N 294.370 2.323 10 20 CECD CC[C@H](N[C@@H]1CC(=O)N(C(C)C)C1)c1ccccc1O 274896960 KKEIOEODQYCGTR-OCCSQVGLSA-N 276.380 2.442 10 20 CECD CC(C)[C@H](CCO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273603081 SJBRZPPNLJBGGG-MFKMUULPSA-N 282.340 2.358 10 20 CECD CC(=O)NCCCN[C@@H](C)c1ccc(C)c(C)c1O 273435737 WYHMMRWEEUZLEO-LBPRGKRZSA-N 264.369 2.186 10 20 CECD Cc1noc(CCCN(C)c2ccc3c(c2)OCO3)n1 270365815 SLRZDBKNFZNFSY-UHFFFAOYSA-N 275.308 2.176 10 20 CECD Cc1ccc([C@@H](C)NCCCS(C)(=O)=O)c(O)c1C 273601727 SBAKNRRZLAFCTM-GFCCVEGCSA-N 285.409 2.094 10 20 CECD O=C(NCc1cccc(Br)c1O)C1CC1 277612343 VJLCUWXCTVCLLA-UHFFFAOYSA-N 270.126 2.181 10 20 CECD COCC[C@@H](CO)N[C@H](C)c1ccc(C)c(C)c1O 281726197 UVMRRJBNWIPSIL-OLZOCXBDSA-N 267.369 2.057 10 20 CECD CN(Cc1ccc(N(C)C)cc1)CN1CC(C)(C)CC1=O 808134359 GFKLDDZJIDWJRX-UHFFFAOYSA-N 289.423 2.400 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@H](C)N(C)C 801548358 SXTUOCVFPMTKOC-ZDUSSCGKSA-N 278.396 2.471 10 20 CECD COCCCC(=O)NCc1ccc(N2CCCC2)cc1 298765775 QJONMQPYHYHGAL-UHFFFAOYSA-N 276.380 2.330 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2CNCCCO2)c(O)c1C 817982239 PSXQDRBTLFCHLM-KBPBESRZSA-N 278.396 2.038 10 20 CECD CC[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@@H](CC)O1 817765540 CKNJIGQHGXGRIF-NXEZZACHSA-N 297.326 2.267 10 20 CECD CCn1nnc(C)c1/C=C1/C(=O)N2CCCc3cccc1c32 817345008 CDWQVOHPYWGVLB-GXDHUFHOSA-N 294.358 2.440 10 20 CECD CCN1CCN(Cc2ccc3ccccc3c2O)CC1=O 816569640 SCKYTNINPQCNNV-UHFFFAOYSA-N 284.359 2.210 10 20 CECD OC[C@@]1(F)CCN(Cc2ccc3ccccc3c2O)C1 816600858 JOOCDFFSOCCQJK-MRXNPFEDSA-N 275.323 2.452 10 20 CECD CN(C)c1ccc(CNC(=O)/C=C\[C@H]2CCOC2)cc1F 822862174 HAZTXHAZWMGWDD-RNZFLTOJSA-N 292.354 2.101 10 20 CECD Cc1cc(O)c(CN2CCC(OCCO)CC2)cc1Cl 824905913 IMEMJWNFEYWBCD-UHFFFAOYSA-N 299.798 2.327 10 20 CECD COc1cccc(CNC(=O)C2(C)CC(F)(F)C2)c1O 821065824 RUOFZFLOFHCKPI-UHFFFAOYSA-N 285.290 2.452 10 20 CECD CCOCc1cc(CNC2([C@@H](C)O)CC2)ccc1OC 827579885 KKXKHOZNSGFDKB-GFCCVEGCSA-N 279.380 2.235 10 20 CECD COc1ccc(O)c(CNC(=O)NCc2ccoc2C)c1 734066032 NAOIISARWPPPIY-UHFFFAOYSA-N 290.319 2.302 10 20 CECD CCCc1noc(COC(=O)c2cc(O)cs2)n1 732355191 GQLJAKGZZXDFNT-UHFFFAOYSA-N 268.294 2.146 10 20 CECD CCOc1ccc(CN2CCC([C@H](C)N)CC2)c(O)c1 843051701 CERAOXZKUQPFJK-LBPRGKRZSA-N 278.396 2.350 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CCN1 841060717 BLOIJMGDTSCYFY-KCJUWKMLSA-N 299.758 2.184 10 20 CECD C[C@H](N[C@H](C)CN1CCOCC1)c1ccc(Cl)cc1O 841744681 JYIJYAFKKYIYNF-NEPJUHHUSA-N 298.814 2.417 10 20 CECD COc1cccc([C@@H](C)NCC[C@@H](C)OC)c1O 846143640 FKXQNPBCDNNDFM-GHMZBOCLSA-N 253.342 2.476 10 20 CECD CO[C@@](C)(C(=O)NCc1cc(Cl)ccc1O)C1CC1 846476420 LWLQRFGSPBNAIZ-CQSZACIVSA-N 283.755 2.477 10 20 CECD CCc1cccc(CN[C@@H](COC)[C@H]2CCCO2)c1O 848907178 JTHKVJTYKUOKLX-LSDHHAIUSA-N 279.380 2.238 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H]2CCCO2)cc1 844400064 UTVJMZGRUCWFGW-INIZCTEOSA-N 278.396 2.242 10 20 CECD COc1cccc([C@@H](C)NCCc2cnccn2)c1O 846160822 ZAIVHAFLLDNUSU-LLVKDONJSA-N 273.336 2.084 10 20 CECD CC[C@H](N[C@@H]1COC[C@@H]1OC)c1ccc(C)cc1O 840826254 JACBOJSUWBZUGS-GUTXKFCHSA-N 265.353 2.155 10 20 CECD O=C(c1cc(O)cs1)N1CCC(OCC2CC2)CC1 743816705 ODXOBMDSDYBOPI-UHFFFAOYSA-N 281.377 2.485 10 20 CECD COc1cccc(CN[C@@H](C)[C@@H]2CCCOC2)c1O 388841980 UPUKCDMGUBIAGI-WCQYABFASA-N 265.353 2.306 10 20 CECD CC(=O)N1CC[C@@H](N[C@H](C)c2ccc(C)c(C)c2O)C1 857083909 APQNZKZRMSOLNZ-TZMCWYRMSA-N 276.380 2.280 10 20 CECD CC[C@H](NCc1cccc(OC)c1O)[C@H](O)C(F)(F)F 765785707 CRXVBHNQZJMXNA-CABZTGNLSA-N 293.285 2.192 10 20 CECD CCOc1ccc(CN2CCCO[C@@H](C)C2)c(O)c1 769319636 VXJJJQGXDJJJFS-LBPRGKRZSA-N 265.353 2.402 10 20 CECD C[C@H](NCCC1CC(O)C1)c1cc([N+](=O)[O-])ccc1O 762650737 RLGRAYDMXUACFB-BMQDGWLCSA-N 280.324 2.112 10 20 CECD CC[C@H](C)[C@@H](OC)C(=O)NCc1cc(C)ccc1O 862755431 GXIJHMYVVDACBW-SMDDNHRTSA-N 265.353 2.378 10 20 CECD Cc1nc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cs1 779501047 QOHGUXOSCWZGGD-HWKANZROSA-N 290.344 2.192 10 20 CECD CCN(C)c1ccc(CN2CCOC[C@H]2C[C@@H](C)O)cc1 773849917 SPBZIJPKJCWRST-RHSMWYFYSA-N 292.423 2.114 10 20 CECD CC(C)[C@@H]1C[C@H](NC(=O)c2cc(O)cs2)CCO1 772932661 JPBJPZCMOVORBP-KOLCDFICSA-N 269.366 2.387 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2c(O)cccc2F)C1 886541699 ZYGLEYJXIWUCLH-MNOVXSKESA-N 280.343 2.193 10 20 CECD C/C(=C/C(=O)OCC(=O)c1ccc(O)c(O)c1)C1CC1 783087628 VJKKHKYOESYEGW-TWGQIWQCSA-N 276.288 2.180 10 20 CECD O=C(NCCc1cccs1)c1c(F)ccc(O)c1O 789944295 QOZBNRGPBDPDJT-UHFFFAOYSA-N 281.308 2.271 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@H](CF)C2)c1O 895574190 VADKKZVRFSRZML-SECBINFHSA-N 284.287 2.100 10 20 CECD CC(C)CC(=O)N1CCN(Cc2cc(F)ccc2O)CC1 1140059189 XYJFFKXGKRRMKI-UHFFFAOYSA-N 294.370 2.222 10 20 CECD Cc1ccc(O)c(CNCCCCCC(=O)O)c1 84853816 SKSHSCCJMMTGDV-UHFFFAOYSA-N 251.326 2.435 10 20 CECD COc1cccc(O)c1CNC[C@@]1(C)CCCO1 756134888 SKAIQJXPDZZNMA-CQSZACIVSA-N 251.326 2.060 10 20 CECD COC(=O)[C@H]1CCC[C@@H]1NCc1ccc(N(C)C)c(F)c1 1326280124 LSXLUVWWAZOWIA-JSGCOSHPSA-N 294.370 2.323 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](C)C[C@@H]2C(=O)O)c1 1607811157 LYVOZWUDRHDVRS-DGCLKSJQSA-N 263.337 2.386 10 20 CECD O=C(O)[C@H]1C[C@H]2CC[C@H]1N2Cc1c(O)ccc2ccncc12 1601790998 MVFLXQBBYYOZTD-TYNCELHUSA-N 298.342 2.378 10 20 CECD C[C@@H](NCCC[C@@H]1CCCN1)c1cc(C(=O)O)ccc1O 1609781339 WGTWDAOSKPFCEI-DGCLKSJQSA-N 292.379 2.273 10 20 CECD O=C(Cc1ccc(O)c(O)c1)Nc1cc(C(=O)O)cs1 1608363438 HTYKGULFTAAOMF-UHFFFAOYSA-N 293.300 2.039 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCC[C@H]2C(=O)O)cc1 1598320451 GIPJKDDKFDIDHG-CABCVRRESA-N 276.380 2.486 10 20 CECD CCN1CCc2cc(CN[C@H](C(=O)O)[C@@H]3C[C@H]3C)ccc21 1776884726 NCBHKPJNJZOTLV-XFJVYGCCSA-N 288.391 2.268 10 20 CECD O=C(NCCCSc1nccs1)Nc1cccnn1 152017976 KETZZNAKKOJFIB-UHFFFAOYSA-N 295.393 2.237 10 20 CECD CCC[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCO1 152514137 KWEUVZARRRQBGE-LBPRGKRZSA-N 279.336 2.122 10 20 CECD Oc1ccccc1CNC[C@@H]1CCN(CC(F)(F)F)C1 37648364 BEEVKVXFMWCBET-NSHDSACASA-N 288.313 2.366 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](C)C[C@@H](C)O)c1 185521170 UREYOKZFOMPGCO-TUAOUCFPSA-N 267.369 2.458 10 20 CECD COC[C@H](NCc1cc2c(cc1O)OCO2)c1ccco1 177572981 KBYDZMDOGFCCAA-NSHDSACASA-N 291.303 2.191 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)C(C)(C)CN(C)C)c(O)c1O 179515764 VUFKVPIHHXVLFH-NSHDSACASA-N 294.395 2.112 10 20 CECD CCCN(CC(=O)OC)Cc1cc(F)cc(C(C)=O)c1O 176890408 CKVDCGOJHDKIJB-UHFFFAOYSA-N 297.326 2.119 10 20 CECD COc1ccc(/C=C2/SC(=S)NC2=O)s1 121697126 FTEJQNUHTBHIEU-GQCTYLIASA-N 257.361 2.246 10 20 CECD CCC[C@@H](O)CNC(=O)NCc1ccc(N(C)C)cc1C 304231766 NVEXKJOKCCXTQQ-OAHLLOKOSA-N 293.411 2.021 10 20 CECD O=C(/C=C/c1cccc(O)c1)NCCc1ccc(O)c(O)c1 180178648 SHKDRAMQSJNHBP-FNORWQNLSA-N 299.326 2.176 10 20 CECD COc1cccc(CN2CC[C@H]([C@@H]3CCOC3)C2)c1O 371310497 LIQCONOOWRFZQO-GXTWGEPZSA-N 277.364 2.259 10 20 CECD CC[C@@H](COC)NC(=O)N[C@H](C)c1cc(OC)ccc1O 129454047 HTLANOXDUNCYGC-MNOVXSKESA-N 296.367 2.186 10 20 CECD Cc1nn(C)c(Cl)c1CNCc1ccccc1O 134236468 HYKRFQNFVMLLIR-UHFFFAOYSA-N 265.744 2.377 10 20 CECD COc1cc(Cl)cc(CNCCC[C@H](C)O)c1O 228091075 JMVFAHZRTRRWIM-VIFPVBQESA-N 273.760 2.305 10 20 CECD Nc1nc(Cl)cc(NCc2ccccc2O)n1 225106611 BGOIGPLAUORMKO-UHFFFAOYSA-N 250.689 2.030 10 20 CECD Cn1nccc1/C=C1\SC(NC2CCCCC2)=NC1=O 45110877 FEULGFWIZAMQGM-XFXZXTDPSA-N 290.392 2.313 10 20 CECD CN(C)C(=O)O[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 295210065 ZZFSUIKCCKPVAF-SNVBAGLBSA-N 298.770 2.318 10 20 CECD CCOC(=O)N1CCC[C@H](C(=O)Nc2ccc(N)cc2)C1 236891681 WMGYFWTVOORTOQ-NSHDSACASA-N 291.351 2.076 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1 529835911 NALPEKWOJZGRHL-FJJYHAOUSA-N 277.364 2.376 10 20 CECD C[C@H]1CCCN(C[C@@H](C)NC(=O)Cc2ccc(N)cc2)C1 263271163 PCRGZAUCFBWJRT-UONOGXRCSA-N 289.423 2.048 10 20 CECD COCCC1(C(=O)NCc2ccccc2O)CCC1 268704678 VQYIYOWXDFKCJS-UHFFFAOYSA-N 263.337 2.215 10 20 CECD C[C@H](N[C@H]1C[C@H](O)C1(C)C)c1ccc(F)c(F)c1O 276986862 WUASNRXCRZVGJP-SWPVVBRQSA-N 271.307 2.480 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@]2(CCOC2)O1 373498533 ZLLCVKPGRLYJJS-ABAIWWIYSA-N 297.782 2.425 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@@]3(CCO[C@H]3C)C2)c1O 280370279 DJSZNYLNNUBOJE-ZQIUZPCESA-N 291.391 2.469 10 20 CECD CCC[C@H](C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 297976248 VTNIBQKXTKWWPM-AWEZNQCLSA-N 291.439 2.489 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)OC[C@H]1CCCO1 805005475 QGYWBVVGMMNINN-OAHLLOKOSA-N 292.379 2.466 10 20 CECD CN(C)CCN(Cc1cc(F)ccc1O)C[C@H]1CCCO1 809737619 JTUDDZYAFZERQR-OAHLLOKOSA-N 296.386 2.074 10 20 CECD Cc1cc(Br)cc([C@H](C)NC[C@H](C)N)c1O 817972966 QOSBBBDICBZVED-IUCAKERBSA-N 287.201 2.461 10 20 CECD C[C@H](N[C@@H]1CCC[C@@H](N)C1)c1cc(F)ccc1O 817969634 FPDCXBWGTHHLSK-MVWJERBFSA-N 252.333 2.452 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CCO[C@H](C)C1 819761685 ZIEAGLHXBIDFEL-NEPJUHHUSA-N 298.379 2.309 10 20 CECD C[C@@H](CCCCN)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 817976655 QMZIPGNAQRSQFA-QWRGUYRKSA-N 281.356 2.469 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](C)n2cccn2)c1 729534989 HGDGDRZLCNNYRH-GHMZBOCLSA-N 289.335 2.036 10 20 CECD CCCN(CC(N)=O)Cc1ccc(N(CC)CC)c(F)c1 814177488 DZMOAUHUQBJTPV-UHFFFAOYSA-N 295.402 2.369 10 20 CECD CO[C@@H]1CN(Cc2cc(-c3ccccc3)ccc2O)C[C@H]1O 825017756 YTVKWNQZQHYTMZ-QZTJIDSGSA-N 299.370 2.251 10 20 CECD C[C@@H](OC[C@@H]1CCCO1)C(=O)N[C@H](C)c1ccccc1O 827930859 SKFMWWCKZGPASK-UPJWGTAASA-N 293.363 2.154 10 20 CECD CCCN(CC(C)(C)O)C(=O)c1cc(O)cs1 829546849 TVOIKPQDZNPOPM-UHFFFAOYSA-N 257.355 2.077 10 20 CECD O=C(/C=C/c1cccnc1)N1C[C@H](O)Cc2ccccc21 493257754 GSGHQHUGLHDQIJ-MVGZEHJDSA-N 280.327 2.045 10 20 CECD COc1cccc(CNC(=O)/C=C(/C)Cl)c1O 901127526 KBHSJVLBNHHQES-VURMDHGXSA-N 255.701 2.160 10 20 CECD COc1ccc(CNC(=O)C[C@@H]2CC[C@H]3C[C@H]23)c(O)c1 831033487 WLZYKFVKXAKRLH-MJVIPROJSA-N 275.348 2.453 10 20 CECD CC(C)(C)O[C@@H]1C[C@H]1C(=O)NCc1ccccc1O 830526026 AUTOJEPEWYFELB-DGCLKSJQSA-N 263.337 2.212 10 20 CECD Nc1ccc(CCNC(=O)c2ccc(NC3CC3)nc2)cc1 832659247 WMCFBCCHDCTUSM-UHFFFAOYSA-N 296.374 2.211 10 20 CECD CC(C)[C@@H](C(=O)O)C(=O)N(C)Cc1ccc(N(C)C)cc1 843329518 LTJBBLRHESMJPA-CQSZACIVSA-N 292.379 2.068 10 20 CECD C[C@@H](CO)C1CCN(C(=O)Nc2ccc(N)cc2)CC1 846310260 KLRULTWKOPPKHQ-NSHDSACASA-N 277.368 2.141 10 20 CECD Nc1ccc(NC(=O)N[C@@H](C2CC2)[C@@H](CO)C2CC2)cc1 841299687 MOVSSNJLBIWCMU-GJZGRUSLSA-N 289.379 2.187 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@H]1CCCCN1 841032920 KAKAVERJOCRUOY-NSHDSACASA-N 272.751 2.416 10 20 CECD C/C=C\C[C@@H](CO)NCc1ccc(N(C)C)cc1C 840938396 OLWJNTYEKJLTDT-YVACAVLKSA-N 262.397 2.478 10 20 CECD CC[C@@H](C[C@@H](C)CO)NCc1cccc(OC)c1O 743499641 LKMNZKXEPWSJTC-YPMHNXCESA-N 267.369 2.288 10 20 CECD COC1([C@H](C)NC(=O)N(C)Cc2ccccc2O)CCC1 840451837 CPYJKNBTUURORP-LBPRGKRZSA-N 292.379 2.491 10 20 CECD C[C@H](N[C@@H](CO)CCF)c1cc(Cl)ccc1O 846209844 VUJDFTVEQAMKDZ-WCBMZHEXSA-N 261.724 2.417 10 20 CECD CCN(C(=O)NCCc1ccc(N)cc1)C1CCC1 841955271 XYEFJIHRVYZGTQ-UHFFFAOYSA-N 261.369 2.395 10 20 CECD COC1(C(=O)NCc2ccc(N(C)C)c(F)c2)CCCC1 754206061 CYHLHEUOWWKDID-UHFFFAOYSA-N 294.370 2.467 10 20 CECD Cc1nnsc1C(=O)NCc1cc(Cl)ccc1O 857547528 INJANHTXJJBALL-UHFFFAOYSA-N 283.740 2.136 10 20 CECD C[C@H](N[C@@H]1CCN(C)[C@@H](C)C1)c1cc([N+](=O)[O-])ccc1O 756610040 HCSJXMUZZSKTED-SDDRHHMPSA-N 293.367 2.434 10 20 CECD C/C=C/C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 752152375 XGZKBRXDLCUZOR-XCVZWFEFSA-N 275.348 2.476 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CC23CCC3)c1 760124452 DWEHCDDPPVXVQV-GFCCVEGCSA-N 261.321 2.207 10 20 CECD Cc1csc(CCC(=O)NCc2ccccc2O)n1 768073536 WEVWQYKDHGBTDO-UHFFFAOYSA-N 276.361 2.406 10 20 CECD Cc1ccc(CN2CCC[C@H](C3OCCO3)C2)c(O)c1 876679059 BDBMAIKSDPIDGI-AWEZNQCLSA-N 277.364 2.286 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNC2CSC2)c1O 877635598 YDTUFZHFZITTFP-UHFFFAOYSA-N 274.729 2.159 10 20 CECD Cc1ccc(CN2CC[C@H](n3cccn3)C2)c(O)c1 877544415 PJBZGTJFOXUHTF-AWEZNQCLSA-N 257.337 2.344 10 20 CECD CCOCc1nnc(NCc2ccc(OCC)cc2O)o1 777518699 XBTAIUWUMSCKHN-UHFFFAOYSA-N 293.323 2.323 10 20 CECD CC(=O)N1CCC(CNCc2ccc(C)cc2O)CC1 877009897 DUQCMZXYZNUXHB-UHFFFAOYSA-N 276.380 2.049 10 20 CECD Cc1cc(O)c(CN[C@H](CO)C[C@H]2CCCO2)cc1C 886226129 HZUCFOJEMNMQTF-LSDHHAIUSA-N 279.380 2.029 10 20 CECD CCN(C)c1ccc(CN(C)CC[C@H](C)O)cc1 773752667 IRWQOEZXZBYQER-ZDUSSCGKSA-N 250.386 2.345 10 20 CECD O=C(/C=C/c1cccc(O)c1)NCc1ccccc1O 780930358 IISCASQQJVCUBE-CMDGGOBGSA-N 269.300 2.427 10 20 CECD COC(=O)c1cnc(SCN(C)C(=O)C(C)C)s1 882174675 VSMDVNCNSOPVSO-UHFFFAOYSA-N 288.394 2.094 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@]1(C)CCCOC1 781161698 YKWFGXIUNYHMCP-KRWDZBQOSA-N 290.407 2.494 10 20 CECD CN(Cc1ncc[nH]1)Cc1c(O)cccc1Cl 894583638 IAHLQFSBIFKPEK-UHFFFAOYSA-N 251.717 2.401 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC/C=C\Cl)c1O 898431660 BPIGZJJYQQGUEM-DJWKRKHSSA-N 272.688 2.151 10 20 CECD CCCN(CCOCCOC)Cc1ccccc1O 79409803 XZNOJUCUPSVWOO-UHFFFAOYSA-N 267.369 2.267 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccccc2CN)cc1 82699675 FSCAKMXGYYMJSE-UHFFFAOYSA-N 283.375 2.141 10 20 CECD CCN(CC)c1ccc(CNC[C@@](C)(O)COC)cc1 69912567 MWUJQCPNYVSFPF-MRXNPFEDSA-N 280.412 2.020 10 20 CECD NCC[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1334753259 BNVXCWJODBONSH-INIZCTEOSA-N 273.424 2.458 10 20 CECD Nc1ccc(CN2CC[C@@H](Oc3ccncc3)C2)cc1 1262488010 NADDRLJSWBZKBX-MRXNPFEDSA-N 269.348 2.317 10 20 CECD CC(=O)NC1CCC(N(C)Cc2ccc(N)cc2)CC1 1356083139 LENOGFULSZAYLV-UHFFFAOYSA-N 275.396 2.148 10 20 CECD C[C@@H]1CN(Cc2ccc(N)cc2)c2ccccc2C(=O)N1 1576808745 IBEADHVSRZJRDP-GFCCVEGCSA-N 281.359 2.407 10 20 CECD C[C@H](N[C@H]1COC(C)(C)C1)c1cc(C(=O)O)ccc1O 1593232830 PHHJOKKXHDJKRH-GXSJLCMTSA-N 279.336 2.309 10 20 CECD C[C@H](N[C@H]1C[C@H](O)C12CCC2)c1cc(C(=O)O)ccc1O 1593217847 DAIYBPDQQNXAHF-HERUPUMHSA-N 291.347 2.045 10 20 CECD COc1cccc([C@H](C)N[C@@H](C(=O)O)C(C)C)c1O 1594123544 NHRBPKKFIKMMRA-JOYOIKCWSA-N 267.325 2.161 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)[C@@](C)(C(=O)O)C2)c1O 1599392882 VIDLZTVWKANZHW-ZBEGNZNMSA-N 293.363 2.252 10 20 CECD CCc1nc(CNCc2ccc(C(=O)O)cc2O)cs1 1776986118 JFIIUCSWYKZMGP-UHFFFAOYSA-N 292.360 2.399 10 20 CECD C[C@]1(C(=O)O)CC[C@H](NCc2ccc3c(c2)CCO3)C1 1776501066 YFEHQDIWOKNNCT-BBRMVZONSA-N 275.348 2.355 10 20 CECD COc1ccc(CN[C@H]2C[C@@H](NC(=O)C(F)F)C2)cc1C 1021757918 FOCULCFBLPKTOU-TXEJJXNPSA-N 298.333 2.006 10 20 CECD COc1ccc(O)c([C@H](C)NCC2CC3(C2)OCCO3)c1 927000223 GJKKFXFCSAGZEI-NSHDSACASA-N 293.363 2.205 10 20 CECD COC(=O)C1(CNCc2ccc3c(c2)CCCO3)CC1 1120039737 LREPMUHBFMDIJV-UHFFFAOYSA-N 275.348 2.054 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN[C@H]1C[C@H](O)C1 850417512 ATGAAPHBOUTEHP-KYZUINATSA-N 262.136 2.312 10 20 CECD CCN(CC)C(=O)CN(C)Cc1cccc(Cl)c1O 124495849 ACULZUROSIOEFR-UHFFFAOYSA-N 284.787 2.346 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)C1(C)C 234812167 SZOXRNGAMWTCJW-VXGBXAGGSA-N 263.341 2.204 10 20 CECD CCOc1cccc(CNC[C@@](C)(O)C(C)C)c1O 304041672 ISZCHAVTZBLBMR-OAHLLOKOSA-N 267.369 2.288 10 20 CECD O=C(N[C@@H](C1CCC1)C1CC1)c1cccc(O)c1O 325331522 ZQPDUBHZIVICSO-ZDUSSCGKSA-N 261.321 2.406 10 20 CECD OC[C@H](CC(F)F)NCc1cc(Cl)ccc1O 717712097 BNEYIDYLMHBSBX-VIFPVBQESA-N 265.687 2.151 10 20 CECD COc1ccc(O)c(CN(CCCCO)C2CC2)c1 305768603 IQOQUTGWWMJJFY-UHFFFAOYSA-N 265.353 2.138 10 20 CECD COCCOC(=O)c1cc(C)n(-c2ccccn2)c1C 120089510 NBNBOIFYQACXCV-UHFFFAOYSA-N 274.320 2.292 10 20 CECD C[C@@H](NCc1ncn(C)n1)c1cc2c(cc1O)CCCC2 186214464 SZTWTTPOYLCPPD-LLVKDONJSA-N 286.379 2.250 10 20 CECD Cc1cc(NC(=O)CSc2nccs2)no1 48874330 ZEZIVHJXNLZOMX-UHFFFAOYSA-N 255.324 2.170 10 20 CECD COc1cccc(CNC(=O)c2ccnc(F)c2F)c1O 194477354 RTOZXDKSBRMFKX-UHFFFAOYSA-N 294.257 2.004 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccnc1S 48606760 PKOFDBVUSQBFIW-UHFFFAOYSA-N 274.345 2.348 10 20 CECD CCn1nncc1CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 527918868 FJWAXRJOBBWWJW-CABZTGNLSA-N 290.342 2.481 10 20 CECD CCCOc1ccc(CNC[C@@H](O)C2CC2)c(O)c1 265254586 PDPXFWZFQKMPCB-OAHLLOKOSA-N 265.353 2.042 10 20 CECD CC[C@H]1C[C@H](CC(=O)NCc2ccc(O)c(O)c2)CCO1 272882227 VOVZODLKLRJACO-YPMHNXCESA-N 293.363 2.309 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCO[C@@H](C(C)C)C2)c(O)c1O 272909354 CVNDAMNVSGZSPF-DGCLKSJQSA-N 293.363 2.340 10 20 CECD CC[C@H]1C[C@@H](C(=O)NCc2ccccc2O)CCO1 272570361 RVJZUKNOLUSJSC-AAEUAGOBSA-N 263.337 2.214 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C(=O)OC)cc1F 272430819 QLFYQRPFXSYVMZ-NSHDSACASA-N 282.359 2.323 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc2c1CCNC2 388445874 VEZZKLLXKDJAGO-UHFFFAOYSA-N 296.370 2.310 10 20 CECD Nc1ccc(CC(=O)Nc2ccccc2-n2cncn2)cc1 386009901 FNYYOKIXOVYRBX-UHFFFAOYSA-N 293.330 2.031 10 20 CECD COC(=O)[C@H](CC(C)(C)C)OC(=O)c1cccc(O)c1O 801858993 RFULOXVINVFJFZ-NSHDSACASA-N 296.319 2.232 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@H](O)C1CC1 809752212 PKDQATOHPOUNBH-HNNXBMFYSA-N 266.360 2.094 10 20 CECD COC(=O)c1cnc(SCc2cnns2)s1 298463848 YWEMLMIONXJIDV-UHFFFAOYSA-N 273.364 2.074 10 20 CECD Cc1nonc1CNCc1cccc(Cl)c1O 809745653 YNGXBJWMEZOZBO-UHFFFAOYSA-N 253.689 2.027 10 20 CECD COc1cccc(O)c1CN1CCCc2n[nH]cc21 811497481 OYRVZVHXQOLGGS-UHFFFAOYSA-N 259.309 2.077 10 20 CECD COC(=O)[C@H](C)NCc1cc(Cl)c(C)cc1O 825691795 BNTXRNSHHJOXIT-QMMMGPOBSA-N 257.717 2.005 10 20 CECD CN(CCc1ccns1)c1ccc(OCC(=O)O)cc1 903603301 NJKPIRFIGBVIPK-UHFFFAOYSA-N 292.360 2.285 10 20 CECD COc1ccc(CNC(=O)NCCC(C)(F)F)c(O)c1 836504770 AMVXQDXFBGQXIS-UHFFFAOYSA-N 288.294 2.245 10 20 CECD O=C(c1cc(O)cs1)N1C[C@@]2(CCCO2)[C@@H]1C1CC1 832926971 JQYSRXKAXDCMBC-JSGCOSHPSA-N 279.361 2.237 10 20 CECD C[C@@H](NCCOCCN(C)C)c1ccc(Cl)cc1O 841751794 KBENSEQVASQMPX-LLVKDONJSA-N 286.803 2.274 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CCCNC2)cc1 841043659 UUKMHSCAZSIUPE-OAHLLOKOSA-N 261.413 2.374 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1cccc(Cl)c1O 840957211 JQQBVNCDZLTNIL-LBPRGKRZSA-N 283.755 2.477 10 20 CECD COc1ccc(CN[C@@H](C)[C@H]2CCCNC2)cc1C 841032849 GEPVHLODUSXTPD-ZFWWWQNUSA-N 262.397 2.481 10 20 CECD Cc1cccc(CNCC2(CS(C)(=O)=O)CCC2)c1O 840975866 RZTMVCOUCHFJOY-UHFFFAOYSA-N 297.420 2.005 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@@H](C)N1 843048952 BMOWDVSKEBIFDJ-RKDXNWHRSA-N 299.758 2.136 10 20 CECD CCn1cnnc1NCc1c(O)cccc1Br 922661567 NSLKHWUHXPXEMW-UHFFFAOYSA-N 297.156 2.378 10 20 CECD CCc1cccc(CNC(C)(C)C(=O)N2CCCC2)c1O 848907623 GFYAXYWBQBMZJU-UHFFFAOYSA-N 290.407 2.445 10 20 CECD NC[C@H]1CCCC[C@@H]1NCc1cc(F)ccc1O 841031324 ROTYXBNHUPSCTB-MFKMUULPSA-N 252.333 2.138 10 20 CECD CO[C@@H](C)CCC(=O)N[C@H](C)c1ccccc1O 827940702 IDLZDUTUSMUPOO-WDEREUQCSA-N 251.326 2.385 10 20 CECD COc1ccc(N(C)C[C@H]2COC(C)(C)O2)cc1F 851808219 MHFXWBSXAOUIRG-NSHDSACASA-N 269.316 2.422 10 20 CECD CCC[C@@H](C)S(=O)(=O)NCc1ccc(N(C)C)cc1 757745267 SWCAIURIDBHQIL-GFCCVEGCSA-N 284.425 2.361 10 20 CECD Cc1cc(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)n[nH]1 756585956 OZAJJZAEUROZDD-SECBINFHSA-N 276.296 2.183 10 20 CECD C[C@H](N[C@H]1CCN(C)[C@H](C)C1)c1cc([N+](=O)[O-])ccc1O 756610047 HCSJXMUZZSKTED-WOPDTQHZSA-N 293.367 2.434 10 20 CECD COC1(C)CN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 767164668 QFSZPPFVWMDVAR-UHFFFAOYSA-N 299.374 2.350 10 20 CECD CC[C@@](C)(NCc1ccc(OC)c(C)c1)C(=O)OC 930151111 CZYVCHWPCHJDBQ-OAHLLOKOSA-N 265.353 2.435 10 20 CECD Cc1noc(C)c1Cn1cc(COc2ccc(N)cc2)nn1 864635450 VHAVQPOAMRBLOK-UHFFFAOYSA-N 299.334 2.092 10 20 CECD COc1cc(O)c(CNC2(CO)CCCCC2)cc1OC 762788049 STRQLTLCCDOCQI-UHFFFAOYSA-N 295.379 2.194 10 20 CECD COc1cc(Cl)cc(CN(CCO)CC2CC2)c1O 761194710 FQYQQSHZWHAPAZ-UHFFFAOYSA-N 285.771 2.259 10 20 CECD CCc1csc(CC(=O)N(C)c2ccc(N)cc2)n1 877075823 IUJBUQLFMWLQSU-UHFFFAOYSA-N 275.377 2.493 10 20 CECD Cc1cnccc1CCNC(=O)/C=C\c1ccc(O)c(O)c1 779542381 OTQQIZWYLBPKFK-HYXAFXHYSA-N 298.342 2.173 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CC[C@H](C)C2)c1 776477704 UOUKQJZBXQVLHS-QWRGUYRKSA-N 263.337 2.453 10 20 CECD CCN(C)c1ccc(CN2CCC[C@H]2CCO)cc1 773848988 RCDLVPUWRYFOIU-INIZCTEOSA-N 262.397 2.490 10 20 CECD CO[C@@H](CNC(=O)NCc1ccc(N)cc1)C(C)(C)C 1120677530 RNWAYZLIMITFKF-ZDUSSCGKSA-N 279.384 2.129 10 20 CECD OCCN(Cc1cc(F)cc(F)c1O)C1CCCC1 893872196 URWDALGQXBYMJX-UHFFFAOYSA-N 271.307 2.407 10 20 CECD COc1cc(C)cc(CNCc2nn(C)cc2Cl)c1O 894896433 XGSCEKMNXWHSMP-UHFFFAOYSA-N 295.770 2.386 10 20 CECD O=C1NC(=S)S/C1=C/c1c(F)ccc(O)c1F 794927290 QAQHCTXUOUKGNT-XVNBXDOJSA-N 273.285 2.159 10 20 CECD CC[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccc(C)cc1O 794800022 BFEMEYPHCDPTPZ-ZIAGYGMSSA-N 276.380 2.362 10 20 CECD CCOCCN(Cc1ccccc1O)C[C@@H]1CCCO1 72952751 YXMMQCPYXJWQGB-HNNXBMFYSA-N 279.380 2.410 10 20 CECD CC[C@@H](N[C@H]1CCN(CCOC)C1)c1ccccc1O 274931798 RAHCNESVELSBJS-DZGCQCFKSA-N 278.396 2.154 10 20 CECD CO[C@@H]1CC[C@H](NC(=O)NCc2cc(C)ccc2O)C1 1332649064 ATQYWIGHLRGLDK-QWHCGFSZSA-N 278.352 2.067 10 20 CECD CCN(CC)CC[C@@H](C)NC(=O)c1cc(O)cs1 1348863803 DCHOUGRETCSIEC-SNVBAGLBSA-N 270.398 2.304 10 20 CECD O=C(O)CC1(NCc2cccc(Cl)c2O)CCOCC1 1608688762 UNTZZTQDVKJVRJ-UHFFFAOYSA-N 299.754 2.159 10 20 CECD COc1ccc(O)c(CNCc2cc(C)c(C(=O)O)o2)c1 1599598950 WJPGUIABUUHERC-UHFFFAOYSA-N 291.303 2.290 10 20 CECD CC(C)CCC(=O)NCCc1ccc(O)c(O)c1 156653466 NCJAFFFEMLJRGJ-UHFFFAOYSA-N 251.326 2.193 10 20 CECD Cc1ccc(O)c(CNCc2ccc(CO)cc2)c1 227458288 HRPQUACDZZVIFV-UHFFFAOYSA-N 257.333 2.483 10 20 CECD COCC[C@](C)(O)CN[C@@H](C)c1ccc(C)cc1O 185467721 QNZIWECOGNTLQQ-WFASDCNBSA-N 267.369 2.139 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@@H](C)c1cc(F)ccc1O 94617745 AAVGUNQUIHHKLH-MNOVXSKESA-N 282.359 2.487 10 20 CECD CCOc1cccc(CN[C@@]2(CC)CCOC2)c1O 378775918 NBCDICAQZYQENQ-HNNXBMFYSA-N 265.353 2.450 10 20 CECD C[C@H]1CNCCN1Cc1cc(Cl)cc(Cl)c1O 722381434 CONFQYXOZPYEJV-QMMMGPOBSA-N 275.179 2.493 10 20 CECD C[C@H](NCC1CC2(C1)OCCO2)c1cc(F)ccc1O 927000803 JWONKTXPVVPXKT-JTQLQIEISA-N 281.327 2.335 10 20 CECD O=C(c1cccc(O)c1O)N1CCOc2ccccc2C1 126404673 RQVMMQWLFZXQSR-UHFFFAOYSA-N 285.299 2.133 10 20 CECD COC[C@@H](O)CCN[C@@H](C)c1cc2c(cc1O)CCCC2 186203067 YKBYBKNKYOZDON-WFASDCNBSA-N 293.407 2.319 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccccc2O)C[C@@H]1C 188109004 IIUSLODHVDZUEL-AAEUAGOBSA-N 263.337 2.023 10 20 CECD CSC[C@@H](CCO)N[C@H](C)c1cc(F)ccc1O 185531035 KVNLZPVSELAXLC-MWLCHTKSSA-N 273.373 2.296 10 20 CECD CCOc1ccc(O)c(CNC[C@@H]2CC[C@@H](O)C2)c1 188828740 NUQQIBWYSALXNZ-DGCLKSJQSA-N 265.353 2.042 10 20 CECD CC[C@@H](NC[C@H]1CCCS(=O)(=O)C1)c1ccccc1O 283963455 FBXJAAGVYPNIAF-TZMCWYRMSA-N 297.420 2.258 10 20 CECD COc1ccc(O)c(CN2CCSC[C@@H]2C)c1 180246496 CFUVVPDGOMTVAM-JTQLQIEISA-N 253.367 2.338 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCOC(C)(C)C2)c(O)c1 185361473 PBRAKAYAEDEUGD-CQSZACIVSA-N 292.423 2.462 10 20 CECD CN(C)c1ccc(CN2CCN(CC3CC3)CC2)cc1 194063085 KHZXNXWFUNQFRX-UHFFFAOYSA-N 273.424 2.280 10 20 CECD Cc1nc(CCN(C)Cc2c(O)cccc2Cl)no1 271158758 IBRUICLJMDIHKI-UHFFFAOYSA-N 281.743 2.412 10 20 CECD C[C@H](NCCCn1cccn1)c1cc([N+](=O)[O-])ccc1O 273403847 NZKHZOHTDJLJNR-NSHDSACASA-N 290.323 2.238 10 20 CECD O=C(c1cccc(O)c1O)N1Cc2ccccc2CO1 377145968 DJZZSHBKWKWIOV-UHFFFAOYSA-N 271.272 2.185 10 20 CECD CCN(C)C(=O)CN[C@@H](C)c1c(C)cc(C)cc1O 294271859 LVYXNCDASBPNJC-LBPRGKRZSA-N 264.369 2.138 10 20 CECD C[C@@H]1CSC[C@H]1NC(=O)N(C)Cc1ccccc1O 807476295 CQUJUCGIDWQIIA-ZYHUDNBSSA-N 280.393 2.285 10 20 CECD Cc1cccc(CN2CC[C@@H](C(=O)N3CCCC3)C2)c1O 290553980 RZKVGAJYSBTRML-OAHLLOKOSA-N 288.391 2.145 10 20 CECD Cc1ccc(C(=O)N2C[C@H](CO)c3ccccc32)c(O)c1O 817796480 MVCNPJVNKFNINQ-LLVKDONJSA-N 299.326 2.143 10 20 CECD C[C@@H](NC[C@@H](N)c1ccc(N(C)C)cc1)C1CCOCC1 817941454 JVCWJZCDDNWFIC-CXAGYDPISA-N 291.439 2.157 10 20 CECD CCOc1ccc(CN2CC(O)(c3ccccc3)C2)c(O)c1 811508932 LMHHQNSPEYWPSS-UHFFFAOYSA-N 299.370 2.494 10 20 CECD COCCOCCNCc1ccc2ccccc2c1O 816539468 HFTCGXPGTQIVCG-UHFFFAOYSA-N 275.348 2.298 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCCC1(O)CCC1 817788892 KNIYFPSVHQIYSD-UHFFFAOYSA-N 292.379 2.229 10 20 CECD O=C(CC1CC(F)(F)C1)NCc1ccc(O)c(O)c1 827317175 PFEWDFWHOAWAEF-UHFFFAOYSA-N 271.263 2.149 10 20 CECD Cc1cc(CN2CCC[C@@H](n3ccnn3)C2)ccc1N(C)C 823468332 FUXONKNYFAIYKB-MRXNPFEDSA-N 299.422 2.490 10 20 CECD COCc1ncsc1C(=O)N[C@H](C)c1ccccc1O 827946523 KWBMHNVUTRNUCF-SECBINFHSA-N 292.360 2.486 10 20 CECD O=C(CN[C@@H]1CCc2cccc(O)c21)NC1CCCC1 834645716 JVWRQRBISBENIE-CYBMUJFWSA-N 274.364 2.028 10 20 CECD COc1cccc([C@H](C)N[C@@H](CO)CC2CC2)c1O 846157376 MARSSZCLNNVSBG-CMPLNLGQSA-N 265.353 2.212 10 20 CECD O=C(N[C@@H]1CCCN2CCCC[C@@H]12)c1cc(O)cs1 848392137 VIJOFVITTRAPGC-NEPJUHHUSA-N 280.393 2.200 10 20 CECD C[C@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@@H]1C 841958338 PIVRTAIQQGQXHG-RYUDHWBXSA-N 261.369 2.109 10 20 CECD C[C@H](Cc1nc(Cc2ccc(N)cc2)no1)n1ccnc1 844905755 FZCZHPDGYBQXAJ-LLVKDONJSA-N 283.335 2.243 10 20 CECD C[C@H](C(=O)NCCc1ccc(N)cc1)c1ccccn1 843342879 QYLIAUNVYWFPOX-LBPRGKRZSA-N 269.348 2.126 10 20 CECD COC/C(C)=C/C(=O)NCc1ccc(N(C)C)c(F)c1 844358428 WVWWNTKYWXGNLJ-YRNVUSSQSA-N 280.343 2.101 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2CCCN2)cc1 841035268 JLRMFPCALQHVDY-OAHLLOKOSA-N 261.413 2.374 10 20 CECD CCN(CC)c1ccc(CN[C@H](CCOC)C(=O)O)cc1 841807279 POIMLXVRQRFOLD-OAHLLOKOSA-N 294.395 2.112 10 20 CECD C[C@H](N[C@H]1C[C@H](CO)C1)c1cc(F)cc(F)c1O 927148821 UUNFJJUNSSRACJ-NRPADANISA-N 257.280 2.092 10 20 CECD Nc1ccc(CCNC(=O)NCCCc2ccco2)cc1 851664525 DFJIRIRBIBJANE-UHFFFAOYSA-N 287.363 2.336 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1ccsn1 857548831 WJLHEEOGWHDQPR-UHFFFAOYSA-N 268.725 2.432 10 20 CECD C[C@H](N[C@H](C)CC[S@@](C)=O)c1cc(F)cc(F)c1O 756742350 KYKKMGDOHDIDQU-BLBZPCKPSA-N 291.363 2.478 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2COC[C@H]2C)c1O 699846509 IQEGEMYVMBSZSY-LDYMZIIASA-N 271.744 2.179 10 20 CECD Cc1ccc(O)c(CNCc2ccc3c(c2)C(=O)NCC3)c1 757945454 XTANBTAYQUZJCX-UHFFFAOYSA-N 296.370 2.276 10 20 CECD Cc1cc(O)c(CN[C@H](CO)CC(F)(F)F)cc1C 756993454 AZIUGLAZXXIFBW-NSHDSACASA-N 277.286 2.412 10 20 CECD CC1(F)CCN(C(=O)c2cccc(O)c2O)CC1 871074932 ONDYPCVNHJXAHL-UHFFFAOYSA-N 253.273 2.062 10 20 CECD O=C(NC[C@H]1CCCCN1C1CC1)c1cc(O)cs1 765943113 GEEKPMKICITXME-LLVKDONJSA-N 280.393 2.200 10 20 CECD CCCNC(=O)CN(CCC)Cc1c(O)cccc1OC 768929665 JMWSCXZZKAEUGY-UHFFFAOYSA-N 294.395 2.139 10 20 CECD CCOC(=O)[C@@H](NCc1cc(OC)ccc1O)C(C)(C)C 768524272 NDRZTRGEZVOGMW-CQSZACIVSA-N 295.379 2.468 10 20 CECD COc1ccc(CNCc2ccno2)cc1Cn1cccn1 877323361 ZNPXXEQANHWGRF-UHFFFAOYSA-N 298.346 2.218 10 20 CECD Cc1cccc(O)c1CN(C)CCc1cnccn1 877171775 KWGONVTUDUMOTP-UHFFFAOYSA-N 257.337 2.165 10 20 CECD Cc1ccc(CN2CC[C@H](C)[S@@](=O)CC2)c(O)c1 877476770 MWHNYQITGBLTMJ-SGTLLEGYSA-N 267.394 2.044 10 20 CECD CCCOc1ccc(CN[C@H](CCO)COC)cc1C 873058046 IHCVOTKAVKKBPD-OAHLLOKOSA-N 281.396 2.271 10 20 CECD COCCN(CC(=O)OC(C)(C)C)Cc1ccccc1O 779003276 UPWBVARPUOWCBN-UHFFFAOYSA-N 295.379 2.182 10 20 CECD C[C@H](NC[C@@H]1CN2CCC[C@H]2CO1)c1c(O)cccc1F 886524701 PCMFUYREQSVEHT-RWMBFGLXSA-N 294.370 2.045 10 20 CECD O=C1CN(Cc2c(O)ccc(Cl)c2F)CN1CC1CC1 789775298 JPSAIVKLXBZPGA-UHFFFAOYSA-N 298.745 2.196 10 20 CECD C[C@H]1[C@@H](C)N(Cc2cc(F)cc(F)c2O)CC[S@]1=O 894039690 LMFGNKMLKNNIBK-BLBZPCKPSA-N 289.347 2.012 10 20 CECD COc1cc(C)cc(CN[C@H]2c3ccccc3C[C@@H]2O)c1O 894340528 PKOAKGHWNCTJPP-RDJZCZTQSA-N 299.370 2.457 10 20 CECD OC[C@H]1CCCN(Cc2cc(F)cc(F)c2O)CC1 894866017 DCEFQCCURYTUAK-JTQLQIEISA-N 271.307 2.265 10 20 CECD C[C@H](O)C[C@@H](C)NCc1cc(Cl)cc([N+](=O)[O-])c1O 782981099 XWAXIFMHSRNCDR-SFYZADRCSA-N 288.731 2.203 10 20 CECD COc1ccc(CN2CC[C@@]3(CCOC3)C2)c(O)c1OC 892175091 JUDNZAWANRMPHG-MRXNPFEDSA-N 293.363 2.022 10 20 CECD C[C@@]1(O)CCCN(Cc2cc(F)cc(F)c2O)CC1 894603076 KFLQWCFWIUPCJT-CQSZACIVSA-N 271.307 2.407 10 20 CECD Cc1ccc([C@@H](C)NCC2(C)OCCO2)c(O)c1 186211932 ZIHMCLUNAXZFAA-LLVKDONJSA-N 251.326 2.114 10 20 CECD COc1ccc(CNC2CC(SC)C2)c(O)c1 708311593 UNAWCQOTXKYHSV-UHFFFAOYSA-N 253.367 2.384 10 20 CECD CC[C@@H](F)C(=O)NCc1ccc(N2CCOCC2)c(F)c1 1335731579 SJTLCPGBRGSOOZ-GFCCVEGCSA-N 298.333 2.027 10 20 CECD CN1CCCc2cc(CNCC3(C)COC3)ccc21 94721795 KIYHLYRSABRNAD-UHFFFAOYSA-N 260.381 2.195 10 20 CECD O=C(CC(F)(F)C(F)F)NCc1cccc(O)c1O 1520508445 BLCPGWDZIUNUTF-UHFFFAOYSA-N 281.205 2.005 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC[C@H](C(=O)O)C1 1600236306 RWZNYGPJLSVTPV-GXTWGEPZSA-N 276.380 2.404 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCc1ccco1 160014991 UMXAUQYEYIMJLI-GQCTYLIASA-N 273.288 2.063 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(CO)CCOCC2)c1 186149569 IKWLLMFMQSMMAC-ZDUSSCGKSA-N 279.380 2.140 10 20 CECD CCOC[C@H]1CCCCN1C(=O)c1cccc(O)c1O 313490717 YZFRCBYINRQAES-LLVKDONJSA-N 279.336 2.129 10 20 CECD CCCOc1ncc[nH]c1=NCc1ccccc1O 527863486 CBUNTZYOAVRFOF-UHFFFAOYSA-N 259.309 2.005 10 20 CECD CCOC[C@H]1CN(Cc2c(O)cccc2Cl)CCO1 529667138 RCOZWSVLHPADEE-LLVKDONJSA-N 285.771 2.283 10 20 CECD CN(C)c1ccc(CNC(=O)NCCC2CC2)cc1F 174057256 OPTRXBDGSZKDSC-UHFFFAOYSA-N 279.359 2.491 10 20 CECD COCCN(Cc1cc(OC)ccc1O)CC(F)(F)F 179900831 FENCLPQHAVFAFN-UHFFFAOYSA-N 293.285 2.412 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cc(Cl)c[nH]1 156722604 QOVYTLQTXIHVOT-UHFFFAOYSA-N 280.711 2.052 10 20 CECD COC(=O)C[C@@H]1CSCCN1Cc1cccc(C)c1O 180401417 XSIYZSLYRQTKSZ-CYBMUJFWSA-N 295.404 2.181 10 20 CECD COCCC[C@@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 186425157 DVYWIMYJHIRTLE-VXGBXAGGSA-N 295.379 2.208 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)C[S@](C)=O)c1 186540040 PTZOGMSTAVEPIP-RVPKQNPDSA-N 255.383 2.118 10 20 CECD COC(=O)[C@@H](C)NCc1cc(Cl)cc(Cl)c1O 42304409 PYOFLXGKOHBRRG-ZCFIWIBFSA-N 278.135 2.350 10 20 CECD CC(C)NC(=O)NCc1ccc(N2CCCC2)cc1 47575361 ROIYGMAFOKZJBV-UHFFFAOYSA-N 261.369 2.494 10 20 CECD CCCN(Cc1ccccc1O)[C@@H](C)CN1CCOCC1 91587908 FYENVMHZJFSOBO-HNNXBMFYSA-N 292.423 2.325 10 20 CECD COC(=O)c1cnc(SC[C@@H]2CCCO2)s1 295160698 GUSIXJYCDLIDHY-ZETCQYMHSA-N 259.352 2.201 10 20 CECD CCn1nncc1CN[C@@H](C)c1ccc(C)c(C)c1O 527919186 FNEQJLAWQMMHET-LBPRGKRZSA-N 274.368 2.471 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cn1cccn1 264119768 RLJFJBIOHDTHHI-UHFFFAOYSA-N 273.336 2.028 10 20 CECD CC(C)N1C[C@H](N[C@@H](C)c2ccc(F)cc2O)CC1=O 273461795 IHDAUCQFXPGTEF-CMPLNLGQSA-N 280.343 2.191 10 20 CECD CCNC(=O)[C@H](C)N[C@H](C)c1cc(Cl)ccc1O 273407093 ORFPYTFZRLAYES-BDAKNGLRSA-N 270.760 2.221 10 20 CECD CC[C@H](NC[C@@H](CO)[C@@H]1CCOC1)c1ccccc1O 280782324 GYJRYSCZWOUNOD-IPYPFGDCSA-N 279.380 2.078 10 20 CECD CC[C@@H](NCC(F)(F)CO)c1ccc(C)cc1O 280128253 OSPUVZKGLDUSOF-LLVKDONJSA-N 259.296 2.369 10 20 CECD Cn1nc(NC(=O)c2c(F)ccc(O)c2O)cc1C1CC1 296169517 TWVUGUIQULJAMW-UHFFFAOYSA-N 291.282 2.100 10 20 CECD COC(=O)c1cnc(SCCOCC(F)F)s1 295390395 UZVNIAFLCQVXNA-UHFFFAOYSA-N 283.321 2.304 10 20 CECD CCN(Cc1ccc(N(C)C)c(C)c1)[C@@H](C)CO 293265163 BOBLSDMLQKHTSZ-ZDUSSCGKSA-N 250.386 2.264 10 20 CECD CO[C@H](C)CN(C)Cc1ccc(N2CCOCC2)c(F)c1 809717026 BXTKKUNLACEMBW-CYBMUJFWSA-N 296.386 2.129 10 20 CECD COc1cccc(O)c1CN1C[C@H](CO)c2ccccc21 816637251 XXBANOJXCYBRLO-GFCCVEGCSA-N 285.343 2.497 10 20 CECD COCCOC[C@H](C)NCc1cc(Cl)c(F)cc1O 816554474 ZMSRKWXWRSMTPV-VIFPVBQESA-N 291.750 2.326 10 20 CECD COC(=O)[C@H](NCc1cc(Cl)c(C)cc1O)C1CC1 825666438 JVBXNHCXBXPVBV-CYBMUJFWSA-N 283.755 2.395 10 20 CECD C[C@H](NC(=O)c1ccc(C=O)n1C)c1ccc(N(C)C)cc1 829817216 LBAUWHKHGISPPS-LBPRGKRZSA-N 299.374 2.395 10 20 CECD COc1cccc(NCc2cc(OC)c(OC)cc2O)n1 826768537 BWPLOBABEWFDSB-UHFFFAOYSA-N 290.319 2.425 10 20 CECD CC[S@@](=O)CCNCc1cc(Cl)c(C)cc1O 825282922 AVBUJTCDXUAGFV-QGZVFWFLSA-N 275.801 2.212 10 20 CECD NC(=O)C[C@@H](NC(=O)c1cc(O)cs1)C1CCCCC1 829567177 ZXMLJRHHOPBCTJ-LLVKDONJSA-N 296.392 2.008 10 20 CECD O=C(O)COc1cccc(NC(=O)c2cc(O)cs2)c1 739842343 HMHZEIKHQZKNFS-UHFFFAOYSA-N 293.300 2.169 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCc3n[nH]cc3C1)CC2 834680703 GFKZBGWIPRITTR-TZMCWYRMSA-N 269.348 2.250 10 20 CECD CN(C)c1ccc(CN2CC(OCC(F)F)C2)cc1 839137581 BOQHVSSYUOVGCH-UHFFFAOYSA-N 270.323 2.219 10 20 CECD COCCOC[C@H](C)N[C@@H]1CCc2cccc(O)c21 834667882 CPLIKRGHCCOIDC-WCQYABFASA-N 265.353 2.021 10 20 CECD Cc1noc([C@H]2CCCN(C(=O)c3cc(O)cs3)C2)n1 731869728 DAGZTZMOMOTIBW-VIFPVBQESA-N 293.348 2.165 10 20 CECD C[C@@H](NC[C@]1(C)CCC(=O)N1)c1cc(Cl)ccc1O 834909559 SKKQPOAJKCSXLN-OTYXRUKQSA-N 282.771 2.365 10 20 CECD O=C1[C@@H](NCc2cc(Cl)ccc2O)C[C@H]2CCCCN12 835074282 RIRYXUHCRIWKOR-OLZOCXBDSA-N 294.782 2.289 10 20 CECD CC[C@H](NC[C@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 846074159 VWWYEMVHNMTFSA-DOMZBBRYSA-N 288.391 2.444 10 20 CECD CC(C)[C@@H]1CCCCN1C(=O)C(=O)Nc1ccc(N)cc1 841040739 YXIZTDIXHNVFTC-AWEZNQCLSA-N 289.379 2.244 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)[C@H]2C[C@H]2C)cc1 844851607 BXVUYWPYQKSEPU-DOMZBBRYSA-N 276.380 2.246 10 20 CECD CCOCc1cc(CNC[C@@H]2CCCNC2)ccc1OC 841033012 MBRYQJIMUVGVLO-OAHLLOKOSA-N 292.423 2.321 10 20 CECD CN(C[C@@H]1CCCC[C@H]1O)C(=O)Nc1ccc(N)cc1 841295775 GDNQOHFXDUKFAW-SMDDNHRTSA-N 277.368 2.284 10 20 CECD Oc1ccccc1CN[C@@H]1CCCN2CCCC[C@@H]12 848575650 URHHWBSKPCTISU-CABCVRRESA-N 260.381 2.499 10 20 CECD Cc1cc(CN2CC[C@@H](N)[C@@H](C)C2)ccc1N(C)C 923291449 SQMIGAFBIGEWPD-DZGCQCFKSA-N 261.413 2.230 10 20 CECD CCn1cc(C(=O)NCc2cc(Cl)ccc2O)cn1 857547844 WQLLVNMRKLGWHJ-UHFFFAOYSA-N 279.727 2.192 10 20 CECD O=C(c1cc(O)cs1)N(CCCO)Cc1ccccc1 768322810 DTYWFVNWYXGEQF-UHFFFAOYSA-N 291.372 2.479 10 20 CECD CCOc1ccc(CN2CCC[C@@](C)(O)C2)c(O)c1 769468987 RUUOXJIKSUJPLQ-OAHLLOKOSA-N 265.353 2.138 10 20 CECD Cc1cccc(O)c1CNCc1cccc(N(C)C)n1 877117506 FLIINPMNUJEWQC-UHFFFAOYSA-N 271.364 2.451 10 20 CECD C[C@H](O)CCCNCc1cc(F)c(N(C)C)cc1F 1118804513 MJBFTGNCMNFQSC-JTQLQIEISA-N 272.339 2.281 10 20 CECD C[C@H]1CCc2n[nH]cc2[C@H]1C(=O)NCc1ccccc1O 878559676 NVTVKEGJGNJCJV-BONVTDFDSA-N 285.347 2.098 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@](C)(O)C(C)C 771371723 KOMFEBIWTBEJHU-MRXNPFEDSA-N 278.396 2.084 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H]1c1ncc[nH]1 779548634 WMACOUXBJVULNG-TXNVCOODSA-N 299.330 2.198 10 20 CECD CCC(=O)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881378614 QMWLOGWZIMQYLQ-UHFFFAOYSA-N 272.352 2.294 10 20 CECD C[C@@H](NC[C@@H](O)C(F)(F)F)c1c(O)cccc1F 886511008 GKSMNDKKLGWUGC-HZGVNTEJSA-N 267.222 2.105 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1c(O)cccc1F 886549507 IYSHNLZKNTXOHG-WDEREUQCSA-N 271.332 2.233 10 20 CECD C[C@@H](NCCOC[C@H]1CCOC1)c1ccccc1O 783507885 CAIDFDZUUADXNL-OLZOCXBDSA-N 265.353 2.096 10 20 CECD Oc1c(F)cc(F)cc1CN1CC(OCC(F)F)C1 894974380 CQJHVHWQEJBZJQ-UHFFFAOYSA-N 279.233 2.136 10 20 CECD COc1ccc(N2CCN(C(=O)[C@@H](F)C(C)C)CC2)cc1 784018384 WNRKEOWKBDYJMI-HNNXBMFYSA-N 294.370 2.338 10 20 CECD C[C@]1(NCc2cc([N+](=O)[O-])ccc2O)CCO[C@@H]1C1CC1 784592771 MVSUWGIBYRAKFC-CABCVRRESA-N 292.335 2.348 10 20 CECD Cn1ccnc1[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1 894779751 NTVGNFHHWLEWSI-SNVBAGLBSA-N 293.317 2.393 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NOCC(F)F 793177610 VNGKCFAZBGBVDX-UHFFFAOYSA-N 287.310 2.057 10 20 CECD COc1ccc(CNC(=O)CC[C@H]2CCCCO2)c(O)c1 794381090 KQLBIBYRRJWMJX-CYBMUJFWSA-N 293.363 2.366 10 20 CECD O=C(NCc1ccccc1O)c1ccc([N+](=O)[O-])cc1 133790584 LCFAPBDTUVTHQQ-UHFFFAOYSA-N 272.260 2.230 10 20 CECD CCOC(CN[C@H](C)c1ccccc1O)OCC 93447309 SHDDDOBHMPNFQC-LLVKDONJSA-N 253.342 2.442 10 20 CECD COC(=O)[C@@H]1CCC[C@H]1NCc1cccc(Cl)c1O 1320837922 VWLRGYZBWVJEHI-ZYHUDNBSSA-N 283.755 2.477 10 20 CECD CNCCC1CCN(Cc2cc(OC)ccc2O)CC1 70188950 POXKECHEWATSBS-UHFFFAOYSA-N 278.396 2.222 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnoc2C2CC2)c1 1331808683 VUNTWLOXVIWKAC-UHFFFAOYSA-N 272.304 2.496 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@](C)(O)CC)cc1 1351363192 MYEQWKQNBCQKKG-MRXNPFEDSA-N 278.396 2.310 10 20 CECD O=C(O)c1cccc(N2Cc3cccc(O)c3C2)n1 1606516900 XZIFBLKVJJMDIW-UHFFFAOYSA-N 256.261 2.006 10 20 CECD CCC(CC)(CNCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1603542061 NYIWQFSCWKJXAV-UHFFFAOYSA-N 296.323 2.281 10 20 CECD CCN1CCCc2cc(CNC[C@@H](C)C(=O)O)ccc21 1776876065 QAWOJPHOLVWDPW-GFCCVEGCSA-N 276.380 2.269 10 20 CECD Nc1ccc(CC(=O)NCCCN2CCCCCC2)cc1 163607825 PNYNADNGQAWECF-UHFFFAOYSA-N 289.423 2.194 10 20 CECD COc1ccc(CCNC(=O)Cc2ccc(N)cc2)cc1 19387039 VGJWXVPUYMGLNE-UHFFFAOYSA-N 284.359 2.179 10 20 CECD COc1cccc(O)c1CNCC1(O)CCC(C)CC1 853092510 WHWMQGIMRZGOPU-UHFFFAOYSA-N 279.380 2.432 10 20 CECD CCOC(=O)[C@@H](C)NCc1cc(Cl)cc(OC)c1O 229051336 MNINEDBREHNPMY-MRVPVSSYSA-N 287.743 2.095 10 20 CECD CO[C@]1(CN[C@H](C)c2cc(C)ccc2O)CCOC1 123156626 ONORRWYVXNLKIO-DOMZBBRYSA-N 265.353 2.157 10 20 CECD C[C@@H](c1ccncc1)N(C)C(=O)Cc1ccc(N)cc1 37823901 CLMZBWWVZOXRTM-LBPRGKRZSA-N 269.348 2.426 10 20 CECD OCC1(NCc2cc(F)cc(F)c2O)CCCC1 708559863 VRFAFDIUKQEOPL-UHFFFAOYSA-N 257.280 2.065 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cc(C)c(C)cc2O)C1 177220604 LXTIHVUXEWXRKV-INIZCTEOSA-N 277.364 2.394 10 20 CECD CC(C)N(C)CC(=O)NCCCSc1nccs1 114376035 CDLDTHNOXKRWKW-UHFFFAOYSA-N 287.454 2.082 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C[C@@H]1CCCO1 173201951 IWLNNJCNHPZSDW-ZDUSSCGKSA-N 290.363 2.047 10 20 CECD CC(C)C[C@H](CO)NCc1ccc(N(C)C)cc1 40773106 JBZSXVYEJXEQFB-CQSZACIVSA-N 250.386 2.249 10 20 CECD COCCCN(C)c1cc(OC)c(OC)c(OC)c1 125700610 NAAGXCXVTNIRPB-UHFFFAOYSA-N 269.341 2.185 10 20 CECD Cc1cnc(CNC(=O)/C=C/c2ccc(O)c(O)c2)s1 181128981 PGXIPGOXBSALSQ-HWKANZROSA-N 290.344 2.192 10 20 CECD Cc1cc(CC(=O)NCc2ccc(N(C)C)c(F)c2)no1 74249658 VIOATIAVMPSQNI-UHFFFAOYSA-N 291.326 2.047 10 20 CECD C[C@H](CO)NCc1cc(Cl)cc(Cl)c1O 35602840 STWLNEXZOQTOQB-ZCFIWIBFSA-N 250.125 2.169 10 20 CECD CO[C@@H](C)CN(C)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 313749881 QDZSXNNLWPZLNO-BXKUYDPTSA-N 294.307 2.164 10 20 CECD C[C@@](O)(CNCc1ccccc1O)c1ccsc1 77460789 USSVOQQICZTOMM-CQSZACIVSA-N 263.362 2.451 10 20 CECD Cc1cnc(CN2CCOc3cc(N(C)C)ccc32)o1 175023980 IZJIMGMMPMFIQW-UHFFFAOYSA-N 273.336 2.448 10 20 CECD CC(C)N(C)CCNCc1c(O)cccc1Cl 83552354 YSWIHEMWYVODAI-UHFFFAOYSA-N 256.777 2.475 10 20 CECD CN(C)C(=O)O[C@H]1CCN(Cc2cccc(Cl)c2O)C1 295122741 NLIPYOLMIJBKPB-NSHDSACASA-N 298.770 2.318 10 20 CECD C[C@@H]1CCN(C(=O)NCc2ccc(N(C)C)cc2)C1 263748611 WWMOSNOXSXVDMI-GFCCVEGCSA-N 261.369 2.304 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCC(C)(C)C)c1O 278835586 JCRJJBWMTAGDMB-UHFFFAOYSA-N 268.313 2.445 10 20 CECD Cc1ccc(O)c([C@@H](C)NCc2nnc3n2CCC3)c1 273382821 IRVJEXFAXWUJOB-LLVKDONJSA-N 272.352 2.089 10 20 CECD COc1cccc(CN2CCC(CCCO)CC2)c1O 272822965 CQIHUNDCTXWOOU-UHFFFAOYSA-N 279.380 2.385 10 20 CECD CN1CC[C@H]2CCN(Cc3ccc(N(C)C)c(F)c3)[C@@H]2C1 272661930 ROGNXQDOMWYEJP-WMLDXEAASA-N 291.414 2.418 10 20 CECD COc1ccc(O)c(CNC(C)(C)c2nc(C)no2)c1 285215982 RLNMDSNFPIFBFI-UHFFFAOYSA-N 277.324 2.117 10 20 CECD CC[C@](C)(OC)C(=O)N1CCOc2cc(N(C)C)ccc21 280249118 DIKZQSKMXSMRRY-INIZCTEOSA-N 292.379 2.293 10 20 CECD Cc1cc(C)c([C@H](C)NCC(C)(C)OCCO)c(O)c1 294114735 KGTVHSHGIAJMOB-ZDUSSCGKSA-N 281.396 2.447 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](O)CC2)cc1F 294120083 TVWNJBHMGALKHQ-CYBMUJFWSA-N 266.360 2.239 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)CSC1CC1 295411140 VGDOLNJGMOKDNH-UHFFFAOYSA-N 292.404 2.374 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2nccnc2C)c1 294852999 BLRVBCRNOIVDLN-LLVKDONJSA-N 287.363 2.393 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@H](CN)C2)c1 817982509 UFPCKBOHJSHZEM-SDDRHHMPSA-N 264.369 2.179 10 20 CECD CC[C@@H](NCC(F)(F)CN)c1ccc(N(C)C)cc1 817965537 ADUDVHJNMNEYHN-CYBMUJFWSA-N 271.355 2.387 10 20 CECD Cc1ccc(C(=O)OCc2nc(C)c(C)o2)c(O)c1O 727003596 AUVKTEISFMYAFZ-UHFFFAOYSA-N 277.276 2.368 10 20 CECD CCC(=O)C1(C(=O)N[C@H](C)c2ccccc2O)CC1 827952469 TYSGWURKKLAHFD-SNVBAGLBSA-N 261.321 2.329 10 20 CECD CN(CCc1ccccc1)CC(=O)NCc1ccccc1O 821055344 MLBMIUGKOINMQE-UHFFFAOYSA-N 298.386 2.183 10 20 CECD C/C(Cl)=C\C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 907274561 RLCNJSWHLYYFBG-QRJSTWQJSA-N 269.728 2.288 10 20 CECD C[C@@H](NC(=O)Nc1cnsn1)c1ccc(N(C)C)cc1 839121703 YWAVIFCYZBXMHE-SECBINFHSA-N 291.380 2.487 10 20 CECD COc1cnc(/C=C\c2ccc3c(c2)CCN3C)nc1O 905076984 PRGRISLUKGEUMW-XQRVVYSFSA-N 283.331 2.354 10 20 CECD CC(C)O[C@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)C1 841297647 ICXNBLDSKJAZBO-BETUJISGSA-N 263.341 2.346 10 20 CECD CCc1cccc(CN[C@H](C)C(=O)N[C@H](C)CC)c1O 848899394 FOYSAOVVYVTXDT-VXGBXAGGSA-N 278.396 2.347 10 20 CECD COc1cccc([C@H](C)N[C@@H]2C[C@H](O)C2(C)C)c1O 846165572 VVKAFHAGAADCTI-BIMULSAOSA-N 265.353 2.211 10 20 CECD CC[C@H](C)[C@](C)(O)CNC(=O)Nc1ccc(N)cc1 841300830 WQILZIQKZBLMLW-IINYFYTJSA-N 265.357 2.187 10 20 CECD COc1ccc(C)nc1NC(=O)c1cc(O)cs1 746710426 QMBURENOOREMLD-UHFFFAOYSA-N 264.306 2.418 10 20 CECD C[C@@H]1NCCC[C@H]1NCc1ccc(N(C)C)c(F)c1 841065024 LGTATRYFPZOMNF-SMDDNHRTSA-N 265.376 2.122 10 20 CECD CCCC[C@@H](CN)NC(=O)N(C)Cc1ccccc1O 841959641 YTXKVCXYHKYGLE-ZDUSSCGKSA-N 279.384 2.051 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1cccc(CC)c1O 848903504 UTLMWUQELNFTBZ-LSDHHAIUSA-N 279.380 2.238 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)Cc2cnn(C)c2)c1O 846168835 MOVCUBPQSLTABO-NWDGAFQWSA-N 289.379 2.416 10 20 CECD CC(C)NC(=S)NCc1cc(Cl)ccc1O 844584701 VXOUSBIRVISZEC-UHFFFAOYSA-N 258.774 2.418 10 20 CECD CC[C@@H](NCCN(C)C(=O)OC)c1ccc(C)cc1O 850547165 BOIJZUZRUYEBKG-CYBMUJFWSA-N 280.368 2.440 10 20 CECD Cc1nnccc1C(=O)NCCCSc1nccs1 753576085 RRDBWWOPJTUQBO-UHFFFAOYSA-N 294.405 2.154 10 20 CECD C[C@H](NCC1(CO)CC1)c1cc(Cl)ccc1O 756638005 PWJUEBNQSXDABU-VIFPVBQESA-N 255.745 2.469 10 20 CECD CNC[C@@H](C)N[C@@H](C)c1ccc(Br)cc1O 854232167 NVBVIRLDNDTUBK-BDAKNGLRSA-N 287.201 2.413 10 20 CECD CCn1cnnc1CCN[C@H](C)c1ccc(F)cc1O 756733544 PRJUMGCAFXKCJK-SNVBAGLBSA-N 278.331 2.036 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@](C)(O)C2)cc1F 862247922 OGQPSSYSGYROGY-HNNXBMFYSA-N 284.350 2.378 10 20 CECD O=C(/C=C\c1cncc(F)c1)NCc1ccccc1O 769365264 OPFWZPXPBHSRFZ-WAYWQWQTSA-N 272.279 2.256 10 20 CECD C[C@H]1C[C@H](NC(=O)c2cc(O)cs2)C[C@@H](C)O1 768575535 LJTRVYDHIZZORX-AYMMMOKOSA-N 255.339 2.140 10 20 CECD C[C@H]1OCC[C@H]1CN(C)c1ccc(OCC(=O)O)cc1 872161080 RVKZHYPEJKYRQY-NEPJUHHUSA-N 279.336 2.011 10 20 CECD C[C@@H](OC(=O)c1cccc(O)c1O)c1nc(C2CC2)no1 776282468 RVAHMRQYURCHEV-SSDOTTSWSA-N 290.275 2.276 10 20 CECD C[C@H](NCc1nnc2n1CCCC2)c1c(O)cccc1F 886590306 SCRSZQSSVWBEKL-JTQLQIEISA-N 290.342 2.310 10 20 CECD CCN1CCC[C@@H](NCc2ccc(N(C)C)cc2C)C1=O 896728554 BGWSIHPKFXPDIN-MRXNPFEDSA-N 289.423 2.162 10 20 CECD COc1ccc(CNc2cnnc(O)c2Cl)c(O)c1 795283669 GKAPZWDKLZWUCR-UHFFFAOYSA-N 281.699 2.162 10 20 CECD COc1ccc(CNC(=O)C[C@@H](C)SC)c(O)c1 794388300 WAEQGWVPYBQOFU-SECBINFHSA-N 269.366 2.159 10 20 CECD C[C@@](O)(CNCc1c(O)ccc(Cl)c1F)C1CC1 790962732 NWGQKEUVJIPAIL-CYBMUJFWSA-N 273.735 2.435 10 20 CECD CN(CC(=O)OC(C)(C)C)Cc1ccccc1O 109771622 AHJYQNUMLBGNME-UHFFFAOYSA-N 251.326 2.166 10 20 CECD C[C@@H]1COCCN1Cc1ccc(Br)cc1O 691738656 WRYUIHRXQVLMMB-SECBINFHSA-N 286.169 2.375 10 20 CECD CCOc1ccc(O)c(CN(C)C(C)(C)CC(=O)O)c1 1605696856 XIRQUSNVPPMRDR-UHFFFAOYSA-N 281.352 2.476 10 20 CECD O=C(O)CCCC(=O)NCc1c(O)ccc2ccccc12 1608708717 FEEKQLFXAOADHE-UHFFFAOYSA-N 287.315 2.417 10 20 CECD C[C@H](NCCOCC(F)F)c1cc(C(=O)O)ccc1O 1609776714 BWHCIVNNELNKPO-QMMMGPOBSA-N 289.278 2.023 10 20 CECD C[C@@H](NCC1(N)CCCC1)c1cc(C(=O)O)ccc1O 1604338185 QTAROWIWNSVVAP-SNVBAGLBSA-N 278.352 2.013 10 20 CECD O=C(O)c1cnc(SCc2nc(CC3CC3)no2)s1 1602535162 UKRZLCCRTGCMAD-UHFFFAOYSA-N 297.361 2.469 10 20 CECD COc1cccc(CNc2ccc(C(=O)O)cn2)c1O 1594129919 ZZOBUQHSAYGWPH-UHFFFAOYSA-N 274.276 2.106 10 20 CECD Cc1ccc([C@H](C)NCC(C)(C)OCCO)c(O)c1 287367627 ONBXVWKGXCJKGE-LBPRGKRZSA-N 267.369 2.139 10 20 CECD Oc1cc2c(cc1CNC1[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]13)OCO2 300558931 BAMVKWXTBLVPDU-PVFTVIPPSA-N 273.332 2.255 10 20 CECD CCOC(=O)[C@H](CC)N1CCCc2cc(CN)ccc21 700969738 OLWZMWTVPFUOFQ-AWEZNQCLSA-N 276.380 2.240 10 20 CECD O=C(N[C@H](C1CCC1)C1CC1)c1cccc(O)c1O 325331521 ZQPDUBHZIVICSO-CYBMUJFWSA-N 261.321 2.406 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(F)cc(F)c2O)CCN1C 708505694 ZQGWNDQLLDRVFR-SKDRFNHKSA-N 270.323 2.243 10 20 CECD CC(=O)c1cc(Cl)cc(CN(CCO)CC2CC2)c1O 690941922 BQHNYDHBVHBPQS-UHFFFAOYSA-N 297.782 2.453 10 20 CECD CCOc1cccc(CNC[C@@H](CO)C(C)C)c1O 394049349 YXDOROVTSGJDFI-ZDUSSCGKSA-N 267.369 2.145 10 20 CECD Nc1ccc(CC(=O)N2CCCC[C@H]2CCC(=O)O)cc1 50927213 YRAOULRJEITYNI-AWEZNQCLSA-N 290.363 2.057 10 20 CECD CN1CCCN(Cc2cccc(Cl)c2O)CC1 124495340 QUBXCEJSEONDNL-UHFFFAOYSA-N 254.761 2.183 10 20 CECD O=C(C[C@H]1CCCO1)NCCCSc1nccs1 74136469 GGKDERXYXYVAOC-SNVBAGLBSA-N 286.422 2.311 10 20 CECD COCCN(C)CCCN[C@H](C)c1ccccc1O 183415153 ZHNXJGFVBUQDBM-CYBMUJFWSA-N 266.385 2.011 10 20 CECD CCc1ccc(C(=O)NCc2ccc(O)c(O)c2)c(O)c1 188451532 SRUJFDYGQNCUNF-UHFFFAOYSA-N 287.315 2.296 10 20 CECD Cc1cc(O)nc([C@H](C)N(C)Cc2ccccc2O)n1 192669580 ZXOBPHFZFKECAJ-NSHDSACASA-N 273.336 2.389 10 20 CECD O=C(/C=C\c1ccc(O)cc1)NCCc1ccc(O)c(O)c1 147636663 KZUJJPCTENPKOE-YWEYNIOJSA-N 299.326 2.176 10 20 CECD CO[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 91772487 WBXLMZDXGKATLZ-KRWDZBQOSA-N 290.407 2.134 10 20 CECD COc1cccc(CNC(=O)[C@@H]2[C@@H](C)[C@H]2C2CC2)c1O 528858160 AAKBZMQCIQZABH-QCZZGDTMSA-N 275.348 2.309 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)CC2(CCOCC2)O1 366732920 YIYCFMMUBYVGCB-GFCCVEGCSA-N 295.354 2.301 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)C(=O)N(C)C)c(O)c1C 276918761 QLXYHMLMZMNMHZ-NEPJUHHUSA-N 264.369 2.136 10 20 CECD CCCc1nnc(NC(=O)c2cccc(O)c2O)s1 279441217 CWVUOMGQLNYGIX-UHFFFAOYSA-N 279.321 2.154 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H](CO)CCOC)cc1 281552309 JKHHXIMKZVLEJF-HIFRSBDPSA-N 280.412 2.191 10 20 CECD CC[C@H](N[C@H](C)C[S@@](C)=O)c1ccc(F)cc1O 286272468 VOYPFZPDVGEYFN-RJVCPDIVSA-N 273.373 2.339 10 20 CECD CCN(C)C(=O)[C@@H](NCc1cc(F)ccc1O)C(C)C 295116549 VWLXQBGKIUAVBD-AWEZNQCLSA-N 282.359 2.124 10 20 CECD CCN(Cc1ccc(N(C)C)c(C)c1)[C@H](C)CO 293435051 BOBLSDMLQKHTSZ-CYBMUJFWSA-N 250.386 2.264 10 20 CECD COC[C@@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@@H](C)O1 294699761 UJUMXWKMWZJUPD-ZBFHGGJFSA-N 292.423 2.297 10 20 CECD CCOc1ccc(CNC[C@@H](CO)C(C)C)c(O)c1 808421873 SLADNIZAGGXPSN-ZDUSSCGKSA-N 267.369 2.145 10 20 CECD CCOC[C@@H](O)CNc1ccccc1OCC(F)F 819460617 STIKSUMGJQFLPV-JTQLQIEISA-N 275.295 2.140 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c1O 817977120 BRRXUFYVPBUSTP-HWNAMQAFSA-N 266.772 2.222 10 20 CECD CCN(C)c1ccc(CN2CCOC[C@@H]2CCOC)cc1 815118414 HHJQTUOKZXDBNX-KRWDZBQOSA-N 292.423 2.380 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCC[C@@H](N)C2)c1 817970443 VQKVHVNDHREJHG-CYZMBNFOSA-N 292.379 2.099 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)c1cnc[nH]1 725891988 QWZZDIWSCXXFQL-UHFFFAOYSA-N 284.363 2.330 10 20 CECD C[C@@H](NC(=O)[C@@H]1CC12CCOCC2)c1ccccc1O 827937072 JVPUGFLEAFLWOL-YPMHNXCESA-N 275.348 2.386 10 20 CECD CCN(C)c1ccc([C@@H](C)NC(COC)COC)cc1 834892179 QLVQKGUEWMSHOV-CYBMUJFWSA-N 280.412 2.455 10 20 CECD Cc1cccc2c1N(C(=O)/C=C/c1cnn(C)c1)CC2 916406652 KFODLSZGZKISCM-VOTSOKGWSA-N 267.332 2.331 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(Cl)cc1O 841747539 CFYDCDGUSUQFSM-ONGXEEELSA-N 294.782 2.460 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)CCN(C)C)c1O 846142350 RROJXYKURJRRJR-VXGBXAGGSA-N 266.385 2.392 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H]2CCNC2)cc1 843049604 SQDLRASRFNEMBA-INIZCTEOSA-N 261.413 2.327 10 20 CECD CC1(C)CNCCN1Cc1cc(Cl)cc(F)c1O 843054566 TYYIMLVERNWGRN-UHFFFAOYSA-N 272.751 2.369 10 20 CECD Oc1cc2c(cc1CNCC[C@@H](O)C1CCCC1)OCO2 865875151 LLVYIFQYSUXZMC-CYBMUJFWSA-N 293.363 2.152 10 20 CECD Cc1conc1C(=O)NCc1ccc(N(C)C)c(F)c1 865051776 UVAHJEFSMZMFJN-UHFFFAOYSA-N 277.299 2.118 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2ccccc2O)CCC1=O 764071142 TZCKMWNZYQXVLD-MNOVXSKESA-N 261.321 2.014 10 20 CECD CNC(=O)[C@H]1CCC[C@@H]1NCc1cc(Cl)ccc1O 765794498 CQYHVLIZJBJZRQ-RYUDHWBXSA-N 282.771 2.050 10 20 CECD C[C@H](NC(=O)Nc1ccnn1C)c1ccc(N(C)C)cc1 775752226 DYRYXTPDTHYOOE-NSHDSACASA-N 287.367 2.369 10 20 CECD Fc1cc(CN2CC=CCC2)ccc1N1CCOCC1 779164771 ZNSPPNDQOWAJSS-UHFFFAOYSA-N 276.355 2.424 10 20 CECD COc1cc(C)cc(CNCc2ccccc2CO)c1O 894202416 HBDWSAPPLCQUET-UHFFFAOYSA-N 287.359 2.491 10 20 CECD C[C@H]1OCC[C@@]12CN(Cc1cc(F)cc(F)c1O)CCO2 894603523 ZJNMPHYIKJQCKE-MEBBXXQBSA-N 299.317 2.050 10 20 CECD CC[C@@H](C)[C@@H](OC)C(=O)NCc1ccccc1O 793679009 BNWATEJOOAZBSV-ZWNOBZJWSA-N 251.326 2.070 10 20 CECD CCC(=O)N[C@H]1C[C@H](CNCc2ccc(OC)c(C)c2)C1 982947259 RCUOMOVIZDPMFM-SHTZXODSSA-N 290.407 2.398 10 20 CECD COc1cccc(CN[C@@H](C)C2CCOCC2)c1O 134496319 MWYJZXGRQQUYNO-NSHDSACASA-N 265.353 2.306 10 20 CECD C[C@H](N[C@@H](C)c1ccccc1O)C(=O)NC(C)(C)C 135719287 XDACWZXBIDJVTG-QWRGUYRKSA-N 264.369 2.346 10 20 CECD C[C@H](CCNCc1cc(F)cc(F)c1O)N(C)C 708514884 MTBGHKZOJSMKRV-SECBINFHSA-N 258.312 2.100 10 20 CECD Oc1ccc(CCNc2ncnc3c2CCC3)cc1O 749287231 HZTCIFCHWYNISS-UHFFFAOYSA-N 271.320 2.031 10 20 CECD COc1cccc(O)c1CN1CCCN(C(C)C)CC1 768137680 MIRACMBKDDRGGR-UHFFFAOYSA-N 278.396 2.317 10 20 CECD Cc1cc(COCC(=O)N[C@H](C)c2ccccc2O)no1 1262637430 SQZMHTYTFAMELH-LLVKDONJSA-N 290.319 2.083 10 20 CECD C[C@@H]1CCN(CCNCc2cc(F)c(N(C)C)cc2F)C1 1348086784 TWIUGAZYWIAUOO-GFCCVEGCSA-N 297.393 2.462 10 20 CECD O=C(NCc1c(O)cccc1F)c1ccsc1C(=O)O 1601530788 VRQIINKWMAUJTQ-UHFFFAOYSA-N 295.291 2.221 10 20 CECD CC(C)c1ccc(O)c(CN[C@H](C)c2cnn[nH]2)c1 1575452915 AHHMZXVSOQOPTQ-SNVBAGLBSA-N 260.341 2.485 10 20 CECD NCC(F)(F)CC(=O)NCc1c(O)ccc2ccccc12 1580217355 QMFYJNAPWOBPKX-UHFFFAOYSA-N 294.301 2.146 10 20 CECD C[C@H](N[C@H]1C[C@@H](O)C12CCC2)c1cc(C(=O)O)ccc1O 1593217849 DAIYBPDQQNXAHF-QCZZGDTMSA-N 291.347 2.045 10 20 CECD CCOCCOCCN[C@@H]1CCc2cccc(O)c21 927088236 YCGYYKZFKOXQRR-CYBMUJFWSA-N 265.353 2.022 10 20 CECD COc1cccc(O)c1CN[C@H]1C[C@H](OC)C12CCC2 839182216 LRSHEGQAFDJBQL-GJZGRUSLSA-N 277.364 2.448 10 20 CECD CC[C@H](NCCc1ccnn1C)c1ccccc1O 158119794 RVXSFEZZDSGOJY-AWEZNQCLSA-N 259.353 2.409 10 20 CECD COc1cccc(CN[C@H]2CSC[C@@H]2C)c1O 285375263 CMKCZLQYFQKBHU-ONGXEEELSA-N 253.367 2.242 10 20 CECD C[C@@H](NCCc1ccnn1C)c1ccc(F)cc1O 184009324 RPWYBVPFHIQPGS-SNVBAGLBSA-N 263.316 2.158 10 20 CECD CN(C)c1ccc(CNCc2ccc(C(=O)O)o2)cc1 71380492 CDUSBGODTOJWLB-UHFFFAOYSA-N 274.320 2.334 10 20 CECD COc1cccc(CNCc2cccc(O)c2)c1O 383953940 NUKIIZFJQOIKTM-UHFFFAOYSA-N 259.305 2.396 10 20 CECD Oc1cccc2c1[C@H](NCCc1cnccn1)CC2 390066237 RSYXKKSTCWWAQW-CYBMUJFWSA-N 255.321 2.002 10 20 CECD OC[C@H](C[C@H]1CCCO1)NCc1cc(Cl)ccc1O 886229735 VBCQTNPMWJNZAJ-QWHCGFSZSA-N 285.771 2.065 10 20 CECD CCc1ncc(C(=O)NCc2cccc(OC)c2O)s1 105649290 QZMGQSXIYAHKRL-UHFFFAOYSA-N 292.360 2.350 10 20 CECD CN1CCN(c2ccc(CNCc3ccccn3)cc2)CC1 107797401 WKVFYDPSSXULRK-UHFFFAOYSA-N 296.418 2.123 10 20 CECD COc1ccc(N2CCC(NCc3ncc[nH]3)CC2)cc1 67696790 DKCUZVKDNBZLDD-UHFFFAOYSA-N 286.379 2.177 10 20 CECD OCC1(CNCc2cccc(Br)c2O)CC1 118906949 DLYKOYWLUIFIDS-UHFFFAOYSA-N 286.169 2.017 10 20 CECD C[C@@H](NCC(C)(C)N1CCOCC1)c1ccc(F)cc1O 62744979 BHZSWGWWBUHUDZ-GFCCVEGCSA-N 296.386 2.293 10 20 CECD COc1cccc(CN[C@H](C)C(=O)OC(C)(C)C)c1O 123343090 GJNWJEUIMFNZLL-SNVBAGLBSA-N 281.352 2.221 10 20 CECD COC[C@H](CCO)NCc1ccc(N2CCCCC2)cc1 219139521 JMCKKFBYPYNYGA-INIZCTEOSA-N 292.423 2.164 10 20 CECD C[C@@H](Cc1ccc(O)cc1)NC(=O)c1cccc(O)c1O 185869741 YWXFEHUNLXBLSG-JTQLQIEISA-N 287.315 2.164 10 20 CECD N#Cc1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 180796975 HYVSXFLDQHYHDW-SOFGYWHQSA-N 294.310 2.299 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCC[C@H]2C)c1O 74126046 HGVJQKRXATUURN-PWSUYJOCSA-N 278.352 2.389 10 20 CECD O=C1CCCN1C1CCN(Cc2cc(F)ccc2O)CC1 180075184 ACPFSOQSGKCPPG-UHFFFAOYSA-N 292.354 2.118 10 20 CECD CCN(CC)C(=O)CN(C)c1ccc(OC)cc1OC 132113411 WPAYVJDJJFDMOZ-UHFFFAOYSA-N 280.368 2.008 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(CCO)cc1 180854674 CQUHHFUSKYESNL-XBXARRHUSA-N 299.326 2.285 10 20 CECD CC(C)C[C@H](CNCc1cc2c(cc1O)OCO2)N(C)C 42879588 FQGFQURJMMAAGU-CYBMUJFWSA-N 294.395 2.187 10 20 CECD C[C@@H](NCc1cc(F)ccc1O)c1nnc2ccccn12 226583459 JIHQINSLSCPVTH-SNVBAGLBSA-N 286.310 2.425 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)[C@H](C)N)cc1 192098365 CURZCHLKRVDXMO-STQMWFEESA-N 277.412 2.132 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@H]1CCC[C@@H]1O 91898572 GOKUTTBQEJZCTI-ZBFHGGJFSA-N 262.397 2.345 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@H](N)C(C)(C)C)ccc21 237093117 RFKMQWZLHICTGA-OAHLLOKOSA-N 289.423 2.059 10 20 CECD CO[C@@H]1CCCC[C@@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272721484 ZNRQJLQVFQMVLR-SYFYSMEQSA-N 291.347 2.185 10 20 CECD Cc1cccc(CN2CC[C@H]3CCN(C)C[C@@H]32)c1O 272625512 MKGITCYIMNWNSH-HIFRSBDPSA-N 260.381 2.227 10 20 CECD CCC1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CC1 274978645 WVZDUNRMUPASJP-SNVBAGLBSA-N 263.337 2.335 10 20 CECD CC(C)N(CCO)Cc1cc(Cl)cc([N+](=O)[O-])c1O 271036887 LNRCDZXARSUJDJ-UHFFFAOYSA-N 288.731 2.157 10 20 CECD CC(C)OCCCN(C)C(=O)/C=C/c1ccc(O)c(O)c1 272654998 NQHGTCNUSPISJZ-SOFGYWHQSA-N 293.363 2.385 10 20 CECD Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c(C)n1C 270999827 CPUXKAZZVDSORX-UHFFFAOYSA-N 288.347 2.026 10 20 CECD OC[C@]1(NCc2cc(-c3ccccc3)ccc2O)CCOC1 273484623 LWDXVMQTAQPRKP-GOSISDBHSA-N 299.370 2.300 10 20 CECD COc1cc(O)c(CN[C@H](C)CN(C)C(C)C)cc1OC 291580543 OWIZCBSHQWVWHO-GFCCVEGCSA-N 296.411 2.228 10 20 CECD CCS(=O)(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 299101064 ZHNWKKNIBLKXQP-UHFFFAOYSA-N 282.409 2.067 10 20 CECD CCC1(CNCc2ccc(N3CCOCC3)cc2)COC1 393969913 ZBAMQDHLBVXZJI-UHFFFAOYSA-N 290.407 2.039 10 20 CECD COC[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)C(C)C 817939517 CAGXBVGVFQIDDP-CVEARBPZSA-N 279.428 2.013 10 20 CECD Cc1nc([C@@H](C)OC(=O)c2cc(O)cs2)no1 811120370 NTVUNZXYVKOKSO-RXMQYKEDSA-N 254.267 2.063 10 20 CECD CC(C)N(C)C[C@H](C)NCc1cc([N+](=O)[O-])ccc1O 810163367 RDYOEYUZOWMVRA-NSHDSACASA-N 281.356 2.119 10 20 CECD C[C@@H]1C[C@H](N[C@H]2CCCNC2)c2c(O)ccc(F)c21 817942167 XMPJMWMKSLIYNG-SCVCMEIPSA-N 264.344 2.421 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CCC[C@H](OC)C2)c1O 815834763 YFIDBDVRTUJYPO-YPMHNXCESA-N 293.363 2.222 10 20 CECD Cn1ncc(CCCNCc2cc(Cl)cc(F)c2O)n1 816637746 NDTXADMJSXHHFI-UHFFFAOYSA-N 298.749 2.036 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2c([N+](=O)[O-])ncn2C)c1 728909582 SMJVMQVQNXYBHC-MRVPVSSYSA-N 292.295 2.216 10 20 CECD COC(=O)C1(C)CN(Cc2cc(Cl)ccc2O)C1 822534768 WOKZRNRVAFLBTA-UHFFFAOYSA-N 269.728 2.041 10 20 CECD C[C@@](O)(CNC(=O)c1cc(O)cs1)c1ccccc1 734023894 QJYKSZZXIPEMBL-CQSZACIVSA-N 277.345 2.091 10 20 CECD CCn1ccc(CN(C)C(=O)c2c(F)ccc(O)c2O)c1 830269012 FPELXEDBYGKAKL-UHFFFAOYSA-N 292.310 2.331 10 20 CECD Cc1cc(O)c(CNC2(CC(=O)O)CCOCC2)cc1C 832900191 SBTRVHOQYBTILG-UHFFFAOYSA-N 293.363 2.123 10 20 CECD CN(Cc1ccc(N(C)C)cc1)CN1CCC(C)(C)C1=O 839952752 KJUBKIWUXJCGDD-UHFFFAOYSA-N 289.423 2.400 10 20 CECD O=C(C[C@@H]1CCOC1)NCCCSc1nccs1 739730347 FDLIEHVBLROCMI-JTQLQIEISA-N 286.422 2.168 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCCO1 839912616 GAABJHJOJBUWPE-CZUORRHYSA-N 290.407 2.287 10 20 CECD Cc1cc(O)c(CN(CC(=O)O)C2CCOCC2)cc1C 833747315 VULNADBHVOIBID-UHFFFAOYSA-N 293.363 2.075 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)Cc1nnc2n1CCC2 840909336 HKBNKJSKKBNFLK-UHFFFAOYSA-N 299.422 2.231 10 20 CECD C[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CS1 840510206 MZUNFUITUKFVOB-PMEPJVLUSA-N 279.361 2.121 10 20 CECD CNC[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 843053336 WTYPWLUYNCKSOU-SECBINFHSA-N 272.751 2.226 10 20 CECD CC[C@H](O)[C@@H](C)C(=O)NCc1cc(Cl)ccc1O 911898956 SXRKWLLUPOJNEZ-KCJUWKMLSA-N 271.744 2.069 10 20 CECD NC[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 843048732 UXGDILBKKWZJIP-MRXNPFEDSA-N 273.424 2.458 10 20 CECD C[C@H](COCC(F)(F)F)NC(=O)Nc1ccc(N)cc1 841301281 INYWMPRUIQDJAN-MRVPVSSYSA-N 291.273 2.358 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2(N)CCCCC2)c1 843489075 CSHWIMFJQPQQOD-NSHDSACASA-N 292.379 2.240 10 20 CECD CO[C@@H](CNC(=O)c1ccc(C)c(O)c1O)C1CCCC1 856154185 HUCFUXUECCWCBJ-ZDUSSCGKSA-N 293.363 2.341 10 20 CECD Cc1ccc([C@@H](C)NCc2nc(C(N)=O)cs2)c(O)c1 850539087 AEMSCNXVNDPXCY-SECBINFHSA-N 291.376 2.107 10 20 CECD C[C@@H](NCC1(N)CCCC1)c1cc(F)ccc1O 854222654 JLKXUJAVVAMJQX-SNVBAGLBSA-N 252.333 2.453 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CCCN(C)C2=O)c(O)c1C 756639434 YTEYZUDIKLCTKX-JSGCOSHPSA-N 276.380 2.280 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC[C@H](C)NC1 863649313 CEOMLPHMYXJFOD-DZGCQCFKSA-N 261.413 2.291 10 20 CECD C[C@H]1[C@@H](C)N(Cc2ccc(N(C)C)cc2)CCN1C 775986906 SNMLISOYSZIKOX-UONOGXRCSA-N 261.413 2.277 10 20 CECD CCO[C@H](CCN(C)C)CNCc1c(C)cccc1O 877157828 CZJAJAHSFRRDBU-CQSZACIVSA-N 280.412 2.147 10 20 CECD C[C@@H](NCc1nnc2n1CCCC2)c1c(O)cccc1F 886590307 SCRSZQSSVWBEKL-SNVBAGLBSA-N 290.342 2.310 10 20 CECD Cc1ccc(CNC(=O)c2cc(O)cs2)n1C 1120468843 NYWKRPGBUXDWBO-UHFFFAOYSA-N 250.323 2.031 10 20 CECD C[C@@H](O)CCCNCc1ccc(N(C)C)c(F)c1 788529999 USLQWXWILURTFN-LLVKDONJSA-N 254.349 2.142 10 20 CECD COc1ccc(CN2CCO[C@H](C)[C@H]2C)c(O)c1OC 892048078 HNGPDPCXPGONBG-GHMZBOCLSA-N 281.352 2.019 10 20 CECD COc1cc(C)cc(CN[C@H](CO)C(C)(C)C)c1O 894453440 UYHPYUJJQCCLLE-CYBMUJFWSA-N 267.369 2.206 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@H]1O 897685591 OPIFTRBYZGVTAF-WMLDXEAASA-N 274.408 2.490 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](c2ccccn2)C1 799195621 YXMZSFFQVOUPLY-JTQLQIEISA-N 274.345 2.478 10 20 CECD COc1cccc(CN[C@@H]2Cc3ccccc3[C@H]2O)c1O 898393745 UBKLZRFQUIJSEC-RHSMWYFYSA-N 285.343 2.149 10 20 CECD O=C(NC[C@@H]1C[C@H]2C=C[C@H]1C2)c1cccc(O)c1O 1335225178 ABNGARKCTCFKJN-DCAQKATOSA-N 259.305 2.040 10 20 CECD C[C@@H](NC(=O)CCC(C)(C)N)c1ccccc1O 877255478 DVEKSVSQHCLIMB-SNVBAGLBSA-N 250.342 2.087 10 20 CECD C[C@H](N[C@H](CO)CC(F)F)c1ccc(N(C)C)cc1 717809030 QCYWFMNMIRSBCD-JQWIXIFHSA-N 272.339 2.419 10 20 CECD COc1ccc(N2CCCN(CCF)CC2)cc1 759329295 WTEAHGBNMMSYLM-UHFFFAOYSA-N 252.333 2.177 10 20 CECD CC(C)(CNC(=O)NCc1ccc(N)cc1)c1ccncc1 1337014900 FLGMADMSCSWHNV-UHFFFAOYSA-N 298.390 2.441 10 20 CECD C[C@H](NC(=O)[C@H]1C[C@@H]1F)c1ccc(N2CCOCC2)cc1 1262725674 FUSXOPGCYLOXPC-CQDKDKBSSA-N 292.354 2.058 10 20 CECD Nc1ccc(CC(=O)N[C@@H](c2ccncc2)C2CC2)cc1 1342277669 YWFPLEWQPFBLEQ-QGZVFWFLSA-N 281.359 2.474 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C(=O)O)[C@@H]2C)c1 1605696750 QSJGZRWBZPLGPO-GWCFXTLKSA-N 279.336 2.086 10 20 CECD CC(C)[C@@H](CNCc1cc(Cl)cc(F)c1O)ON 1575435692 VTZZUVSOIOANTG-LLVKDONJSA-N 276.739 2.189 10 20 CECD C[C@H](N[C@H](C)c1nccn1C)c1cc(C(=O)O)ccc1O 1593202748 BCQQZMFZJPVMOD-VHSXEESVSA-N 289.335 2.236 10 20 CECD CCn1cc(CNCc2cccc(OC)c2O)c(C)n1 20352703 AADZCAPGQRLJIC-UHFFFAOYSA-N 275.352 2.215 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cc(Cl)cc(OC)c1O 229118978 HFEURJWHHNUKSG-SNVBAGLBSA-N 287.743 2.349 10 20 CECD Cc1noc(C)c1CCC(=O)NCc1ccc(N)cc1 701376486 MMORWQSOBYRBCM-UHFFFAOYSA-N 273.336 2.123 10 20 CECD CCN(C[C@H](C)OC)C(=O)Nc1ccc(N)cc1 382756803 PGZFOGDBXXUYPL-JTQLQIEISA-N 251.330 2.158 10 20 CECD COc1ccc(O)c(CNC[C@@H](C)CC2(C)OCCO2)c1 716023726 WRBMJMXTMIEFQH-LBPRGKRZSA-N 295.379 2.280 10 20 CECD OCC1(CNCc2c(O)cccc2Cl)CCC1 717681223 DRSCLHLHSBFKRH-UHFFFAOYSA-N 255.745 2.298 10 20 CECD OC[C@@H](CC1CC1)NCc1cc(Cl)ccc1O 754835807 WUGUEHHQMKFSCS-GFCCVEGCSA-N 255.745 2.296 10 20 CECD C[C@@H](NCc1cnc(N(C)C)n1C)c1ccccc1O 877755575 FUMDNBDRTNLNAQ-LLVKDONJSA-N 274.368 2.043 10 20 CECD COC1CCN(C(=O)NCc2ccc(N(C)C)cc2)CC1 53984923 ZMYPRPUKVXTXLD-UHFFFAOYSA-N 291.395 2.073 10 20 CECD CNC[C@@H]1CCCN(Cc2cc(F)cc(C(C)=O)c2O)C1 50158915 GTOXGQXEDFOMNT-LBPRGKRZSA-N 294.370 2.165 10 20 CECD C[C@@H](NC(=O)c1cc[nH]c1)c1ccc(N2CCOCC2)cc1 68308136 PPNPFGQARGFSTA-CYBMUJFWSA-N 299.374 2.342 10 20 CECD CN(Cc1ccccc1O)[C@@H]1CCCC[C@@H]1S(C)(=O)=O 179560768 RRVNNBMKZFSZFA-HIFRSBDPSA-N 297.420 2.180 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@@H]2CCCOCC2)cc1 183069531 DQICXHHWSJAKTD-CQSZACIVSA-N 291.395 2.121 10 20 CECD CN(CCCc1cnn(C)c1)c1ccc2c(c1)OCO2 121327467 CMXHXTILYSGYHC-UHFFFAOYSA-N 273.336 2.218 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](C)C1CC1 186429467 UZOOJEOXTKWWET-NXEZZACHSA-N 263.337 2.191 10 20 CECD CCc1cccc(CN[C@@H](CO)CC(C)C)c1O 691485352 ZHNNCWHCYOEGPV-CQSZACIVSA-N 251.370 2.451 10 20 CECD C[C@H](NCc1ccc(C(N)=O)cc1)c1ccccc1O 179874063 IALLMQMISAYQPR-NSHDSACASA-N 270.332 2.342 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2OCCc3ccccc32)cc1 237943059 VBPFOCBLNFUTPJ-QGZVFWFLSA-N 296.370 2.242 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@H](COC)C2)cc1 93529516 YZMXQQUZDWIXIY-KRWDZBQOSA-N 292.423 2.380 10 20 CECD COc1ccc(O)c(CN2CCN(C)C[C@H]2C(C)C)c1 182134073 HLBOOOXMWABCKD-HNNXBMFYSA-N 278.396 2.173 10 20 CECD CN(C)c1ccc(CNC[C@H]2CC[C@H](O)C2)cc1F 276660397 JNTNBXWIBXMZGX-AAEUAGOBSA-N 266.360 2.142 10 20 CECD C[C@@H](NCC1(N2CCOCC2)CC1)c1ccc(F)cc1O 278467447 NIGPQAGFRJMELK-GFCCVEGCSA-N 294.370 2.047 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)c(F)c1O)c1ncnn1C 276638284 OLDWWKVVJGZBAD-SFYZADRCSA-N 282.294 2.211 10 20 CECD Cc1cc(O)c(CN2CC[C@H](N3CCCC3=O)C2)cc1C 276857008 JVRUHWVIAIQQKP-HNNXBMFYSA-N 288.391 2.206 10 20 CECD O=C(NCc1ccccc1O)NC[C@@H]1CCCSC1 287132379 BYDOGDJPKHWQHS-NSHDSACASA-N 280.393 2.335 10 20 CECD COC(=O)C[C@@H]1CC[C@H](NCc2ccccc2O)[C@@H]1C 280901005 OLBXEXJWSOVKNL-DYEKYZERSA-N 277.364 2.460 10 20 CECD Cc1cc(C(=O)N(C)C2(CO)CC2)c(C)n1-c1ccccn1 808127691 QCGGKEFWTRMSHE-UHFFFAOYSA-N 299.374 2.086 10 20 CECD CC[C@@H](N[C@H](C)C(=O)NCCF)c1ccc(C)cc1O 800498477 LCIVVKOZGWIATI-DGCLKSJQSA-N 282.359 2.216 10 20 CECD Oc1c(CNCCN2CCC2)ccc2ccccc12 816557922 GUBXYFNWQSBFEZ-UHFFFAOYSA-N 256.349 2.341 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)CC1CC1 819693518 QEUKNHVKNZLQGS-UHFFFAOYSA-N 291.347 2.084 10 20 CECD Cc1cc(O)c(CNC[C@H]2CCOC2)cc1Cl 825107272 FVBRHESJECFGEU-SNVBAGLBSA-N 255.745 2.480 10 20 CECD CC[C@@H](OC)C(=O)NCCCSc1nccs1 733973622 SBPSFXOMBADZQM-SECBINFHSA-N 274.411 2.167 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ncccc2N(C)C)c1 913000453 JZYIWEPSCCXWRU-UHFFFAOYSA-N 285.347 2.092 10 20 CECD CCc1noc([C@@H](C)OC(=O)c2cc(O)cs2)n1 745002554 MEAPCBVXHSPHKR-ZCFIWIBFSA-N 268.294 2.317 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1c(O)cccc1Cl 843121734 JDMYLJZKRPRRNC-UWVGGRQHSA-N 272.751 2.177 10 20 CECD Oc1ccc(Cl)cc1CN[C@H]1CCN(CC(F)F)C1 841894168 PBHBPEGIVXXJFZ-NSHDSACASA-N 290.741 2.475 10 20 CECD CCc1cccc(CN(C)C[C@@H]2CCN(C(C)=O)C2)c1O 848890846 UPMRXSWEDVTOPT-AWEZNQCLSA-N 290.407 2.255 10 20 CECD Nc1ccc(CCNC2CCN(CC3CC3)CC2)cc1 841035205 LOAMHJNGAHYCOD-UHFFFAOYSA-N 273.424 2.275 10 20 CECD CN(C)c1ccc(CNC(=S)NCC2CC2)cc1F 849256113 PWJSZWSGCMOSDD-UHFFFAOYSA-N 281.400 2.266 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](C)[C@H]2CN)c1O 843353401 HIPLHNNOIJZURT-ZUZCIYMTSA-N 294.370 2.293 10 20 CECD C[C@@H](C[C@@H]1CCOC1)NC(=O)Nc1ccc(N)cc1 841299740 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OCc1ccnc(NCc2ccc(N3CCCC3)cc2)n1 767177007 BPPJQHNFILBDIR-UHFFFAOYSA-N 284.363 2.181 10 20 CECD CCC[C@H](CNC(=O)c1ccc(C)c(O)c1O)OCC 862419096 QQFBOQCXSHJODT-LLVKDONJSA-N 281.352 2.341 10 20 CECD CCC[C@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)OCC 862418494 MBUYEPCCVGBQRL-FNOHHLHBSA-N 293.363 2.432 10 20 CECD CCC1(CC)NC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 760950428 QDRYYBLQSVNNPG-UHFFFAOYSA-N 289.379 2.363 10 20 CECD Cc1ccc(CNC[C@@](C)(O)c2ccco2)c(O)c1 877072034 GKUNWBPIAGHVEA-OAHLLOKOSA-N 261.321 2.291 10 20 CECD Cc1cccc(O)c1CN(CCO)Cc1cccnc1 876690455 VRBCWHVQGJDREX-UHFFFAOYSA-N 272.348 2.090 10 20 CECD C[C@@H](NC(=O)NCCCF)c1ccc(N(C)C)cc1 773395086 ATGXPIHAAFVBRP-LLVKDONJSA-N 267.348 2.472 10 20 CECD NC[C@H](NCc1ccc(N2CCCC2)cc1)C1CC1 1117954017 XFGFHURYQAPGJF-INIZCTEOSA-N 259.397 2.114 10 20 CECD O=C(Nc1cccc2c1OCCO2)c1cccc(O)c1O 776634304 KAWVVYVFFVGKRF-UHFFFAOYSA-N 287.271 2.121 10 20 CECD C[C@@H](Cn1ccnc1)N[C@H](C)c1c(O)cccc1F 886503037 ZHSRCODBOIORME-WDEREUQCSA-N 263.316 2.467 10 20 CECD C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@@H]2c1cc(Cl)cc(F)c1O 777900105 ZOWGPXKKXHJDIX-RESLBDFXSA-N 298.745 2.414 10 20 CECD CC[C@H](C)[C@H](NCc1ccc(N(C)C)c(C)c1)C(N)=O 887055646 DHMMXANCRUKWQO-NHYWBVRUSA-N 277.412 2.051 10 20 CECD FC[C@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 895575362 SAKYXUMKHPWKBY-OAHLLOKOSA-N 278.371 2.315 10 20 CECD COc1ccc(CNC[C@H]2CC[C@H](C)O2)c(O)c1OC 894817469 QUTWODGHTLYCHW-CMPLNLGQSA-N 281.352 2.067 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@@H]1CCC=CO1 780742427 GRZXMXOLHOUBAQ-ZDUSSCGKSA-N 276.336 2.226 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1cc(F)cc(F)c1O 894993269 HUKQCADJRDFGAA-LBPRGKRZSA-N 285.290 2.102 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CO[C@@H](C)C1 784109586 WCXDUEJZHYBSPZ-JSGCOSHPSA-N 276.380 2.102 10 20 CECD COc1ccc(O)c(CN2CC[C@H](N3CCCC3)C2)c1 133950413 UQZRGRJFLJWQKQ-AWEZNQCLSA-N 276.380 2.071 10 20 CECD Cc1ccc(O)c(CN2CCC[C@@H](C(=O)NC3CC3)C2)c1 1319701654 JBLUMYPPIGJBGA-CYBMUJFWSA-N 288.391 2.191 10 20 CECD O=C(NCCC1CCOCC1)NCc1ccccc1O 1318563830 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CCN(CC)c1ccc(CNC(=O)C(C)(C)CN)cc1 827341045 RJKBHVGGTDHADV-UHFFFAOYSA-N 277.412 2.134 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H](O)C1CCC1 825240577 MTMBVKKRYUYHBB-LBPRGKRZSA-N 273.735 2.435 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)CN1CCOC1=O 902065644 QRSFOAXGCQRMPM-UHFFFAOYSA-N 291.395 2.373 10 20 CECD COc1ccc(N(C)C[C@H](N)CC(F)F)cc1OC 903906175 UAOCDNNOJREXGT-SECBINFHSA-N 274.311 2.123 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)[C@@H](O)C(F)(F)F 865711617 PKGWFZRXYPBRAZ-QPUJVOFHSA-N 275.270 2.023 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H]2CC[C@@H](C1)N2 843054569 UDCPUSXRXFRNOS-CVEARBPZSA-N 273.424 2.387 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1COc2ccccc2C1 748461542 ZFCGAVCPOCIYGS-CQSZACIVSA-N 298.342 2.195 10 20 CECD CC(C)N(CC(=O)O)Cc1cc(Cl)c(F)cc1O 840998124 IWBLCNGWJKQZHK-UHFFFAOYSA-N 275.707 2.480 10 20 CECD O=C(CCNC1CC1)NCc1c(O)ccc2c1CCCC2 848427599 ZDZYGBVINVUBQD-UHFFFAOYSA-N 288.391 2.029 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CS[C@@H](C)C2)c1 858538581 ODYKCGFDJCFOQV-JQWIXIFHSA-N 280.393 2.394 10 20 CECD CCc1nncn1CCN[C@H](C)c1cc(C)ccc1O 756621883 UGXAGCMLBJWTMR-GFCCVEGCSA-N 274.368 2.205 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1ccc(N(C)C)c(F)c1 759173948 SCHLYNMGHGYLJV-GOEBONIOSA-N 296.386 2.175 10 20 CECD COc1cc(CN2CC[C@H](N3CCCC3)C2)c(O)cc1C 768452032 NJFWCHDQTKQZJG-HNNXBMFYSA-N 290.407 2.379 10 20 CECD CC(C)OCCNC(=O)N[C@H](C)c1ccccc1O 868498690 WXUWFVVORJJKLS-LLVKDONJSA-N 266.341 2.177 10 20 CECD CO[C@H](C(=O)NCc1ccc(N(C)C)cc1C)C(C)C 769949147 UZLYIVVMKQAQCD-HNNXBMFYSA-N 278.396 2.348 10 20 CECD Cc1ccc([C@H](C)NCCN2CCC(CO)CC2)c(O)c1 1116585332 XOKPAXCCYNIZQM-AWEZNQCLSA-N 292.423 2.056 10 20 CECD CSC1CCN(Cc2cc3c(cc2O)OCO3)CC1 872627731 WAKDAMOPFNIDKX-UHFFFAOYSA-N 281.377 2.448 10 20 CECD C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@H]2c1cc(Cl)cc(F)c1O 777900103 ZOWGPXKKXHJDIX-BITCUVMXSA-N 298.745 2.414 10 20 CECD O=C(NCc1cccc(Br)c1O)[C@H]1C[C@H]1F 1123754968 RTUBHAJKCABZFD-IONNQARKSA-N 288.116 2.129 10 20 CECD COc1ccc(CNCCC[C@@H]2CCOC2)c(O)c1OC 894769228 SGDKQGVKYDRSGW-GFCCVEGCSA-N 295.379 2.316 10 20 CECD COc1cc(C)cc(CN(C)Cc2cccc(O)n2)c1O 897391507 RQSCOALZWSUDJI-UHFFFAOYSA-N 288.347 2.442 10 20 CECD CN(Cc1nc2ccccc2[nH]1)C(=O)c1cccc(O)c1O 790516375 PPMCOSQCNQANRU-UHFFFAOYSA-N 297.314 2.246 10 20 CECD COc1ccc(CNC(=O)/C=C(/C)C2CC2)c(O)c1 794379650 USEZCSIYTAXAQE-YFHOEESVSA-N 261.321 2.373 10 20 CECD Nc1ccc(NC(=O)[C@H]2COc3ccccc3O2)cc1 16857427 SEOPGQORIJOUPZ-CQSZACIVSA-N 270.288 2.047 10 20 CECD CCc1cnc(NC(=O)c2cccc(O)c2O)s1 187143927 JZVVROWENBVCSJ-UHFFFAOYSA-N 264.306 2.369 10 20 CECD C[C@@H](C(=O)NC(C)(C)C)N(C)Cc1ccccc1O 109769226 RRFDOUKMRIGHEQ-NSHDSACASA-N 264.369 2.127 10 20 CECD CCN1CCC[C@@H]1CNCc1cc(F)cc(F)c1O 708504698 UILJPHKCGXGBGI-GFCCVEGCSA-N 270.323 2.244 10 20 CECD C[C@@H]1CCN(CCNCc2cc(Cl)ccc2O)C1 744449703 CBAYBZWDXCCAKZ-LLVKDONJSA-N 268.788 2.477 10 20 CECD CC1=NO[C@@](C)(C(=O)NCc2cc(Cl)ccc2O)C1 1337281397 KAOJZACWRZCQQX-CYBMUJFWSA-N 282.727 2.217 10 20 CECD CCC[C@@H]1C[C@@H](C(=O)NCc2cccc(O)c2O)CCO1 1352658393 UGEAKNUVRPNXPH-WCQYABFASA-N 293.363 2.309 10 20 CECD C[C@H](C(=O)O)N(Cc1cc(F)cc(F)c1O)C1CCC1 1589486853 MWEUCMIVVALNAQ-MRVPVSSYSA-N 285.290 2.498 10 20 CECD C[C@H](N[C@H]1CCn2ccnc21)c1cc(C(=O)O)ccc1O 1593232108 MHCUYNPZGOLOKA-CABZTGNLSA-N 287.319 2.083 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2COC(C)(C)O2)c1 230206456 RBGIZOVBYZLWAR-ZYHUDNBSSA-N 281.352 2.203 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2nnc(C)s2)c1 289659580 GPWPDCNHWUFARS-SECBINFHSA-N 293.392 2.454 10 20 CECD O=C(O)C[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 708214577 CPRWTPSBQXOELQ-SECBINFHSA-N 285.290 2.357 10 20 CECD CC1(C)CN(Cc2ccc(Br)cc2O)C[C@H]1N 720767589 JNZDOESXRWUKED-GFCCVEGCSA-N 299.212 2.324 10 20 CECD CN(C)C1(CNCc2cc(Br)ccc2O)CC1 397917099 FCAQVYQFRCRVRV-UHFFFAOYSA-N 299.212 2.339 10 20 CECD COC[C@@H]1CN(Cc2c(O)ccc3ccccc23)CCO1 172922333 UOEXMRRCNPGJIP-AWEZNQCLSA-N 287.359 2.393 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)CCCC3)CCO1 179435138 BTJURUBQAOWCRA-GFCCVEGCSA-N 261.365 2.492 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](CN)C2)c1O 50250130 WREXTMSOIZHJIA-JTQLQIEISA-N 282.771 2.029 10 20 CECD Cc1ccc(C(=O)NC[C@H]2CC=CCC2)c(O)c1O 177676636 CHGIDXCFCMWKHG-NSHDSACASA-N 261.321 2.492 10 20 CECD CN(C)c1ccc(CNC2(C(=O)O)CCCC2)cc1 283777264 CSZMDLXSROFMMZ-UHFFFAOYSA-N 262.353 2.240 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CCn2cccn2)c1O 79433922 ZTJHWIQQBVAZNL-UHFFFAOYSA-N 291.326 2.062 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)[C@@H](CO)SC)c1 185511131 RMNQWWXXRQMGQT-ISTVAULSSA-N 285.409 2.164 10 20 CECD C[C@H](N[C@H](C)C[S@@](C)=O)c1cc(Cl)ccc1O 186539977 AWTZBLQBXKHZEZ-KSRUKNBBSA-N 275.801 2.463 10 20 CECD COc1cccc(CN[C@@H](CCO)c2ccco2)c1O 184504732 XVMMDKOXTBTAGO-LBPRGKRZSA-N 277.320 2.207 10 20 CECD CNC(=O)CCCN(C)Cc1c(O)cccc1Cl 131834054 ZRDJJQNRLAWEOV-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CC[C@@](C)(O)CN[C@H](C)c1cc(OC)ccc1O 87013369 VHUVSCCVBZKAMQ-QMTHXVAHSA-N 253.342 2.212 10 20 CECD Cc1c(CNC(=O)NCc2cc[nH]n2)n(C)c2ccccc12 526910320 ZWEZCEHTAAFPQV-UHFFFAOYSA-N 297.362 2.209 10 20 CECD CCN(CC)C(=O)CCCC(=O)NCc1ccccc1O 264026909 GKHVZWANYMLEOY-UHFFFAOYSA-N 292.379 2.047 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccn(C)c1 268564653 GNWNURGTXAXVNL-UHFFFAOYSA-N 271.364 2.363 10 20 CECD COc1cccc(CN[C@@H]2CCc3nc(C)ncc3C2)c1O 360256287 YJOBPNREOFXUAW-CQSZACIVSA-N 299.374 2.146 10 20 CECD Cc1noc(NCc2ccc(N(C)C)c(F)c2)n1 271979225 MCWAGIDUTIPVCU-UHFFFAOYSA-N 250.277 2.195 10 20 CECD CC[C@H](C)[C@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273591062 PDQCXYPAWPWMOW-IMSIIYSGSA-N 282.340 2.358 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H]3CCN(C)C[C@H]32)c1 272609194 KDYYAKKCWJXRPJ-CZUORRHYSA-N 290.407 2.317 10 20 CECD C[C@H](NC[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O 273372637 GLSWGCNLXHMGHB-GXSJLCMTSA-N 266.297 2.130 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]2c2nc(C)no2)c1 289968732 YYZFBKBWNVRVML-ZDUSSCGKSA-N 289.335 2.429 10 20 CECD CC[C@H](NC[C@@H](O)C1CCOCC1)c1ccc(F)cc1O 286004635 HTNHXDJCVLWTIH-GOEBONIOSA-N 297.370 2.360 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cccc(OC)c2O)[C@H]1SC 298198598 XQTMMHFBWKJNCI-UXIGCNINSA-N 297.420 2.399 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccnc(N(C)C)c1 298768475 BMOOGFRBTOXKJF-UHFFFAOYSA-N 285.347 2.125 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1cnc[nH]1 807840794 KCUVMTNVKPHYFH-UHFFFAOYSA-N 286.118 2.352 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1c1cc[nH]n1 807432274 KBFQSYAWSXNXDZ-SNVBAGLBSA-N 263.322 2.154 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCC[C@H](N)C2)c1 817970047 KFSPTVNMUVBIOO-SRVKXCTJSA-N 264.369 2.321 10 20 CECD OCC1(CNCc2ccc3ccccc3c2O)CC1 816555951 VDUYWQCSXKREHC-UHFFFAOYSA-N 257.333 2.408 10 20 CECD C[C@@H](NCCN)c1ccc(N2CCCCC2)c(F)c1 817934262 FGTQYXVFIKLIIE-GFCCVEGCSA-N 265.376 2.425 10 20 CECD Nc1ccc(CCN[C@@H]2CCN3CCC[C@@H]3C2)cc1 817956214 TZCPJOUWFIERLR-HZPDHXFCSA-N 259.397 2.028 10 20 CECD CCn1nc(C)c(CN[C@H]2CCc3cccc(O)c32)n1 818345632 NKACDZRXEGYXCP-LBPRGKRZSA-N 272.352 2.089 10 20 CECD C[C@H](NCCN)c1ccc(N2CCCCC2)c(F)c1 817934263 FGTQYXVFIKLIIE-LBPRGKRZSA-N 265.376 2.425 10 20 CECD CCN(CC)c1ccc(CN(C)CCn2cncn2)cc1 727221688 HBFNDMLKAZVUFT-UHFFFAOYSA-N 287.411 2.256 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2c(O)cccc2F)C1=O 903387762 IYSCTAKRGLRAMC-JQWIXIFHSA-N 280.343 2.193 10 20 CECD CCCNC(=O)CCCN[C@H](C)c1cc(OC)ccc1O 839539100 JEKNAWVHOVHMIT-GFCCVEGCSA-N 294.395 2.358 10 20 CECD O=C(NC[C@H](O)c1cccc(F)c1)c1cc(O)cs1 731871406 JSRXNCYDHPSZHV-NSHDSACASA-N 281.308 2.056 10 20 CECD CC(C)[C@]1(C)C[C@@H]1NC(=O)c1c(F)ccc(O)c1O 839800215 VGFNRMBRPPSKRL-HZMBPMFUSA-N 267.300 2.401 10 20 CECD COc1cccc([C@H](C)N[C@H](CCO)CSC)c1O 846144533 LCXJSAZIHXRUFM-WDEREUQCSA-N 285.409 2.165 10 20 CECD COc1ccc(CNC2(C(=O)O)CCCC2)cc1C 841801702 XHROPCNTXAYFJM-UHFFFAOYSA-N 263.337 2.491 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@@H]1CCCNCC1 841058567 SVGPKNNBZLMWIG-LLVKDONJSA-N 272.751 2.416 10 20 CECD COc1ccc(N2CCN(Cc3cnc(C)nc3)CC2)cc1 916984558 INKKXNGTAOMZHP-UHFFFAOYSA-N 298.390 2.116 10 20 CECD CN(C)c1ccc([C@H](N)CNC[C@H]2CCSC2)cc1 841046259 YQKPPYSBDZGIAR-IUODEOHRSA-N 279.453 2.095 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCCCC(=O)O)c1 848447403 QYIKWXXAWVZPGX-JTQLQIEISA-N 295.335 2.223 10 20 CECD CCCN(CC(=O)NC)Cc1ccc(N(C)C)cc1C 840911594 JALZMLMKOKQVKA-UHFFFAOYSA-N 277.412 2.019 10 20 CECD CO[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)[C@H](C)C1 841958630 HIYXOBNAYHWBGE-DOMZBBRYSA-N 291.395 2.020 10 20 CECD COc1cc(Cl)cc(CNCC2(N)CCCC2)c1O 849350159 SJPXOJHTNXGEFD-UHFFFAOYSA-N 284.787 2.415 10 20 CECD CCN(C)c1ccc(Cn2ccnc2[N+](=O)[O-])cc1 918369134 PZMMYGBVCMQMIX-UHFFFAOYSA-N 260.297 2.296 10 20 CECD COc1cccc([C@H](C)N[C@H](C)C2(CO)CC2)c1O 850513873 HRGLCSOWSNXQGX-WDEREUQCSA-N 265.353 2.212 10 20 CECD C[S@@](=O)c1ccc(CNCc2ccccc2O)cc1 754333399 CZICCVXCCVEYSP-LJQANCHMSA-N 275.373 2.419 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@]1(C)CCCOC1 935948574 PBNWQOQWXDUVDY-MRXNPFEDSA-N 298.379 2.311 10 20 CECD COc1cccc(O)c1CN(C[C@@H]1CCOC1)C1CC1 768257560 MPLTVJGNLOREAR-LBPRGKRZSA-N 277.364 2.402 10 20 CECD CC(C)CC[C@H](CO)NC(=O)/C=C/c1ccc(O)c(O)c1 862778166 DKQVNMJHHOFYDR-OQHXTRMZSA-N 293.363 2.024 10 20 CECD Cc1ccc(CNCCCn2ccnc2C)c(O)c1 876945369 BEYHGTWSSRXRMG-UHFFFAOYSA-N 259.353 2.385 10 20 CECD CN1CCN(c2ccc(CNCC3(C)CC3)cc2)CC1 771845152 ZGYCNTYIKUXIFP-UHFFFAOYSA-N 273.424 2.328 10 20 CECD C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H](C)S1 779487502 HCHNSFCMYMEZRK-JYBZGJHDSA-N 293.388 2.463 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C[C@@H](O)C1CC1 1117637662 HDRVWHGMYSQUCP-QGZVFWFLSA-N 274.408 2.490 10 20 CECD Nc1ccc(Cc2nc(C(=O)N3C[C@H]4C[C@H]4C3)cs2)cc1 876994399 HWBCBIAAKAMOAX-TXEJJXNPSA-N 299.399 2.408 10 20 CECD CCOC(=O)[C@H]1CCCN(Cc2ccc(C)cc2O)C1 876510415 VBZWHWFDHFVGND-AWEZNQCLSA-N 277.364 2.476 10 20 CECD C[C@@H](NCC[C@@H]1CCOC1=O)c1ccc(N(C)C)cc1 775834282 MUAZSSHDCVXCCT-TZMCWYRMSA-N 276.380 2.356 10 20 CECD Cc1cc(Cn2cc(C3CCNCC3)nn2)ccc1N(C)C 881376988 CJOYGBBCTVDKIL-UHFFFAOYSA-N 299.422 2.168 10 20 CECD Oc1ccccc1CN1CCN(Cc2cscn2)CC1 778999461 MQYJTHMWXLBFNL-UHFFFAOYSA-N 289.404 2.167 10 20 CECD COc1ccc(CNCC=C(C)C)c(O)c1OC 1120040909 SGYDYCLRAXRIDW-UHFFFAOYSA-N 251.326 2.465 10 20 CECD C[C@H](NCCN1CCOCC1(C)C)c1c(O)cccc1F 886523129 XLBSLRHYPHJJMM-LBPRGKRZSA-N 296.386 2.293 10 20 CECD COc1ccc(CNCCCCCCO)c(O)c1OC 893303738 UGFZLAADMFLLCS-UHFFFAOYSA-N 283.368 2.052 10 20 CECD Oc1cc(F)c(Cl)cc1CNCCO[C@@H]1CCOC1 897201316 IRKZHFWWOOXBMG-SNVBAGLBSA-N 289.734 2.080 10 20 CECD COc1ccc(O)c(CNC(C)(C)C(=O)OC(C)C)c1 898506547 KLJUGYOVQGFGEP-UHFFFAOYSA-N 281.352 2.221 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1ccc(F)cc1O 186029873 OAINZQAJJNTLQL-UWVGGRQHSA-N 289.372 2.005 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCC1CCOCC1 1328388599 ZZESZBWPBNFYLS-UHFFFAOYSA-N 292.379 2.350 10 20 CECD CSC1CCN(C(=O)NCc2ccc(N)cc2)CC1 1337070357 NVPCVUDCGSBOBN-UHFFFAOYSA-N 279.409 2.306 10 20 CECD C[C@@H](NCCOC[C@@H]1CCCO1)c1ccccc1O 775136648 NFSDTXZQOZPRAP-OLZOCXBDSA-N 265.353 2.238 10 20 CECD CC(C)CC(=O)N1CCC(NCc2ccc(N)cc2)CC1 1335290487 YCGUTWUGVRGYRI-UHFFFAOYSA-N 289.423 2.396 10 20 CECD C[C@@H](CC(=O)NCc1ccc(N)cc1)c1ccncc1 1341923599 MQMYHYZHBZJTJL-LBPRGKRZSA-N 269.348 2.474 10 20 CECD O=C(O)CN(Cc1ccc(F)c(F)c1O)C1CCCC1 1602059088 UTRHMJCSTGXAMX-UHFFFAOYSA-N 285.290 2.500 10 20 CECD CCOC(=O)C[C@@H](NCc1ccc(N)cc1)C(F)(F)F 1577943402 HFSMIKRONKNVCO-LLVKDONJSA-N 290.285 2.243 10 20 CECD CCCOc1ccc(CNC2(C(=O)O)CC2)cc1C 1776819477 HLZZVIAARMRXEG-UHFFFAOYSA-N 263.337 2.491 10 20 CECD O=C(O)[C@H]1CCCN(Cc2ccc(Cl)cc2O)C1 1595196942 GPKCZTVHEMLBAH-JTQLQIEISA-N 269.728 2.342 10 20 CECD COc1ccc(O)c(CNCc2ccc(CO)cc2)c1 227464563 AYFNIYOYPMDPDM-UHFFFAOYSA-N 273.332 2.183 10 20 CECD CCOc1cccc(CN2CC[C@H](N)[C@@H](CC)C2)c1O 122251443 SUISXPROUVYUGS-JSGCOSHPSA-N 278.396 2.350 10 20 CECD CCN(CC)C(=O)[C@H](C)N[C@H](C)c1ccccc1O 37126692 IIXJBYKTXVYSRF-NEPJUHHUSA-N 264.369 2.300 10 20 CECD CN(C)C[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 179633862 MTTVWNHYJNEVHK-NSHDSACASA-N 268.788 2.429 10 20 CECD CCOc1cccc(CN2CCC[C@@H](C)[C@@H]2CN)c1O 70175516 OROJWMQXNUNPKK-OCCSQVGLSA-N 278.396 2.350 10 20 CECD COc1ccc(CN[C@H](CO)C[C@@H]2CCCO2)cc1C 886229645 TUPJRJCEUOSLLL-GJZGRUSLSA-N 279.380 2.023 10 20 CECD COc1cccc(CNC(=O)NC2CCCC2)c1O 170791907 WDEFPFDRGSJORS-UHFFFAOYSA-N 264.325 2.143 10 20 CECD Cc1cc(Cl)cc(CN2CCC[C@@H]2C(=O)N(C)C)c1O 179637760 KISJMOUQZHSGOR-CYBMUJFWSA-N 296.798 2.407 10 20 CECD COc1cccc(CNC(=O)NC2CCSCC2)c1O 174536028 RUQHLNRMCHDAJT-UHFFFAOYSA-N 296.392 2.096 10 20 CECD CCCCOC(=O)CN(C)c1ccc2c(c1)OCO2 121246510 RPCGFAVKZNANTM-UHFFFAOYSA-N 265.309 2.195 10 20 CECD C[C@@H](NC[C@@H]1CC[C@H](O)C1)c1ccc(F)c(F)c1O 189335215 NZLIZKLRHUNWMI-BBBLOLIVSA-N 271.307 2.482 10 20 CECD CCC[C@@]1(C)C(=O)NCCN1Cc1cc(C)c(C)cc1O 189034233 WWFQDCSKZYFHDD-KRWDZBQOSA-N 290.407 2.500 10 20 CECD Cc1ccc(C(=O)NCCOC2CCCC2)c(O)c1O 182142313 KWSHFQPSWYFXBI-UHFFFAOYSA-N 279.336 2.095 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2cc(Cl)ccc2O)C1 86778749 ZIFMHASPOZWTCI-ZDUSSCGKSA-N 269.728 2.342 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(O)CCCC2)cc1 194636914 PDUBVXZQIQNDGM-UHFFFAOYSA-N 290.407 2.454 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CC[C@@H](N)C1 236733180 KXJHTACQCRRAHQ-GXTWGEPZSA-N 276.380 2.258 10 20 CECD CC(=O)c1cc(F)cc(CN(C)[C@@H]2CCCC[C@H]2O)c1O 252920831 GIBKAWZCYWCZCQ-HUUCEWRRSA-N 295.354 2.469 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CCCOC1 266576752 SZADGUOBEYCVGD-CYBMUJFWSA-N 289.375 2.314 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1ccn(C)c1 267088488 PBOFTEHRCZFYPY-UHFFFAOYSA-N 273.336 2.072 10 20 CECD C[C@H]1OCC[C@]12CN(Cc1cccc(Cl)c1O)CCO2 279702511 RITZWNCYFBFARK-ABAIWWIYSA-N 297.782 2.425 10 20 CECD CC[C@@H](N[C@H]1CCN(CCOC)C1)c1ccc(C)cc1O 279973789 DDTHQZBRRHJPMY-GOEBONIOSA-N 292.423 2.462 10 20 CECD O=C1CN(Cc2cc(Cl)ccc2O)C(=O)N1CC1CC1 277531887 VRIHWXBEFRAONS-UHFFFAOYSA-N 294.738 2.220 10 20 CECD COC1(CC(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCC1 276786608 IXUUMPMDWLXFCM-NSHDSACASA-N 293.363 2.104 10 20 CECD CC[C@@H](N[C@@H](CCO)COC)c1ccc(C)cc1O 280018449 HECPOCHVENVTDQ-GXTWGEPZSA-N 267.369 2.139 10 20 CECD C[C@H](NCCN(C)C)c1cc2c(cc1O)CCCC2 287049830 MVEKDQBMSXEFPC-LBPRGKRZSA-N 262.397 2.483 10 20 CECD CC(C)[C@@H](O)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 285294244 CRUALWCVDGANPD-MRXNPFEDSA-N 290.407 2.261 10 20 CECD CC[C@@H](N[C@H](CO)CCOC)c1ccc(C)cc1O 281764877 WOSIHVKHGAQDNI-GXTWGEPZSA-N 267.369 2.139 10 20 CECD O=C(COC(F)F)NCc1c(O)ccc2c1CCCC2 802784029 IAKHBNNFPGMBKI-UHFFFAOYSA-N 285.290 2.126 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N(C)CCO 298800049 WCGUUYUETPTBPK-UHFFFAOYSA-N 278.377 2.220 10 20 CECD CCCCCOCC(=O)NCc1ccc(N)cc1 297257289 RFUODAWDDDEAPP-UHFFFAOYSA-N 250.342 2.092 10 20 CECD CC(C)[C@H](C(=O)O)[C@H](C)NCc1ccc2c(c1)CCO2 819163582 KXVOBPALTWGOGT-NHYWBVRUSA-N 277.364 2.456 10 20 CECD Cc1cnc(C(=O)NCCCSc2nccs2)o1 813811934 JGGSIGARJLOXPK-UHFFFAOYSA-N 283.378 2.352 10 20 CECD C[C@H]1C[C@@H](C(=O)O)CN(Cc2ccc(N(C)C)c(F)c2)C1 817881620 MFPGKOGRSYSQRM-WCQYABFASA-N 294.370 2.434 10 20 CECD CN(Cc1ccccc1O)C(=O)NOC/C=C\Cl 812704499 ODMKWOPYTFNQNR-DAXSKMNVSA-N 270.716 2.218 10 20 CECD Cc1cc(O)c(CN2CCC(C(N)=O)CC2)cc1Cl 824490770 JYDNITDFLYZLOI-UHFFFAOYSA-N 282.771 2.051 10 20 CECD CCN1C[C@H](NCc2ccc3ccccc3c2O)CC1=O 824893536 UYPIPGOCUXJZOO-CQSZACIVSA-N 284.359 2.256 10 20 CECD C/C=C/C(=O)NC1CCN(c2ccc(OC)cc2)CC1 726629958 FNHAWTSZQLFAEL-ONEGZZNKSA-N 274.364 2.356 10 20 CECD Cc1cc(O)c(CNCCCN(C)C)cc1Cl 825050199 OZEHDGFSUFBOOX-UHFFFAOYSA-N 256.777 2.395 10 20 CECD CN(Cc1cn(-c2ccc(N)cc2)nn1)C(C)(C)C 905058203 KEWMFSHWYNVDBK-UHFFFAOYSA-N 259.357 2.080 10 20 CECD COC(=O)CCCCCCNC(=O)c1cc(O)cs1 732266210 WOHNTEQWBHCZLK-UHFFFAOYSA-N 285.365 2.307 10 20 CECD CCC[C@H](CNC(=O)NCc1cccc(OC)c1O)OC 838639543 DWDDUFYQSOQZJV-GFCCVEGCSA-N 296.367 2.015 10 20 CECD C[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)CS1 840957380 AGDISSKUPMVEJO-WPRPVWTQSA-N 268.338 2.284 10 20 CECD CCN1CCCN(Cc2ccc(N(C)C)cc2C)CC1=O 840942334 ZMDMFWIDASAYLT-UHFFFAOYSA-N 289.423 2.115 10 20 CECD CC(C)(C)CC[C@@H](NC(=O)Cc1ccc(N)cc1)C(=O)O 841844884 ADOOSLIEEUQNJP-CYBMUJFWSA-N 292.379 2.207 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1cc(OC)ccc1O 843427559 RCCUKZYSZLNDCG-DGCLKSJQSA-N 267.369 2.288 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@H](C)CCO 840894095 PBLFFNIXLSUARV-KGLIPLIRSA-N 264.413 2.353 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCNC1 841032356 BMMJMXDAOYUVEZ-OCCSQVGLSA-N 279.403 2.369 10 20 CECD CN(Cc1ccccc1O)C(=O)NCC1(N)CCCCC1 841922383 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COCCCN(C)C(=O)NCc1ccc(N(C)C)c(F)c1 57647042 AXECTLJXBBUNLR-UHFFFAOYSA-N 297.374 2.070 10 20 CECD CCc1cc(CN2CCNC(=O)C2)c(O)c(C(C)(C)C)c1 58593170 YMFOYAYQEOCGJP-UHFFFAOYSA-N 290.407 2.184 10 20 CECD C/C(=C\C(=O)NCCc1ccc(O)c(O)c1)C1CC1 179092598 MMOYCTVVMGZFPX-CSKARUKUSA-N 261.321 2.113 10 20 CECD CN1C[C@H](N(C)Cc2cccc(Cl)c2O)CCC1=O 862428941 XNHUVEWCJWPJKD-LLVKDONJSA-N 282.771 2.098 10 20 CECD COC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1O 178849398 HLSDAADPQQENMK-MRXNPFEDSA-N 297.354 2.492 10 20 CECD CCOC(=O)[C@@H](NCc1ccccc1O)[C@@H](C)CC 187863462 DEDJBZWAOAFMOE-FZMZJTMJSA-N 265.353 2.460 10 20 CECD CCOC(=O)N1CC[C@H](N[C@H](C)c2cc(F)ccc2O)C1 186456423 NRAYLTUKMVDDST-PWSUYJOCSA-N 296.342 2.413 10 20 CECD C[C@H](NCc1ccc(N2CCCC2)cc1)c1nncn1C 37293660 LGTGOCAAXKVHLM-ZDUSSCGKSA-N 285.395 2.266 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CC[C@H](C)OC)c1 184026285 FNZLPBXHUMKRCI-QWRGUYRKSA-N 281.352 2.393 10 20 CECD COC(C)(C)CNC(=O)N(C)Cc1ccc(N(C)C)cc1 75310150 RSGMSUIPCWVMBY-UHFFFAOYSA-N 293.411 2.319 10 20 CECD CN(C)c1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)nc1 180990748 DOZVSJNVDYQCAH-XBXARRHUSA-N 299.330 2.211 10 20 CECD CCNC(=O)CN(C)c1ccc(OC(C)C)cc1 191581322 DVRRTZBFGSSKMF-UHFFFAOYSA-N 250.342 2.046 10 20 CECD C[C@H](NCCC(=O)NC(C)(C)C)c1ccccc1O 135719426 YNLMTBHAWQJBEF-NSHDSACASA-N 264.369 2.348 10 20 CECD CCOc1cccc(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)c1O 228537558 JIJQCWKKEAFYER-NWANDNLSSA-N 290.407 2.350 10 20 CECD COCCn1cc(CN[C@@H](C)c2ccc(F)cc2O)cn1 282848852 TZHUBANRNPDTER-NSHDSACASA-N 293.342 2.225 10 20 CECD COCC1(CNCc2ccc(N(C)C)cc2)CCOCC1 291724105 MZCXILWGRUYUPK-UHFFFAOYSA-N 292.423 2.285 10 20 CECD CCOC1(CNC(=O)c2c(F)ccc(O)c2O)CCCC1 295483638 CGEBKDHCUMULGQ-UHFFFAOYSA-N 297.326 2.316 10 20 CECD C[C@H](NC(=O)[C@@](C)(O)C1CC1)c1ccc(N(C)C)cc1 804568196 XJQKFZAJROEORI-ZBEGNZNMSA-N 276.380 2.091 10 20 CECD CC(=O)C(=O)COC(=O)CCCc1c[nH]c2ccccc12 808487359 HLVTTXDMAUAWGK-UHFFFAOYSA-N 287.315 2.192 10 20 CECD CCc1nc(C)c(CNC(=O)NCc2ccccc2O)o1 291988796 XTSSNWPAOIXPQD-UHFFFAOYSA-N 289.335 2.250 10 20 CECD C[C@H](NC(=O)COC(F)F)c1ccc(N(C)C)cc1 803119993 DCFISRYCRCNBBP-VIFPVBQESA-N 272.295 2.169 10 20 CECD CCOc1ccc(CNC[C@]2(O)CCC[C@H]2C)c(O)c1 815160116 PYONITMESVRFMB-MLGOLLRUSA-N 279.380 2.432 10 20 CECD CN(Cc1nc[nH]n1)Cc1ccc2ccccc2c1O 816513590 VWLFRNSADDQSIM-UHFFFAOYSA-N 268.320 2.296 10 20 CECD CC[C@H](NCc1ccc(N(CC)CC)c(F)c1)C(=O)NC 825315455 AZXYAKPAAWZFCO-AWEZNQCLSA-N 295.402 2.286 10 20 CECD CN(C[C@H]1CCSC1)c1ccc(OCC(=O)O)cc1 902015186 CUVIBLPHXPEXJU-LLVKDONJSA-N 281.377 2.339 10 20 CECD C[C@H](NC(=O)[C@@H]1[C@H]2CCC(=O)[C@@H]21)c1ccc(N(C)C)cc1 907492351 IXDWSWUOWZKZKV-SQWYCQTGSA-N 286.375 2.155 10 20 CECD COC[C@H]1COCCN1Cc1c(O)ccc2ccccc12 902561842 CKWWCEBCPWJIHB-AWEZNQCLSA-N 287.359 2.393 10 20 CECD Oc1ccccc1CN(CCn1cncn1)C1CCCC1 732204051 ARCKVKCKGPNPKQ-UHFFFAOYSA-N 286.379 2.429 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCC[C@@H]3C[C@@H]32)c(O)c1O 838253961 JBPQLVGRHAORQM-ADEWGFFLSA-N 261.321 2.325 10 20 CECD CC(C)n1cc(C(=O)NCCc2ccc(N)cc2)cn1 832659277 XSUOTTKXFIZJCU-UHFFFAOYSA-N 272.352 2.019 10 20 CECD C[C@@H](Cc1ccncc1)NCc1cc([N+](=O)[O-])ccc1O 749293718 DTZONCZUIFATAT-NSHDSACASA-N 287.319 2.416 10 20 CECD CNC[C@H]1CCCN1Cc1ccc(N(C)C)cc1C 843056123 TXYUCDBLRAUHEC-MRXNPFEDSA-N 261.413 2.245 10 20 CECD O=C(O)C1CCN(Cc2c(O)ccc3ccncc23)CC1 740482170 NXGSGVHYCHILRW-UHFFFAOYSA-N 286.331 2.237 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@@H]2CNC(=O)C2)c1O 840837930 MBLJAQHWMBQFHD-NXEZZACHSA-N 282.771 2.141 10 20 CECD C[C@@H]1C[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)CS1 840510202 MZUNFUITUKFVOB-DREQKGALSA-N 279.361 2.121 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C(=O)O)C(C)C 844253789 IEGFFXZPAAGEJQ-AWEZNQCLSA-N 292.379 2.034 10 20 CECD CC[C@H](NC(=O)NCc1ccccc1O)[C@H]1CCCO1 756104909 DNHFOWFOTUKRRD-GXTWGEPZSA-N 278.352 2.149 10 20 CECD COC(=O)C1=NO[C@@H](CSc2ncc(Cl)s2)C1 850000581 ZSIDYRCUWBTZND-RXMQYKEDSA-N 292.769 2.207 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H](C)C[C@@H]2CCOC2)c1 858299172 QHENSZKHGVUNHY-OLZOCXBDSA-N 292.379 2.315 10 20 CECD CCC[C@H](OCC)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 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FC(F)c1noc(CNCc2ccc3c(c2)CCO3)n1 895726892 JWQDRQFYWGIJAN-UHFFFAOYSA-N 281.262 2.232 10 20 CECD COc1cc(C)cc(CN(C)[C@@H]2CCCC[C@H]2O)c1O 895439101 WMBKGVGTRJAJER-ZIAGYGMSSA-N 279.380 2.445 10 20 CECD CC[C@H](NCCN1CCOC[C@@H]1C)c1ccc(F)cc1O 796751602 AGLMHVBVFUJKMA-WFASDCNBSA-N 296.386 2.293 10 20 CECD C[C@H]1CN(Cc2ccc(Br)cc2O)CCO1 691738377 VUHZUPQMSIXHJN-VIFPVBQESA-N 286.169 2.375 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCO[C@@H](C)C2)c1 223168972 OREOJWVAVMPWAV-CMPLNLGQSA-N 251.326 2.058 10 20 CECD Cc1ccc(CNC(=O)c2cccc(O)c2O)cc1F 192900068 ZDKNOGOBRQFUOE-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CC(C)[C@H](CC(=O)O)NCc1ccc2c(c1)CCO2 1320873150 XVEWKWKJUJEDKU-ZDUSSCGKSA-N 263.337 2.210 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@]2(C)CO)c1O 723023307 RMPAYJBJSRMIBV-HNNXBMFYSA-N 281.327 2.081 10 20 CECD C[C@@H]1[C@@H](C(=O)O)CCN1Cc1cc2c(cc1O)CCC2 1604635155 FPRSGKRQCNWSJZ-YGRLFVJLSA-N 275.348 2.176 10 20 CECD COc1cccc([C@H](C)N[C@H]2CC=C(C(=O)O)C2)c1O 1607309407 HHVDNRITSHAXRQ-ONGXEEELSA-N 277.320 2.225 10 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2.070 10 20 CECD CN(C[C@H]1CCCC[C@H]1O)C(=O)Nc1ccc(N)cc1 841295772 GDNQOHFXDUKFAW-BXUZGUMPSA-N 277.368 2.284 10 20 CECD COC(=O)[C@@H]1CN(Cc2cc(F)ccc2O)C[C@H]1C1CC1 846121811 CLRZPQQTAWZYAU-UONOGXRCSA-N 293.338 2.162 10 20 CECD CN(C)Cc1cnc(CNCCc2ccc(N)cc2)s1 841038973 WABZMRZDIVHIBH-UHFFFAOYSA-N 290.436 2.119 10 20 CECD CCOc1ccc(CN[C@@H]2CCN(C)[C@H](C)C2)c(O)c1 742374630 AQWZPBLGNVLUPS-TZMCWYRMSA-N 278.396 2.363 10 20 CECD CC[C@H](C)C[C@H](CO)NC(=O)/C=C\c1ccc(O)c(O)c1 844037958 VUCJKLOQTPCCHH-PDCNKGEESA-N 293.363 2.024 10 20 CECD CCC[C@@H](O)CC(=O)N(C)Cc1ccc(N(C)C)cc1 750097834 YOGSPNUGGNINQB-OAHLLOKOSA-N 278.396 2.262 10 20 CECD C[C@@H](NC[C@H]1C[C@@H](O)C1)c1cc(F)cc(F)c1O 858545457 OUTWVBPHLORUOG-MRTMQBJTSA-N 257.280 2.092 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)CCCF)C2)cc1 854981539 VJGAFDRSTOTOBD-CYBMUJFWSA-N 294.370 2.387 10 20 CECD O=C(NCc1ccccc1O)c1cccc(C2OCCO2)c1 764068062 LDRVLPZJPPSAAE-UHFFFAOYSA-N 299.326 2.368 10 20 CECD CCO[C@@H](C(=O)NCc1cc(C)ccc1O)C1CC1 862754420 XOCSBHAMMCXSIY-CQSZACIVSA-N 263.337 2.132 10 20 CECD O=C1NCCC12CCN(Cc1cccc(Cl)c1O)CC2 877782547 DDWJBSANNWIUHN-UHFFFAOYSA-N 294.782 2.148 10 20 CECD Cc1nc(C(C)C)oc1C(=O)NCc1cccc(O)c1O 1123977137 AMZLEIIYMLHNOH-UHFFFAOYSA-N 290.319 2.448 10 20 CECD C[C@H](CCS(C)(=O)=O)N[C@H](C)c1c(O)cccc1F 886541182 ROTGVAPVXGNQTF-NXEZZACHSA-N 289.372 2.005 10 20 CECD C[C@@H](NCCN1C[C@@H]2CC[C@H](C1)O2)c1c(O)cccc1F 886620590 NQQLDDMMGWDPRQ-UPJWGTAASA-N 294.370 2.045 10 20 CECD O=C(Nc1ccc2c(c1)OCO2)c1c(F)ccc(O)c1O 789942853 RJGDXPCLZWEFKW-UHFFFAOYSA-N 291.234 2.218 10 20 CECD COc1ccc(CNCC2(O)CCCCC2)c(O)c1OC 892815671 HNBATTZZNLQZFX-UHFFFAOYSA-N 295.379 2.194 10 20 CECD CC[C@H]1CN(Cc2ccc(OC)c(OC)c2O)C[C@H](C)O1 891806054 VSTXHFZACINORZ-AAEUAGOBSA-N 295.379 2.409 10 20 CECD COc1ccc(CN[C@H]2CSC[C@@H]2C)c(O)c1OC 894411926 BTTSEUYOFIBFJL-ONGXEEELSA-N 283.393 2.251 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2csc(O)n2)c1 792238617 SUZVOICSRVWORR-SSDOTTSWSA-N 294.332 2.054 10 20 CECD COc1ccc(CNC(=O)NCC2(SC)CC2)c(O)c1 793087050 ZZCGUDMIWVATNY-UHFFFAOYSA-N 296.392 2.096 10 20 CECD Cc1cc(NCCCSc2nccs2)nc(CO)n1 1322698910 CFVGIANGIORIDW-UHFFFAOYSA-N 296.421 2.328 10 20 CECD Cc1ccc([N+](=O)[O-])c2c1N[C@@H](c1ccc([N+](=O)[O-])cc1)[C@H]1CC=C[C@H]21 92526444 OKTPVQSWWDPCNZ-OLZOCXBDSA-N 351.362 4.638 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1nc(C2CC2)cs1 1346695020 JPESSYJXEIWAQA-UHFFFAOYSA-N 290.344 2.362 10 20 CECD Cc1ccc(C(=O)O)c(O)c1NC(=O)c1cc(O)cs1 1607736189 VRPODOYRPDRVTH-UHFFFAOYSA-N 293.300 2.418 10 20 CECD COc1cc(Cl)cc(CNC(C)(C)CCO)c1O 169088040 NDLIXSXDZQIJOQ-UHFFFAOYSA-N 273.760 2.305 10 20 CECD C[S@](=O)C1(CNCc2ccc3c(c2)CCCO3)CC1 922099692 MMRNVVBOLSIJMQ-IBGZPJMESA-N 279.405 2.012 10 20 CECD Oc1ccc(F)cc1CNCCCOC[C@H]1CCCO1 226582987 OZYSBXQBIVIDKW-CQSZACIVSA-N 283.343 2.207 10 20 CECD COc1cccc(CN(C)C[C@@H]2CCCOC2)c1O 156030877 TXLXWHXZJCRTMV-LBPRGKRZSA-N 265.353 2.259 10 20 CECD Cc1cccc(CNCC2([S@@](C)=O)CCC2)c1O 281873162 UVQTWUAKJKKZTH-GOSISDBHSA-N 267.394 2.091 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](C)CCCO)c1 294863039 TZDRTLOOZMMCMP-VXGBXAGGSA-N 267.369 2.460 10 20 CECD C[C@@H](CC(C)(C)O)NCc1ccc(N(C)C)cc1 295077220 PWRGKCSWQHYVGH-LBPRGKRZSA-N 250.386 2.392 10 20 CECD C[C@H](Cn1cccn1)N[C@H](C)c1ccc(F)cc1O 62747595 FGFBPZVJKQFFFI-GHMZBOCLSA-N 263.316 2.467 10 20 CECD Cc1ccc(O)c(CNCCCc2cn[nH]c2C)c1 71408870 MHDXEKIIAFBKJP-UHFFFAOYSA-N 259.353 2.455 10 20 CECD C[C@H](CNCc1ccccc1O)C(=O)OC(C)(C)C 320154113 JTGWYFQWVJHVQL-LLVKDONJSA-N 265.353 2.460 10 20 CECD C[C@@H](CCNCc1cccc(Cl)c1O)N(C)C 697836562 JJWARDFLPGKVHS-JTQLQIEISA-N 256.777 2.475 10 20 CECD CN1CCCc2cc(CNC(=O)Nc3ccn(C)n3)ccc21 107052703 ISBXCNIZWHBBCI-UHFFFAOYSA-N 299.378 2.124 10 20 CECD CC[C@H](C)[C@](C)(O)CNCc1cc([N+](=O)[O-])ccc1O 304067298 UJMLVCGSWBHBAF-IINYFYTJSA-N 282.340 2.187 10 20 CECD CCCCCN(CC(N)=O)Cc1cc(C)ccc1O 180805041 ABMQEMLKVBSWND-UHFFFAOYSA-N 264.369 2.178 10 20 CECD CCCOc1ccc(CNC[C@](C)(O)CSC)c(O)c1 120679671 FZKVCWCISSDJAE-HNNXBMFYSA-N 299.436 2.385 10 20 CECD C[C@@H](N[C@H]1CCCCNC1=O)c1cc(Cl)ccc1O 184982123 MCLWOCXWDZAYEF-SKDRFNHKSA-N 282.771 2.365 10 20 CECD COCc1cccc(S(=O)(=O)Nc2ccc(O)cc2)c1 182419379 VKXPQYULGDKXFK-UHFFFAOYSA-N 293.344 2.339 10 20 CECD COc1ccc(O)c(CN(CCO)c2ccccc2)c1 191970544 FHBASTWBRYNUJG-UHFFFAOYSA-N 273.332 2.400 10 20 CECD CSC1(CNC(=O)c2ccc(C)c(O)c2O)CCC1 194622668 HPUNSOIEBSYTMC-UHFFFAOYSA-N 281.377 2.422 10 20 CECD CCOc1ccc(O)c(CN[C@H]2C[C@H]3CC[C@H]2NC3)c1 530247302 ZXXKBBYEHUMBMC-DFBGVHRSSA-N 276.380 2.021 10 20 CECD CCN(CCCO)Cc1cc(Cl)cc([N+](=O)[O-])c1O 271198029 ONSAHQVFGOQXBO-UHFFFAOYSA-N 288.731 2.158 10 20 CECD CCCOc1ccc(CN2CC[C@H](C(=O)OC)C2)c(O)c1 271114084 VPGSQUXGOBAZJG-ZDUSSCGKSA-N 293.363 2.176 10 20 CECD O=C(c1cccc(O)c1O)N1CCCC[C@@H]1c1cc[nH]n1 286073004 RZDWRYZIZFGQPQ-GFCCVEGCSA-N 287.319 2.188 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](SC)C2)c1 295098496 SJHMZDAXHLJRRT-GFCCVEGCSA-N 253.367 2.338 10 20 CECD COC(=O)CC1CC(NCc2ccc3c(c2)CCO3)C1 818330006 KSWWXVBAZWLUQT-UHFFFAOYSA-N 275.348 2.053 10 20 CECD COc1ccccc1NC[C@H](O)CCOC(C)C 819393411 CTOBTSMKQJOULN-GFCCVEGCSA-N 253.342 2.283 10 20 CECD CN(CCS(C)(=O)=O)Cc1ccc2ccccc2c1O 816487324 JMTRVQFKMTXMQI-UHFFFAOYSA-N 293.388 2.022 10 20 CECD CCC(=O)C1(C(=O)NCc2ccc(N(C)C)cc2C)CC1 825872780 APYDJVAVVXSTEQ-UHFFFAOYSA-N 288.391 2.437 10 20 CECD CCOc1ccc(CN[C@@H](C)C(=O)OC(C)C)c(O)c1 825118970 ZWLCYCCDZGHJKQ-NSHDSACASA-N 281.352 2.221 10 20 CECD Oc1cccc(Cl)c1CN1CCC[C@H](n2ccnn2)C1 822503342 GKINBRQFBMKPDC-NSHDSACASA-N 292.770 2.474 10 20 CECD CC[C@@H](NCCCON)c1ccc(N(C)C)cc1 902419910 VMSMKYJXZOVLCC-CQSZACIVSA-N 251.374 2.074 10 20 CECD CN(C(=O)/C=C\c1cccnc1)c1ccc(Cl)nn1 492139413 VWKCCMMKAGJBDD-DAXSKMNVSA-N 274.711 2.201 10 20 CECD COc1ccc(CN[C@@H](C)[C@@H](C)C(=O)O)cc1C 901446263 SOKMWTMWWJQQQL-MNOVXSKESA-N 251.326 2.202 10 20 CECD COCc1cn(Cc2cc(Cl)cc(C(C)=O)c2O)nn1 900496488 POIOYSJTQXGXKP-UHFFFAOYSA-N 295.726 2.034 10 20 CECD CCc1nocc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 831925626 ZXBDWQBVYSXYAV-VIFPVBQESA-N 290.319 2.009 10 20 CECD CC(C)[C@@H]1C[C@H]1CNC(=O)NCc1ccccc1O 836622752 VUBQZZIAYWMJEN-STQMWFEESA-N 262.353 2.484 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CC[C@@H]2CCCCN21 901125507 YESIKYUBAGGYHU-KBPBESRZSA-N 274.364 2.025 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCC2(N)CC2)c1O 902408647 ZZOXTDDBJPAWFC-SECBINFHSA-N 254.761 2.496 10 20 CECD Cc1ccc([C@H](C)NCCN2CCCOCC2)c(O)c1 903228144 POIXPSDOWSUIER-AWEZNQCLSA-N 278.396 2.074 10 20 CECD O=C1[C@H](NCc2cc(Cl)ccc2O)C[C@@H]2CCCCN12 835074285 RIRYXUHCRIWKOR-QWHCGFSZSA-N 294.782 2.289 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H](C)C[C@@H](C)N 831211265 FEDHDSYDIJNCIB-CHWSQXEVSA-N 293.411 2.440 10 20 CECD CCc1cccc(CN[C@H](C)Cc2cnccn2)c1O 848893789 CMYZLFGQWLZPCL-GFCCVEGCSA-N 271.364 2.465 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)CC1COC1 910558924 SMIWKASKXQTKAZ-ZDUSSCGKSA-N 290.407 2.145 10 20 CECD OC[C@H](CNCc1ccccc1O)c1ccc(F)cc1 840962637 INDNEVQFLYHNTI-AWEZNQCLSA-N 275.323 2.397 10 20 CECD COc1cccc(CN[C@H]2CCCC[C@@H]2CN)c1O 841030126 KJXIMGXNJCDEJD-YPMHNXCESA-N 264.369 2.008 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)[C@@H](C)OC)c1O 846162981 CWNGTJZJWXWUBK-HBNTYKKESA-N 253.342 2.475 10 20 CECD COc1cc(O)c(CN2CCCC[C@@H]2[C@@H](C)N)cc1OC 843044718 GHEHQPMUJDQNGN-DGCLKSJQSA-N 294.395 2.111 10 20 CECD O=C(c1cccc(O)c1O)N1CCC(OC2CCC2)CC1 841446121 ZWWHSHQWODEEMM-UHFFFAOYSA-N 291.347 2.272 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)[C@@H]2CC2(F)F)cc1 844856832 NNIJTNPQHBGVHM-ZDUSSCGKSA-N 298.333 2.245 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@H](C)c1ccc(C)cc1O 186030303 JRNQKXLOSYITFV-NWDGAFQWSA-N 285.409 2.174 10 20 CECD CCOc1ccc(O)c([C@H]2NC(C)(C)C(=O)N2CC)c1 840833699 TWJUXTRJOOZLTO-ZDUSSCGKSA-N 278.352 2.020 10 20 CECD C[C@H]1OCC[C@@H]1C(=O)NCc1cc(Cl)ccc1O 846473534 MSTSQWKRZKPZLJ-KCJUWKMLSA-N 269.728 2.087 10 20 CECD COc1cccc([C@@H](C)N[C@@H](CCO)CSC)c1O 846144528 LCXJSAZIHXRUFM-MNOVXSKESA-N 285.409 2.165 10 20 CECD Oc1c(Br)cccc1CN[C@H]1CCCNCC1 841057107 IFHICYLWECCJBL-NSHDSACASA-N 299.212 2.386 10 20 CECD CCc1cccc(CN[C@@H](CC2CC2)C(=O)OC)c1O 848917192 PSAZUMKBOBWHLB-AWEZNQCLSA-N 277.364 2.386 10 20 CECD C[C@@H](NCC1(CO)CCC1)c1cc([N+](=O)[O-])ccc1O 757655595 FOHVRPJQKBGKPB-SNVBAGLBSA-N 280.324 2.114 10 20 CECD COc1ccc(CN[C@H]2CCN(C(=O)C3CC3)C2)cc1C 1018391160 GAQPBOOLMZEUNI-HNNXBMFYSA-N 288.391 2.104 10 20 CECD O=C(N[C@H]1CCO[C@@H](C2CC2)C1)c1cc(O)cs1 765864420 JJGNTSYXRUGGAE-GXSJLCMTSA-N 267.350 2.141 10 20 CECD Cc1ccc(CN[C@@H](C)[C@@H](O)C(F)(F)F)c(O)c1 877693715 ORERKHVRBOMMLE-GZMMTYOYSA-N 263.259 2.102 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCC1CCC1 779530750 ZJEXXHJQBBRHCI-FNORWQNLSA-N 261.321 2.417 10 20 CECD COCCN1[C@@H](C)CN(Cc2c(C)cccc2O)C[C@H]1C 877605795 JJDZRLSXGLGWPP-GASCZTMLSA-N 292.423 2.242 10 20 CECD O=C(OCc1ccc(CO)cc1)c1cc(O)cs1 778803383 OJAXFJPWSNVIBW-UHFFFAOYSA-N 264.302 2.303 10 20 CECD C[C@H](N[C@H](CCO)C(F)(F)F)c1c(O)cccc1F 886803929 PFFUHNHCBTYRRC-OIBJUYFYSA-N 281.249 2.495 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCCC(F)(F)[C@@H]1O 883146434 NAHKSOLMKPJSQS-CMPLNLGQSA-N 293.260 2.309 10 20 CECD C[C@H](NC[C@@H](C)CN1CCOCC1)c1c(O)cccc1F 886530361 ISQFJEWTSVUYEC-OLZOCXBDSA-N 296.386 2.150 10 20 CECD COCc1cc(NCc2ccc(N(C)C)c(F)c2)ncn1 782135239 IHAROFJDRKXBCZ-UHFFFAOYSA-N 290.342 2.440 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](O)C[C@@H]2C)c1O 788268590 GKOWXGAKLVDDLX-KWQFWETISA-N 271.744 2.009 10 20 CECD COc1cc(C)cc(CNCCO[C@H]2CCCCO2)c1O 894794300 NOYIMYDHEVGJKT-HNNXBMFYSA-N 295.379 2.342 10 20 CECD COc1cccc(CNC(=O)Nc2cncc(F)c2)c1O 799235775 MQQRAIXLYGUBSY-UHFFFAOYSA-N 291.282 2.257 10 20 CECD COc1ccc(CNC(=O)NC2CCSCC2)c(O)c1 792949455 AQWGWTMDMIJPKE-UHFFFAOYSA-N 296.392 2.096 10 20 CECD C[C@@]1(NCc2c(O)cccc2Br)CCOC1 706868316 FADBNYHLLXNXIV-GFCCVEGCSA-N 286.169 2.423 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC[C@@H]1CCOC1 1324664779 ALWXELQHZXSDGE-QQHVMHFCSA-N 278.304 2.081 10 20 CECD COC(=O)CN(Cc1ccc(C)cc1O)CC(C)C 1349600829 ZJSXNLYYDYXDJW-UHFFFAOYSA-N 265.353 2.332 10 20 CECD CO[C@@H]1CCC[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1516718587 AQVLVDGZQONWIV-IUODEOHRSA-N 294.370 2.323 10 20 CECD C[C@H]1CN(c2nnc(-c3sccc3O)n2C)C[C@@H]1C 1519508129 OXRRMTJLQDGHER-IUCAKERBSA-N 278.381 2.341 10 20 CECD Cc1cncc(CCC(=O)NCc2cccc(O)c2O)c1 1520509315 SSAKWOCAEAJVKN-UHFFFAOYSA-N 286.331 2.050 10 20 CECD O=C(O)[C@H](CC(F)(F)F)NCc1cccc(F)c1O 1608530120 NCMFRZUMZNQLEE-QMMMGPOBSA-N 281.205 2.027 10 20 CECD CCOc1ccc(O)c(CNCc2cc(C(=O)O)co2)c1 1597129433 ACMUOIPIFZADEX-UHFFFAOYSA-N 291.303 2.372 10 20 CECD CCCOCOc1ccc(N(C)C)c(C(=O)O)c1 1595946669 WEXPMLZYSCCXNA-UHFFFAOYSA-N 253.298 2.214 10 20 CECD C[C@H](N[C@@H](C)c1ccccc1O)C(=O)N1CCCC1 136421251 LWWFFURTCGFQTQ-RYUDHWBXSA-N 262.353 2.054 10 20 CECD CO[C@@H](CN1CCOc2cc(N(C)C)ccc21)C1CC1 822791869 XRFXPOKZNNDDCX-INIZCTEOSA-N 276.380 2.376 10 20 CECD CCCN1CCC(NCc2cc(F)ccc2O)CC1 226619109 YDMRMXSXMJKLTG-UHFFFAOYSA-N 266.360 2.495 10 20 CECD CCOc1cccc(CN[C@H](C)CC(C)(C)O)c1O 295006882 JCGVNXQMAAGQLO-LLVKDONJSA-N 267.369 2.430 10 20 CECD Nc1ccc(CC(=O)N2CCC=C(Cl)C2)cc1 404198063 GRVVQUMGGZNWGP-UHFFFAOYSA-N 250.729 2.166 10 20 CECD CC(C)N(C)C[C@H](C)NCc1cc(F)cc(F)c1O 708516967 LZOKCNDMOFYLRC-JTQLQIEISA-N 272.339 2.489 10 20 CECD Cc1ccc([C@H](C)N[C@H](CO)C[C@@H]2CCCO2)c(O)c1 886669900 GNJTVUUTIOELTP-IHRRRGAJSA-N 279.380 2.281 10 20 CECD CCO[C@@H](CC)C(=O)NCc1ccc(N(C)C)cc1C 115280818 QKSNVQDVPBZPLJ-HNNXBMFYSA-N 278.396 2.492 10 20 CECD COc1cccc(CNC(=O)c2cc(C3CC3)on2)c1O 178245351 MDWWQRHFDQSOJX-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CC[C@H](NC[C@@H]1CCCS(=O)(=O)C1)c1ccccc1O 283963449 FBXJAAGVYPNIAF-JSGCOSHPSA-N 297.420 2.258 10 20 CECD CC[C@@H](CCO)NC(=O)NCc1ccc(N(C)C)cc1C 77831703 YFTCICAJAJHWOV-AWEZNQCLSA-N 293.411 2.021 10 20 CECD CC(C)(O)CNCc1cccc(Br)c1O 82687379 HNCPFJPCNURMBS-UHFFFAOYSA-N 274.158 2.015 10 20 CECD C[C@@H](O)CCCNCc1cccc(Br)c1O 227958388 OCDFVZVZWCJQNV-SECBINFHSA-N 288.185 2.405 10 20 CECD CCN(Cc1nonc1C)c1ccc(OC)c(OC)c1 265166239 XHFKOFQSAVESIR-UHFFFAOYSA-N 277.324 2.422 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)c(O)c1 273529601 WANXKJKSXCRVFW-QWHCGFSZSA-N 276.380 2.361 10 20 CECD CCC(C)(C)N[C@@H](C)C(=O)NCc1cccc(OC)c1O 274906618 GDXZWLPHRXRMPT-NSHDSACASA-N 294.395 2.184 10 20 CECD CCOc1cccc(CN[C@H](COC)[C@@H]2CCCO2)c1O 278604501 ICLJSEJQRKOOQR-KGLIPLIRSA-N 295.379 2.075 10 20 CECD NCc1ccc2c(c1)CCCN2C[C@@H](O)CC(F)(F)F 700922683 GEPXTHQFBCMVLK-LBPRGKRZSA-N 288.313 2.211 10 20 CECD CC[C@@H](NCCc1n[nH]c(C)n1)c1ccc(F)cc1O 286035334 JLIPEEBQLGDOJL-GFCCVEGCSA-N 278.331 2.241 10 20 CECD C[C@H]1OCC[C@@]12CN(Cc1ccc(N(C)C)cc1)CCO2 280404249 LBLTXDBKEHUNTL-RHSMWYFYSA-N 290.407 2.132 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@H]1O 293698143 CMOGHEJFSZYMMF-GDBMZVCRSA-N 262.397 2.264 10 20 CECD CNC(=O)CCCN(C)Cc1ccc(N(C)C)c(C)c1 293706584 DGDBJIQDDVZCLB-UHFFFAOYSA-N 277.412 2.019 10 20 CECD CCCN1C[C@@H](CN[C@@H](C)c2cc(F)ccc2O)CC1=O 817589640 OVQUBXKZLLCWAB-NWDGAFQWSA-N 294.370 2.440 10 20 CECD Oc1c(CN2CCC3(C2)OCCO3)ccc2ccccc12 816502545 GJDMYQOIULKPRT-UHFFFAOYSA-N 285.343 2.494 10 20 CECD CCOCc1cc(CN[C@H]2CCN(C)C2)ccc1OC 729681804 JQTINDQEKWUMHQ-HNNXBMFYSA-N 278.396 2.025 10 20 CECD CCc1cccc(CNC[C@@H](CO)CC2CC2)c1O 827359609 QFJJLROEFJAMLF-ZDUSSCGKSA-N 263.381 2.453 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@H]2C[C@@H](O)C2)cc1 839790371 XLVZTFBPGUSSOM-FZNQNYSPSA-N 284.359 2.347 10 20 CECD CC1(N)CCN(Cc2c(O)ccc(Cl)c2F)CC1 843107858 PPLYDGOZOWDQLU-UHFFFAOYSA-N 272.751 2.498 10 20 CECD CC(C)[C@H](N)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 841882095 WFYUYNYUMASYFS-IUODEOHRSA-N 292.427 2.096 10 20 CECD Cc1cc(Br)cc(CN2CCNC[C@H]2C)c1O 843047769 SWVWGEMDHWZDDJ-SNVBAGLBSA-N 299.212 2.257 10 20 CECD C[C@H]1C[C@@H](C)O[C@@H]1C(=O)NCc1cc(Cl)ccc1O 846477620 UEJXLJUCVDBFNE-RWEMILLDSA-N 283.755 2.475 10 20 CECD CCN(CC)c1ccc(CN[C@H](CO)CCF)cc1 846095528 AYMUFICFTPSWRF-AWEZNQCLSA-N 268.376 2.343 10 20 CECD COc1cccc([C@H](C)NCCCO[C@@H]2CCOC2)c1O 846149841 MVNAICRLBMCVGJ-QWHCGFSZSA-N 295.379 2.247 10 20 CECD C[C@@H](C[C@@H](C)N)NCc1cccc(Br)c1O 843129933 UXUMSKDFABPWLG-BDAKNGLRSA-N 287.201 2.370 10 20 CECD CC[C@@H](CCO)N[C@@H](C)c1cccc(OC)c1O 846145518 OGOXGPFQPBBZAZ-QWRGUYRKSA-N 253.342 2.212 10 20 CECD Oc1cc2c(cc1CN1CCOC[C@@H]1C1CCC1)OCO2 843428715 MBMAJWJQMABOPQ-CYBMUJFWSA-N 291.347 2.122 10 20 CECD Oc1ccc(Cl)cc1CNC(=S)NC1CC1 844583497 ATBOGVCHVLTBJO-UHFFFAOYSA-N 256.758 2.172 10 20 CECD CO[C@H](CN(C)Cc1ccc(N(C)C)cc1)[C@H]1CCOC1 851720753 RYNNLZFTXZXCGT-DOTOQJQBSA-N 292.423 2.236 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](O)COCC2CC2)c(O)c1 756509360 AWSMBKFZKCYSCE-TZMCWYRMSA-N 279.380 2.139 10 20 CECD COc1cc(N2CCN(C(C)C)CC2)cc(OC)c1OC 759887734 WXJNXKXGJHCTLQ-UHFFFAOYSA-N 294.395 2.243 10 20 CECD C[C@@H](C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1)N(C)C 750602262 GYFHSDQAUAMVSA-ZDUSSCGKSA-N 289.423 2.194 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@H]1CCCO1 935945231 PUJDEUDBUYETSF-LLVKDONJSA-N 284.352 2.063 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnc(C3CC3)[nH]2)cc1 1116251629 VFBKHAXYRHULKF-UHFFFAOYSA-N 284.363 2.283 10 20 CECD Cc1cccc(O)c1CNCC(C)(C)C1(O)CCOCC1 877593965 KSXNZJKNECTSFC-UHFFFAOYSA-N 293.407 2.358 10 20 CECD Cc1ncsc1CNC(=O)/C=C\c1ccc(O)c(O)c1 779484562 UMACFWYHYYXHFO-HYXAFXHYSA-N 290.344 2.192 10 20 CECD CNC(=O)CN(Cc1ccccc1)Cc1ccc(C)cc1O 877773062 ZMRFVWZHVJWNTB-UHFFFAOYSA-N 298.386 2.449 10 20 CECD CC(C)[C@](C)(O)C(=O)NCc1ccc2c(c1)CCCN2C 771295801 MSKDRXISQUZXIZ-KRWDZBQOSA-N 290.407 2.092 10 20 CECD COc1cc(O)c(CN[C@H]2C[C@H](OC)C2(C)C)cc1OC 776231887 PSBQBCSHOKBXAW-GJZGRUSLSA-N 295.379 2.313 10 20 CECD O=C1CCCN1[C@H]1CCCN(Cc2cc(F)ccc2O)C1 779011511 FFYBVTHMWWIEMW-AWEZNQCLSA-N 292.354 2.118 10 20 CECD CCN(Cc1ccc(N2CCN(C)CC2)cc1)C1CC1 775652042 FGLZGGVUJBWZAC-UHFFFAOYSA-N 273.424 2.423 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)N(C)c2ccc(N)cc2)C1 884441940 SQCVZKGYYKGAQR-QMTHXVAHSA-N 284.363 2.321 10 20 CECD CC1(CO)CCN(Cc2cc(F)cc(F)c2O)CC1 894469382 NCCJECNRCWNIBE-UHFFFAOYSA-N 271.307 2.265 10 20 CECD OC[C@H]1Cc2ccccc2N1Cc1cc2c(cc1O)OCO2 895243635 AFUPWHBCWYFCJR-CYBMUJFWSA-N 299.326 2.045 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)CCOC(C)C)c1 788276746 UYANTEQZFMHQDV-STQMWFEESA-N 297.395 2.227 10 20 CECD COc1ccc(CN2C[C@@H](C)[C@H](C)C2)c(O)c1OC 892067881 BRILBVAOYQUEFH-GHMZBOCLSA-N 265.353 2.497 10 20 CECD COC[C@@H](NCc1cc(C)cc(OC)c1O)C(C)C 894268444 DYQGJEMEYSAMKX-CYBMUJFWSA-N 267.369 2.470 10 20 CECD COc1ccc(CNC[C@@H]2CCCCO2)c(O)c1OC 892678392 GOQJGLGXRWYYQW-LBPRGKRZSA-N 281.352 2.068 10 20 CECD Cc1cc(C)n(CCCNCc2ccccc2O)n1 134225540 XLBWBPLSRDYORQ-UHFFFAOYSA-N 259.353 2.385 10 20 CECD C[C@H](N[C@H](C)CC[S@@](C)=O)c1cc(F)ccc1O 168841743 DJEMVQXTELVNAJ-JJQCHNSYSA-N 273.373 2.339 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCC[C@H]3OCC[C@H]23)cc1 1337016679 UNCLVQXNWWVPSQ-RBSFLKMASA-N 289.379 2.026 10 20 CECD COc1ccc(CN[C@@H]2CC[C@@H](CC(=O)O)[C@H]2C)c(O)c1 1607259942 GZKJSNYFYBXKJR-UHIISALHSA-N 293.363 2.380 10 20 CECD Cc1cc(CNCc2cccc(F)c2O)oc1C(=O)O 1607648046 BCFWDEQPEXNURS-UHFFFAOYSA-N 279.267 2.421 10 20 CECD CC(C)(C)OC(=O)NC/C=C\CNCc1ccc(N)cc1 1575219532 YGSKLKDMLJLXQU-PLNGDYQASA-N 291.395 2.439 10 20 CECD CCN1CCc2cc(CN[C@@H]3CC[C@H](C(=O)O)C3)ccc21 1776877497 BQEBISBJUCXCFW-LSDHHAIUSA-N 288.391 2.412 10 20 CECD C[C@@H]1CCC[C@]1(NCc1cc(F)cc(F)c1O)C(=O)O 1776636280 DPXXFUCCQFGTKN-XLKFXECMSA-N 285.290 2.403 10 20 CECD C[C@@H]1OCCN(C(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 151473252 JPWYTCOIHZXEFA-STQMWFEESA-N 291.395 2.071 10 20 CECD CN(C(=O)/C=C\c1cccnc1)c1ccccc1C(=O)O 208486524 AIJJJQGKKSQOAX-HJWRWDBZSA-N 282.299 2.456 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CC12CCOCC2 377951730 UEPOXECRRLXVDY-ZDUSSCGKSA-N 275.348 2.167 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCCC[C@H]1O 708410225 VSNPBZPHGBNJSE-VXGBXAGGSA-N 257.280 2.064 10 20 CECD COc1ccc(O)c(CNC(=O)COc2ccccc2)c1 114543283 ABKPJKUTLOIPDY-UHFFFAOYSA-N 287.315 2.096 10 20 CECD Cc1ccc(C(=O)N2C[C@H](C)OC(C)(C)C2)c(O)c1O 177676485 VCHNVTMBVBOLNG-JTQLQIEISA-N 279.336 2.046 10 20 CECD Cc1ccc(C(=O)NC(C2CC2)C2CC2)c(O)c1O 179408196 DSAUBNJDYLZDDV-UHFFFAOYSA-N 261.321 2.325 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)C3CC3)C2)cc1 62574819 QOPRTJDQRHOQAU-LBPRGKRZSA-N 274.364 2.048 10 20 CECD Cn1ccc(CNCc2cc(Br)ccc2O)n1 231608724 NTORTCUZSWJINO-UHFFFAOYSA-N 296.168 2.178 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ccc([N+](=O)[O-])cn1 183598706 BFMUDABURAUKPK-VIFPVBQESA-N 289.291 2.444 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](C)N(C)C)c1 38088601 DAXLOCSNWZXRGZ-QWRGUYRKSA-N 252.358 2.002 10 20 CECD C[C@H](NCCOCC(F)F)c1cc(F)ccc1O 188746758 SLIOEHLOUCXRRO-QMMMGPOBSA-N 263.259 2.464 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CSCCS2)cc1 195329168 BRLIDSAXVQJLJT-ZDUSSCGKSA-N 296.461 2.217 10 20 CECD CN(C)CC[C@@H](NC(=O)Cc1ccc(N)cc1)C(C)(C)C 236982905 NHHSEVBXNZSYPK-OAHLLOKOSA-N 291.439 2.294 10 20 CECD CC[C@@H](NCC[C@@H](O)COC)c1ccc(N(C)C)cc1 90951331 AYRHNWSCECDKID-HZPDHXFCSA-N 280.412 2.191 10 20 CECD CC(C)c1nocc1C(=O)NCc1ccccc1O 528855293 QOUJUVPYLREOAJ-UHFFFAOYSA-N 260.293 2.434 10 20 CECD O=C1NC(=S)S/C1=C/c1cccnc1Cl 255391287 LJUQKPYADZNNKR-GQCTYLIASA-N 256.739 2.224 10 20 CECD CC[C@@H](C(=O)NCc1c(C)c2ccccc2n1C)N(C)C 352125908 NSVCYCFOYDLQJF-AWEZNQCLSA-N 287.407 2.443 10 20 CECD c1cc(N2CCCC2)ccc1OCc1nnnn1C1CC1 267360710 CIUPPOFFACDSOZ-UHFFFAOYSA-N 285.351 2.187 10 20 CECD COc1cccc(CN[C@H](CO)c2ccc(F)cc2)c1O 265256296 PUUGYMVVIXAXKA-CQSZACIVSA-N 291.322 2.363 10 20 CECD CC[C@@H](NCc1nnc2n1CCC2)c1ccccc1O 271710368 OGRSJQWURRJHPC-GFCCVEGCSA-N 272.352 2.171 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1cc(C)ccc1O 274896525 GAQCAXXALIPWGW-OCCSQVGLSA-N 277.364 2.474 10 20 CECD C[C@@H](NCCN1CCCCC1)c1cc([N+](=O)[O-])ccc1O 273301113 BJEMSLIYRFGLEB-GFCCVEGCSA-N 293.367 2.437 10 20 CECD C[C@@H]1OCC[C@]12CN(Cc1cc(Cl)ccc1O)CCO2 377274182 WNSLEDALAUGYPI-NHYWBVRUSA-N 297.782 2.425 10 20 CECD CC(=O)C(=O)COC(=O)c1c2c(nc3ccccc13)CCC2 808486575 FNESIJHOAYBDLY-UHFFFAOYSA-N 297.310 2.038 10 20 CECD C[C@@H]1C[C@H](N[C@H]2CCNC2)c2c(O)ccc(F)c21 817944429 BSKMDTSUETVQDL-YWVKMMECSA-N 250.317 2.031 10 20 CECD OCCN(Cc1cc(Cl)c(F)cc1O)CC1CC1 816496450 KWYRUZLNKAAUQX-UHFFFAOYSA-N 273.735 2.389 10 20 CECD CCn1cnc2c(NCc3cccc(OC)c3O)ncnc21 727432373 KCONGXSNBRMTEE-UHFFFAOYSA-N 299.334 2.173 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2cc(OC)ccc2O)n1 828682190 KJHWYWASEITIGL-SNVBAGLBSA-N 290.367 2.171 10 20 CECD Cc1cc(O)c(CNC[C@H](O)COCC2CC2)cc1Cl 825197875 WJGAGXNASPBRSG-ZDUSSCGKSA-N 299.798 2.231 10 20 CECD CC[C@H](NC[C@H]1CCOC[C@@H]1OC)c1ccccc1O 824710226 VZSZYXYHEUFOTF-INWMFGNUSA-N 279.380 2.484 10 20 CECD FC1(F)CCNC[C@@H]1CNCc1ccc2c(c1)CCCO2 904386024 NANWYOZZGLKGKP-CQSZACIVSA-N 296.361 2.346 10 20 CECD CC[C@@H](N[C@H](C)CC(=O)NC)c1ccc(F)cc1O 834901411 UTKCCROPHCWPSK-BXKDBHETSA-N 268.332 2.097 10 20 CECD C[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)CCN1C 745855145 RYUCAHZLEAAWJD-GXTWGEPZSA-N 291.395 2.016 10 20 CECD OC[C@H](CCF)NCc1ccc2ccccc2c1O 846096431 HTIQLYWWAQCEHN-ZDUSSCGKSA-N 263.312 2.356 10 20 CECD CCc1cccc(CNC[C@H]2CCOC[C@@H]2OC)c1O 848915845 MNOXDLDWXXMIGO-HIFRSBDPSA-N 279.380 2.096 10 20 CECD CCN(Cc1nc(Cc2ccc(N)cc2)no1)C1CC1 843159548 SPPAIDZCFXJHLM-UHFFFAOYSA-N 272.352 2.227 10 20 CECD Nc1ccc(CCNCc2ccc3c(c2)OCCO3)cc1 841037827 YBHMYZYUMJWKAQ-UHFFFAOYSA-N 284.359 2.372 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)N[C@H](C)CN)cc1 841970405 ZYRKJFKFUSHRIE-CYBMUJFWSA-N 292.427 2.021 10 20 CECD O=C(CCCc1nccs1)NCc1ccc(O)cc1O 910945573 DHINXQHFOXYNDQ-UHFFFAOYSA-N 292.360 2.193 10 20 CECD CCc1cccc(CNC2CCN(CCOC)CC2)c1O 848894280 HYKGVRWVWCXHIV-UHFFFAOYSA-N 292.423 2.155 10 20 CECD CN(Cc1cc(Cl)ccc1O)C1CCNCC1 843045066 HHMOFGWVLLWKNF-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)c2csnn2)c1 840969899 LYFORGCCIIKTLH-SECBINFHSA-N 279.365 2.493 10 20 CECD COC(=O)C1(CNC(=O)c2cc(O)cs2)CCCCC1 753523121 ITLMNLXEVUAFOR-UHFFFAOYSA-N 297.376 2.307 10 20 CECD Cc1nnc([C@@H](C)NC(=O)c2cc(O)cs2)s1 760455807 YGJOEQNXVPQDBC-RXMQYKEDSA-N 269.351 2.105 10 20 CECD NC(=O)[C@@H]1CCCCN1Cc1ccc(N2CCCC2)cc1 1116438156 FLMYYYHUIYXBOW-INIZCTEOSA-N 287.407 2.127 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H](C)n1cccc1 1116645835 PXRGDWXRNGFISS-VXGBXAGGSA-N 288.347 2.208 10 20 CECD COCCC(C)(C)NCc1cc(OC)c(OC)cc1O 776231114 MBNBCJSBSRECSB-UHFFFAOYSA-N 283.368 2.314 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CC[C@H]2[C@H](O)C3)cc1 887039250 FYOAQTIDISFKCT-CWRNSKLLSA-N 260.381 2.098 10 20 CECD O=C(NCc1cccc(O)c1O)C1CC2(CCC2)C1 1123889151 NCYUONCLPASGOG-UHFFFAOYSA-N 261.321 2.294 10 20 CECD CCN(C)c1ccc(CN(C)CC2(O)CCOCC2)cc1 773887230 FIUSFJVDFQZVJY-UHFFFAOYSA-N 292.423 2.116 10 20 CECD C[C@H](NCCC1(O)CCOCC1)c1c(O)cccc1F 886609609 XPCCHGCRCXITRF-NSHDSACASA-N 283.343 2.114 10 20 CECD CCN(CC)c1ccc(CN2C[C@H]3C[C@]3(CO)C2)cc1F 783737427 ZXOFTJJIEFQSND-RHSMWYFYSA-N 292.398 2.486 10 20 CECD C[C@H](N[C@@H](CCO)C1CC1)c1c(O)cccc1F 886549119 BUFWXAJNNKMBTD-CABZTGNLSA-N 253.317 2.343 10 20 CECD COc1ccc(CNCCC(C)(C)OC)c(O)c1OC 895816544 KKSLDZHEEIIUDI-UHFFFAOYSA-N 283.368 2.314 10 20 CECD Cc1cc(N)nc(NCCCSc2nccs2)n1 892515215 IXVGRGJBEWPXQZ-UHFFFAOYSA-N 281.410 2.418 10 20 CECD CCC[C@@](C)(CO)NCc1cc(C)cc(OC)c1O 894259556 WTAUGJWTJQHJKR-HNNXBMFYSA-N 267.369 2.350 10 20 CECD Cc1c(NCc2c(O)cccc2Br)nnn1C 706857878 KXRLRDXKNVQRJO-UHFFFAOYSA-N 297.156 2.204 10 20 CECD COc1ccc(O)c(CNCc2ncc(C)s2)c1 224827782 ROJKPLDMNYFVBM-UHFFFAOYSA-N 264.350 2.456 10 20 CECD COc1cc(C)nc(NCc2ccc(N(C)C)cc2)n1 733893881 FLFROEKUZHNISI-UHFFFAOYSA-N 272.352 2.472 10 20 CECD C[C@H]1COC[C@H]1NCc1ccc2c(c1)CCCN2C 699460945 CMTQYQZNNBSGCB-SWLSCSKDSA-N 260.381 2.194 10 20 CECD Nc1ccc(CNC(=O)c2c[nH]cc2C2CC2)cc1 1346209787 LQGCYFDXBJBXCB-UHFFFAOYSA-N 255.321 2.404 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@H]1[C@@H](C)C1(F)F 1346735052 HKDTXYCXEGBTRI-SXMVTHIZSA-N 285.290 2.046 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCc1nnnn1C1CC1 1342407559 IGHSFJMWHZXZDG-CMPLNLGQSA-N 299.378 2.360 10 20 CECD O=C(O)c1cccc2c1CCN2C(=O)c1cc(O)cs1 1608941087 HPTOHFIDTJRXMS-UHFFFAOYSA-N 289.312 2.355 10 20 CECD COc1cc(C)cc(CN[C@@H](CC2CC2)C(=O)O)c1O 1607149310 HFOZIIKKESZYLU-LBPRGKRZSA-N 279.336 2.052 10 20 CECD Cc1ccc(CN2CCC[C@H](C)[C@H]2C(=O)O)c(O)c1 1605273097 GPDJDVLXUOGEOC-FZMZJTMJSA-N 263.337 2.386 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)C1(C)CC1 160021131 OFJULKUDSBNTLZ-UHFFFAOYSA-N 288.391 2.282 10 20 CECD C[C@@H](CNCc1ccc2c(c1)CCCO2)CC(=O)O 258989981 ZBJUHBYUFOGPQO-LLVKDONJSA-N 263.337 2.212 10 20 CECD COc1ccc(N(C)C[C@@H](O)CC(F)(F)F)cc1 844352738 FRTVIJOCYLDWEU-JTQLQIEISA-N 263.259 2.445 10 20 CECD CN1CCC[C@H](CCNCc2ccc3c(c2)CCO3)C1 839183314 WFAGAINRNUGRMD-CQSZACIVSA-N 274.408 2.443 10 20 CECD COc1cccc(CNCCCN(C)C(C)C)c1O 227436223 LHAPRZRUCISADS-UHFFFAOYSA-N 266.385 2.221 10 20 CECD Cc1ccc(C(=O)NCc2ccccc2O)cc1O 166370070 BDHWMLCNNZOCED-UHFFFAOYSA-N 257.289 2.336 10 20 CECD C[C@](O)(CNCc1ccc2c(c1)CCO2)C(F)(F)F 270578097 WAIBQOPPIKMYBF-LBPRGKRZSA-N 275.270 2.024 10 20 CECD CN1CCN(c2ccc(CNCc3ccncc3)cc2)CC1 107797389 JHYJLQNPQJMXDW-UHFFFAOYSA-N 296.418 2.123 10 20 CECD CNC[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 71141937 XDRHLWNEIBFTOO-SNVBAGLBSA-N 254.761 2.087 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cccc(CO)c1 180887527 LASTXPMCEOSLAM-FNORWQNLSA-N 285.299 2.242 10 20 CECD N#Cc1ccccc1/C=C/C(=O)NCc1ccc(O)c(O)c1 182527728 SZLAYQLIFQQEPV-SOFGYWHQSA-N 294.310 2.299 10 20 CECD C[C@@H](NCc1ccc(C(N)=O)cc1)c1cc(F)ccc1O 184862480 ISMMNCLGXAIKJL-SNVBAGLBSA-N 288.322 2.481 10 20 CECD CC[C@](C)(O)CN[C@H](C)c1ccc(F)c(F)c1O 187707420 BSOQFDXMXDRJKB-OQPBUACISA-N 259.296 2.482 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)CCOC(C)C 189423951 NPIPCDJHGRHCDO-UHFFFAOYSA-N 287.381 2.121 10 20 CECD Cc1cc(C(=O)Oc2cnn(C)c2)c(C)n1-c1ccccn1 190466104 NIDXAORHFXTKLQ-UHFFFAOYSA-N 296.330 2.442 10 20 CECD CCn1nccc1C(=O)NCc1c(O)ccc2c1CCCC2 131840873 RENJESSSBSMAFC-UHFFFAOYSA-N 299.374 2.417 10 20 CECD C[C@@H](NCCn1ccnc1)c1ccc(F)c(F)c1O 191184766 GIAYEDMPVXBXQW-SECBINFHSA-N 267.279 2.218 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@H](C)O)cc1 130667696 WNXPVFUAPQVCSJ-ZDUSSCGKSA-N 250.386 2.345 10 20 CECD C[C@H]1C[C@H](CN)CN1Cc1cc(Br)ccc1O 220336633 DBAQHJKAGAFGRK-VHSXEESVSA-N 299.212 2.324 10 20 CECD CN1C(=O)CN(C(=O)/C=C\c2cccnc2)c2ccccc21 255440812 ZAVHRKCYVAYXQL-HJWRWDBZSA-N 293.326 2.104 10 20 CECD COC[C@H](N[C@@H](C)c1cc(OC)ccc1O)[C@H]1CCCO1 278932149 XNPDJNHJWLQORD-HZUKXOBISA-N 295.379 2.245 10 20 CECD Oc1ccc(F)cc1CN1CCO[C@H]2CCC[C@H]21 272252232 IOAPSYCCMZFNFY-OCCSQVGLSA-N 251.301 2.285 10 20 CECD Oc1ccccc1CN1CCC[C@H](c2ncc[nH]2)C1 271352589 LRJGEYXBLMPDSJ-ZDUSSCGKSA-N 257.337 2.495 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CO)CC2)cc1 293232106 SGZVKCPUOIPCTI-OAHLLOKOSA-N 262.397 2.347 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@@H]1CCN(C)C1 801549360 LELXSPCOIIYEPH-OAHLLOKOSA-N 290.407 2.473 10 20 CECD Cc1cc(CN2CC(=O)N(CC3CC3)C2)ccc1N(C)C 293949284 BPXSEMKIDRQFLG-UHFFFAOYSA-N 287.407 2.073 10 20 CECD C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cc(Br)ccc1O 817977858 QTOTUGNFDGUUPP-UVRHIYEWSA-N 297.196 2.023 10 20 CECD CC[C@H](NC[C@@H](N)C1CC1)c1ccc(F)cc1O 817964548 CHXNDYQYBPDYRH-OLZOCXBDSA-N 252.333 2.309 10 20 CECD CCOc1cccc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1O 824837879 JJONAXQGVJSSKQ-BYNSBNAKSA-N 287.359 2.176 10 20 CECD CC(=O)N[C@@H]1CCN(Cc2cc(Cl)c(C)cc2O)C1 826130150 DRUVZHNAGJURMY-GFCCVEGCSA-N 282.771 2.064 10 20 CECD Oc1cccc2c1[C@@H](NCCOC[C@H]1CCOC1)CC2 834578565 UWSVPAVFYQBSEI-JSGCOSHPSA-N 277.364 2.022 10 20 CECD CCOCc1cc(CNC[C@@H](N)CC)ccc1OC 841070139 MBGXOFFYVCSUAA-AWEZNQCLSA-N 266.385 2.059 10 20 CECD CC[C@H](NC[C@H]1CNC(=O)C1)c1cccc(Cl)c1O 840837737 LVJWCRFCYQTDBU-CABZTGNLSA-N 282.771 2.222 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)cc2C)[C@@H]1C 840942213 VPAOFGRSNZJORA-CJNGLKHVSA-N 290.407 2.444 10 20 CECD COc1cccc([C@H](C)NCCN(C)C(C)C)c1O 846144295 IQHWSHYLFCHGIA-LBPRGKRZSA-N 266.385 2.392 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)CC[C@H]1N 843052028 OROTUMJYBITVGJ-JOYOIKCWSA-N 254.761 2.215 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CN)C2)cc1F 843047848 YSSPKFNWSIMSRA-CYBMUJFWSA-N 265.376 2.062 10 20 CECD CCO/C=C\C(=O)N[C@H](C)c1cc(OC)ccc1O 847590998 MKBICMHQRYCNEY-GQYWMQPJSA-N 265.309 2.128 10 20 CECD Oc1c(F)cccc1CN1CCC(NCC2CC2)CC1 843054239 HKHRFNMHWRJWAO-UHFFFAOYSA-N 278.371 2.495 10 20 CECD COc1cccc([C@H](C)N[C@H]2CCc3n[nH]cc3C2)c1O 846152858 FDYOGDGXHXERPG-JQWIXIFHSA-N 287.363 2.332 10 20 CECD C[C@H](NCc1cccc(F)c1O)[C@H]1CCCNC1 841032710 FNZLQYLFLNTKFS-QWRGUYRKSA-N 252.333 2.009 10 20 CECD COc1cccc([C@H](C)N[C@H]2CC[C@H](O)CC2)c1O 846156310 DIZRAMLHOFOELZ-SRVKXCTJSA-N 265.353 2.355 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)C[C@@H]2C=CCC2)cc1 846663220 FLMUAXFLGOJJOF-CZUORRHYSA-N 287.407 2.225 10 20 CECD COc1ccc(N(C)CCCN2CCCC2=O)cc1F 757853287 ZUJUGAOKVBDSAL-UHFFFAOYSA-N 280.343 2.283 10 20 CECD CO[C@H]1C[C@@H](NC(=O)NCc2ccccc2O)C1(C)C 753343509 NIELIRQVTVVAQF-OLZOCXBDSA-N 278.352 2.005 10 20 CECD CC(C)(C)N1CC[C@H](NC(=O)NCc2ccccc2O)C1 852465360 FJLWLLJCSMECHI-ZDUSSCGKSA-N 291.395 2.064 10 20 CECD C[C@@H]1CCN(Cc2c(O)cccc2Cl)C[C@H]1CO 857061646 SVEUIABNSKDXOG-MNOVXSKESA-N 269.772 2.496 10 20 CECD CON(C(=O)/C=C\c1ccc(O)c(O)c1)C1CCCC1 757637876 OLZBPOAZUYIQDB-CLFYSBASSA-N 277.320 2.444 10 20 CECD CC[C@H]1CO[C@@H](C)CN1C(=O)c1cc(O)cs1 754906985 KLBQBMCWFOTLKB-IUCAKERBSA-N 255.339 2.093 10 20 CECD Cc1nocc1C(=O)N(C)Cc1ccc(N(C)C)cc1 864635414 ZXEXJTQNVHPZHV-UHFFFAOYSA-N 273.336 2.321 10 20 CECD CCN1C[C@@H](C)N(C(=O)c2cc(O)cs2)C[C@H]1C 766251665 XHBONJZCOXNXCB-NXEZZACHSA-N 268.382 2.008 10 20 CECD COCCOC[C@H]1CCN(Cc2c(C)cccc2O)C1 876775122 OUGYIXNWJSTLBB-AWEZNQCLSA-N 279.380 2.186 10 20 CECD C[C@H](N[C@@H]1C[C@@H](O)C1(C)C)c1cc(F)cc(F)c1O 779065408 POLWUHLWFTZKHE-UPZJHPNMSA-N 271.307 2.480 10 20 CECD O=C(N[C@H](CO)c1c(F)cccc1F)c1cc(O)cs1 778510684 LVTGCNCTVJRVSS-SNVBAGLBSA-N 299.298 2.195 10 20 CECD C[C@H](N[C@@H]1C[C@H]2CCCCN2C1=O)c1c(O)cccc1F 886623311 ARNSBIDPOSIYCK-DMDPSCGWSA-N 292.354 2.335 10 20 CECD COC[C@H](N[C@H](C)c1ccc(F)cc1O)[C@@H]1CCCO1 788619613 QKBVQESWRIQOOK-DGFSRKRXSA-N 283.343 2.376 10 20 CECD COc1ccnc(NC(=O)c2ccc(C)c(O)c2O)c1 780997241 COJSTPCDDHFMGB-UHFFFAOYSA-N 274.276 2.062 10 20 CECD COc1ccc(CNCc2cn(C)nc2C2CC2)c(O)c1 894184917 HJEVUUQAFHMDDT-UHFFFAOYSA-N 287.363 2.302 10 20 CECD COc1ccc(CNC(=O)NCc2cccs2)c(O)c1 792763258 NDKWIMAUPWZDQF-UHFFFAOYSA-N 292.360 2.462 10 20 CECD COC(CN(C)C(=O)c1ccc(CN=[N+]=[N-])s1)OC 1537962820 FIEYCXSWYFBYCL-UHFFFAOYSA-N 284.341 2.249 10 20 CECD C[C@H](NC(=O)c1ccc(N)cc1)c1ccccc1O 1579482856 ACELDKISDVFMBD-JTQLQIEISA-N 256.305 2.465 10 20 CECD CCOc1cccc(CNC[C@H]2CC[C@@H](O)C2)c1O 188839421 GPRKPBYVFVULEV-WCQYABFASA-N 265.353 2.042 10 20 CECD CC(=O)N1CCC(NCc2c(O)cccc2Cl)CC1 89710494 QCRFWIJQMHPSPC-UHFFFAOYSA-N 282.771 2.146 10 20 CECD CC[C@@]1(C)CN(Cc2c(O)cccc2OC)CCO1 785984555 LLFXIMUEDWFFKJ-HNNXBMFYSA-N 265.353 2.402 10 20 CECD CO[C@H]1CCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1 1337744232 RNGWBIHFFLQZGY-CABCVRRESA-N 276.380 2.184 10 20 CECD CC(C)[C@H](CO)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1341584987 LCIUUIJMCQLJKS-WFASDCNBSA-N 293.411 2.130 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc(C(=O)O)c1 1601239106 SJCZNPWFHDFXOO-ALCCZGGFSA-N 299.282 2.448 10 20 CECD CC[C@H](COc1ccc(N(C)C)c(C(=O)O)c1)OC 1605054082 AGNAIDOHWRAARD-SNVBAGLBSA-N 267.325 2.255 10 20 CECD CC[C@@H](CNC(=O)C1CC1)NCc1ccc(OC)c(C)c1 1753464184 NQHAJEZZBGSFBH-HNNXBMFYSA-N 290.407 2.398 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C)[C@H]2C(=O)O)cc1 1776855661 VVSGCSQNRHBDTO-WFASDCNBSA-N 276.380 2.438 10 20 CECD C[C@@H](CNCc1ccc2c(c1)CCCO2)[C@H](F)C(=O)O 1776425620 BHFHTSXJVJKLKN-HZMBPMFUSA-N 281.327 2.160 10 20 CECD COc1cc(C(=O)NCc2ccc(O)c(O)c2)ccc1C 159048207 AUNWCMSYXOFUEM-UHFFFAOYSA-N 287.315 2.345 10 20 CECD OCC[C@@H](NCc1ccc2c(c1)CCCO2)C1CC1 921769349 BTVIQDCXQOZPOT-OAHLLOKOSA-N 261.365 2.262 10 20 CECD CCOc1cccc(CN[C@@H]2C[C@H](O)C2(C)C)c1O 128267218 YSWJFDPQFQHZAC-OLZOCXBDSA-N 265.353 2.040 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCC(=O)NC(C)C 36781630 UCXIIDOUMHZNKF-NEPJUHHUSA-N 276.380 2.363 10 20 CECD C[C@H](NCCn1ccnc1)c1ccc(N(C)C)cc1 41119595 YEUVWZBEMJGYAL-ZDUSSCGKSA-N 258.369 2.300 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CC1)c1ccc(F)cc1O 282315538 NIKIGVWDMILYGB-DYBLOJMWSA-N 271.357 2.093 10 20 CECD CC[C@H](C)OCC(=O)NCc1ccc(N(C)C)c(F)c1 119563083 VYJVSFUJWAEWJH-NSHDSACASA-N 282.359 2.323 10 20 CECD Cc1cccc(CN2CCN(C(=O)C(C)(C)C)CC2)c1O 179671909 OEZJGJYCKJEMAF-UHFFFAOYSA-N 290.407 2.391 10 20 CECD CN1C[C@H](N(C)Cc2cc(Cl)ccc2O)CCC1=O 862428644 UEJDHTMFBDJCGN-GFCCVEGCSA-N 282.771 2.098 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)C[S@](C)=O)c(O)c1 186540808 ZTOHUEWDQBRXIX-DINDLPBHSA-N 255.383 2.118 10 20 CECD C[C@@H](NCC(F)(F)CO)c1cc(Cl)ccc1O 184694446 OQZOANDYTYQYJF-SSDOTTSWSA-N 265.687 2.324 10 20 CECD COCCN(Cc1cccc(C)c1O)CC(F)F 180013831 RNBAXEQHROVDJK-UHFFFAOYSA-N 259.296 2.414 10 20 CECD CN(C)c1ccc(CNC(=O)C2CCC(O)CC2)cc1F 194201926 HTZKKRJQZUMTFJ-UHFFFAOYSA-N 294.370 2.059 10 20 CECD CC[C@H](N[C@@H](C)C(=O)NC(C)C)c1ccccc1O 228929452 RNHQNXFXQZONGU-AAEUAGOBSA-N 264.369 2.346 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)[C@@H](C)N)cc1F 192111044 YFNATPJORBYRFG-VXGBXAGGSA-N 295.402 2.271 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NC[C@H](C)N)c2C)c1 194924921 JIWRGZNIFMBOAH-LBPRGKRZSA-N 285.391 2.480 10 20 CECD CC[C@H](COC)N[C@H](C)c1cc(C(=O)OC)ccc1O 273553352 GJGVLHOXIAFZAH-ZYHUDNBSSA-N 281.352 2.254 10 20 CECD CCOc1cccc(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c1O 271175571 FUUNDNFJQPIYJU-JGRMJRGVSA-N 297.420 2.132 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@H]2CCNC2)c1O 817945230 XOXIXDMJNCOJSJ-KOLCDFICSA-N 254.761 2.367 10 20 CECD OC[C@@H]1CCN(Cc2ccc3ccccc3c2O)C1 816499497 RXDFGCBTYBLITR-GFCCVEGCSA-N 257.333 2.360 10 20 CECD CC[C@@H](NC[C@@H]1CNCCCO1)c1cccc(Cl)c1O 817982979 XEXHYKCQMOBKFN-SMDDNHRTSA-N 298.814 2.465 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2O3)c1 733806434 CQRWBTGWSHZFTF-XPGAZNKBSA-N 291.347 2.146 10 20 CECD O=C1[C@H](NCc2cccc(Cl)c2O)C[C@H]2CCCCN12 835075662 ZLUYKQGAFLDRRI-DGCLKSJQSA-N 294.782 2.289 10 20 CECD COCCCCN(C)c1ccc(OCC(=O)O)cc1 833725093 OUDYQKHHSLCHRG-UHFFFAOYSA-N 267.325 2.013 10 20 CECD COCCOC[C@@H](C)NCc1ccc(N(C)C)cc1C 840935435 PIWNQYTZTAGJQC-CQSZACIVSA-N 280.412 2.202 10 20 CECD COc1cccc([C@H](C)N[C@@H](CCO)C(C)C)c1O 846149427 ZJDSCKZRVMVWIQ-AAEUAGOBSA-N 267.369 2.458 10 20 CECD CN(C)C(=O)[C@@H]1CCN(Cc2c(O)ccc3ccccc23)C1 840177783 LQKSDRUEFNEZOM-CQSZACIVSA-N 298.386 2.456 10 20 CECD CC[C@H](NC(=O)C(=O)Nc1ccc(N)cc1)C1CCCC1 841138731 GTEKIJKEWRDYQF-AWEZNQCLSA-N 289.379 2.292 10 20 CECD C[C@H](Cc1ccco1)NC(=O)NCc1ccccc1O 748461598 ZWJOLQRXZTVKCA-LLVKDONJSA-N 274.320 2.416 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N[C@H]1CCCOCC1 845094613 UUDUFESUXUXLKR-LBPRGKRZSA-N 298.770 2.414 10 20 CECD CCN1CC[C@H](NCc2ccc3c(c2)CCO3)[C@H](C)C1 742207084 OXKYVENEXZNXQK-CJNGLKHVSA-N 274.408 2.441 10 20 CECD COCCN(C)CCN[C@@H](C)c1ccc(Cl)cc1O 841747111 NUFRCGSVDGPDON-NSHDSACASA-N 286.803 2.274 10 20 CECD CCCN1CC(=O)N[C@H]1c1cc(Cl)c(F)cc1O 840826297 KIDHCZZAQNQFPA-GFCCVEGCSA-N 272.707 2.025 10 20 CECD CCc1cccc(CNC2(C(=O)NC)CCCC2)c1O 848904304 PUUASOSQDSRASU-UHFFFAOYSA-N 276.380 2.103 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1ccc(F)cc1O 756734262 VJOIPLWAQNQHPR-QWRGUYRKSA-N 271.332 2.233 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCc2ccncc21 755995775 SDPCTBQNWBIYLB-DUXPYHPUSA-N 282.299 2.095 10 20 CECD C[C@H](NCC1CC2(C1)OCCO2)c1c(O)cccc1F 926999577 KYKRLFYEAFEEHR-JTQLQIEISA-N 281.327 2.335 10 20 CECD CC(C)Oc1ccc(N(C)CCN2CCOC2=O)cc1 759933580 NMIHIWFFXWOXSP-UHFFFAOYSA-N 278.352 2.362 10 20 CECD Cc1ccc(C(=O)NCC2(O)CCC(C)CC2)c(O)c1O 856473716 AKNJQKSRSQNVHC-UHFFFAOYSA-N 293.363 2.077 10 20 CECD C[C@H](NC1COC(C)(C)OC1)c1ccc(F)cc1O 757698427 QWBOORZIFRPEPY-VIFPVBQESA-N 269.316 2.333 10 20 CECD COc1cc(CN[C@@H](C)CC(N)=O)c(O)c(C(C)(C)C)c1 850197076 KCKDASMERDFHMZ-JTQLQIEISA-N 294.395 2.052 10 20 CECD C[C@H](NC[C@]1(O)CCSC1)c1cc(F)cc(F)c1O 756639195 YUJFATKZMUCNSH-ISVAXAHUSA-N 289.347 2.189 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](O)C2CCCCC2)c1 862756922 AUJPPKZIFQJEEC-HNNXBMFYSA-N 277.364 2.258 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCCC[C@H]3C1)[C@H](O)CO2 768465235 YQQMPBBACLSBMJ-BFQNTYOBSA-N 289.375 2.440 10 20 CECD C[C@@H](NC[C@H]1C[C@H](O)C1)c1cc(F)cc(F)c1O 872126695 OUTWVBPHLORUOG-NQMVMOMDSA-N 257.280 2.092 10 20 CECD CC(C)c1ncc(C(=O)NCCc2ccc(N)cc2)[nH]1 1118202714 BSGGUYGQYOTLSG-UHFFFAOYSA-N 272.352 2.088 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCCSC2)c1 875342494 LKYJVWAECXFZBA-GFCCVEGCSA-N 280.393 2.395 10 20 CECD Cc1ccc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(O)c1 877567214 VLLJEXCALIVTJP-OCVGTWLNSA-N 257.333 2.086 10 20 CECD C[C@@H](NCCC(=O)N1CCC[C@H]1C)c1ccccc1O 879648370 LRBDUODBTUNGSJ-CHWSQXEVSA-N 276.380 2.444 10 20 CECD C[C@H]1OCC[C@@H]1CN1CCOc2cc(N(C)C)ccc21 878319654 YKUVZFFFDBSWPT-CHWSQXEVSA-N 276.380 2.376 10 20 CECD CCCNC(=O)CCN[C@H](C)c1c(O)cccc1F 886508594 GJJHTNQYDOFWQU-SNVBAGLBSA-N 268.332 2.098 10 20 CECD C[C@H](Cc1cnccn1)N[C@H](C)c1ccccc1O 783506585 YMDXVPKJKNECDE-VXGBXAGGSA-N 257.337 2.464 10 20 CECD O=C(OCC(=O)c1ccc(O)c(O)c1)C1=CCCCC1 784863786 NSOIPOBLPNVILF-UHFFFAOYSA-N 276.288 2.324 10 20 CECD COc1cc(C)cc(CNCC[C@@H](C)OC)c1O 894214954 LXNFVVNQMVENQR-LLVKDONJSA-N 253.342 2.224 10 20 CECD C[C@H](COc1ccccc1)NC(=O)c1cccc(O)c1O 790554660 KCXFDSGGTUTHJG-LLVKDONJSA-N 287.315 2.295 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCCSC2)c(O)c1 793077555 UKXDEKGCCABFJM-LLVKDONJSA-N 296.392 2.096 10 20 CECD CCOCCOCCNCc1cccc(CC)c1O 897203717 CFKHOOMKNLHODZ-UHFFFAOYSA-N 267.369 2.097 10 20 CECD CN(C)c1ccc(CN2CCC3(CC2)OCCO3)cc1 77253359 RSCWTSMBVVVJMT-UHFFFAOYSA-N 276.380 2.092 10 20 CECD O=C(Nc1ccc2c[nH]nc2c1)c1cccc(O)c1O 192970924 FHBZUVNGSYBNME-UHFFFAOYSA-N 269.260 2.226 10 20 CECD Oc1cc(Br)ccc1CNC[C@H]1C[C@@H](O)C1 720892978 LFKJKUOOGUIGOJ-DKTWLAJQSA-N 286.169 2.015 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1334937439 RQEZRTWEWXDNLC-QJPTWQEYSA-N 292.379 2.247 10 20 CECD c1cc(N2CCOCC2)ccc1CNCCC1CC1 88454308 CQWXWJHHFUAYGS-UHFFFAOYSA-N 260.381 2.413 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC[C@@H](CF)C1 1339816833 AUQNKLADZYQAQG-FUEXJSSKSA-N 279.311 2.319 10 20 CECD NC[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1261482648 UOZAPQMUZPBWTP-HNNXBMFYSA-N 259.397 2.067 10 20 CECD Nc1ccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 1345160412 VLOSIESUATXGTB-CQSZACIVSA-N 297.406 2.186 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)c1ncnn1C 1350427986 DPAVICZEPSBTKM-UHFFFAOYSA-N 285.395 2.442 10 20 CECD O=C(O)[C@@]12C[C@@H](NCc3ccc(F)c(F)c3O)C[C@@H]1C2 1608817921 MBQCSQXLXJOWKT-ITMYJUKJSA-N 283.274 2.013 10 20 CECD C[C@@H](NC[C@@H]1CCCC[C@H]1O)c1cc(C(=O)O)ccc1O 1609780232 NPYIJZMWZBANHF-SCDSUCTJSA-N 293.363 2.292 10 20 CECD CCC(CC)(CNC(=O)Nc1ccc(N)cc1)C(=O)O 1604998964 XRHCPEODJYYCOX-UHFFFAOYSA-N 279.340 2.281 10 20 CECD C[C@H]1NCC[C@@H]1NC/C=C/c1ccc(N(C)C)cc1 1579505156 MQWWOWNJFARQPS-GNVQUDOXSA-N 259.397 2.106 10 20 CECD COc1ncc(C(=O)NCc2ccc(N)cc2)cc1Cl 1579324451 NHWQKCVSCPALGU-UHFFFAOYSA-N 291.738 2.256 10 20 CECD C[C@H](CO)CCCN[C@H](C)c1cc(C(=O)O)ccc1O 1592758590 SXAQBCYWESPZAG-WDEREUQCSA-N 281.352 2.150 10 20 CECD CCOc1ccc(N(C)Cc2nc(CCOC)no2)cc1 150733367 BSNLOYYHKBHANH-UHFFFAOYSA-N 291.351 2.294 10 20 CECD c1cn2c(n1)[C@H](NCc1ccc3c(c1)CCO3)CCC2 848526382 YHPZXPUZQAAKDX-CQSZACIVSA-N 269.348 2.443 10 20 CECD O=C(NCCc1ccccc1)c1cccc(O)c1O 126220189 QEPZNESNGFONRA-UHFFFAOYSA-N 257.289 2.070 10 20 CECD CC[C@H](N[C@H](C)CN1CCOCC1)c1ccccc1O 36932891 RSRDIOIWMBTULR-HIFRSBDPSA-N 278.396 2.154 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@H]3CNC[C@H]3C2)cc1 401022540 RSGJKRMLGVWNQH-ARFHVFGLSA-N 273.424 2.230 10 20 CECD CCc1cccc(CN2CC[C@H](CN(C)C)C2)c1O 688531846 DICYHVAKACDIKN-CYBMUJFWSA-N 262.397 2.338 10 20 CECD Cc1ccc(O)c(CN[C@H](CCO)C(F)(F)F)c1 886371896 XUNBPZWPMABHJY-LLVKDONJSA-N 263.259 2.104 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H](C)OCCC(C)C)c1 114541467 FQQHCSCROONIHC-LBPRGKRZSA-N 295.379 2.468 10 20 CECD CCCCCN(CC(N)=O)Cc1ccc(N(C)C)cc1 180810999 GZCWDLHCWKVLPG-UHFFFAOYSA-N 277.412 2.230 10 20 CECD COCCC[C@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186425104 DVYWIMYJHIRTLE-RYUDHWBXSA-N 295.379 2.208 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CCCC[C@@H]1O 124816180 GYQQTCQGVWIHJC-RYUDHWBXSA-N 255.745 2.439 10 20 CECD CCN(C)CCN[C@@H](C)c1ccc(F)c(F)c1O 187669136 STVVGTOPTMKIJK-VIFPVBQESA-N 258.312 2.273 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1cc(F)ccc1O 182317598 HRFRGRRUKMJOPY-CQSZACIVSA-N 266.316 2.152 10 20 CECD CC(C)OCCCNC(=O)N(C)Cc1ccccc1O 43062183 QAMNRNRLRPWFMV-UHFFFAOYSA-N 280.368 2.349 10 20 CECD CC(C)C[C@H](O)CNCc1ccc(N2CCOCC2)cc1 224269587 SCNAHPCYYTWHKZ-KRWDZBQOSA-N 292.423 2.020 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H](CO)O[C@H](C)C2)cc1 191535594 FVYXWBZSXCELKF-PBHICJAKSA-N 292.423 2.114 10 20 CECD CC(C)N(CCC(=O)O)Cc1cc(F)ccc1O 232635166 CWQKYSVZUBAPNW-UHFFFAOYSA-N 255.289 2.216 10 20 CECD CCOCC(=O)NCc1c(C)c2ccccc2n1C 348672183 ZIGVSFBLKJCYQF-UHFFFAOYSA-N 260.337 2.139 10 20 CECD COC(=O)C[C@@H](O)CSc1ncc(C(C)(C)C)s1 268280027 AUVHRZCBCCZJIX-MRVPVSSYSA-N 289.422 2.457 10 20 CECD Cc1cc(C(=O)N2CCC(=O)CC2)c(C)n1-c1ccccn1 270738094 BRRLXZCHYDBDJH-UHFFFAOYSA-N 297.358 2.294 10 20 CECD Cc1nc([C@H]2CCCN(Cc3ccccc3O)C2)n[nH]1 271445909 SXPTZJMKEKCLJB-ZDUSSCGKSA-N 272.352 2.198 10 20 CECD Oc1c(Cl)cccc1CN1CCOC[C@H]1[C@@H]1CCCO1 377701409 PAYAPZAMFKAIPG-KBPBESRZSA-N 297.782 2.425 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1cc(C)c(C)cc1O 281003009 XVUUCXVSDBYKKO-LLVKDONJSA-N 251.326 2.002 10 20 CECD C[C@H](N[C@@H]1CCc2cccc(O)c21)[C@H](C)N1CCOCC1 297766284 OZZGNGZRFFHAOB-KCQAQPDRSA-N 290.407 2.078 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](O)CC(C)(C)C2)c1 295232214 OBQRHXMBKGMNFV-CYBMUJFWSA-N 279.380 2.384 10 20 CECD C[C@@H]1CCCCN(C(=O)c2c(F)ccc(O)c2O)C1 295093969 ZSPBUEWSMHRMPN-SECBINFHSA-N 267.300 2.499 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H]2CC23CCNCC3)c1 817976700 RQBNJOAEQIJQCW-WFASDCNBSA-N 260.381 2.493 10 20 CECD C[C@@H](CN)N[C@@H](C)c1cccc(C(F)(F)F)c1O 817970114 LIVYJOMIDLPOCU-YUMQZZPRSA-N 262.275 2.409 10 20 CECD COc1ccc(CN[C@H](CC(F)(F)F)C(=O)O)cc1C 901780730 TVTVZBDOMWYSDS-SNVBAGLBSA-N 291.269 2.499 10 20 CECD Cc1cc(C(=O)NCc2ccccc2O)nn1C(C)C 825658801 OUUGSNAPTHWABW-UHFFFAOYSA-N 273.336 2.408 10 20 CECD Nc1ccc(CNC(=O)CSCC(F)(F)F)cc1 837303018 QKSXWGHVJUEIAO-UHFFFAOYSA-N 278.299 2.181 10 20 CECD NC(=O)Cc1ccc(CN[C@@H]2CCc3cccc(O)c32)cc1 834803065 JKNNHKRELKSTIH-OAHLLOKOSA-N 296.370 2.197 10 20 CECD C[C@@H]1C[C@H](CNC(=O)NCc2ccccc2O)[C@@H](C)O1 840278110 YSNMGRMSLQWXEJ-NQBHXWOUSA-N 278.352 2.005 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NC1CCC1 845000675 BLOHQFLAOBJJNO-UHFFFAOYSA-N 254.717 2.397 10 20 CECD COc1ccc(N(C)Cc2cc3n(n2)CCC3)c(OC)c1 844310251 JZYAEIDIMFSKCK-UHFFFAOYSA-N 287.363 2.483 10 20 CECD CCO[C@H](CCN(C)C)CNCc1cccc(CC)c1O 848901279 RBWQHMMTFWSWOY-MRXNPFEDSA-N 294.439 2.401 10 20 CECD O=C(O)c1coc(NCCCSc2nccs2)n1 844211152 INWRQGDLUQLAPY-UHFFFAOYSA-N 285.350 2.424 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](C)CC(N)=O)cc1 743524682 ZQSIONQMXLZDKC-NSHDSACASA-N 299.374 2.088 10 20 CECD Cc1ccn2cc(C(=O)NCc3ccccc3O)nc2c1 748353039 JWLBKWHQQJLACK-UHFFFAOYSA-N 281.315 2.278 10 20 CECD CCN1CC[C@H](N(C)C(=O)Cc2ccc(N)cc2)C[C@@H]1C 844184970 BAFKKNMDHLRLBX-BBRMVZONSA-N 289.423 2.143 10 20 CECD CC(=O)c1cc(F)cc(CN(C)Cc2nc(C)no2)c1O 847091120 FIZSDWCWHDWLJP-UHFFFAOYSA-N 293.298 2.057 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@]2(C)CCO[C@@H]2C)c1O 755155657 CNMGZAOMDRAXLP-BMIGLBTASA-N 281.327 2.391 10 20 CECD OCCC1(NCc2ccc3c(c2)CCCO3)CCOCC1 921850868 VATPHDZRMKDOEL-UHFFFAOYSA-N 291.391 2.033 10 20 CECD CC[C@@H](NC[C@](C)(O)COC)c1ccc(N(C)C)cc1 765934130 AEJSOKCIPLFTOE-CVEARBPZSA-N 280.412 2.191 10 20 CECD COc1ccc(N(C)C[C@H]2CC3(CC3)C(=O)O2)c(OC)c1 763737372 PTAGRGOTYWQKMZ-GFCCVEGCSA-N 291.347 2.236 10 20 CECD CCC[C@H](CCO)NCc1cc(OC)c(OC)cc1O 877667062 LESHTJWQQCUZEU-GFCCVEGCSA-N 283.368 2.050 10 20 CECD COc1cccc(O)c1CN1CCS[C@@H]2COCC[C@H]21 770279155 FSCQYMXOFAFAMY-IUODEOHRSA-N 295.404 2.107 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccccc1O 779537496 PXLNDWNOLZBOGV-SOFGYWHQSA-N 285.299 2.133 10 20 CECD CC[C@@]1(O)CCN(Cc2ccc(N(C)C)c(F)c2)C1 779220128 XXSLLZFRLFADFY-OAHLLOKOSA-N 266.360 2.239 10 20 CECD CO[C@H]1CCC[C@H]1C(=O)NCc1ccc(N(C)C)cc1C 1120605278 RKRYEKFFZTZZEW-CVEARBPZSA-N 290.407 2.492 10 20 CECD COc1ccc(CNC[C@@H]2CCOC[C@H]2C)c(O)c1OC 894419500 GIIFFYMBTLCSCB-NEPJUHHUSA-N 295.379 2.172 10 20 CECD CC[C@H](NCc1ccc(C(N)=O)nc1)c1ccc(C)cc1O 794808341 ABCLMZIZJQSCCJ-AWEZNQCLSA-N 299.374 2.435 10 20 CECD CN(C)Cc1ccccc1NC(=O)c1cccc(O)c1O 790530529 OUXDNUTXTDPRFB-UHFFFAOYSA-N 286.331 2.412 10 20 CECD COC(=O)c1cnc(SCC[C@@H]2CCOC2)s1 1328002258 USMBLSMWLMDBAO-QMMMGPOBSA-N 273.379 2.448 10 20 CECD COc1cccc(O)c1CN(C)C[C@@H]1CCCN(C)C1 768545751 CQBCBSYZAFGBQX-CYBMUJFWSA-N 278.396 2.174 10 20 CECD C[C@@H](C(=O)N[C@H](C)c1ccccc1O)n1ccnc1 1336880744 KERPBNNXPPLECH-MNOVXSKESA-N 259.309 2.027 10 20 CECD CCCn1cc(/C=C2\SC(=S)NC2=O)c(C)n1 1337621771 KOYRVIVBQMKKHT-UITAMQMPSA-N 267.379 2.090 10 20 CECD CC[C@H](F)C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 1336440281 YULKZOVQHQDXQO-WFASDCNBSA-N 294.370 2.449 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CCC(F)(F)C1 795186637 ZRTBYFHLWFKLEP-SNVBAGLBSA-N 285.290 2.192 10 20 CECD C[C@@](NC(=O)c1cc(O)cs1)(C(=O)O)c1ccccc1 1603239385 IOBSCHLZRQOIKK-AWEZNQCLSA-N 291.328 2.184 10 20 CECD COc1cccc(O)c1CN1CCC(CCC(=O)O)CC1 1610356929 QANOCDPDONXNNR-UHFFFAOYSA-N 293.363 2.478 10 20 CECD CN(Cc1cc(C(=O)O)n(C)c1)c1ccc2c(c1)OCO2 1598506637 HXIYCEXHEBIHLP-UHFFFAOYSA-N 288.303 2.088 10 20 CECD COC(=O)CN(c1ccc(OC)c(F)c1)C(C)C 160207445 MBCUEEWSORDTNH-UHFFFAOYSA-N 255.289 2.222 10 20 CECD COc1ccc(CNCC(C)(C)N2CCOCC2)cc1C 35052641 GPIJZJXODSJXIP-UHFFFAOYSA-N 292.423 2.204 10 20 CECD COC(=O)c1cc(CNCc2ccccc2O)oc1C 164476571 OESMORBWOINNDZ-UHFFFAOYSA-N 275.304 2.370 10 20 CECD C[C@@H]1CCC[C@]1(O)CNCc1ccc(N(C)C)cc1 293165398 VWXRMZPUCKVILD-CJNGLKHVSA-N 262.397 2.393 10 20 CECD COc1ccc(O)c(CNC[C@]2(O)CCC[C@@H]2C)c1 294002336 MHLSOKBPUJHNHG-XHDPSFHLSA-N 265.353 2.042 10 20 CECD COc1ccc(CN[C@H]2C[C@H](OC)C23CCC3)c(O)c1 713480344 HRFXCZQJGRTXCJ-GJZGRUSLSA-N 277.364 2.448 10 20 CECD C[C@H](NC[C@@H]1CCCCS1(=O)=O)c1ccccc1O 694515736 QUEGGZPVRODAIP-RYUDHWBXSA-N 283.393 2.010 10 20 CECD COc1cccc(CNC(=O)[C@H]2C[C@H]2C2CC2)c1O 176130921 JFEBKFZGBBCOOW-RYUDHWBXSA-N 261.321 2.063 10 20 CECD NC(=O)CC1CCN(Cc2cccc(Cl)c2O)CC1 179720305 GIRZUARAGUFXEG-UHFFFAOYSA-N 282.771 2.133 10 20 CECD CC(=O)c1cc(F)cc(CNC2(CO)CCCC2)c1O 305228447 LFMWMZQCMIGZKB-UHFFFAOYSA-N 281.327 2.129 10 20 CECD CC[C@@H](NC[C@@H](O)C(F)(F)F)c1ccccc1O 121940190 APXWNDPNLGESII-MWLCHTKSSA-N 263.259 2.356 10 20 CECD Cc1cccc(OC[C@@H](O)CNCc2ccccc2O)c1 134227841 ULHQEXISGQXJJU-HNNXBMFYSA-N 287.359 2.230 10 20 CECD COC1(CN[C@@H](C)c2ccccc2O)CCOCC1 183624789 ZXZNGKVWLRJCTQ-LBPRGKRZSA-N 265.353 2.238 10 20 CECD CCN(CC(=O)N(C)C1CC1)c1ccc(OC)c(OC)c1 264936190 RGEHMYSVFADDGE-UHFFFAOYSA-N 292.379 2.151 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCO[C@H](C)C2)cc1OC 271819350 MOFDNVYTUHSNHT-VXGBXAGGSA-N 295.379 2.314 10 20 CECD Oc1ccccc1CNC[C@H]1COC2(CCCC2)O1 271422683 MPEUAANETYRBOL-ZDUSSCGKSA-N 263.337 2.168 10 20 CECD Cc1cc(O)c(CNCC2=CCN(C)CC2)cc1C 271851384 TVABJFPINLNYLU-UHFFFAOYSA-N 260.381 2.361 10 20 CECD C[C@H](NCC1(S(C)(=O)=O)CCCC1)c1ccccc1O 285859261 ZNQMWWXGZGIOPA-LBPRGKRZSA-N 297.420 2.400 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](n3cccn3)C2)cc1 291363670 YQDUNYWWJAPLCT-MRXNPFEDSA-N 270.380 2.396 10 20 CECD CC(C)(C)OCCCC(=O)NCc1ccc(O)c(O)c1 802783634 AHSLYETTZRPJHS-UHFFFAOYSA-N 281.352 2.309 10 20 CECD CC[C@@H](NCc1ccc(N2CCOCC2)cc1)C(C)(C)O 394010605 DBKKQBFZXVCOQT-MRXNPFEDSA-N 292.423 2.162 10 20 CECD COc1ccc(CNC(=O)c2ncoc2C2CC2)c(O)c1 816550227 LROVRPBARBUXRP-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CCNCCCN[C@@H](C)c1cc(F)cc(F)c1O 817943154 JMVGCOUUBXKWHZ-VIFPVBQESA-N 258.312 2.321 10 20 CECD COC(=O)c1ccc(NCc2cc(OC)ccc2O)nc1 813595041 VQWCXEQOULMSQF-UHFFFAOYSA-N 288.303 2.195 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCC(O)CC1 816482139 WEIUUWJCTRFXEV-UHFFFAOYSA-N 259.708 2.141 10 20 CECD COc1cc(O)c(CN2CCn3cccc3C2)cc1OC 905745087 KWPCHYRDQWCXPT-UHFFFAOYSA-N 288.347 2.227 10 20 CECD Cc1n[nH]c(C)c1NC(=O)/C=C\c1ccc(O)c(O)c1 588403348 FQIYCAUOMRTOSI-XQRVVYSFSA-N 273.292 2.090 10 20 CECD O=C(O)CN(Cc1ccccc1O)C(=O)C=C1CCCC1 911487461 UXBOGZPSXZIMRW-UHFFFAOYSA-N 289.331 2.306 10 20 CECD COC/C(C)=C/C(=O)N1CCOc2cc(N(C)C)ccc21 844413043 PNDAEKYQIRCQTO-FMIVXFBMSA-N 290.363 2.071 10 20 CECD CN[C@@H]1CCCN(Cc2ccc(N(C)C)cc2C)C1 843048712 SCICYKBCCSHVCK-OAHLLOKOSA-N 261.413 2.245 10 20 CECD Oc1ccc(Br)cc1CNC[C@H]1CCCNC1 841033221 PZSYTOZXTLZNMK-JTQLQIEISA-N 299.212 2.244 10 20 CECD CCc1cccc(CNCCCOC[C@@H]2CCOC2)c1O 848896909 KQOGZEAUGJVMEQ-AWEZNQCLSA-N 293.407 2.487 10 20 CECD CC1(C)CC[C@H](OC(=O)/C=C/c2ccc(O)c(O)c2)C1=O 840336884 USIVWWVXEGEOHS-BPJJOFIESA-N 290.315 2.412 10 20 CECD COc1cccc([C@H](C)N[C@@H]2CCn3ccnc3C2)c1O 846162243 CGFOPBWEZALINY-NWDGAFQWSA-N 287.363 2.263 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C(=O)O)[C@H]2C)c1O 846283357 DQOBBXRMGJFGSQ-PRHODGIISA-N 295.310 2.029 10 20 CECD CCc1cccc(CN2CCN(C(C)=O)CC2(C)C)c1O 848900178 CIYVEIVZERPCSR-UHFFFAOYSA-N 290.407 2.397 10 20 CECD COc1cc(O)c(CN[C@@H]2CCS[C@H]2C)cc1OC 843435092 QFIRXEZOUVVNTI-GXSJLCMTSA-N 283.393 2.393 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@]2(C)OC)c(O)c1 850408656 CFUKCWZCFZOCNH-KGLIPLIRSA-N 251.326 2.058 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2[nH]c(C)nc2C)c1 857117348 ZNTPUMLCMJTSAV-QMMMGPOBSA-N 289.335 2.232 10 20 CECD C[C@@H]1CCN(Cc2cc(Cl)ccc2O)C[C@H]1CO 857061445 QWDRKKYJFSCVDX-PWSUYJOCSA-N 269.772 2.496 10 20 CECD C[C@H](NC(=O)NCc1ncccn1)c1ccc(N(C)C)cc1 852260947 HGOJQWVRSCLQKT-LBPRGKRZSA-N 299.378 2.103 10 20 CECD COCCC1CCN(C(=O)c2cc(O)cs2)CC1 862427925 HVJYUSDWEYNPTN-UHFFFAOYSA-N 269.366 2.342 10 20 CECD CC[C@@H](N[C@H]1CCN(C)C1)c1ccc(N(C)C)cc1 765769582 LHVHGFBIGZGCMC-GOEBONIOSA-N 261.413 2.497 10 20 CECD CCC[C@H](CCO)N[C@H](C)c1cc(C(=O)OC)ccc1O 866415598 ZMFFCQAHLCMVIH-DGCLKSJQSA-N 295.379 2.381 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)[C@H](O)Cc1ccccc1 764996847 DGYKEVLHQCHLTN-GXFFZTMASA-N 291.372 2.176 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCCn2cncn2)cc1 776975270 OZNKDSWSSMWTQM-CQSZACIVSA-N 287.411 2.475 10 20 CECD Cc1ccnc(NC(=O)CN(C)Cc2cccc(C)c2O)c1 775670388 YELAIJWXIQIXGW-UHFFFAOYSA-N 299.374 2.475 10 20 CECD CCCC(=O)N1CCC[C@H]1C(=O)N(C)c1ccc(N)cc1 877078364 NRDLENIEEWHRFC-AWEZNQCLSA-N 289.379 2.023 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@H]2CC=CC[C@H]2C1 881433713 LXIYQLIJDLGHBE-AOOOYVTPSA-N 277.295 2.275 10 20 CECD CC[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ncc[nH]1 785420987 JBHTVDRJHRKTPB-DUMNWFOQSA-N 287.319 2.102 10 20 CECD C[C@H](NCCCn1ccnc1)c1c(O)cccc1F 886487528 HZCVJRVJVCXZGF-NSHDSACASA-N 263.316 2.469 10 20 CECD FC[C@@H]1CCN(Cc2ccc(N3CCOCC3)cc2)C1 895575360 SAKYXUMKHPWKBY-HNNXBMFYSA-N 278.371 2.315 10 20 CECD COc1ccc(CN2CC[C@@H](CCCO)C2)c(O)c1OC 894798068 SPZYNLKPWROOTM-GFCCVEGCSA-N 295.379 2.004 10 20 CECD CC[C@H](NCc1ccc(OC)c(OC)c1O)[C@@H]1CCCO1 893256422 RQWIINUSCNZLHK-STQMWFEESA-N 295.379 2.457 10 20 CECD Cc1c[nH]nc1C(=O)N(C)Cc1ccc(N(C)C)cc1 799531852 WUAQFNZYWAGPCX-UHFFFAOYSA-N 272.352 2.056 10 20 CECD CCn1ccc(CN(C)C(=O)c2cccc(O)c2O)c1 790989856 CXWCGAMGDCQRII-UHFFFAOYSA-N 274.320 2.191 10 20 CECD C[C@@H]1[C@H](O)CCN1Cc1ccc(N2CCCC2)cc1 1324379748 WUWUCCZFEAOVCR-CZUORRHYSA-N 260.381 2.242 10 20 CECD COc1cc(Cl)cc(CNCCOCC(F)F)c1O 189008332 LPPGCPGKHWWGHO-UHFFFAOYSA-N 295.713 2.426 10 20 CECD C[C@@H](CCNCc1cc(F)cc(F)c1O)N(C)C 708514886 MTBGHKZOJSMKRV-VIFPVBQESA-N 258.312 2.100 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@H](C)c1ccccc1O 760884211 FIXNYMICFTWSDV-OSAQELSMSA-N 265.353 2.237 10 20 CECD C[C@@H](NCCCn1ccnc1)c1cc(F)ccc1O 94617044 CPTKVGSUKHZLMC-LLVKDONJSA-N 263.316 2.469 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2csc(C)n2)c1 1331497781 JUXDEQGXCOKQNP-UHFFFAOYSA-N 291.376 2.465 10 20 CECD CCN1CC[C@H](CN[C@H](C)c2cc(C(=O)O)ccc2O)C1 1610004885 RJZZQLVHNKHTIN-VXGBXAGGSA-N 292.379 2.083 10 20 CECD COc1cc(C)cc(CN2CCC(CC(=O)O)CC2)c1O 1610294710 ZJZZZHQMBNACCU-UHFFFAOYSA-N 293.363 2.396 10 20 CECD CN1Cc2c(NCc3ccc(N)cc3)cccc2C1=O 1578543497 XAFJOZQYNWTMGF-UHFFFAOYSA-N 267.332 2.467 10 20 CECD C[C@H](NCCCSc1nccs1)[C@H]1C[C@@H]1C(=O)O 1593267167 MHNMLMVTZIAQDT-AEJSXWLSSA-N 286.422 2.324 10 20 CECD CN(C)c1ccc2c(c1)OCCN2CCC1(O)CCC1 839531405 KDILZNPROFFFNN-UHFFFAOYSA-N 276.380 2.257 10 20 CECD C[C@@](O)(CNCc1cc(F)cc(F)c1O)C(F)(F)F 708535579 MVXUGGFRUAWMFM-SNVBAGLBSA-N 285.212 2.073 10 20 CECD CC1([C@@H]2CCCN(Cc3ccc(N)cc3)C2)OCCO1 1120269582 USYOUZYLRSERAS-CQSZACIVSA-N 276.380 2.244 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc[nH]c1 115490077 PAFIWQHHUWGJIB-UHFFFAOYSA-N 257.337 2.319 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccc[nH]1 61223172 KWDLMSXGDDMNAO-UHFFFAOYSA-N 257.337 2.353 10 20 CECD C[C@@H]1C[C@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 68535648 WSXIYTFXKGMCEZ-CZUORRHYSA-N 288.391 2.138 10 20 CECD CC(=O)CCCC(=O)NCc1ccc2c(c1)CCCN2C 184716741 DLUGEJPXZYYANS-UHFFFAOYSA-N 288.391 2.445 10 20 CECD C[C@H](NCCN1CCC(N(C)C)CC1)c1ccccc1O 183544364 DMNDDVIVQONJHR-AWEZNQCLSA-N 291.439 2.069 10 20 CECD Cc1ccc(C(=O)N(C)C[C@@H]2CCCC[C@@H]2O)c(O)c1O 183004920 XCZYSHINIRNKFF-AAEUAGOBSA-N 293.363 2.029 10 20 CECD CCCCCNC(=O)CN(C)c1ccc(OC)cc1OC 132127725 URUDHMMEKZGKTD-UHFFFAOYSA-N 294.395 2.446 10 20 CECD CCC(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 49180137 QGEYPIXZKRNAGK-GFCCVEGCSA-N 262.353 2.110 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ccco2)cc1F 268792752 GXKHJOQNDYGHSS-UHFFFAOYSA-N 276.311 2.344 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CN(C)C1CCC1 266602380 ROTSNCMXQDJUQD-UHFFFAOYSA-N 289.423 2.195 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CCCO1 270175991 DPTFKTYAUDOFOI-CQSZACIVSA-N 263.337 2.310 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C)[S@@](=O)CC2)c1 277456237 KEZDFROAYHEYNS-ODXCJYRJSA-N 297.420 2.134 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]2c2ncon2)c1 362049179 ZOGVVEIRLXQTAN-GFCCVEGCSA-N 275.308 2.121 10 20 CECD COc1cc(O)c(CN(C)Cc2ccccn2)cc1OC 273393427 KLCWHJQMRHCNBM-UHFFFAOYSA-N 288.347 2.436 10 20 CECD Nc1ccc(CC(=O)N2CCOC[C@H]2c2ccccc2)cc1 370271801 XUHDGBHNMNYNOM-KRWDZBQOSA-N 296.370 2.411 10 20 CECD CN(C)c1ccc(CNCCCO)c(C(F)(F)F)c1 280063033 XBAALHRHPMPVHS-UHFFFAOYSA-N 276.302 2.243 10 20 CECD COc1cccc(O)c1CN1CC[C@H](N2CCCC2)[C@H]1C 809724183 GBPSQPZUAYCSQL-HIFRSBDPSA-N 290.407 2.459 10 20 CECD C[C@H](N)C[C@@H](C)N[C@H](C)c1ccc(N2CCOCC2)cc1 817891450 KLWQLXVBCOAMGD-RRFJBIMHSA-N 291.439 2.300 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1CCC1CCC1 819169096 WLCKOYHUIOOVGD-UHFFFAOYSA-N 288.347 2.347 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](C)CC 819692675 DSGYWURGOMZMTI-GFCCVEGCSA-N 293.363 2.330 10 20 CECD C[C@H](CC(=O)N(C)Cc1ccccc1O)n1cccn1 819383616 XOOWNDTWKSPEBX-GFCCVEGCSA-N 273.336 2.198 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCc2cnn3ccccc23)c1 729679575 JUECXDYWSIBTNN-UHFFFAOYSA-N 298.302 2.238 10 20 CECD C[C@@H](CC(F)(F)F)NC(=O)c1c(F)ccc(O)c1O 828625048 VMVLREMYDUKDRZ-YFKPBYRVSA-N 281.205 2.308 10 20 CECD COc1ccc2c(c1)CCCN2C/C=C(\C)C(=O)O 832493389 APUSMMWCUDIUGE-YRNVUSSQSA-N 261.321 2.479 10 20 CECD O=C(/C=C\c1cccs1)NCc1ccc(O)c(O)c1 588401158 RALVEPOSKGJMQA-XQRVVYSFSA-N 275.329 2.489 10 20 CECD C[C@@H](Cc1cnccn1)N[C@@H]1CCc2cccc(O)c21 834544583 NWKGLKLCVFEBCF-SMDDNHRTSA-N 269.348 2.390 10 20 CECD CC(C)N1CCC[C@H](CNC(=O)c2cc(O)cs2)C1 731872387 HQBKWNLNTYCVBN-LLVKDONJSA-N 282.409 2.304 10 20 CECD COC(=O)CN(C(=O)/C=C\c1cccnc1)c1ccccc1 736036384 ZBDXLUJOMHLEKJ-KTKRTIGZSA-N 296.326 2.301 10 20 CECD C[C@@H]1CC2(CCOCC2)CN1C(=O)Cc1ccc(N)cc1 843513517 GUONAOSKGLGUQV-CYBMUJFWSA-N 288.391 2.229 10 20 CECD Cc1cccc2c1N[C@H](c1cc([N+](=O)[O-])ccc1O)NC2=O 914579761 TYXXJCOELVFQCJ-AWEZNQCLSA-N 299.286 2.463 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1 848594375 JZRLPTXAOKWIOV-HUUCEWRRSA-N 288.395 2.407 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)C1CNC1 843124733 LVIMBWQSQPMNOK-UHFFFAOYSA-N 259.397 2.081 10 20 CECD C[C@@H](CCO)N(C)Cc1c(O)ccc(Cl)c1F 846111002 LXCVWNUWWSMSFV-QMMMGPOBSA-N 261.724 2.387 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H]1[C@@H]1CCCOC1 844147705 YPJIPTSYJZUWQN-PWSUYJOCSA-N 281.377 2.485 10 20 CECD CON(C)C(=O)[C@H](C)N[C@H](C)c1cc(Cl)ccc1O 858580163 WQYBOWAAQVFWAV-BDAKNGLRSA-N 286.759 2.105 10 20 CECD CCC[C@H](O)C(=O)N(CC)Cc1ccc(N(C)C)cc1 930905867 RZSLQHAFNKPKIQ-HNNXBMFYSA-N 278.396 2.262 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](OC(C)C)C1 843412991 CUBTVOYCEBAINB-GFCCVEGCSA-N 265.353 2.400 10 20 CECD COC[C@H](O)CCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756780234 XSJQCOYRFFDSGM-CKYFFXLPSA-N 283.343 2.067 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H](F)c1ccccc1 769608386 VMPXSUUPCFWJIZ-AWEZNQCLSA-N 275.279 2.425 10 20 CECD Cc1ccc(CNCCC(=O)Nc2ccccn2)c(O)c1 876979621 MDISJMYXXWWJFU-UHFFFAOYSA-N 285.347 2.214 10 20 CECD Oc1ccc(F)cc1CN1CCCC[C@@H]1C1OCCO1 779008343 SWAQWQMIDGQODO-CYBMUJFWSA-N 281.327 2.259 10 20 CECD Cc1cccc(O)c1CN1CCN(CCOC(C)C)CC1 876760840 UNAHVEGWYDXKMV-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CCOc1nnc(CN[C@H](C)c2ccccc2O)s1 879649199 NQEKTINXTYGJFA-SECBINFHSA-N 279.365 2.493 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1[nH]cnc1C 874232239 RQLXUAPLERGAML-UHFFFAOYSA-N 286.379 2.446 10 20 CECD CC(C)[C@@](C)(O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775402675 FSLNWLXCQSQPRB-BLLLJJGKSA-N 278.396 2.337 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@@H]2CCC=CO2)c1O 775098313 WAGAMKUZVQZXAC-NSHDSACASA-N 294.307 2.091 10 20 CECD Cc1ccc2c(c1)CCN2C(=O)/C=C\c1cnn(C)c1 773380828 ZNARQFJEKVDUNC-XQRVVYSFSA-N 267.332 2.331 10 20 CECD CC1=NO[C@H](CNCc2cc(F)c(N(C)C)cc2F)C1 895302165 PCKJPQLRRBTBES-NSHDSACASA-N 283.322 2.285 10 20 CECD COc1cccc(NC(=O)c2ccc(C)c(O)c2O)c1O 781022282 XNYWPBKRWYTNBL-UHFFFAOYSA-N 289.287 2.373 10 20 CECD CC(C)[C@@H](F)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 784464207 ZJAJRUKBNJJJFN-NOZJJQNGSA-N 269.316 2.139 10 20 CECD COCC[C@H](C)OC(=O)/C=C\c1ccc(O)c(O)c1 784287384 RAGKQEBWLNGNJB-OAQKJQOQSA-N 266.293 2.079 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(=O)C3CC3)C2)cc1C 965996247 GAQPBOOLMZEUNI-OAHLLOKOSA-N 288.391 2.104 10 20 CECD CC[C@@H](NCCN1CCO[C@@H](C)C1)c1ccc(C)cc1O 794807786 LQWXMJLZNMHVRR-GOEBONIOSA-N 292.423 2.462 10 20 CECD CC[C@@]1(O)CCCN(Cc2cc(C)cc(OC)c2O)C1 895444112 PFUJVPGPVQGFCQ-MRXNPFEDSA-N 279.380 2.446 10 20 CECD CCOC(=O)C[C@@H]1CCCN1Cc1c(O)cccc1OC 1320469050 BWUXIROUHDQAGU-LBPRGKRZSA-N 293.363 2.318 10 20 CECD Cc1cc(C)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)[nH]1 1320878968 NDDGWBKJPUYJGO-UHFFFAOYSA-N 289.287 2.082 10 20 CECD Oc1cccc(Br)c1CNC[C@@H](O)C1CC1 706863354 FBBOGPKNPUCPRR-GFCCVEGCSA-N 286.169 2.015 10 20 CECD C[C@H]1CN[C@H](C)CN1Cc1ccc(N2CCCC2)cc1 1326236313 HINMFBDXNNGTRR-CABCVRRESA-N 273.424 2.469 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2NCC1(CC(N)=O)CC1 1331556582 JFBLQRPLLMIQSV-RYUDHWBXSA-N 288.391 2.494 10 20 CECD C[C@@H](N=c1nc[nH]n1CC1CC1)c1ccc(N(C)C)cc1 1262691833 QQKBTEHEEQQBMU-GFCCVEGCSA-N 285.395 2.349 10 20 CECD O=C(O)c1cnc(Sc2cccnc2[N+](=O)[O-])s1 1602534780 LQOIHNLGYPISFD-UHFFFAOYSA-N 283.290 2.296 10 20 CECD CO[C@H](CSc1ncc(C(=O)O)s1)C1CC1 1610232491 RGRDGPWNVMHRLB-SSDOTTSWSA-N 259.352 2.358 10 20 CECD Cc1cc(CN2CCNCC2)ccc1N1CCCCC1 1574134476 LBAIANDWESDTRO-UHFFFAOYSA-N 273.424 2.391 10 20 CECD COc1ccc(O)c([C@H](C)NCC(C)(C)N(C)C)c1 20125832 RTNAXPCIVVLELT-NSHDSACASA-N 266.385 2.392 10 20 CECD O=C(O)[C@]1(NCc2cc(F)cc(F)c2O)CCC[C@H]2C[C@@H]21 1777600642 PYESXKPCEVNOOJ-CYBUAMNDSA-N 297.301 2.403 10 20 CECD CCN1CCCc2cc(CN[C@H](C)C(=O)O)ccc21 1776875326 YBAZHFLBWGLALO-LLVKDONJSA-N 262.353 2.022 10 20 CECD CCC[C@H](O)CN[C@H](C)c1cc(OC)ccc1O 168771354 DGXDICSGKLLZNU-MNOVXSKESA-N 253.342 2.212 10 20 CECD CC1(C(=O)O)CC(NCc2ccc3c(c2)CCCO3)C1 1776497051 XLSGKEDSOHWYDS-UHFFFAOYSA-N 275.348 2.355 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCO[C@H]2CCOC2)c1 927079947 IJDXWGZXZLXUCJ-OLZOCXBDSA-N 265.353 2.157 10 20 CECD CCOc1cccc(CNCC(C)(C)CCO)c1O 231403502 VQYFJDQPSVKDPU-UHFFFAOYSA-N 267.369 2.289 10 20 CECD COCCOCCCN[C@H]1CCc2cccc(O)c21 296080891 SNLXEEHYUDXIDZ-ZDUSSCGKSA-N 265.353 2.022 10 20 CECD OC[C@@H](CC1CC1)NCc1cccc(Cl)c1O 776252037 KWSKEDHJBIKRBO-LLVKDONJSA-N 255.745 2.296 10 20 CECD COC[C@@H](C)CNC(=O)N[C@H](C)c1cc(OC)ccc1O 170888419 YBNQPZZWSYORTR-WDEREUQCSA-N 296.367 2.044 10 20 CECD CCN(CC)c1ccc(CNC(=O)NCC(C)(C)O)cc1 171755805 OQPONHITCMKYNR-UHFFFAOYSA-N 293.411 2.103 10 20 CECD CCCCOCC(=O)N[C@@H](C)c1cc(OC)ccc1O 118495602 SZRPNVCHLVGTNI-NSHDSACASA-N 281.352 2.395 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2O)C1 183565279 NAKMHBUUNRDXIB-RYUDHWBXSA-N 262.353 2.054 10 20 CECD CO[C@@H](C)CN[C@@H](C)c1ccc(N2CCOCC2)cc1 182431053 WVAFCWFNBOYPBC-KBPBESRZSA-N 278.396 2.209 10 20 CECD Cc1cccc(CN2CCC(Cn3ccnn3)CC2)c1O 180781112 AZAGKWBEPITWOD-UHFFFAOYSA-N 286.379 2.204 10 20 CECD CC(C)c1nccn1CC(=O)c1ccc(O)c(O)c1 182795220 SZCJYNPWLPIBTF-UHFFFAOYSA-N 260.293 2.301 10 20 CECD CCCCCN(CCO)Cc1cc2c(cc1O)OCO2 126893378 NBEOIJGQLUWICH-UHFFFAOYSA-N 281.352 2.105 10 20 CECD COc1ccc(O)c(CN2CC[C@@H]([C@@H]3CCOC3)C2)c1 374998458 NLLQCFMNIJXDMZ-CHWSQXEVSA-N 277.364 2.259 10 20 CECD C[C@H](NCCCC(=O)N(C)C)c1ccc(F)c(F)c1O 187672398 ZYVFZLDZFVDHQH-VIFPVBQESA-N 286.322 2.189 10 20 CECD C[C@H](N[C@@H]1C[C@@H](O)C1(C)C)c1ccc(F)cc1O 228848275 FZTFEFUXECSAGL-ZEGGKSINSA-N 253.317 2.341 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](C)O[C@@H](CO)C2)cc1 248955893 FVYXWBZSXCELKF-WMLDXEAASA-N 292.423 2.114 10 20 CECD CN(CCCn1ccnc1)Cc1ccc(N(C)C)cc1 182671322 UIMCMPZUYWOIRW-UHFFFAOYSA-N 272.396 2.471 10 20 CECD CCC1(O)CCN(Cc2cc(OC)c(OC)cc2O)CC1 271091812 LFPDYFQPGMEYQG-UHFFFAOYSA-N 295.379 2.146 10 20 CECD CCCOc1ccc(CNC(C)(C)[C@H](C)O)c(O)c1 270705280 JOWNVJZBOCSOQQ-NSHDSACASA-N 267.369 2.430 10 20 CECD CC[C@H](N[C@@H](C)C(=O)NCCF)c1ccc(N(C)C)cc1 282821487 RTXAMUAZWACFSH-WFASDCNBSA-N 295.402 2.268 10 20 CECD COC[C@](C)(O)CN[C@H](C)c1cc(Cl)cc(C)c1O 808695273 KHFCEKWXMUNOJD-QMTHXVAHSA-N 287.787 2.402 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1occ2c1CCC2 802783693 BXBRZZZCIVWMDF-UHFFFAOYSA-N 273.288 2.110 10 20 CECD O=C(CCCC1CC1)OCC(=O)c1ccc(O)c(O)c1 812601811 GOTKLOOQJDQVFZ-UHFFFAOYSA-N 278.304 2.404 10 20 CECD Oc1c(CNC[C@H](O)C2CC2)ccc2ccccc12 816610330 GYRBLWUWGJRIBU-HNNXBMFYSA-N 257.333 2.406 10 20 CECD CCCCN(Cc1ccccc1O)C[C@H]1COCCO1 829516013 MPTBWFTYDCTXCA-HNNXBMFYSA-N 279.380 2.410 10 20 CECD Cc1cc(N(C)C(=O)/C=C\c2cccnc2)ccn1 492566638 OFJXGNUKOWAMSH-WAYWQWQTSA-N 253.305 2.461 10 20 CECD Cc1cc(O)c(CN[C@@H](C)CN(C)C)cc1Cl 825900788 RGKLJCAZPBWCRP-JTQLQIEISA-N 256.777 2.394 10 20 CECD CN(Cc1c(O)cccc1Cl)C1(CO)CCC1 827903802 PMAMEKWNDMXEII-UHFFFAOYSA-N 255.745 2.392 10 20 CECD CC[C@@H](NC[C@@]1(C)CCC(=O)N1)c1ccccc1O 834908861 MJHMPXJNDGTMFB-IUODEOHRSA-N 262.353 2.102 10 20 CECD Cc1oc(CN(C)C(=O)c2cc(O)cs2)cc1C(=O)O 738966806 IJGFKQHRDYXFRP-UHFFFAOYSA-N 295.316 2.326 10 20 CECD C[C@@H](NC(=O)CNc1ccccn1)c1ccc(N(C)C)cc1 907493793 SVCAEHWHJSIWRT-CYBMUJFWSA-N 298.390 2.437 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NC(=O)NCc1ccccc1O 836642885 WATMPYOMROLONS-YGRLFVJLSA-N 278.352 2.005 10 20 CECD NCc1ccc2c(c1)CCCN2CCOCC1CC1 700945171 RJZKPNLCJYBFPF-UHFFFAOYSA-N 260.381 2.325 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](C)N[C@H](C)C2)c1O 843351836 GSERZFBGXYXICM-AOOOYVTPSA-N 296.798 2.430 10 20 CECD COc1cccc([C@H](C)NC[C@@H]2CCOC2)c1O 846146479 RVIHCZFACBZNIP-QWRGUYRKSA-N 251.326 2.088 10 20 CECD Cc1n[nH]c(C)c1[C@@H](C)NC(=O)c1cc(O)cs1 910070019 FSVCNTDYPRYOGQ-ZCFIWIBFSA-N 265.338 2.285 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H]3CCC[C@H](N)[C@H]3C2)c1 843060221 YEJMOBGIXJVJQV-RCBQFDQVSA-N 290.407 2.350 10 20 CECD C[C@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(Cl)cc1O 841755576 JIVVNNRNHFUSLF-LKFCYVNXSA-N 282.771 2.365 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](CCN)C2)c1O 843377581 DIMUPFDRAYDSKN-LBPRGKRZSA-N 294.370 2.295 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C1)[C@@H](O)CO2 840101538 JZZMOKKXDBTRTO-AXOBHVTPSA-N 299.370 2.072 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@H](C)CC(=O)O 911410179 QFRKULZLKRVDAW-NSHDSACASA-N 292.379 2.178 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](N)C[C@H]2C)c1O 846707860 ZRNNCBRWFJIJLB-NOZJJQNGSA-N 280.343 2.046 10 20 CECD C[C@H](N[C@@H](CCO)C1CC1)c1cc(F)cc(F)c1O 756739388 MUAOXPLCMGQPJT-SDBXPKJASA-N 271.307 2.482 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1cccnc1 857547323 ZALYESYIJBJPQN-UHFFFAOYSA-N 262.696 2.371 10 20 CECD COc1ccc(N(C)CCN2CCOC2=O)cc1Cl 758143402 WFHPXDYHSONSBU-UHFFFAOYSA-N 284.743 2.237 10 20 CECD CS(=O)(=O)C1(CNCc2ccccc2O)CCCCC1 850376702 KRTSSMICPGVCCR-UHFFFAOYSA-N 297.420 2.229 10 20 CECD COCC[C@@](C)(O)CN[C@@H](C)c1cc(F)cc(F)c1O 756585592 KZTRVYOBLXVCBB-LKFCYVNXSA-N 289.322 2.109 10 20 CECD CCC1(CNC(=O)N[C@H](C)c2ccccc2O)COC1 868679907 TVVUSWPESVJVNI-LLVKDONJSA-N 278.352 2.179 10 20 CECD Cc1ocnc1CNC(=O)N[C@H](C)c1ccccc1O 868470785 FNNAUVPFWXHBHW-SECBINFHSA-N 275.308 2.249 10 20 CECD CCC(CC)(CN)C(=O)N[C@@H](C)c1ccccc1O 877255910 JYWIGECEQCEPBN-NSHDSACASA-N 264.369 2.335 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H](OC)C(C)C)c1 771416036 CEQSXDHCUOUVOJ-QMTHXVAHSA-N 281.352 2.249 10 20 CECD CC[C@H](N[C@H](C)C(=O)N(C)C)c1ccc(N(C)C)cc1 773046416 LFPGBGPENBMODQ-DOMZBBRYSA-N 277.412 2.270 10 20 CECD C/C=C\C[C@H](CO)NCc1cc(F)cc(F)c1O 883090224 FIIXJAWEGHPJLJ-OTDNITJGSA-N 257.280 2.087 10 20 CECD CCn1cnc2c1CCN(Cc1cc(C)ccc1O)C2 897336611 IZHMNNNAMYNTSB-UHFFFAOYSA-N 271.364 2.475 10 20 CECD COc1ccc(N2CCN(CCC[C@H](C)O)CC2)cc1F 789328556 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1598526856 GRAFYDGTNLKJBY-UHFFFAOYSA-N 286.287 2.145 10 20 CECD COCCOCCCN[C@@H](C)c1ccc(C)cc1O 20192900 YQILXXQBMSTHLI-ZDUSSCGKSA-N 267.369 2.404 10 20 CECD CC(C)c1nocc1CNCc1ccc(C(=O)O)cc1O 1776390517 RXBJDPNENXHSKM-UHFFFAOYSA-N 290.319 2.492 10 20 CECD C[C@@H](CCO)N[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 151989676 ICOHEOSWTODZBO-STQMWFEESA-N 296.386 2.084 10 20 CECD CN(C)CC1CCN(Cc2cc(F)ccc2O)CC1 226562256 QRPRTLVNBZKKHT-UHFFFAOYSA-N 266.360 2.305 10 20 CECD COc1cccc(CNC[C@@H]2CCO[C@@H](C)C2)c1O 271259449 AJXZIYVRVQDTRB-NWDGAFQWSA-N 265.353 2.306 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@@H]1COCCO1 38060502 ZEAXJRXYVSOXSG-JHJVBQTASA-N 277.364 2.254 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](O)C(C)(C)C2)c1O 279695168 GKXKKKSHSIEXFD-CYBMUJFWSA-N 297.782 2.451 10 20 CECD Cc1nnc(CCN[C@@H]2CCc3cccc(O)c32)s1 297470139 YMYZLFXNSRLVMI-LLVKDONJSA-N 275.377 2.372 10 20 CECD CCc1cccc(CNCC[C@H](C)CCO)c1O 709418261 QRJCFMZPCKZELI-LBPRGKRZSA-N 251.370 2.453 10 20 CECD COc1ncccc1C(=O)N(C)Cc1ccc(N(C)C)cc1 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CC(C)NC(=O)CN(C)Cc1ccc(N2CCCC2)cc1 1253976164 QPMQYSGBBSMYMS-UHFFFAOYSA-N 289.423 2.243 10 20 CECD COc1cccc(CN2CCCC[C@@H]2CCN)c1O 70148669 RKDGBWOUVXVBRY-CYBMUJFWSA-N 264.369 2.104 10 20 CECD COc1cccc(CN[C@@H]2CCN(C(C)(C)C)C2)c1O 693905631 IKGNGZOKCVKNFL-CYBMUJFWSA-N 278.396 2.363 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@@H](c1cc(O)ccc1O)N2 1336755499 BQDOKNONKOGTGY-AWEZNQCLSA-N 270.288 2.260 10 20 CECD CO[C@H]1CCC[C@H]1C(=O)N(C)Cc1ccccc1O 1358032710 HZDBEQAFKSHTIJ-OCCSQVGLSA-N 263.337 2.166 10 20 CECD Cc1ncsc1/C=C/C(=O)N1C[C@@H](N)Cc2ccccc21 1353918503 PZWRFVKGMMCRNS-YBJDMEARSA-N 299.399 2.381 10 20 CECD C[C@@H]1C[C@@H]2CC[C@H](C(=O)NCc3ccccc3O)CN2C1 1521266157 MMENUIMBAGZACF-SNPRPXQTSA-N 288.391 2.129 10 20 CECD CC(F)(F)C1(C(=O)NCc2cccc(O)c2O)CC1 1528770948 IAAZCAJMEDVKOQ-UHFFFAOYSA-N 271.263 2.149 10 20 CECD O=C(O)[C@@H]1CC12CCN(Cc1cc(F)cc(F)c1O)CC2 1608608765 QRDDFWSESNPDQP-NSHDSACASA-N 297.301 2.357 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@@H]2CC(=O)O)c1 1610455014 DACNGUYWVSFYPQ-CYBMUJFWSA-N 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10 20 CECD COc1ccc(N2CCCN(C(=O)[C@H]3C[C@H]3C)CC2)cc1 55877681 WHCQHPCQDNNITR-CJNGLKHVSA-N 288.391 2.390 10 20 CECD COc1cc(O)c(CNC2(C)CCOCC2)cc1OC 182654228 CSRJMCKYXLXOTB-UHFFFAOYSA-N 281.352 2.068 10 20 CECD CCC[C@@](C)(O)C(=O)NCCCSc1nccs1 125882418 KLRZISNWYNAUER-GFCCVEGCSA-N 288.438 2.293 10 20 CECD C[C@@H](NCCN1CCOCC1(C)C)c1ccc(F)cc1O 185333731 WUILJVXYHMMLHG-GFCCVEGCSA-N 296.386 2.293 10 20 CECD C[C@H](N[C@@H]1CCc2[nH]ncc2C1)c1ccc(F)cc1O 186115021 KHFJJLONKLMDMN-JOYOIKCWSA-N 275.327 2.463 10 20 CECD Cc1ccnc(O)c1C(=O)N(C)Cc1ccccc1O 183628093 YYFRAKGDWVQFPJ-UHFFFAOYSA-N 272.304 2.073 10 20 CECD CCC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCO1 181270221 YLCWGWQWXZBAOU-IYNGYCSASA-N 291.347 2.139 10 20 CECD CN(C)c1ccc(CNC(=O)c2nccs2)cc1 82269489 IQOBBGYKXLWRJH-UHFFFAOYSA-N 261.350 2.139 10 20 CECD CCOc1ccc(O)c(CN[C@H](CO)CC(C)C)c1 236869341 KSCWZCNPLRKDDE-ZDUSSCGKSA-N 267.369 2.288 10 20 CECD COC(=O)[C@@H](NCc1cc(C)c(C)cc1O)C1CC1 276451515 JWBWAIXNPGMHJI-AWEZNQCLSA-N 263.337 2.050 10 20 CECD 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277.412 2.065 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](CN)C[C@H]1C 843057846 MMGDHFYZDQVZOU-KGLIPLIRSA-N 261.413 2.230 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H](N)[C@H](C)C2)c1O 843353772 PSCNPJKPLVRVNW-YMTOWFKASA-N 296.798 2.417 10 20 CECD NCC[C@H](NCc1cc(Cl)ccc1O)C(F)F 841074376 PFZHWZFIDYGWRW-VIFPVBQESA-N 264.703 2.118 10 20 CECD N[C@@H]1CCO[C@@H](C2CCN(Cc3ccccc3O)CC2)C1 841103870 LMWPGFOOTLPAJI-NVXWUHKLSA-N 290.407 2.111 10 20 CECD CON(CC(C)(C)C)C(=O)NCCc1ccc(N)cc1 841963081 VSSVVUJEVSUILW-UHFFFAOYSA-N 279.384 2.430 10 20 CECD CN[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 843048625 LSIGFOYRTJTAKP-LLVKDONJSA-N 254.761 2.229 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](N)C[C@H]2C)c1 846698517 IHEOOZHPALTUAG-DGCLKSJQSA-N 264.369 2.103 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]([C@H]3CCNC3)C2)c1 843125018 LGTUWIRICLHYBS-UONOGXRCSA-N 290.407 2.222 10 20 CECD CCc1cnc(O)c(C(=O)NCc2ccc(N(C)C)cc2)c1 854271482 IRZKDGUZBCCHGX-UHFFFAOYSA-N 299.374 2.346 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H]2CCC[C@]2(N)C1 857226263 JKNSISBCRXUEKZ-RDJZCZTQSA-N 273.424 2.374 10 20 CECD Cc1cc(CN=c2nc[nH]n2C)c(C)n1-c1ccccc1 858802138 DPECFBWPKCUQJP-UHFFFAOYSA-N 281.363 2.257 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C(C)C)[nH]n2)c1 862760912 XXZSRISYWSOYSQ-UHFFFAOYSA-N 273.336 2.477 10 20 CECD CC[C@@H](NCc1ccc(C)cc1O)[C@@H](O)C(F)(F)F 877126104 FFGWCWVDCUYFCR-ZYHUDNBSSA-N 277.286 2.492 10 20 CECD Cc1ccc(CNCCc2cnc(C)cn2)c(O)c1 877577774 JHORUBANXTUQFS-UHFFFAOYSA-N 257.337 2.131 10 20 CECD CCOc1ccc(CN(C)CC(=O)N(CC)CC)c(O)c1 771934251 ZUNGFRQGPZBLIE-UHFFFAOYSA-N 294.395 2.091 10 20 CECD CCN(C)c1ccc(Cn2cc(C(=O)OC)nc2C)cc1 771585163 CIDSPUHQHXXUJE-UHFFFAOYSA-N 287.363 2.483 10 20 CECD CC[C@H](N[C@H](CO)C1CCOCC1)c1ccccc1O 775551296 LZNMFBUBJPAWQW-LSDHHAIUSA-N 279.380 2.220 10 20 CECD CN(C)c1ccc([C@H](N)CNCc2ccc(N)cc2)cc1 1120269144 NHQWYEKXCGCBOI-QGZVFWFLSA-N 284.407 2.124 10 20 CECD CCc1nncn1CCN[C@H](C)c1c(O)cccc1F 886534076 ALEBHUSFECCULJ-SNVBAGLBSA-N 278.331 2.036 10 20 CECD C[C@]1(NCc2cc([N+](=O)[O-])ccc2O)CCO[C@H]1C1CC1 784592772 MVSUWGIBYRAKFC-GJZGRUSLSA-N 292.335 2.348 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(CO)c(F)c1 788284366 ZBDLXDYLEPHCIT-UHFFFAOYSA-N 289.306 2.296 10 20 CECD C[C@@H](CCS(C)(=O)=O)N[C@@H](C)c1cc(F)ccc1O 185791786 AJFVKUYWZVEZAR-UWVGGRQHSA-N 289.372 2.005 10 20 CECD COC(=O)[C@H]1CCC[C@H]1NCc1ccc(N(C)C)c(F)c1 1326280122 LSXLUVWWAZOWIA-GXTWGEPZSA-N 294.370 2.323 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H](C)CNC 1328725132 MIWYVJSNZZWXHG-ZDUSSCGKSA-N 293.411 2.169 10 20 CECD Cc1ccc([C@H](C)NCc2nnc(C)n2C)c(O)c1C 1320117982 CKEFOMQWEYGFCE-NSHDSACASA-N 274.368 2.297 10 20 CECD C[C@H](C[S@](C)=O)N(C)Cc1ccc(N2CCCC2)cc1 1343004213 GSJJUNXDDILDDJ-VLIAUNLRSA-N 294.464 2.486 10 20 CECD COCCCCN[C@@H](C)c1cc(C(=O)O)ccc1O 1606870616 WJTKRIONDKAHCS-JTQLQIEISA-N 267.325 2.168 10 20 CECD O=C(O)[C@H]1C[C@H]2CC[C@H]1N(Cc1cccc(F)c1O)C2 1601791362 OFPUWQRVENJUNC-SUZMYJTESA-N 279.311 2.216 10 20 CECD COC(=O)c1coc(/C=C\C(=O)Nc2ccc(N)cc2)c1 1578885282 HVPVGZSJWIZNIS-SREVYHEPSA-N 286.287 2.300 10 20 CECD C[C@H](N[C@H]1C[C@@H](C)O[C@@H]1C)c1cc(C(=O)O)ccc1O 1594261946 SKIGAPZFIBKBIF-COMAGPEQSA-N 279.336 2.307 10 20 CECD CC[C@H](C)C[C@@H](NCc1cccc(OC)c1O)C(=O)O 1594953669 RQAZRFCMKAXCOU-CMPLNLGQSA-N 281.352 2.380 10 20 CECD CN(CCN1CCCCC1)Cc1cc(F)ccc1O 846115246 SSESIVSEWUHKMN-UHFFFAOYSA-N 266.360 2.449 10 20 CECD COCCOCCCCN[C@@H](C)c1ccccc1O 167442916 LNXAJKJBWANROG-ZDUSSCGKSA-N 267.369 2.486 10 20 CECD CC[C@H]1CN(Cc2cc(OC)ccc2O)[C@H](C)CO1 403831376 QAYXRFAVTWUHGE-YPMHNXCESA-N 265.353 2.400 10 20 CECD COc1cccc(CNC[C@@H]2CC[C@@H](C)O2)c1O 398174448 VJEYAUXHGJBKFV-PWSUYJOCSA-N 251.326 2.058 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H](CC(=O)O)C1 820870837 BQQQVIKUJYRXAJ-NSHDSACASA-N 279.336 2.088 10 20 CECD Cc1ccc(C(=O)Nc2ccc(N(C)C)cn2)c(O)c1O 177677137 ZRAWNETZCSPKBA-UHFFFAOYSA-N 287.319 2.120 10 20 CECD COc1cccc(CNC(=O)c2ccccc2O)c1O 68488692 ZYVAGDQSLRSYKR-UHFFFAOYSA-N 273.288 2.036 10 20 CECD CSC[C@H]1CCCN1C(=O)c1ccc(C)c(O)c1O 182830633 HQWOJVJGJHVDGK-SNVBAGLBSA-N 281.377 2.374 10 20 CECD CC1(CO)CCN(Cc2cc(F)ccc2O)CC1 184070878 PAKAKXUIDRJDSJ-UHFFFAOYSA-N 253.317 2.126 10 20 CECD CCc1cccc(CN[C@@H]2CCN(C3CC3)C2)c1O 691528503 YGMPGULOOKENNZ-CQSZACIVSA-N 260.381 2.281 10 20 CECD OCCCSCCNCc1cc(Cl)ccc1O 222941135 YHXIPMWUJRTIOK-UHFFFAOYSA-N 275.801 2.251 10 20 CECD C[C@@H]1CCN(Cc2cccc(Cl)c2O)[C@@H]1CO 191179873 HGRYPUCGNJFJLF-BXKDBHETSA-N 255.745 2.248 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)[C@H](C)N)cc1 192098369 CURZCHLKRVDXMO-OLZOCXBDSA-N 277.412 2.132 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1Cc2ccccc2CN1 237168226 KVLFQISLWDVHBA-MRXNPFEDSA-N 296.370 2.065 10 20 CECD COc1ccc(O)c(CN(CCCO)CC(F)(F)F)c1 271742294 RGVSCNGXAKQHDH-UHFFFAOYSA-N 293.285 2.148 10 20 CECD CC[C@@H](NCC1(O)CCN(C)CC1)c1ccc(F)cc1O 285929060 FDNXTSCFLNXTFT-CQSZACIVSA-N 296.386 2.029 10 20 CECD Cc1ccncc1/C=C/C(=O)N1CCCc2n[nH]cc21 280046823 GZTIZGIFUUEXBV-SNAWJCMRSA-N 268.320 2.106 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Cl)C[C@]2(CCOC2)O1 280331015 RELRTFUZPIUTKB-NHYWBVRUSA-N 297.782 2.425 10 20 CECD CCc1nc([C@H](C)N[C@@H]2CCc3cccc(O)c32)n[nH]1 297073407 WLZYNSIBVQBIAH-GXSJLCMTSA-N 272.352 2.411 10 20 CECD COc1cc(O)c(CNCCC2(OC)CCC2)cc1OC 293703990 RVGJIMZGQQWCIZ-UHFFFAOYSA-N 295.379 2.458 10 20 CECD COC[C@@](C)(O)CN[C@@H](C)c1cc(Cl)cc(C)c1O 808695141 KHFCEKWXMUNOJD-HZMBPMFUSA-N 287.787 2.402 10 20 CECD CCCN1CCC[C@H]1CNCc1cc(F)ccc1O 809716504 WCMDQIWYCYUFNU-AWEZNQCLSA-N 266.360 2.495 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCc2cnnn2C)c1O 808719115 RZVCTACBFOHFJE-SECBINFHSA-N 280.759 2.333 10 20 CECD CO[C@H]1COC[C@@H]1N[C@@H](C)c1cc(Cl)ccc1O 290111805 IRLIDWRZDORRDB-QWRKXWFKSA-N 271.744 2.110 10 20 CECD C[C@H](NC[C@@H]1CCCNC1)c1ccc(F)cc1O 817945957 OHYFCOLFXNSAQK-WDEREUQCSA-N 252.333 2.182 10 20 CECD CC[C@H](O)CNCc1ccc(N2CCSCC2)cc1 818963983 HJKMNWLRFUCEOW-HNNXBMFYSA-N 280.437 2.100 10 20 CECD O=C(CCc1cncs1)NCc1ccccc1O 815833654 YABHEWAQVRNGIL-UHFFFAOYSA-N 262.334 2.098 10 20 CECD CC[C@H](N[C@H]1CCNC1)c1cc(Cl)ccc1O 817944639 ITGPZNDRANZWLK-JQWIXIFHSA-N 254.761 2.448 10 20 CECD CCOCC[C@@H](O)CNc1ccccc1OCC 819392493 FXLWVPSEDIXEKW-GFCCVEGCSA-N 253.342 2.285 10 20 CECD CCOc1ccc(CN2CCC[C@H](CC(=O)O)C2)c(O)c1 820387358 LUUNUTMPWJFUBI-GFCCVEGCSA-N 293.363 2.478 10 20 CECD CN(Cc1c[nH]c(C(=O)O)c1)Cc1ccccc1O 833694390 JDPCEERIXQJHBA-UHFFFAOYSA-N 260.293 2.051 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1ccc(N(C)C)cc1C 840938741 GHYABJSPYGZSGF-IRXDYDNUSA-N 292.423 2.345 10 20 CECD COCCCCN(C)Cc1ccc([N+](=O)[O-])c(OC)c1O 841894796 VMNYQSQBGUGEFY-UHFFFAOYSA-N 298.339 2.167 10 20 CECD C[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)[C@@H](C)[C@H]1C 842273260 DCEFFBGMVAGNAV-VGMNWLOBSA-N 267.300 2.353 10 20 CECD Nc1ccc(Cc2noc([C@H]3CCCOC3)n2)cc1 843158693 HBIDBKHQEFNRNB-NSHDSACASA-N 259.309 2.137 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H]2[C@@H](C)CCN[C@@H]2C)c1O 842476088 GHKPCWVEZFYJPI-FEUHOPSXSA-N 294.370 2.210 10 20 CECD C[C@@H](N[C@H](CO)C1CCOCC1)c1ccc(Cl)cc1O 841752065 FOYSZFOEELTGMT-QMTHXVAHSA-N 299.798 2.484 10 20 CECD CCc1cccc(CNc2ccc(CO)cn2)c1O 848908093 NABBNFHFPNGABJ-UHFFFAOYSA-N 258.321 2.454 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H]3OCC[C@@H]3C2)c1 843421295 WPKCAPPZNMOKLJ-WBMJQRKESA-N 277.364 2.402 10 20 CECD COc1ccc(N(C)CCN(C)Cc2cnccn2)cc1 846051457 HEWZSKBAXUFTBB-UHFFFAOYSA-N 286.379 2.053 10 20 CECD C[C@@H](Cc1ccncc1)NC(=O)NCCc1ccc(N)cc1 841852672 OAMOKSVLDLELTF-ZDUSSCGKSA-N 298.390 2.137 10 20 CECD CC[C@@H](CN1CCOCC1)NCc1c(O)cccc1Cl 922590886 WLDRNGQWFHFMEN-LBPRGKRZSA-N 298.814 2.246 10 20 CECD CCOc1ccc(CN2CC[C@H](C)[C@@H](CO)C2)c(O)c1 857060665 DIFABNXPOYCYPV-GXTWGEPZSA-N 279.380 2.241 10 20 CECD Cc1nnc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)s1 757637428 HUJLYPSYJUJYPS-ZETCQYMHSA-N 294.336 2.311 10 20 CECD CCCNC(=O)CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756355046 GDHSMFFWUYPHNJ-ONGXEEELSA-N 280.343 2.195 10 20 CECD COc1cccc(O)c1CN(C)CC1(O)CCCC1 769447646 IHLCMPNKFAONLG-UHFFFAOYSA-N 265.353 2.138 10 20 CECD O=C(N[C@@H]1Cc2cccc(O)c2C1)c1cc(O)cs1 760919448 DHWBMCZLLKNOHA-SECBINFHSA-N 275.329 2.057 10 20 CECD Cc1ccc(CN2CC[S@@](=O)C(C)(C)CC2)c(O)c1 877569963 BMXFMEZURFZFAY-LJQANCHMSA-N 281.421 2.434 10 20 CECD COc1ccc(CN[C@@H](C)C2CCNCC2)cc1C 873222386 PYSFTMNOYQIFMI-ZDUSSCGKSA-N 262.397 2.481 10 20 CECD CSC[C@@H](C)NCc1ccc(N2CCC(O)CC2)cc1 877051771 NLGMNWZYZXASPJ-CYBMUJFWSA-N 294.464 2.489 10 20 CECD CCOc1cccc(CN[C@@]2(CCOC)CCOC2)c1O 775035466 ZZDDRMHZCMIVLD-INIZCTEOSA-N 295.379 2.076 10 20 CECD O=C(OCc1cccc([N+](=O)[O-])c1)c1cccc(O)c1O 776280526 SSPFGXUIWYFSFF-UHFFFAOYSA-N 289.243 2.363 10 20 CECD O=C(NCc1ccccc1O)C1(c2cccnc2)CC1 774063570 HGHYALPJUFVARC-UHFFFAOYSA-N 268.316 2.135 10 20 CECD CCN(C)c1ccc(CN[C@H](C(N)=O)C(C)(C)C)cc1 773781714 JNYILAPEKUFXIZ-CQSZACIVSA-N 277.412 2.132 10 20 CECD CC1=NO[C@H](CNCc2ccc(N(C)C)cc2C)C1 895300877 WJYLGAAWFYLJEE-HNNXBMFYSA-N 261.369 2.315 10 20 CECD C[C@@H]1CSC[C@H]1NCc1cc([N+](=O)[O-])ccc1O 796396567 SMUTZHJHACFWFP-LDYMZIIASA-N 268.338 2.142 10 20 CECD COc1ccc(CN(C)Cc2ccc(N)cc2)cn1 1352791091 UULDFRRVKMGCKZ-UHFFFAOYSA-N 257.337 2.304 10 20 CECD CNC[C@H](C)CN[C@H](C)c1cc(F)cc(F)c1O 1329022573 FTBTWLSYHKCHMO-DTWKUNHWSA-N 258.312 2.177 10 20 CECD CCn1cc(NCc2cc(F)cc(F)c2O)cn1 708535202 JKUFDXPYEAIYCF-UHFFFAOYSA-N 253.252 2.499 10 20 CECD CN(C)c1ccc(CNCc2cccnc2O)cc1 714954685 WJFMWJFPRKVMRM-UHFFFAOYSA-N 257.337 2.143 10 20 CECD CCOc1ccc(N2CCN(C(=O)CCCF)CC2)cc1 1334350864 ZVWFZDUFFIWITI-UHFFFAOYSA-N 294.370 2.484 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1C[C@H]2C[C@H]1[C@H]1C[C@@H]12 1348047580 OJJHRDRMQLDWQZ-NAWOPXAZSA-N 273.332 2.006 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCC1(N)CC1 1353500680 BYCHMBQNAJUZEH-UHFFFAOYSA-N 291.395 2.195 10 20 CECD O=C(CC1(C(F)(F)F)CC1)NCc1cccc(O)c1O 1521852175 SCGLYMIVJOYKQS-UHFFFAOYSA-N 289.253 2.447 10 20 CECD COc1cc(C)c(CN[C@@H]2CC[C@H]3CCN[C@H]2C3)c(O)c1 1579145241 XRRLVBFLIRZTJQ-MAZHCROVSA-N 290.407 2.329 10 20 CECD C[C@@H](NC(=O)c1cnc(N)s1)c1ccc(N(C)C)cc1 1576232640 ALOMJQDGTUZHCJ-SECBINFHSA-N 290.392 2.282 10 20 CECD CC[C@H](NCC(C)C)c1cccc(-c2nn[nH]n2)c1O 1590463905 MNDNRRGPFYJDRI-LBPRGKRZSA-N 275.356 2.269 10 20 CECD COc1ccc(N(C)C/C(C)=C\C(=O)O)cc1F 1599584492 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185361238 CKZWSAUVNAJFJN-GFCCVEGCSA-N 296.386 2.293 10 20 CECD O=C(CSC(F)(F)F)NCCc1ccc(O)c(O)c1 122601007 RMFOGAXVMQUGRU-UHFFFAOYSA-N 295.282 2.010 10 20 CECD C[C@H](N[C@H](C)c1cc(F)ccc1O)[C@@H](C)N1CCOCC1 185376535 YGBFPSJMJKAGQU-YNEHKIRRSA-N 296.386 2.291 10 20 CECD COc1cccc(CN2C[C@@H](C)OC[C@H]2C)c1O 132192297 UHXZMTLMWQZGOA-GHMZBOCLSA-N 251.326 2.010 10 20 CECD COc1ccc(N(C)CC(=O)N2CCCC2)cc1Cl 131448059 GGMWFEDSLRHIPG-UHFFFAOYSA-N 282.771 2.407 10 20 CECD COc1cccc(CN[C@]2(CO)CCc3ccccc32)c1O 135910219 HJNWXXLIIMQERX-SFHVURJKSA-N 299.370 2.324 10 20 CECD CCOC[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C(C)C 191431343 FQGBCDRUVBRBRC-STMXVASLSA-N 293.363 2.288 10 20 CECD Oc1c(Br)cccc1CNCCN1CCCC1 42411778 IQMAVGSIJJLFFM-UHFFFAOYSA-N 299.212 2.340 10 20 CECD C[C@H](NCc1cc(F)ccc1O)C(=O)OC1CCCC1 192006422 FDAUUVLTWOIJBT-JTQLQIEISA-N 281.327 2.495 10 20 CECD CCOCCOC1CN(Cc2cc(C)c(C)cc2O)C1 272369020 BBUGZLRESQHOBH-UHFFFAOYSA-N 279.380 2.246 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@@H]1CCC[C@@H]1O 271252671 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CCOc1cccc(CN(C)Cc2nnc(C)o2)c1O 827039186 JUDNAMWQOHCBCU-UHFFFAOYSA-N 277.324 2.114 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2ccc(N(C)C)cc2C)C1 827812393 LLTFOHOETZZGLL-HDJSIYSDSA-N 276.380 2.102 10 20 CECD CN(C)c1ccc([C@@H](CNC(=O)OCCF)N(C)C)cc1 908460698 XVFMZXBNIFPHAQ-CQSZACIVSA-N 297.374 2.051 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H]2CC[C@@H](C)O2)c1 834915806 UEBNZWONGJISKD-MDZLAQPJSA-N 293.363 2.397 10 20 CECD C[C@@H]1C[C@H](N[C@H]2C[C@@H](O)C2)c2c(O)ccc(F)c21 834904630 ANMUZPOEPFPZJQ-REIXXSIJSA-N 251.301 2.193 10 20 CECD CO[C@H](CNC(=O)c1cc(O)cs1)Cc1ccccc1 833599181 OMFZQIRVWXHWTG-ZDUSSCGKSA-N 291.372 2.441 10 20 CECD CCS(=O)(=O)CCCN[C@H](C)c1ccc(C)cc1O 840888166 BTCPNDJJWZEUQC-GFCCVEGCSA-N 285.409 2.176 10 20 CECD CCOc1ccc(CN2CCC[C@H](C)[C@@H]2CN)c(O)c1 843051957 NDEPWYXZZKBUHU-WFASDCNBSA-N 278.396 2.350 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1C[C@H]2CC[C@@H]1O2 846475627 DHARANWGMSKRRK-WZRBSPASSA-N 281.739 2.229 10 20 CECD COC1([C@H](C)NC(=O)/C=C\c2ccc(O)c(O)c2)CCC1 840530652 AIIOOVOZWQMKOA-XOIDGJRKSA-N 291.347 2.185 10 20 CECD C[C@H]1CCCN(Cc2cccc(F)c2O)[C@H]1CCN 844901213 FZCVMLSBEXUJPN-FZMZJTMJSA-N 266.360 2.481 10 20 CECD CCN(CC)c1ccc(CN2CCCNCC2)cc1F 843047636 SMCIUSNAAYIYBV-UHFFFAOYSA-N 279.403 2.467 10 20 CECD O=C(NCc1ccccc1O)NC[C@@H]1Cc2ccccc2O1 748459930 LJKRZTFTZPCBIT-AWEZNQCLSA-N 298.342 2.195 10 20 CECD N=C(NCc1cc(Cl)ccc1O)N1CCSCC1 849049305 QBUUKVXPVZIVLN-UHFFFAOYSA-N 285.800 2.119 10 20 CECD CCc1cccc(CN2CC[C@@H](COCCOC)C2)c1O 848890672 TYINGAJXHDTXPS-CQSZACIVSA-N 293.407 2.440 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@H]2CNC(=O)C2)c1O 840838031 MBLJAQHWMBQFHD-ZJUUUORDSA-N 282.771 2.141 10 20 CECD Cc1ccc([C@H](C)NCc2ccnc(N(C)C)n2)c(O)c1 756792118 YLESSNPYTADBNZ-LBPRGKRZSA-N 286.379 2.407 10 20 CECD CC[C@@]1(C)NC(=O)N(CCCSc2nccs2)C1=O 761296744 HEVRNZGXOBZLMX-GFCCVEGCSA-N 299.421 2.346 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCC1CC=CC1 862630868 PWPUTQBVDKLHDG-VURMDHGXSA-N 259.305 2.193 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2cc(C)n(C)n2)c1 860807796 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C[C@]1(C(=O)O)CC[C@@H](NCc2ccc3c(c2)CCO3)C1 1776501071 YFEHQDIWOKNNCT-CJNGLKHVSA-N 275.348 2.355 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCCCN(C)C1 858245733 WQBSPGRZGIIURQ-CYBMUJFWSA-N 278.396 2.222 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](COC)OC)cc1 227705079 OVXWXRQDABMLOG-INIZCTEOSA-N 280.412 2.284 10 20 CECD CCC(CC)N(CCOC)C(=O)c1cccc(O)c1O 126338559 WPMFBIKDPSBNKE-UHFFFAOYSA-N 281.352 2.375 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cnn(C)c2C)c1 182450962 LILRBSMNZYIARW-SNVBAGLBSA-N 275.352 2.294 10 20 CECD CC[C@](C)(CNCc1ccc(OC)cc1O)OC 322509250 ILXVIDZNZONLDV-CQSZACIVSA-N 253.342 2.306 10 20 CECD NCC[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 723674929 LGCKQZPHCNRCAR-SNVBAGLBSA-N 254.761 2.216 10 20 CECD CC(C)(O)C(C)(C)CNCc1cc(F)ccc1O 393614388 IHLDJTDSTJZZOF-UHFFFAOYSA-N 255.333 2.418 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2cc(C)on2)c1 172019393 CRCMKLNOADYRMX-UHFFFAOYSA-N 277.280 2.019 10 20 CECD NC(=O)CCN(C(=O)/C=C/c1cccnc1)c1ccccc1 73841989 LZQPOXGWSDHFNG-CMDGGOBGSA-N 295.342 2.003 10 20 CECD CCOC(=O)[C@H](NCc1cccc(OC)c1O)[C@H](C)CC 187870789 JXCIEGJQKHQGIH-BXUZGUMPSA-N 295.379 2.468 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CC=CCC1 156614794 KGNCDCNHBLFRSN-GFCCVEGCSA-N 261.321 2.113 10 20 CECD Oc1ccc(F)cc1CN1CCOC[C@H]1C1CC1 180196747 QDRIIKIVABFROW-ZDUSSCGKSA-N 251.301 2.142 10 20 CECD CO[C@@]1(C)C[C@@H](NC(=O)c2cccc(O)c2O)C1(C)C 185778403 RPWXRIDWDSBCER-ABAIWWIYSA-N 279.336 2.031 10 20 CECD CCN(CC(=O)NC)Cc1cc(Cl)cc(Cl)c1O 132611992 PMEHWZOPGFVVCY-UHFFFAOYSA-N 291.178 2.267 10 20 CECD Cc1cc(O)c(CN(C)[C@@H](C)[C@@H](C)S(C)(=O)=O)cc1C 93420565 HYXXTXKRLIBERI-QWHCGFSZSA-N 299.436 2.262 10 20 CECD C[C@H](NC[C@H](O)C1CCOCC1)c1ccc(N(C)C)cc1 90055582 AXVMVFLNRDNYIE-GUYCJALGSA-N 292.423 2.191 10 20 CECD CN(C)CCN(Cc1cc(F)ccc1O)C[C@@H]1CCCO1 809737616 JTUDDZYAFZERQR-HNNXBMFYSA-N 296.386 2.074 10 20 CECD C[C@H]1C[C@H](NCC(F)(F)CN)c2c(O)ccc(F)c21 817965864 DPCZFKXUGYIERA-CBAPKCEASA-N 274.286 2.263 10 20 CECD COc1cccc(CNCC[C@@]2(O)C[C@H]3CC[C@H]2C3)c1O 813784169 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CC[C@H](C)C[C@@H](CO)NC(=O)/C=C/c1ccc(O)c(O)c1 844037957 VUCJKLOQTPCCHH-FXOGGVSJSA-N 293.363 2.024 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@H](C)c1cccc(OC)c1O 846163137 KXUAFCWSXCTXGE-UXIGCNINSA-N 295.379 2.245 10 20 CECD CC(C)C[C@@H]1CCCN1C(=O)C(=O)Nc1ccc(N)cc1 841026083 ROVZZXFOQZTVKR-AWEZNQCLSA-N 289.379 2.244 10 20 CECD COCCCCNC(=O)NCc1cc(Cl)ccc1O 844884696 LKZKHYSZPXMDEX-UHFFFAOYSA-N 286.759 2.271 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@]2(CCCN2)C1 841104925 AWCMIWTVQPBMGK-KRWDZBQOSA-N 273.424 2.389 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@H](C)c1ccc(C)c(C)c1O 840826221 IFDXOJKMGPXKFG-KWCYVHTRSA-N 265.353 2.073 10 20 CECD CON(C(=O)/C=C/c1ccc(O)c(O)c1)C1CCCC1 757637880 OLZBPOAZUYIQDB-VQHVLOKHSA-N 277.320 2.444 10 20 CECD C[C@H]1COC[C@@H]1NCCCSc1nccs1 925101784 JSPHGDNTVKLRTL-UWVGGRQHSA-N 258.412 2.250 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNC2[C@@H]3[C@H]4CC[C@@H](C4)[C@@H]23)c1 850393258 QRVBCYZRJWZPJK-QYAIJTBZSA-N 274.320 2.435 10 20 CECD C[C@H](O)C[C@@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 757654147 CCJGQAMFOMALLM-KXUCPTDWSA-N 268.313 2.110 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2CCC[C@H]2O)cc1F 858175393 MNDXYLUZMYPPNO-TZMCWYRMSA-N 270.323 2.034 10 20 CECD O=C(N[C@@H]1CCC[C@@H]2OCC[C@H]21)c1cc(O)cs1 761607287 GYPXRDDAXZFKFD-AXFHLTTASA-N 267.350 2.141 10 20 CECD CNC(=O)CCCN(C)Cc1cc2c(cc1O)CCCC2 768462960 PKPONFLPHBXEGN-UHFFFAOYSA-N 290.407 2.229 10 20 CECD Cc1cccc(O)c1CN1CC(C)(C)O[C@@]2(CCOC2)C1 877492946 YRDUUSKLNINFOR-KRWDZBQOSA-N 291.391 2.471 10 20 CECD CCCOc1ccc(CN[C@@H](CCO)COC)cc1C 873058044 IHCVOTKAVKKBPD-HNNXBMFYSA-N 281.396 2.271 10 20 CECD O=C1CCCN1[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 779011512 FFYBVTHMWWIEMW-CQSZACIVSA-N 292.354 2.118 10 20 CECD COC[C@H](NCc1ccc([N+](=O)[O-])c(OC)c1O)C(C)C 775026981 CVMFZRLUVXPFSC-NSHDSACASA-N 298.339 2.070 10 20 CECD CO[C@H]1CCC[C@@H]1CNCc1cc(F)ccc1O 779106260 BACBXJKHLVUVNG-YGRLFVJLSA-N 253.317 2.436 10 20 CECD CO[C@@H](CN(C)c1ccc(OCCN(C)C)cc1)C1CC1 877342491 NRXYLIMMSCXXGV-KRWDZBQOSA-N 292.423 2.488 10 20 CECD CCN(C)c1ccc(CN2CCC(CO)(OC)CC2)cc1 773943838 HRXZMOXFQSCCPK-UHFFFAOYSA-N 292.423 2.116 10 20 CECD CC[C@H]1C(=O)N(CC)CCN1Cc1cccc(Cl)c1O 779216974 LQJMYVVNKMGEEZ-ZDUSSCGKSA-N 296.798 2.488 10 20 CECD COc1cccc(O)c1CN1CC[C@H]2[C@H](CCCN2C)C1 770352397 NLDIEIVAAZUKMW-HIFRSBDPSA-N 290.407 2.317 10 20 CECD CCN(C)c1ccc(CN(C)CCN2CCCC2=O)cc1 773754513 GOADBRSMLOXCRB-UHFFFAOYSA-N 289.423 2.197 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@@H](C)c1c(O)cccc1F 886590436 VGJCTPUNYLUZKD-ZKYQVNSYSA-N 283.343 2.376 10 20 CECD CCOc1ccc(CN2CCC[C@@]2(C)CO)c(O)c1 789557787 MVOQNKRKIJECQY-HNNXBMFYSA-N 265.353 2.138 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCCOC2)c1O 894199072 FUNPQHOTJAZZPA-LBPRGKRZSA-N 265.353 2.225 10 20 CECD Nc1ccc(/C=C2/SC(N3CCCCC3)=NC2=O)cn1 899341637 GCFKJTPLQYIZAE-DHZHZOJOSA-N 288.376 2.120 10 20 CECD O=C(NCc1ccccc1O)[C@H]1Cc2ccccc2O1 135358916 SGDGOKPHWYJDKJ-OAHLLOKOSA-N 269.300 2.012 10 20 CECD COC(=O)CN(Cc1cc(OC)c(C)cc1O)CC(C)C 1319798898 QKKXBOSRCGDYJI-UHFFFAOYSA-N 295.379 2.340 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@@H]1CCCCO1 88296394 JCGIZOPWDVGIEP-ZDUSSCGKSA-N 263.337 2.310 10 20 CECD CC(C)n1[nH]cnc1=NCc1ccc(N2CCCC2)cc1 1327375417 MXXLYZYICQKHJR-UHFFFAOYSA-N 285.395 2.493 10 20 CECD CC[C@](C)(CO)NCc1c(O)cccc1Br 706883143 FJNGLWMCAYFGTF-GFCCVEGCSA-N 288.185 2.405 10 20 CECD C[C@H](NCCO)c1cc(Cl)c(Cl)cc1O 192613725 UKSFSQQYNAJOPM-LURJTMIESA-N 250.125 2.342 10 20 CECD CC(C)C[C@@H]1C(=O)NCCN1Cc1cc(F)cc(F)c1O 1333714773 OSDMXUTUYWTSOC-CYBMUJFWSA-N 298.333 2.017 10 20 CECD Oc1cc2c(cc1CN1CCc3ncncc3C1)CCC2 1337204866 JRFNPPZJDUEHHN-UHFFFAOYSA-N 281.359 2.229 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1CCC[C@H](F)C1 1345723967 VBHZRKPMXGHHPX-RYUDHWBXSA-N 266.316 2.472 10 20 CECD CON(C)C(=O)[C@H](C)N[C@H]1C[C@H](C)c2c(C)ccc(O)c21 1351353563 RQEZRTWEWXDNLC-SRVKXCTJSA-N 292.379 2.247 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1c[nH]c(C(=O)O)c1 1600236252 OKMMPRWOVBEPQU-UHFFFAOYSA-N 287.363 2.377 10 20 CECD O=C(O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1cccc(F)c1O)C2 1601791359 OFPUWQRVENJUNC-IRUJWGPZSA-N 279.311 2.216 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@H](CCC(N)=O)C2)c1 164272233 RBOLAHWWCPFDQI-CQSZACIVSA-N 290.407 2.487 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](C)CCCO)c1 294863034 TZDRTLOOZMMCMP-RYUDHWBXSA-N 267.369 2.460 10 20 CECD C[C@@H](N[C@H]1CCc2cccc(O)c21)C(=O)NC(C)(C)C 295787446 ABDOCUYZBCMXCF-PWSUYJOCSA-N 276.380 2.272 10 20 CECD Oc1cccc2c1[C@H](NC[C@H]1CCN(C3CC3)C1)CC2 313395041 SOJYKKGPVQKIER-IUODEOHRSA-N 272.392 2.453 10 20 CECD CCc1cccc(CN[C@@H](C)[C@H](CO)SC)c1O 709456720 SZWLMVMWPYXEKN-GWCFXTLKSA-N 269.410 2.157 10 20 CECD CCC[C@@H](CNCc1ccc(OC)cc1O)OC 378710659 SUQLJLYMEWVYRW-ZDUSSCGKSA-N 253.342 2.306 10 20 CECD CCOc1cccc(CN[C@@H](C)c2n[nH]c(C)n2)c1O 392439876 AKKAWGVMYQQWJL-VIFPVBQESA-N 276.340 2.068 10 20 CECD Cc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2O)cc1 55328157 FXVGYLNZMXKDIN-UHFFFAOYSA-N 298.342 2.298 10 20 CECD Oc1ccc(N2CCN(Cc3ccccc3O)CC2)cc1 179552364 XLYCMAPIGCTBKU-UHFFFAOYSA-N 284.359 2.420 10 20 CECD Cc1csc(NC(=O)c2ccc(C)c(O)c2O)n1 177665396 VKBKSGPCQDHAHF-UHFFFAOYSA-N 264.306 2.423 10 20 CECD COC[C@H](NCc1cc(OC)ccc1O)c1ccco1 182531245 YJLYVXFGAAYKLO-ZDUSSCGKSA-N 277.320 2.471 10 20 CECD CC(C)C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 68535555 FUUQEURSHUKZRG-UHFFFAOYSA-N 276.380 2.138 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2ccc(F)cc2O)C1 185787781 KPJTWTIUUOIADM-JQWIXIFHSA-N 280.343 2.193 10 20 CECD Cc1nc(C)c(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)o1 186431130 RKBAAQMUXLWNAP-MRVPVSSYSA-N 290.319 2.064 10 20 CECD CCn1ccnc1CN(C)c1ccc2c(c1)OCO2 121410765 MZMLSQXAEZOYCG-UHFFFAOYSA-N 259.309 2.268 10 20 CECD Cc1ccsc1CNC(=O)c1cccc(O)c1O 126484328 MRPKXWZEXBOIQM-UHFFFAOYSA-N 263.318 2.398 10 20 CECD CCOc1cccc(CN2CC[C@H](OCCOC)C2)c1O 188812538 SIHWOYAZPNIJAZ-AWEZNQCLSA-N 295.379 2.028 10 20 CECD COC(=O)[C@@H](C)NCc1ccc(N2CCCCC2)cc1 48142209 HAVCUUOJDBOBBW-CYBMUJFWSA-N 276.380 2.328 10 20 CECD CN(Cc1cccnc1)Cc1cc2c(cc1O)OCO2 192500944 SJGGQFMBFGFEQU-UHFFFAOYSA-N 272.304 2.148 10 20 CECD CC(C)n1ccc(C(=O)NCc2ccccc2O)n1 265078322 POZIQFYICFWPLF-UHFFFAOYSA-N 259.309 2.100 10 20 CECD COCCN(CCO)Cc1cc(Cl)cc(Cl)c1O 93005883 LSIJMSSMPUZBDA-UHFFFAOYSA-N 294.178 2.140 10 20 CECD N[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 50227689 YMYMPYXOMLYYBY-SECBINFHSA-N 261.152 2.232 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(CN)CCCC1 237081490 GZUSHNXIURDVIE-UHFFFAOYSA-N 289.423 2.196 10 20 CECD CC(C)[C@]1(C(=O)O)CCN(Cc2ccccc2O)C1 232753885 USKBICWYCGJSNY-HNNXBMFYSA-N 263.337 2.325 10 20 CECD CCOCc1cc(CNCCC[C@@H](C)O)ccc1OC 278604690 IEJGHQPMJZAJPV-CYBMUJFWSA-N 281.396 2.482 10 20 CECD COc1ccc(O)c(CNC[C@](C)(O)c2cccs2)c1 271877520 ZUIZQDFSZBVFMM-HNNXBMFYSA-N 293.388 2.460 10 20 CECD CC[C@H](O)CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273605140 TVZJGPJOKHCYJX-KOLCDFICSA-N 268.313 2.112 10 20 CECD COC[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCO1 278928495 USMWMBXFYMTMCR-GDBMZVCRSA-N 296.386 2.175 10 20 CECD CC[C@H](NCCn1ccnc1)c1ccc(F)cc1O 285694354 OOTSBTGOSPFMLS-ZDUSSCGKSA-N 263.316 2.469 10 20 CECD C[C@H](NCCc1cn[nH]c1)c1ccc(F)c(F)c1O 289759065 LOCIIANTRDXCJI-QMMMGPOBSA-N 267.279 2.287 10 20 CECD O=C(OCCCN1CCCCC1)c1cccc(O)c1O 800203965 VOZKITJMTGGSCY-UHFFFAOYSA-N 279.336 2.131 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)OC1CCOCC1 810050133 OWBBAYUXGSOPIX-UHFFFAOYSA-N 292.379 2.466 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](C(=O)O)C[C@@H](C)C2)c1 817881990 SXBWLSFAVAUUHI-YPMHNXCESA-N 293.363 2.334 10 20 CECD C[C@H](NC1CCNCC1)c1cc(Cl)ccc1O 817937524 XGPXPUZRCIESMW-VIFPVBQESA-N 254.761 2.448 10 20 CECD CN(C)c1ccc(CN(C(=O)c2ncc[nH]2)C2CC2)cc1 821033287 OFVUWECTKZTKIP-UHFFFAOYSA-N 284.363 2.281 10 20 CECD COCCCCC(=O)N[C@H](C)c1ccccc1O 827930107 BJHBTTDLNXEOCO-LLVKDONJSA-N 251.326 2.386 10 20 CECD NC1CC(NCc2cc(Cl)cc(Cl)c2O)C1 906510746 UNKKFVPQRIDMDY-UHFFFAOYSA-N 261.152 2.278 10 20 CECD COC(=O)CCCCOc1ccc(N(C)C)cc1 863469931 PNSYLRKMRDYSFI-UHFFFAOYSA-N 251.326 2.475 10 20 CECD CC(C)CN(CCC(=O)O)Cc1ccccc1O 833486786 RCEBFEUGHVRESX-UHFFFAOYSA-N 251.326 2.325 10 20 CECD CO[C@@](C)(C1CC1)[C@@H](C)NC(=O)c1cc(O)cs1 839837813 TYDHAIOAOLROQQ-AMIZOPFISA-N 269.366 2.387 10 20 CECD C[C@@H](CC(=O)N(C)Cc1ccccc1O)c1cnn(C)c1 839541941 JTEJIGSFRZVPDN-LBPRGKRZSA-N 287.363 2.278 10 20 CECD C[C@H](NC[C@@](C)(O)C1CC1)c1ccc(F)cc1O 386613304 KXENWSDEUVFSCV-LKFCYVNXSA-N 253.317 2.343 10 20 CECD CN[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 843048626 LSIGFOYRTJTAKP-NSHDSACASA-N 254.761 2.229 10 20 CECD CC(C)NC(=N)NCc1cccc(Br)c1O 849023080 KDSJTVPJDJEMTL-UHFFFAOYSA-N 286.173 2.177 10 20 CECD Nc1ccc(CC(=O)NCCOc2ccccc2F)cc1 746403782 FFUMCGSTCPHIBZ-UHFFFAOYSA-N 288.322 2.146 10 20 CECD C[C@H](N[C@H](CO)CCF)c1ccc(N(C)C)cc1 846208773 KZGRNKOEEXXRGW-AAEUAGOBSA-N 254.349 2.124 10 20 CECD CCOc1ccc([C@H]2NC(C)(C)C(=O)N2CC)c(O)c1 840831173 DIEFMQZFDQGMMX-ZDUSSCGKSA-N 278.352 2.020 10 20 CECD COc1cccc([C@@H](C)NC[C@](C)(O)C(C)C)c1O 846147422 UXSHRAYCPYYMSD-ABAIWWIYSA-N 267.369 2.458 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C1=COCC1 840558450 YKLAGYLEZPGULE-CYBMUJFWSA-N 288.391 2.412 10 20 CECD C[C@H](N[C@@H]1CCOC[C@H]1O)c1ccc2ccccc2c1O 858553297 NOGPDOZVAHPUPJ-IUIKQTSFSA-N 287.359 2.346 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C)[C@@H](CO)C2)c1O 856792239 LOTUOEOQUJTUAY-ZWNOBZJWSA-N 295.354 2.184 10 20 CECD Cc1ccc(O)c(CNC(=O)CCCC(=O)NC(C)C)c1 862760472 RMRSCTWQGKEDJE-UHFFFAOYSA-N 292.379 2.012 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC(N(C)C)C2)cc1 763259440 KOFINOJDUXWWQR-UHFFFAOYSA-N 297.402 2.480 10 20 CECD CN(C)c1cc(F)c(CNc2nnco2)cc1F 865291912 UQEMHBGMSUWHIA-UHFFFAOYSA-N 254.240 2.026 10 20 CECD CNC[C@@H]1CCCN1Cc1ccc(N2CCCC2)cc1 1118242018 UULVZHSFMSBSHQ-KRWDZBQOSA-N 273.424 2.471 10 20 CECD CCCOc1ccc(CN[C@@H](COCC)C(=O)O)cc1C 871879116 ZTTVEATVUUFALF-AWEZNQCLSA-N 295.379 2.363 10 20 CECD CCCOc1ccc(CNCc2cnnn2C)cc1C 873127589 UPTBMNQMTWVAAW-UHFFFAOYSA-N 274.368 2.202 10 20 CECD CCCN(C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1116439727 PNZXCFOTDNPWAG-UHFFFAOYSA-N 279.403 2.419 10 20 CECD Cc1cc(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)no1 775406905 QASNLUMKBCDAAX-GFCCVEGCSA-N 287.363 2.469 10 20 CECD Oc1ccccc1CNc1ccc2nnc(C3CC3)n2n1 774524079 NDGYXBOFFHBTBR-UHFFFAOYSA-N 281.319 2.319 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CC12CCCC2 778918241 HSVCMYKIRGHORQ-LLVKDONJSA-N 261.321 2.294 10 20 CECD CCCOc1ccc(CNC[C@H](C)S(C)(=O)=O)cc1C 873096304 VXFGZMQBYAUAIP-ZDUSSCGKSA-N 299.436 2.307 10 20 CECD C[C@@H](O)[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1116511795 BMMANIVACGVAGE-ZBFHGGJFSA-N 274.408 2.490 10 20 CECD CCOCCONC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773516694 JPMPFIYQVSXHET-GFCCVEGCSA-N 295.383 2.081 10 20 CECD CCS(=O)(=O)CCCN[C@@H](C)c1ccc(N(C)C)cc1 775834227 MDQQVQDUICWSME-ZDUSSCGKSA-N 298.452 2.228 10 20 CECD O=C(O)[C@H](CC1CC1)NCc1ccc2c(c1)CCCO2 1120000701 BNSVFWWJULGEBR-AWEZNQCLSA-N 275.348 2.355 10 20 CECD C[C@@H](NCc1ccc(N2CCN(C)CC2)cc1)c1ncc[nH]1 883290202 NWZCPBSUWYIATI-CQSZACIVSA-N 299.422 2.012 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)CO1 784143793 HPBNEUKHTQXSNB-UKRRQHHQSA-N 288.391 2.328 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)C[C@H](C)O)CC2)cc1 783535211 LKXNXNMRCKKNME-KBPBESRZSA-N 292.423 2.413 10 20 CECD O=C(NOCc1ccccc1)c1c(F)ccc(O)c1O 789954521 LLTUIHHRAZSTLK-UHFFFAOYSA-N 277.251 2.099 10 20 CECD CC[C@@H](N[C@H](C)C(=O)N(C)C)c1ccc(F)cc1O 796827156 QDSDKYYMXKHBQV-BXKDBHETSA-N 268.332 2.049 10 20 CECD CCOc1ccc(CN[C@@H](CO)CC2CCC2)c(O)c1 793321087 GGWZUAPIJUAKGH-CQSZACIVSA-N 279.380 2.432 10 20 CECD CC[C@@H](COC)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 898450664 SONNWIGHKWZNAZ-DOTOQJQBSA-N 293.455 2.370 10 20 CECD COCC1CN(Cc2ccc(Br)cc2O)C1 895975165 QBOHXOZLXNWVJI-UHFFFAOYSA-N 286.169 2.233 10 20 CECD CCn1ncnc1CNCc1c(O)ccc(Cl)c1F 793346387 NFPKOBUEHUPKRF-UHFFFAOYSA-N 284.722 2.086 10 20 CECD Cc1nc([C@H](C)NCc2ccc3c(c2)CCCO3)n[nH]1 894467483 LZGQFSVCVWCIET-JTQLQIEISA-N 272.352 2.289 10 20 CECD C[C@H](OC(=O)/C=C\c1ccc(O)c(O)c1)C(=O)C1CC1 798637975 HXYLDBUHTQOUGW-XGLGWPIMSA-N 276.288 2.022 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC/C=C/C1CC1 1324371709 OVTXKPFBUCFHGR-NBHWMUFKSA-N 259.305 2.193 10 20 CECD CO[C@@H](C)CNCc1cc(Br)cc(F)c1O 715723155 WFXOXWXGMDWPSA-ZETCQYMHSA-N 292.148 2.418 10 20 CECD CC(C)[C@@H]1C[C@H]1CNC(=O)NCc1ccc(N)cc1 1336878189 WWGKIWSYDSROAB-JSGCOSHPSA-N 261.369 2.360 10 20 CECD Nc1ccc(CNC(=O)N2CCOC3(CCCC3)C2)cc1 1335725251 LCLPWPKTAIDBOB-UHFFFAOYSA-N 289.379 2.123 10 20 CECD CCn1c(Nc2ccn(C)n2)nnc1-c1sccc1O 1340027363 YQOOFYDTGZXXTI-UHFFFAOYSA-N 290.352 2.209 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@H](C(=O)O)C2)c(Cl)c1 1600285831 HFZCSVVQCKPXBD-KYZUINATSA-N 269.728 2.307 10 20 CECD COC[C@](C)(CC(=O)O)NCc1cc(C(C)C)ccc1O 1599149345 FSVMBYQSFXLJRY-INIZCTEOSA-N 295.379 2.485 10 20 CECD CCOc1ccc(N(C)Cc2nnnn2C2CC2)cc1 150729967 OUHKXXUHTYMZME-UHFFFAOYSA-N 273.340 2.043 10 20 CECD CC[C@H](NCCN(C)CCOC)c1ccc(N(C)C)cc1 159366157 CUEBYEKQPJJLFV-KRWDZBQOSA-N 293.455 2.372 10 20 CECD CCn1nccc1CN[C@H]1CCc2cccc(O)c21 853242021 ZENNSFVTJMGHOP-ZDUSSCGKSA-N 257.337 2.386 10 20 CECD OCc1ccc(CNCc2ccc3c(c2)CCO3)cc1 227458916 NQOVLQGCQOWAPE-UHFFFAOYSA-N 269.344 2.404 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CCC[C@@H](O)C2)cc1 230668646 FYWQKBVDQNHOKH-GDBMZVCRSA-N 262.397 2.393 10 20 CECD COC[C@@H](CN[C@H](C)c1ccc(C)cc1O)OC 230672251 WHVWBJBMGHMEKN-VXGBXAGGSA-N 253.342 2.013 10 20 CECD 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CCCN(Cc1ccccc1O)C(=O)CCc1c[nH]cn1 189312498 XQZLLUWKTXLNAR-UHFFFAOYSA-N 287.363 2.487 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(O)CCCC2)c1 87016670 SUZFPAAJLBTCNT-NSHDSACASA-N 265.353 2.357 10 20 CECD CC(C)[C@@H]1OCCC[C@H]1CNC(=O)c1cccc(O)c1O 193128180 QBNRMKAMMVJUBS-NHYWBVRUSA-N 293.363 2.279 10 20 CECD O=Cc1c[nH]nc1/C=C\c1ccc(N2CCOCC2)cc1 255415754 KPQPFUMGYKVLCK-UTCJRWHESA-N 283.331 2.229 10 20 CECD CC[S@@](=O)c1ccccc1C(=O)N1CCS[C@H](C)C1 264093235 BURYVJMQISLMEG-NSPYISDASA-N 297.445 2.392 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)c(F)c1O)c1ncn(C)n1 277003731 ZRMPFPTYKFMOIF-SFYZADRCSA-N 282.294 2.211 10 20 CECD C[C@H]1C[C@@H](C)O[C@@H]1C(=O)N(C)Cc1ccccc1O 282558107 SMGVPBBDKRAVNN-WDMOLILDSA-N 263.337 2.164 10 20 CECD CC[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCCO1 281575054 LSXCYCKZSVIOBK-IYNGYCSASA-N 291.347 2.139 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)C[C@@H](C)[S@]1=O 289848965 UVTRLZLKZXIKOM-QRVQBPJGSA-N 297.420 2.132 10 20 CECD CN(C)c1ccc(CNC(=O)OC2CCOCC2)cc1F 289724971 IRPJBRMZFKNIKO-UHFFFAOYSA-N 296.342 2.297 10 20 CECD COC(=O)N1CCC(N[C@@H]2CCc3cccc(O)c32)CC1 295962252 MCWOWEPKKXMGEQ-CYBMUJFWSA-N 290.363 2.200 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@]2(O)CCN(C)C2)c1O 808715816 XNQXPRRAQAQMLA-IAQYHMDHSA-N 298.814 2.071 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCCC[C@H]2N)c1 818614639 DINQFTMPYBKQLF-LERXQTSPSA-N 264.369 2.321 10 20 CECD C[C@H](NCC[C@@H]1CCNC1)c1cc(F)cc(F)c1O 817955557 YUBWLQLWILUYQT-UWVGGRQHSA-N 270.323 2.321 10 20 CECD OCCC[C@H]1CCN(Cc2cc(F)ccc2O)C1 825338325 OKTFHVSACKGVIC-NSHDSACASA-N 253.317 2.126 10 20 CECD CC(C)N(Cc1ccc(N2CCOCC2)cc1)C1COC1 824472744 XNZVOMARTDHBFX-UHFFFAOYSA-N 290.407 2.132 10 20 CECD CC(C)N(CCCNC(=O)Cc1ccc(N)cc1)C(C)C 830943963 RLTPAEOYQWNMEA-UHFFFAOYSA-N 291.439 2.436 10 20 CECD CC[C@H](CN1CCOCC1)N[C@H]1CCc2cccc(O)c21 903342010 AREQRFXZVABMNJ-CABCVRRESA-N 290.407 2.080 10 20 CECD C[C@@]1(C(=O)O)CCN(Cc2cccc(Cl)c2O)C1 833554495 UVFXJBLNTYVORO-CYBMUJFWSA-N 269.728 2.342 10 20 CECD Cc1cc(O)c(CN[C@@H](CN)C(C)(C)C)cc1C 841087918 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C[C@@H]1CCN(C(=O)NCCc2ccc(N)cc2)C[C@@H]1C 841958961 IXLLTHDTAQQWNT-OLZOCXBDSA-N 275.396 2.499 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@@H]1CCOC1 840892577 BIMUBWNUZBFRMX-UKRRQHHQSA-N 262.397 2.371 10 20 CECD COC[C@H](C)CC(=O)NCc1ccc(N(C)C)cc1C 755327120 OFCOIZFYWGPYCS-GFCCVEGCSA-N 278.396 2.350 10 20 CECD CN1CCc2cc(/C=C\c3nccc(O)n3)ccc21 751536675 WUJXZZICCUEVMN-HYXAFXHYSA-N 253.305 2.345 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C)[C@@H](CO)C2)cc1C 857061107 KANXBYMLXYHMRA-IAQYHMDHSA-N 263.381 2.459 10 20 CECD Cc1ccc([C@H](C)NCCN2CCOC[C@@H]2C)c(O)c1C 756534466 KVQLKUZPKTXBFG-ZFWWWQNUSA-N 292.423 2.380 10 20 CECD CCOc1ccc(CN2CCOC(C)(C)C2)c(O)c1 768843250 UMJFQDTZAARJDO-UHFFFAOYSA-N 265.353 2.402 10 20 CECD Cc1cc(O)c(CN2C[C@H]3COC[C@H]3C2)cc1Cl 872265865 NBSGDNBHTQVOFM-TXEJJXNPSA-N 267.756 2.432 10 20 CECD COC(=O)[C@@H]1CCC[C@@H](C(=O)N(C)c2ccc(N)cc2)C1 877075222 AMOKSFJDBDPIOV-VXGBXAGGSA-N 290.363 2.211 10 20 CECD CO[C@@H](C)CCNCc1ccc(N2CCC(O)CC2)cc1 876997429 WXXQELOSQAIBIU-AWEZNQCLSA-N 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2.260 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1cccc(OC)c1O 1116443656 FNJSYRXFTKYTKV-UHFFFAOYSA-N 281.352 2.174 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1C[C@]12CCOC2 764124095 BROMCGVMNACBBL-MFKMUULPSA-N 298.433 2.168 10 20 CECD Cc1cc(Br)cc(CNCCN2CCC2)c1O 776253874 WGEKVRITIWQUHE-UHFFFAOYSA-N 299.212 2.258 10 20 CECD CCOc1ccc(CN[C@@H]2CCC[C@@H]2CCO)c(O)c1 778216192 KDVLONQKLHPRFG-IUODEOHRSA-N 279.380 2.432 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)O[C@@]2(CCCOC2)C1 877494288 JIMNXBDMZQKYKV-YOEHRIQHSA-N 291.391 2.471 10 20 CECD CCCOc1ccc(CN[C@H](C)CS(C)(=O)=O)cc1C 873049685 KEPLIRKXDCYGBV-CYBMUJFWSA-N 299.436 2.307 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCO[C@H](C)C2)c1 776473497 LDKOGUKSZCEWDH-WOPDTQHZSA-N 293.363 2.393 10 20 CECD CC[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H](C)O 789950585 RLOWAFPYLCRGNC-IUODEOHRSA-N 278.396 2.118 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2c(O)ccc3c2CCCC3)CO1 784441305 DSBLHVWCISLOGP-YPMHNXCESA-N 289.375 2.312 10 20 CECD CN(CCCO)Cc1cc(Br)cc(F)c1O 894663300 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CCc1cccc(CN2CCC(CCC(N)=O)CC2)c1O 848888463 URHVNEYHVCNOJP-UHFFFAOYSA-N 290.407 2.432 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2ccco2)c1 858089405 QUPMKFLBYDZRRX-UHFFFAOYSA-N 274.320 2.336 10 20 CECD C[C@H](NCCN1CCC[C@@H]1C)c1cc([N+](=O)[O-])ccc1O 756617706 PGLLOPUEWBEIDH-RYUDHWBXSA-N 293.367 2.435 10 20 CECD COc1cc(CNC/C=C/CO)c(O)c(C(C)(C)C)c1 850357576 OJHSVSDZJYRJPI-AATRIKPKSA-N 279.380 2.336 10 20 CECD C[C@@H](N[C@@H](CO)C1CCOCC1)c1cc(Cl)ccc1O 757659870 STOOKDJTGSCQHR-YGRLFVJLSA-N 299.798 2.484 10 20 CECD CN(C)c1cc(F)c(CN2C[C@@H]3CCCN[C@@H]3C2)cc1F 862246538 QGRIWCPOIKHSNT-XHDPSFHLSA-N 295.377 2.215 10 20 CECD CCOC(=O)C1(C)CC(NCc2cccc(OC)c2O)C1 877525650 KIKHYMSCWYHQMW-UHFFFAOYSA-N 293.363 2.222 10 20 CECD C[C@@H]1NC(=O)[C@@H](C)N(Cc2cc(Cl)ccc2O)[C@H]1C 895113779 KDCPPPUASINNGI-LPEHRKFASA-N 282.771 2.143 10 20 CECD O=C(COC(=O)c1ccc(Cl)o1)c1ccc(O)c(O)c1 782521571 MQVMJDUITKJZPZ-UHFFFAOYSA-N 296.662 2.384 10 20 CECD COc1cc(C)cc(CN[C@@H]2CN(C3CC3)C[C@@H]2C)c1O 894344340 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281.425 2.457 10 20 CECD CCOc1ccc(N(CC)C[C@H]2CN(C)C(=O)O2)cc1 1347641050 FDSBYNZCEVVMGA-CQSZACIVSA-N 278.352 2.362 10 20 CECD CCCCN(Cc1ccccc1O)C[C@H]1CN(C)C(=O)O1 1347647765 PGJYDNZRKNIHDY-CQSZACIVSA-N 292.379 2.445 10 20 CECD CN1CCCc2cc(CNC(=O)c3ccns3)ccc21 1357847195 ODJJELULTHRNJJ-UHFFFAOYSA-N 287.388 2.456 10 20 CECD O=C(CC1CC(F)(F)C1)NCc1cccc(O)c1O 1520508975 QHLHYHFJSVNJDQ-UHFFFAOYSA-N 271.263 2.149 10 20 CECD COC[C@@H](N[C@@H](C)c1cc(C(=O)O)ccc1O)C1CC1 1606814278 CGFBMQDZUHGRJS-TVQRCGJNSA-N 279.336 2.166 10 20 CECD CC1(C)CN[C@@H]1C(=O)NCc1c(O)ccc2ccccc12 1573614936 QMNDUXKCVKFXHN-OAHLLOKOSA-N 284.359 2.160 10 20 CECD Oc1c(F)cccc1CNCc1cccc2c1CCNC2 1580888679 VMJXUCHRNPSSKY-UHFFFAOYSA-N 286.350 2.467 10 20 CECD C[C@](O)(CSc1ncc(C(=O)O)s1)C(F)(F)F 1593419473 KZFZARHTHILMTF-ZETCQYMHSA-N 287.284 2.247 10 20 CECD CN(C)c1ccc(CN[C@]2(C)CCC[C@@H]2C(=O)O)cc1 1777040104 AGDZBLCRCBJAKE-GDBMZVCRSA-N 276.380 2.486 10 20 CECD CC(C)(C)[C@@H](CN)NCc1ccc2c(c1)CCCO2 904358324 LFBSDQOFSGFXSN-OAHLLOKOSA-N 262.397 2.475 10 20 CECD COc1ccc(CNCc2cnn(C)c2Cl)c(O)c1 816597203 JDKJJRPZJFXKMK-UHFFFAOYSA-N 281.743 2.078 10 20 CECD O[C@@H](CNCc1ccc2c(c1)CCCO2)c1ccco1 921516121 LDNNJVWNAJHHSF-AWEZNQCLSA-N 273.332 2.428 10 20 CECD COCCC(C)(C)CNCc1cc2c(cc1O)OCO2 230866912 YXANWBGUUQSHQX-UHFFFAOYSA-N 281.352 2.273 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)c2nncn2C)c1 37017586 CSQJKVFWYYXPHA-QWRGUYRKSA-N 260.341 2.241 10 20 CECD Cc1csc(CNCc2cc3c(cc2O)OCO3)n1 42880323 XCYMBMOWXLPSAL-UHFFFAOYSA-N 278.333 2.176 10 20 CECD C[C@H](NCC1([S@@](C)=O)CCC1)c1ccccc1O 281125099 SOPYOABRXSYZAR-BBATYDOGSA-N 267.394 2.344 10 20 CECD CN1CCCc2cc(CNCc3cnn(C)c3)ccc21 50286812 VLTIOYVDTKEOIT-UHFFFAOYSA-N 270.380 2.092 10 20 CECD C[C@H](NCCc1cncn1C)c1cc(F)ccc1O 401746394 KOWTUAPBBKBUIA-JTQLQIEISA-N 263.316 2.158 10 20 CECD NC[C@H]1CN(Cc2ccccc2O)CC[C@@H]1C(F)(F)F 704353290 YFWLSSSFQXNQQY-RYUDHWBXSA-N 288.313 2.351 10 20 CECD COCCN[C@H](C)c1ccc(Br)cc1O 134906141 FHZLZXXPBSEVSC-MRVPVSSYSA-N 274.158 2.452 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)NCc1c(O)ccc2c1CCCC2 174519730 ACKGHCDMUAPIMZ-CZUORRHYSA-N 289.375 2.312 10 20 CECD CSCC[C@@H](C)N(C)C(=O)c1cccc(O)c1O 126566741 VZIDXPCSVOHZKO-SECBINFHSA-N 269.366 2.311 10 20 CECD C[C@H](Sc1nccs1)c1nnnn1C1CC1 187910701 FVHPHVJGNKOGGS-LURJTMIESA-N 253.356 2.318 10 20 CECD CC[C@H](C)NC(=O)CCN[C@H](C)c1cc(OC)ccc1O 38013626 YKRZPQFRVKIPIC-NWDGAFQWSA-N 294.395 2.356 10 20 CECD CC[C@]1(C(=O)NCc2ccc(N(C)C)c(F)c2)CCCN1 134584465 ZMQQXFUJCYUVJP-MRXNPFEDSA-N 293.386 2.040 10 20 CECD Oc1cccc(Cl)c1CNC[C@@H]1CC[C@H](O)C1 236564536 DYGGNQYNPIVWDG-ZJUUUORDSA-N 255.745 2.296 10 20 CECD CCN(CC)c1ccc(CN2CCC3(C2)OCCO3)cc1 93013780 YDRDMWNSHOIOMJ-UHFFFAOYSA-N 290.407 2.482 10 20 CECD CN(C)[C@@H]1CCC[C@@H](NC(=O)NCc2ccccc2O)C1 267285087 ARKAWQZTMHRCTE-ZIAGYGMSSA-N 291.395 2.064 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H](F)C(F)(F)F)cc1 277483379 OFCBCFLWJQVDER-JTQLQIEISA-N 278.249 2.269 10 20 CECD CC(C)[C@H]1C[C@H](NC(=O)NCc2ccccc2O)CCO1 271567484 SZLUIDKLAAXONB-UKRRQHHQSA-N 292.379 2.395 10 20 CECD CN1[C@H]2CC[C@H]1CC(NCc1cc([N+](=O)[O-])ccc1O)C2 278629075 GRZLKZAFVVWSFB-STQMWFEESA-N 291.351 2.015 10 20 CECD C[C@@H](NC[C@@]1(N(C)C)CCSC1)c1ccccc1O 272931962 ZQRYRUNWPUVEKW-DOMZBBRYSA-N 280.437 2.480 10 20 CECD CCOCC(C)(C)CNC(=O)NCc1ccccc1O 289384733 KXWIRGQQNCHZEC-UHFFFAOYSA-N 280.368 2.254 10 20 CECD CC(C)N(CCC(=O)N(C)C)Cc1ccc(N(C)C)cc1 299198453 LMAICOHEZPASBY-UHFFFAOYSA-N 291.439 2.441 10 20 CECD Oc1ccccc1CNC[C@@H](O)Cc1cccc(F)c1 295119838 NAWKDJDTTPYIEM-HNNXBMFYSA-N 275.323 2.225 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ncoc1C 819761483 RQQGUTDIIOZBPM-UHFFFAOYSA-N 281.308 2.104 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ncc(C)o2)c1 813811359 ZMYJNFKSNHGEQZ-SECBINFHSA-N 276.292 2.188 10 20 CECD C[C@H]1CCNCC[C@H]1NCc1ccc(N(C)C)c(F)c1 817900635 PCNBIEYBQFFDSV-SWLSCSKDSA-N 279.403 2.369 10 20 CECD CNc1nc(C)cc(C(=O)N[C@H](C)c2ccccc2O)n1 827946222 AUCSXKPBDNPJRB-SNVBAGLBSA-N 286.335 2.023 10 20 CECD CO[C@H]1COCC[C@@H]1CNCc1cc(Cl)c(C)cc1O 826049757 ZDNOVWBMEJUTRP-ABAIWWIYSA-N 299.798 2.495 10 20 CECD CCC[C@H](CNCc1ccc([N+](=O)[O-])c(OC)c1O)OC 824543201 GOXSCXMMVZYPOB-LLVKDONJSA-N 298.339 2.214 10 20 CECD CC[C@H](CO)N(C)Cc1ccc(N(C)C)c(F)c1 824533866 RHIWEWCVVGVQKU-GFCCVEGCSA-N 254.349 2.094 10 20 CECD CCOc1cnc(C(=O)N[C@H](C)c2ccccc2O)cn1 827940707 IGTIMIAFSDTJNH-SNVBAGLBSA-N 287.319 2.072 10 20 CECD C[C@@H]1CCCC[C@@H]1NC(=O)COC(=O)c1cc(O)cs1 731911233 GZZSQKBRZWZCGU-KOLCDFICSA-N 297.376 2.305 10 20 CECD C[C@H](NC[C@H]1CCN1C)c1ccc(Cl)cc1O 903317818 VHUGYORTPYMBSP-GXSJLCMTSA-N 254.761 2.400 10 20 CECD CC(C)COC[C@H](O)CN[C@H]1CCc2cccc(O)c21 834531206 SDLRSQUFPAHPMZ-KGLIPLIRSA-N 279.380 2.003 10 20 CECD Cc1nc(NC(=O)NCc2ccccc2O)oc1C 748325287 NQAYKBOCRQPYFZ-UHFFFAOYSA-N 261.281 2.319 10 20 CECD CCOc1ccc(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)c(O)c1 843059727 RBAODYCQKLEMRJ-VBNZEHGJSA-N 290.407 2.350 10 20 CECD C[C@@H]1CCCCN1[C@H](C)CNC(=O)Cc1ccc(N)cc1 844171222 HABVOROWJKVLDT-ZIAGYGMSSA-N 289.423 2.190 10 20 CECD COC[C@@H](NC(=O)c1cc(O)cs1)c1ccco1 746697275 PDAYMAICKDWTKH-SECBINFHSA-N 267.306 2.164 10 20 CECD COc1cc(O)c(CN2C[C@@H]3[C@H](C2)C3(F)F)cc1OC 844759345 XFXSLVXQORJPSN-AOOOYVTPSA-N 285.290 2.106 10 20 CECD Cc1cc(Br)c(O)c(CN(C)[C@@H]2CCNC2)c1 843049163 HDZBJEYFRNKPTH-LLVKDONJSA-N 299.212 2.257 10 20 CECD COCC1(NCc2cc(Br)ccc2O)CC1 390592728 ZRUWATQRVHUNIZ-UHFFFAOYSA-N 286.169 2.423 10 20 CECD Cc1cc(O)c(CN2CC[C@]3(CCCN3)C2)cc1C 841105675 XUFXHXAXFHYEDW-MRXNPFEDSA-N 260.381 2.337 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C)[C@H](CO)C2)c1 857061141 KPPBDYZPACLYJW-JSGCOSHPSA-N 279.380 2.241 10 20 CECD C[C@H]1C[C@@H](NCCNC(=O)C2CC2)c2c(O)ccc(F)c21 756372207 PJHWJMILHSPFJP-JOYOIKCWSA-N 292.354 2.195 10 20 CECD CO[C@H]1C[C@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2O)C1 858584886 XKFQOZKSDJFOJA-FXPVBKGRSA-N 266.297 2.128 10 20 CECD Cc1cccc2nc(COC(=O)c3cccc(O)c3O)cn12 758548201 QDXRIYAJNYSAIV-UHFFFAOYSA-N 298.298 2.411 10 20 CECD CCn1ncc(C)c1NC(=O)c1ccc(C)c(O)c1O 855750840 ILIOQJDVJIAOOS-UHFFFAOYSA-N 275.308 2.183 10 20 CECD CCOc1ccc(CN2C[C@@H]3CCC[C@@]3(N)C2)c(O)c1 857226742 YJHPMFGYWLOCHZ-XJKSGUPXSA-N 276.380 2.104 10 20 CECD CC(C)(C)c1nnc(C(=O)NCc2ccccc2O)o1 865922001 ZGNMEBYMDLGPOV-UHFFFAOYSA-N 275.308 2.003 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)Nc1ncnc2[nH]ccc12 762799793 BARCZSJJSRVTSX-SECBINFHSA-N 284.319 2.412 10 20 CECD CC(=O)C1=NN(c2ccc(Cl)cc2C)C(=O)C1 871944788 RUFXAXVUPDACLX-UHFFFAOYSA-N 250.685 2.330 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCn3ccnc3C2)c1 779064240 HPJYTHKFDUHKRK-RYUDHWBXSA-N 287.363 2.263 10 20 CECD Cc1ccc(CN2CCN(c3nccnc3C)CC2)c(O)c1 877501548 QQRDIMNYPZICMX-UHFFFAOYSA-N 298.390 2.121 10 20 CECD C[C@H](N[C@@H](C)c1c(O)cccc1F)C(=O)N1CCCC1 886605180 LFZIPGZMVZTTRK-QWRGUYRKSA-N 280.343 2.193 10 20 CECD COc1ccc(CNCC(C)(F)F)c(O)c1OC 894623542 GCKGIZTWALYOHK-UHFFFAOYSA-N 261.268 2.154 10 20 CECD C[C@@H]1c2nncn2CCN1Cc1c(O)ccc(Cl)c1F 792185344 DGTZWGIMQCDQJR-MRVPVSSYSA-N 296.733 2.353 10 20 CECD Cc1cccc(NC(=O)c2c(F)ccc(O)c2O)n1 790070359 OHERDYURLFUIIF-UHFFFAOYSA-N 262.240 2.193 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)C1(CO)CC1 696098768 GSVFCHSYXDSMBC-VIFPVBQESA-N 255.745 2.296 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2C=C[C@H](C(=O)O)C2)cc1F 1330275642 VPMPELAUOYLTFD-ONGXEEELSA-N 296.317 2.150 10 20 CECD C[C@H](NCCC[C@H]1CCCN1)c1cc(C(=O)O)ccc1O 1609781338 WGTWDAOSKPFCEI-AAEUAGOBSA-N 292.379 2.273 10 20 CECD O=C(O)[C@H](CC(F)F)NCc1ccc(Cl)cc1O 1601639196 NGYSVCGCILRWOI-QMMMGPOBSA-N 279.670 2.244 10 20 CECD C/C(=C\c1ccccn1)C(=O)NCc1ccc(N)cc1 1574980235 QTYXCQIWXHGRQF-ZRDIBKRKSA-N 267.332 2.384 10 20 CECD C[C@H](NC1(C2CC2)CC1)c1cccc(-c2nn[nH]n2)c1O 1589953069 YHPKSSSCHULKII-VIFPVBQESA-N 285.351 2.166 10 20 CECD Nc1ccc(CCNC(=O)[C@]23CCCC[C@H]2OCC3)cc1 1580443328 XYDJIZFKUHDHRG-WBVHZDCISA-N 288.391 2.277 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1cc(F)c(F)cc1O 1594824977 ITSDQGCZHGDQCS-ZDUSSCGKSA-N 273.279 2.403 10 20 CECD C[C@H]1[C@H](C(=O)O)CCN1Cc1c(O)ccc2ccncc12 1594165477 CTJHIQCFUIINSN-CMPLNLGQSA-N 286.331 2.235 10 20 CECD C[C@@H](Sc1ncc(C(C)(C)C)s1)C(=O)NC(N)=O 164220149 YPJNFYICUKRBFQ-ZCFIWIBFSA-N 287.410 2.116 10 20 CECD COc1cc(CN2CCSCC2)c(O)cc1C 159866623 KQVZBTDIMKPZDS-UHFFFAOYSA-N 253.367 2.258 10 20 CECD CCN(Cc1ccccn1)C(=O)c1cccc(O)c1O 126485524 ODKJILCJXWLVGC-UHFFFAOYSA-N 272.304 2.155 10 20 CECD COc1cccc(CNC[C@@H]2CCO[C@H](C)C2)c1O 271260285 AJXZIYVRVQDTRB-VXGBXAGGSA-N 265.353 2.306 10 20 CECD Cc1c([C@@H](C)NCc2cccc(F)c2O)cnn1C 158718198 ZTRMTWYSTOHRAX-SECBINFHSA-N 263.316 2.424 10 20 CECD Cc1nc(CCN[C@@H](C)c2ccc(N(C)C)cc2)n[nH]1 272564349 ODCVRBGZTMXTLB-NSHDSACASA-N 273.384 2.072 10 20 CECD C[C@@H](CNCc1ccc2c(c1)CCO2)CN1CCCC1 58062690 QYYDUUQCHVLCSP-AWEZNQCLSA-N 274.408 2.443 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H]3COC[C@@H]32)c1 690781904 NSYCVICMZMSNSB-RISCZKNCSA-N 263.337 2.012 10 20 CECD Cc1cc(CNCc2c(O)cccc2Br)n[nH]1 716471007 SDXRVTGQUNXSAT-UHFFFAOYSA-N 296.168 2.476 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CCCSC1 810275998 YUDHBEVNFUNEKY-NSHDSACASA-N 251.351 2.152 10 20 CECD COCCOC[C@H]1CCN(Cc2cc(C)c(C)cc2O)C1 173398821 PKDXOELKEWHBKD-HNNXBMFYSA-N 293.407 2.494 10 20 CECD C[C@H](NCCCO)c1ccc(Br)cc1O 134904069 HLKSODSMQCIHKO-QMMMGPOBSA-N 274.158 2.188 10 20 CECD CN(C)C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C1 179630672 LYPXFPAXZXZBBF-HNNXBMFYSA-N 261.413 2.136 10 20 CECD COc1ccc(O)c(CNC(=O)C(=O)c2ccc(C)cc2)c1 114512507 SRKPHMBQZQAZJU-UHFFFAOYSA-N 299.326 2.208 10 20 CECD CCCNC(=O)COc1ccc(N2CCCC2)cc1 178194601 AUEJZRBBAXNENU-UHFFFAOYSA-N 262.353 2.192 10 20 CECD Cc1ccc(C(=O)NCc2ccc(O)c(F)c2)c(O)c1O 182837519 FCSQEGCGDPFNBV-UHFFFAOYSA-N 291.278 2.181 10 20 CECD COCCN1CCC(N[C@@H](C)c2ccc(F)cc2O)CC1 185144815 VCOLTTRKOGMFHG-LBPRGKRZSA-N 296.386 2.293 10 20 CECD Cc1ccc(O)c(CN2CCCN3CCC[C@@H]3C2)c1 134195812 BMKCEALBRHAOGH-OAHLLOKOSA-N 260.381 2.371 10 20 CECD CN(Cc1ccccc1O)C(=O)COC1CCCC1 298766097 AQNZIQJVVNBPBJ-UHFFFAOYSA-N 263.337 2.310 10 20 CECD CCCC[C@H]1NC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 272094205 MMEJETOORRJUQM-CQSZACIVSA-N 289.379 2.363 10 20 CECD C[C@@H](NCc1nncn1C)c1cc(Cl)ccc1O 273407669 OYAAPHKCTXPDCG-MRVPVSSYSA-N 266.732 2.025 10 20 CECD CC(C)C[C@H](C)NC(=O)c1c(F)ccc(O)c1O 278681428 IJHIKYVPOYNICO-QMMMGPOBSA-N 255.289 2.401 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cccc(N)n2)cc1 272358492 RSAAVMNGPHLWAK-UHFFFAOYSA-N 298.390 2.440 10 20 CECD C[C@H]1C[C@@H](C)O[C@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 282194737 PJTYXSODFFCZFR-FIXISWKDSA-N 294.370 2.321 10 20 CECD C[C@@H](NCCN1CC=CCC1)c1cc([N+](=O)[O-])ccc1O 280993239 MZAMWVXJXRHDNL-GFCCVEGCSA-N 291.351 2.213 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CC(=O)OCC 282451563 IUOVMHJMFRYSNQ-UHFFFAOYSA-N 293.363 2.474 10 20 CECD COc1ccc(O)c(CN2CCC3(CC2)OCCCO3)c1 293534007 CDBBWWLUNQZUNB-UHFFFAOYSA-N 293.363 2.130 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CC1CCOCC1 808094896 JAOMAAJJVZQBLR-UHFFFAOYSA-N 298.379 2.311 10 20 CECD OC[C@]12C[C@@H]1CN(Cc1ccc3ccccc3c1O)C2 816586590 MHKKTXYXLNSNKX-RHSMWYFYSA-N 269.344 2.360 10 20 CECD C[C@@H](NCCCC(=O)O)c1ccc(N2CCOCC2)cc1 818051871 BJZJOHJWANYESH-CYBMUJFWSA-N 292.379 2.039 10 20 CECD COc1ccc(N2CC[C@@H](CNc3nnc(C)o3)C2)cc1 819934049 GOUKAJPMKOBRRU-LBPRGKRZSA-N 288.351 2.325 10 20 CECD CNCCN[C@H](C)c1cc(Br)ccc1O 817951246 CHBVCLORBYZOOF-MRVPVSSYSA-N 273.174 2.025 10 20 CECD COc1cccc(CN2CC[C@@H]3OCC[C@@H]3C2)c1O 724814558 QYPKVPVOFYLABX-YPMHNXCESA-N 263.337 2.012 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC[C@@H]2C[C@@H]21 826035835 KBLOGKDDIAYAFE-KGYLQXTDSA-N 260.337 2.380 10 20 CECD CCC(=O)NC1CCN(c2ccc(OC)cc2)CC1 726562104 FTGBRACNLVWJDB-UHFFFAOYSA-N 262.353 2.190 10 20 CECD CC(C)[C@@H](NCc1cc(Cl)cc(F)c1O)C(=O)O 820044039 RJTLHDLEYSIZOR-SNVBAGLBSA-N 275.707 2.384 10 20 CECD COc1cccc(CNC(=O)NCC2=CCCC2)c1O 823095322 YOYIKZSXEVUCBF-UHFFFAOYSA-N 276.336 2.310 10 20 CECD O=C(O)[C@@H]1CC12CCN(Cc1cccc(F)c1O)CC2 833771435 FLVNTWXUPMHESW-NSHDSACASA-N 279.311 2.218 10 20 CECD CN(C)C1(CNC(=O)c2cc(O)cs2)CCCC1 732271211 RDCLHYVXMGHDLI-UHFFFAOYSA-N 268.382 2.058 10 20 CECD O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc(O)cs1 732273241 OCIXDOSCQOCHPD-LLVKDONJSA-N 293.348 2.082 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NOCC2CC2)c1 838607791 ZMTPADGYZCZCLC-SECBINFHSA-N 280.324 2.103 10 20 CECD COCC1(c2nc(Cc3ccc(N)cc3)no2)CCC1 843160382 IRNTZYZLOWXZGK-UHFFFAOYSA-N 273.336 2.311 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2cccc(OC)c2O)n1 846170493 AFNPHDFZXUZXCA-JTQLQIEISA-N 290.367 2.171 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@H](C)c1cccc(OC)c1O 846142689 GKWNAMWIRJJTKL-VXGBXAGGSA-N 294.395 2.356 10 20 CECD CC[C@H](C)C[C@H](CO)NC(=O)/C=C/c1ccc(O)c(O)c1 844038259 VUCJKLOQTPCCHH-VAFIWLDWSA-N 293.363 2.024 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)CCCN)c1O 843351490 XRZPQEJERFHAKB-UHFFFAOYSA-N 270.760 2.029 10 20 CECD Cc1ccc(C(=O)N[C@H](C)Cc2ccccn2)c(O)c1O 848311086 IZPUNDYPPJIBII-LLVKDONJSA-N 286.331 2.162 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@H](F)C1 846630138 IVMHLWAZZCLKEU-QZPNVGJNSA-N 265.284 2.072 10 20 CECD Cc1noc([C@@H](C)OC(=O)/C=C\c2ccc(O)c(O)c2)n1 759595963 SJRHJRFRDATMOQ-RZAAKKIOSA-N 290.275 2.107 10 20 CECD C[C@H](N[C@@H](C(N)=O)c1ccccc1)c1cc(F)ccc1O 756382795 UJASNNUALBNBNP-ZUZCIYMTSA-N 288.322 2.409 10 20 CECD C[C@H](N[C@H](C)c1nncn1C)c1cc(F)cc(F)c1O 756531717 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Cc1cccc(O)c1CN1CCOCC(F)(F)C1 877536420 PGTJQPQACREFHH-UHFFFAOYSA-N 257.280 2.168 10 20 CECD CN(C(=O)c1cnc2n1CCCCC2)c1ccc(N)cc1 877074307 GFXIKWGGEXQLJY-UHFFFAOYSA-N 284.363 2.468 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@@H]1CC12CCC2 876426584 POHKYLDVPTXIBU-CYBMUJFWSA-N 260.337 2.476 10 20 CECD C[C@@H](C[C@H]1CCCC(=O)N1)NCc1ccc2c(c1)CCO2 876996618 XBIWTTIPYFBICO-SWLSCSKDSA-N 288.391 2.158 10 20 CECD C[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)C[C@@H](C)S1 1117793990 IDOYOXKSTVDJBK-HTQZYQBOSA-N 285.340 2.203 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@@H](O)C2(C)C)c(O)c1 778193266 VIBCJJKGGSQXTB-ZIAGYGMSSA-N 265.353 2.040 10 20 CECD Cc1nonc1CN[C@H](C)c1ccc(F)cc1O 872137658 VAYYTFKAPVDBQC-SSDOTTSWSA-N 251.261 2.074 10 20 CECD CCC[C@@H](O)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 775404372 NENOATFONHYVNT-IUODEOHRSA-N 278.396 2.481 10 20 CECD CCN(C)c1ccc(CN2CCc3ncncc3C2)cc1 880599099 DMTRBKMHKUQJAG-UHFFFAOYSA-N 282.391 2.491 10 20 CECD C[C@@H](Cn1cccn1)N[C@@H](C)c1c(O)cccc1F 886543188 LMZNOCFXWFOUHW-QWRGUYRKSA-N 263.316 2.467 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1cc(C)cc(OC)c1O 887329897 RTNVSABRLHEMOW-MRXNPFEDSA-N 292.379 2.330 10 20 CECD C[C@@H](NC(=O)NCCN1CCC[C@H]1C)c1ccccc1O 897518233 HVINPPGMCYLDJC-CHWSQXEVSA-N 291.395 2.237 10 20 CECD CC[C@@H](C)[C@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423485 XNSPQZBEFGHCGO-RISCZKNCSA-N 264.369 2.342 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CNCC(C)C 1326614723 RSBITUUFBCRQAT-UHFFFAOYSA-N 278.396 2.376 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1cc(C)ccc1O 186029779 ZMOCEMRNESHUQO-NEPJUHHUSA-N 285.409 2.174 10 20 CECD CC[C@H](C)NC(=O)[C@H](C)N(C)Cc1ccccc1O 171937414 YDLASLMHDCAUCL-RYUDHWBXSA-N 264.369 2.127 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](F)C2)c1O 689911816 GMSINSMYEXEGSQ-SNVBAGLBSA-N 255.264 2.278 10 20 CECD CC[C@H](F)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1514664258 SMEXSNSUJWOEHP-LSDHHAIUSA-N 295.402 2.220 10 20 CECD O=C(O)c1ccc2c(c1)OCCN(Cc1ccccc1O)C2 1602425686 HNWDMBGOAQYWOR-UHFFFAOYSA-N 299.326 2.485 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CC[C@H](C(=O)O)CC2)c1 1600464358 AHHKKKSDTKDZDB-HAQNSBGRSA-N 291.347 2.208 10 20 CECD O=C(O)[C@H](NCc1cc(Cl)c(F)cc1O)C1CC1 1601674214 LAKOZLDGYIRBHJ-LLVKDONJSA-N 273.691 2.138 10 20 CECD COc1cc(C)c(CN2C[C@@H](C)C[C@H](C(=O)O)C2)c(O)c1 1594054278 UKRUCRSZADGZOJ-JQWIXIFHSA-N 293.363 2.252 10 20 CECD CN(C)c1ccc(CNC[C@@H](CC(=O)O)C(F)F)cc1 1777040290 TXDWCRPIIBZGKH-LLVKDONJSA-N 286.322 2.198 10 20 CECD COc1ccc(CC(=O)Nc2ccc(N)cc2)cc1OC 19273559 LLWFKGHDENAQBP-UHFFFAOYSA-N 286.331 2.467 10 20 CECD CC[C@@H](NCCCN(C)CCOC)c1ccccc1O 155114211 PRAYOTLGCASLST-OAHLLOKOSA-N 280.412 2.401 10 20 CECD Cc1cc(CN(C)Cc2ccc(N(C)C)cc2)n(C)n1 841828719 ZLELMIYUHOFDSB-UHFFFAOYSA-N 272.396 2.427 10 20 CECD Cc1cc(CN[C@@H](C)c2cc(F)ccc2O)n(C)n1 284520727 WQGNCOBNBNDKRZ-JTQLQIEISA-N 263.316 2.424 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)C2CCC2)c1 315761466 CLDDRFCIQRJQJZ-BONVTDFDSA-N 265.353 2.212 10 20 CECD CO[C@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)C12CCC2 713079535 RYBKIFPNGGCDPP-STQMWFEESA-N 275.352 2.348 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@H]1CCCO1 53508574 BVLLCMDYSCBFGI-OAHLLOKOSA-N 291.395 2.073 10 20 CECD CO[C@]1(C)C[C@H](NCc2cc3c(cc2O)OCO3)C1(C)C 174137482 ZUGLWJSAXKVUPF-GOEBONIOSA-N 293.363 2.414 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1n[nH]c2c1CCC2 115490845 HDBZSODZNOSATH-UHFFFAOYSA-N 298.390 2.203 10 20 CECD COc1cc(O)c(CNC[C@]2(C)CCCO2)cc1OC 182641063 UCXAAGUSZOGGQG-HNNXBMFYSA-N 281.352 2.068 10 20 CECD C[C@H](N)[C@@H]1CCCCN1Cc1cc(F)ccc1O 219584592 RLKMCHHWBWCVIU-GWCFXTLKSA-N 252.333 2.233 10 20 CECD COc1cc(O)c(CNCC2(CO)CCCC2)cc1OC 186523130 VDYMCHZDNDZHFT-UHFFFAOYSA-N 295.379 2.052 10 20 CECD C[C@](O)(CNCc1ccccc1O)c1ccccc1 134650550 BQELPOWFSPLSDT-INIZCTEOSA-N 257.333 2.390 10 20 CECD O=C(NC1CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 42933357 VHADIDPUXSYIJG-CQSZACIVSA-N 290.363 2.245 10 20 CECD CN(C)c1ccc(CNc2nnc(-c3cnn(C)c3)o2)cc1 191128795 QNHGFXTTXZORJR-UHFFFAOYSA-N 298.350 2.148 10 20 CECD CCc1nc(C(=O)NCc2c(C)c3ccccc3n2C)no1 352125599 JLJZUQVGRIDYHY-UHFFFAOYSA-N 298.346 2.362 10 20 CECD CCCOc1ccc(CN[C@@H](C)c2ncn(C)n2)c(O)c1 275389855 ASLMEZMWLFPQNJ-NSHDSACASA-N 290.367 2.160 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(C)C1)c1cccc(Cl)c1O 287635071 KOIMUGFCAFXKSE-BXKDBHETSA-N 282.771 2.317 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCOC[C@H]2C)c1 289195515 AZXKMAQSBZEMEN-VXGBXAGGSA-N 265.353 2.163 10 20 CECD C[C@@H](NC(=O)[C@](C)(O)C1CCC1)c1ccc(N(C)C)cc1 813525325 QDHYTBSWKVAOSY-SJKOYZFVSA-N 290.407 2.481 10 20 CECD C[C@H](CN)N[C@H](C)c1cc(Br)c(F)cc1O 817966585 QNDSMZWLMLDLEB-RNFRBKRXSA-N 291.164 2.292 10 20 CECD COc1cccc(O)c1CN1CC2(CCNCC2)C[C@@H]1C 818431223 HBBUOELCRMBDBT-ZDUSSCGKSA-N 290.407 2.365 10 20 CECD COc1cccc(CNCCCC2(O)CCC2)c1O 817414991 QEALPLUHMGAYAM-UHFFFAOYSA-N 265.353 2.186 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H]2COCCO2)c(O)c1 815561482 IHKXOEZXWVJVDW-CHWSQXEVSA-N 265.353 2.075 10 20 CECD Oc1c(CN2C[C@@H]3CNC[C@H]3C2)ccc2ccccc12 816522372 WCDHJCHOOZGXMI-GJZGRUSLSA-N 268.360 2.197 10 20 CECD C[C@H](N[C@@H]1CCCNCC1)c1cc([N+](=O)[O-])ccc1O 817967952 CVWAEUYSXKSFPB-WDEREUQCSA-N 279.340 2.093 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1F 824839442 ZDUVXRIQPUYDSM-DLTLXFJOSA-N 288.366 2.277 10 20 CECD CC1CCN(c2ccc(CN[C@H](C)C(=O)O)cc2)CC1 904217627 SHTFUIMVMARKQF-CYBMUJFWSA-N 276.380 2.486 10 20 CECD CN(C)c1ccc(CNC[C@@](C)(O)C2CC2)cc1F 733326504 HEHOPIVUPDPNSD-OAHLLOKOSA-N 266.360 2.142 10 20 CECD CC[C@H](NC[C@]1(C)CCC(=O)N1)c1ccc(C)cc1O 834907811 CVBYVDLLCXIJSM-BBRMVZONSA-N 276.380 2.410 10 20 CECD COC[C@H](C)N(C)CCN(C)c1ccc(OC)cc1 844401310 LGTRJEVTVPCEBL-ZDUSSCGKSA-N 266.385 2.098 10 20 CECD Cn1c(-c2ccccc2)cnc1SC[C@@H]1CCC(=O)N1 845301623 ZTBWHVZQEBCZTJ-LBPRGKRZSA-N 287.388 2.458 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCNC2CC2)cc1 848411520 QWRFBDKJZULLJM-UHFFFAOYSA-N 289.423 2.291 10 20 CECD CCN(CC)c1ccc(CNC(=N)N2CCC2)cc1 848993245 OPMAXFIQOYEMEP-UHFFFAOYSA-N 260.385 2.263 10 20 CECD CN1C(=O)C2(CCCC2)N[C@H]1c1cccc(Cl)c1O 742439106 IGWZQVJMLBJKEB-GFCCVEGCSA-N 280.755 2.419 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@](C)(O)C1 840918340 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280.368 2.350 10 20 CECD COc1cc(Cl)cc(CN(C)CC(C)(C)O)c1O 184694065 YTORUCXGSLJLRI-UHFFFAOYSA-N 273.760 2.257 10 20 CECD Cc1cccc(CN2CCN(Cc3ccncc3)CC2)c1O 182041914 OFCHKVOXUJCMBD-UHFFFAOYSA-N 297.402 2.413 10 20 CECD C[C@H](CN(C)C(=O)c1cccc(O)c1O)c1nccs1 193161882 TZWLWPAOSYDKAD-SECBINFHSA-N 292.360 2.430 10 20 CECD Cc1cc(O)c(CN(CCO)Cc2cccnc2)cc1C 93085918 KITFKQLSNZIQTQ-UHFFFAOYSA-N 286.375 2.399 10 20 CECD COc1cc(Cl)cc(CN2CCO[C@@H](C)C2)c1O 184676739 BXVAPMYPBKIWHZ-VIFPVBQESA-N 271.744 2.275 10 20 CECD CCOC[C@H](O)CN(Cc1ccc(N(C)C)cc1)C1CC1 265062961 ZFQQMBOEDYVVFQ-QGZVFWFLSA-N 292.423 2.114 10 20 CECD CCOC(C)(C)CNC(=O)NCc1ccccc1O 275663016 MBPMDTHJCASHPL-UHFFFAOYSA-N 266.341 2.007 10 20 CECD C[C@@H]1COCC[C@@H]1CNCc1cc(F)ccc1O 289577766 JUQFGTWXFJHZKC-GHMZBOCLSA-N 253.317 2.294 10 20 CECD C[C@@H]1COCC[C@H]1CNC(=O)N(C)Cc1ccccc1O 287773262 GRUSOGFTXQEENO-OLZOCXBDSA-N 292.379 2.206 10 20 CECD COc1ccc(O)c(CN2CC[C@H](c3nccn3C)C2)c1 377888021 HWJAAMVXHBEXMQ-LBPRGKRZSA-N 287.363 2.124 10 20 CECD C[C@@H]1CCC[C@H]1NCC(=O)NCc1ccc(N(C)C)cc1 282062697 MSCYQWVEDQHAPV-CZUORRHYSA-N 289.423 2.147 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](CC)N(C)C 298569241 KHGCSICNVGPMBS-CQSZACIVSA-N 278.396 2.471 10 20 CECD CCONC(=O)NCc1cc(Cl)cc(Cl)c1O 804869922 IPIRZHPBCHYJBH-UHFFFAOYSA-N 279.123 2.450 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)C[C@H](CC)O1 817640662 RHOWOHFMVKCUGV-RYUDHWBXSA-N 293.363 2.436 10 20 CECD C[C@@H](NCc1cc(F)ccc1O)c1ccnc(O)c1 816639048 GBBJRDMSYNQWNM-SECBINFHSA-N 262.284 2.483 10 20 CECD CC(C)[C@H](NCc1cc(Cl)cc(F)c1O)C(=O)O 820053408 RJTLHDLEYSIZOR-JTQLQIEISA-N 275.707 2.384 10 20 CECD CO[C@@H](C1CC1)[C@H](C)NCc1cc([N+](=O)[O-])ccc1O 825099096 UPJITDFXJMKOAR-LKFCYVNXSA-N 280.324 2.204 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)[C@@H](CO)CC(C)(C)C 825039919 BKDHABDSCUROBH-GFCCVEGCSA-N 295.379 2.350 10 20 CECD O=C(O)c1ccc(CNC(=O)c2cc(O)cs2)cc1 738679300 WMIYVUAQCSRSEX-UHFFFAOYSA-N 277.301 2.082 10 20 CECD C[C@H]1CC[C@@H](CNC(=O)N(C)Cc2ccccc2O)O1 838741345 CNCPWPZESWCZPI-AAEUAGOBSA-N 278.352 2.101 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)C(C)(C)O 734841315 LIQUXBRKWYJPJZ-JTQLQIEISA-N 254.349 2.141 10 20 CECD Cc1csc(NC(=O)NCc2ccccc2O)n1 748324506 GGUZRYRJOHOTQN-UHFFFAOYSA-N 263.322 2.479 10 20 CECD Cc1cc([C@@H]2CCCN2C(=O)Cc2ccc(N)cc2)no1 746316174 OQEQWWXODGEIIN-HNNXBMFYSA-N 285.347 2.471 10 20 CECD CO[C@@H]1COC[C@H]1N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 842913310 ZHLNGEOQCZQKJO-MVVXRAEJSA-N 281.327 2.083 10 20 CECD Oc1cccc2c1[C@H](NCCC1CCNCC1)CC2 844924383 KYXXIWKVFGOSDC-CQSZACIVSA-N 260.381 2.359 10 20 CECD CCN(C)c1ccc([C@H](C)NCCN2CCCC2=O)cc1 846208838 MKQHQDNHUHDDDS-AWEZNQCLSA-N 289.423 2.416 10 20 CECD C[C@H](N)CN(C)Cc1ccc(N2CCCCC2)cc1 844221073 SIPLYYZMZWYJKL-AWEZNQCLSA-N 261.413 2.456 10 20 CECD Cc1cc(Br)cc(CNCC(C)(C)N)c1O 841030379 GTALQRRNIHJRFQ-UHFFFAOYSA-N 287.201 2.290 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2C[C@H](F)CN2)cc1 841079083 KHGSQILALBSUCS-GJZGRUSLSA-N 279.403 2.322 10 20 CECD COC[C@H](CC(C)C)NC[C@H](N)c1ccc(N(C)C)cc1 841045919 SQQATQOLHWBISW-RDJZCZTQSA-N 293.455 2.403 10 20 CECD Cc1cc(O)c(CN2CCO[C@@H](CF)C2)cc1C 840171063 FISKPDDZGGVHLP-ZDUSSCGKSA-N 253.317 2.179 10 20 CECD COc1ccc(N(C)Cc2cn3cccnc3n2)cc1OC 920418535 DGAJDRSIWYEDHH-UHFFFAOYSA-N 298.346 2.383 10 20 CECD CC[C@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)C1 841047600 RJWPNYJYGOLOMD-FZMZJTMJSA-N 289.379 2.292 10 20 CECD CC[C@@H]1COC[C@@H]1NCc1ccc(N2CCOCC2)cc1 850382103 NJHXVVDRCDMCHH-WBVHZDCISA-N 290.407 2.038 10 20 CECD COc1cccc(O)c1CNc1cnn(CCF)c1 858246303 ZVISVSCCAOSVJI-UHFFFAOYSA-N 265.288 2.179 10 20 CECD COc1cc(CN[C@@H]2CCN(C)C2)c(O)c(C(C)(C)C)c1 850119033 MQSXKACNFTYZHK-CYBMUJFWSA-N 292.423 2.492 10 20 CECD CN(C)c1cc(F)c(CNC2CCOCC2)cc1F 858100505 IOZCBXGREKVRNY-UHFFFAOYSA-N 270.323 2.299 10 20 CECD CCON(C)C(=O)NCc1ccc(N(C)C)cc1C 753524924 YXAZWBSWBZUXNG-UHFFFAOYSA-N 265.357 2.154 10 20 CECD CCOC(=O)[C@@H]1CCCC[C@@H]1NC(=O)c1cc(O)cs1 854823365 HHRPNIFSHYIEFU-MNOVXSKESA-N 297.376 2.305 10 20 CECD C[C@@]1(C(=O)O)CCC[C@H]1NCc1ccc2c(c1)CCO2 756388554 PHTGUDLROVSNNV-GDBMZVCRSA-N 275.348 2.355 10 20 CECD CN(CC(=O)NCc1cc(Cl)ccc1O)C1CCC1 863928647 VKUGDQCTZIQEKV-UHFFFAOYSA-N 282.771 2.146 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)COC(F)(F)F)c1 934940486 NDBRZLAZYZJSLD-SSDOTTSWSA-N 293.241 2.114 10 20 CECD C[C@@H](NCc1noc2c1COCC2)c1ccccc1O 931553398 CVMNXYPADUYOJQ-SNVBAGLBSA-N 274.320 2.304 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C(=O)O 863740242 UDGZUTKDKILDII-DGCLKSJQSA-N 294.370 2.434 10 20 CECD Cc1ccc(CN2C[C@H](C)[C@@](C)(C(=O)O)C2)c(O)c1 1600415720 KWZRPCQJZMUMHV-NHYWBVRUSA-N 263.337 2.243 10 20 CECD Cc1nc2n(n1)CCN(Cc1cc(Cl)cc(F)c1O)C2 775701702 VXYIKWPTEJEIKK-UHFFFAOYSA-N 296.733 2.100 10 20 CECD CCCC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CC1 784147807 OIIVAEFQSCTSRT-UHFFFAOYSA-N 278.304 2.404 10 20 CECD COc1ccc(CN2CC[C@@H](SC)C2)c(O)c1OC 894691862 IQEUKXKVAIGXNS-LLVKDONJSA-N 283.393 2.347 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cc(OCC)ccc2O)C1 896962944 UHBKIDBVLHRNCD-GFCCVEGCSA-N 293.363 2.176 10 20 CECD CCOc1ccc(CNC[C@H]2CC(C)=NO2)c(O)c1 895312180 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LFNYLROIBWRDRY-UHFFFAOYSA-N 276.355 2.471 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCSCC2)c(O)c1 230661667 OHWRKQQGIHETDN-CYBMUJFWSA-N 280.437 2.400 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@H]1CCc2cccc(O)c21 297794714 QBMMJPIAADOBRT-SUZMYJTESA-N 267.394 2.082 10 20 CECD CN(C)c1ccc(CNCCCOC(F)F)cc1 398149867 CQFUSNAQMXFCTL-UHFFFAOYSA-N 258.312 2.472 10 20 CECD CCN(CC)c1ccc(CNC(=O)C[C@H]2CCCN2)cc1 178712596 XBQVTEOUUJJKHL-OAHLLOKOSA-N 289.423 2.291 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(OC)CCOCC2)c1 186146911 DGUSPZHTYAFBMO-GFCCVEGCSA-N 295.379 2.247 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NCCN(C)C)cc1 120318611 HFJKGXGXSRRNDB-UHFFFAOYSA-N 285.391 2.386 10 20 CECD Oc1cc2c(cc1CNc1ccc3c(c1)OCO3)OCO2 42879373 BOILFXHUBKVMHA-UHFFFAOYSA-N 287.271 2.462 10 20 CECD COC(=O)[C@H](C)N(Cc1cc(OC)ccc1O)C1CCC1 191648986 HOLOPCXFZQUVOW-NSHDSACASA-N 293.363 2.317 10 20 CECD C[C@H](NCc1ccnn1C)c1ccc(F)c(F)c1O 191200212 QIHNNKNANPNAHA-QMMMGPOBSA-N 267.279 2.255 10 20 CECD C[C@H](N[C@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 86758479 TWAGIAZHJOAPJJ-HZMBPMFUSA-N 262.353 2.266 10 20 CECD COCCN(Cc1ccno1)c1ccc(OC)c(OC)c1 81155891 BJDUATZYMSPXRO-UHFFFAOYSA-N 292.335 2.345 10 20 CECD CCOCCO[C@H]1CCN(Cc2cccc(OC)c2O)C1 92067512 ITDMWMJOKJCOJH-AWEZNQCLSA-N 295.379 2.028 10 20 CECD CCn1ccnc(NCc2c(O)ccc3c2CCCC3)c1=O 91013077 LUJGSBFPFCTJKW-UHFFFAOYSA-N 299.374 2.460 10 20 CECD CCn1nccc1NC(=O)c1ccc(C2=S=CC=C2)o1 341080688 ABTQKNGVKKQWBC-UHFFFAOYSA-N 287.344 2.374 10 20 CECD Cc1c(CNC(=O)Cc2cncn2C)n(C)c2ccccc12 525942545 YQKLUQRKIVJABF-UHFFFAOYSA-N 296.374 2.079 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2[C@H](C)O[C@H](C)[C@H]2C)c1 528863882 QWXSPQGNAZSHKJ-OZWUEAAUSA-N 293.363 2.077 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@H](C)c1ccc(F)cc1O 252815240 UWEBFDITFIEQRO-CLFVBBPSSA-N 273.373 2.339 10 20 CECD CCOCCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273426015 UDCNRYVILGHBMC-SNVBAGLBSA-N 268.313 2.378 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](O)C(C)C)cc1F 286507110 MQPGSVURKDPFNV-OAHLLOKOSA-N 296.386 2.305 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)c(F)c2)[C@@H](C)C1 809698279 XPEDWBKBSWGMRM-ZDUSSCGKSA-N 279.403 2.418 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1cncnc1 292371847 VPLHZGQYFCOCBZ-UHFFFAOYSA-N 298.390 2.134 10 20 CECD COCCO[C@H]1CCCN(Cc2c(O)cccc2OC)C1 802653571 YXOJTTWFPCIKIX-ZDUSSCGKSA-N 295.379 2.028 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@H]1O 293698147 CMOGHEJFSZYMMF-GOEBONIOSA-N 262.397 2.264 10 20 CECD CCCCCOCC(=O)NCc1ccccc1O 299596722 UVYHREOTRCEDDZ-UHFFFAOYSA-N 251.326 2.215 10 20 CECD CCN(C)c1ccc([C@H](C)NCCC(=O)O)cc1 818193815 WMOWHHLKKHUKPC-NSHDSACASA-N 250.342 2.268 10 20 CECD CC[C@H](NC[C@H]1CNCCCO1)c1cc(Cl)ccc1O 817982702 VNUDWIDPBFUMDX-OCCSQVGLSA-N 298.814 2.465 10 20 CECD COC(=O)[C@H](CNCc1ccccc1O)CC(C)C 813332622 DFMCUMSHHFJSEI-ZDUSSCGKSA-N 265.353 2.317 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3[C@@H](CO)[C@@H]3C2)cc1Cl 825964147 PMADABGVEFRCPN-GDNZZTSVSA-N 267.756 2.024 10 20 CECD COc1ccc(CNC[C@@H]2CCOC[C@H]2OC)cc1C 824708358 FNBFCSKWEKKRQW-GOEBONIOSA-N 279.380 2.145 10 20 CECD C[C@@H]1CCCC[C@H]1OCC(=O)NCc1ccc(N)cc1 837303341 IBENZGQMXSSKBA-IUODEOHRSA-N 276.380 2.480 10 20 CECD CN1CCCc2cc(CNC(=O)[C@H]3CCC(=O)C3)ccc21 843778093 AQRACHCPSUATBA-AWEZNQCLSA-N 286.375 2.054 10 20 CECD CC[C@@H](C[C@H](C)CO)NCc1cc2c(cc1O)OCO2 743499719 PVTZIAQXPLAPAF-JQWIXIFHSA-N 281.352 2.008 10 20 CECD CCO[C@@H](CC(=O)NCc1ccc(O)cc1O)C(C)C 910950478 GBNUYODICNQFIR-AWEZNQCLSA-N 281.352 2.165 10 20 CECD Cn1nccc1[C@@H]1CCCCN1C(=O)Cc1ccc(N)cc1 846690271 GOPMJPBEIDGAOC-INIZCTEOSA-N 298.390 2.299 10 20 CECD C/C=C\C(=O)N1CCCN(c2ccc(OC)cc2)CC1 917821598 YBKIFXYLBIAXAJ-HYXAFXHYSA-N 274.364 2.310 10 20 CECD CN(C)[C@H](C(=O)NCc1ccccc1O)c1ccccc1 748346630 QBLSBEILQQWNTB-INIZCTEOSA-N 284.359 2.311 10 20 CECD C[C@H](CCCN)NCc1cc(Cl)cc(F)c1O 841079978 MLHRTMCFBLYDAY-MRVPVSSYSA-N 260.740 2.402 10 20 CECD CCOc1ccc(CN[C@@H](CN)C(C)(C)C)c(O)c1 841086687 CUFSXZBOWUONCP-AWEZNQCLSA-N 266.385 2.254 10 20 CECD COc1ccc(N(C)CCCNC(=O)C(F)(F)F)cc1 844353411 WCFBJSXWCNYZQJ-UHFFFAOYSA-N 290.285 2.200 10 20 CECD CCN(CCSC)C(=O)c1ccc(C)c(O)c1O 844122637 LHIFWWNJPWDGPX-UHFFFAOYSA-N 269.366 2.231 10 20 CECD Fc1cnc(NCc2ccc(N3CCOCC3)cc2)cn1 853229658 JMBLFQWXYZEKKR-UHFFFAOYSA-N 288.326 2.064 10 20 CECD CN(C)c1cc(F)c(CNCc2ccn(C)n2)cc1F 858154345 FBEYELAWNHFKCM-UHFFFAOYSA-N 280.322 2.054 10 20 CECD CN(C)c1cc(F)c(CNC[C@H]2CCOC2)cc1F 858093997 JGQRXXBBZPTFBJ-SNVBAGLBSA-N 270.323 2.157 10 20 CECD CC[C@H](NCCN1CC[C@H](O)C1)c1cc(Cl)ccc1O 858602389 XZDGYTDVTUEYTG-JSGCOSHPSA-N 298.814 2.153 10 20 CECD C[C@H](NCc1c(O)ccc(Cl)c1F)C1(CO)CC1 850361448 RZCXRAVZHIEACP-QMMMGPOBSA-N 273.735 2.435 10 20 CECD COC(=O)CCC(C)(C)NCc1ccccc1O 762785431 IMXJQJHDWALDQZ-UHFFFAOYSA-N 251.326 2.214 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](F)C(F)(F)F)c1 862756973 CFXGGGOWJSTLQW-VIFPVBQESA-N 265.206 2.217 10 20 CECD CC[C@](C)(CN(C)c1ccc(OCC(=O)OC)cc1)OC 877315085 JYFCYFGWVHURRI-MRXNPFEDSA-N 295.379 2.490 10 20 CECD CC[C@H](NCCS(=O)(=O)CC1CC1)c1ccccc1O 775522150 KNJGDWIIFJQDQZ-AWEZNQCLSA-N 297.420 2.258 10 20 CECD Cc1cccc(O)c1CN1CCC(C2OCCO2)CC1 876680062 YGIXRRVPEIQHNN-UHFFFAOYSA-N 277.364 2.286 10 20 CECD COC[C@@H](CO)N[C@H](C)c1cccc(C(F)(F)F)c1O 788804555 IRIGGKJPLKMNEH-RKDXNWHRSA-N 293.285 2.069 10 20 CECD C[C@H](O)C[C@H](C)NCc1cc(Cl)cc([N+](=O)[O-])c1O 782981101 XWAXIFMHSRNCDR-YUMQZZPRSA-N 288.731 2.203 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H](C)S1=O 792192677 OQXRWTFDIAZCOV-RYUDHWBXSA-N 298.427 2.233 10 20 CECD Cc1cc(C)c(O)c(CN2CCO[C@]3(CCO[C@H]3C)C2)c1 794657569 BGXPSEDQKSTCAO-WMLDXEAASA-N 291.391 2.389 10 20 CECD CCOc1cc(C(=O)NCc2cc(Cl)ccc2O)[nH]n1 1329048403 FPLMKHUDJXZSFR-UHFFFAOYSA-N 295.726 2.097 10 20 CECD COC(=O)CCCCN[C@H](C)c1ccccc1O 879650220 QEXGHYLEVNJUQP-LLVKDONJSA-N 251.326 2.386 10 20 CECD CC[C@H](CNCc1cc(C)cc(OC)c1O)OC 1262111870 SFJIDVQNCBNANK-GFCCVEGCSA-N 253.342 2.224 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](N)CC(C)C)c1 1341721858 OJCJSLFOIHVDEN-RYUDHWBXSA-N 294.395 2.342 10 20 CECD Cc1cccc(-n2c(C)cc(CNC(=O)CCN)c2C)c1 1579746937 FHDMGBQORHTDAV-UHFFFAOYSA-N 285.391 2.368 10 20 CECD N[C@H](C(=O)NCc1ccc(O)cc1O)C1CCCCCC1 1580114163 ZPADLCNQZLGNGQ-HNNXBMFYSA-N 292.379 2.012 10 20 CECD CC(C)(NCc1cc(Cl)c(F)cc1O)C(=O)O 1590870405 GCMVOFHGOQLKKF-UHFFFAOYSA-N 261.680 2.138 10 20 CECD CCCN(CCO)Cc1ccc(N(C)C)c(F)c1 161210174 ZNCRBWKJTIYHRN-UHFFFAOYSA-N 254.349 2.096 10 20 CECD NC1(CNCc2ccc3c(c2)CCCO3)CCCC1 904376547 BGILMEHJRAZSHX-UHFFFAOYSA-N 260.381 2.373 10 20 CECD C[C@H](N[C@@H]1CCc2cccc(O)c21)C(=O)NC(C)(C)C 295787437 ABDOCUYZBCMXCF-CMPLNLGQSA-N 276.380 2.272 10 20 CECD C[C@@]1(C(=O)O)CCCN1Cc1cc(F)cc(F)c1O 708215095 GSXOYICCMXBKDA-ZDUSSCGKSA-N 271.263 2.110 10 20 CECD CCOCCCCNC(=O)NCc1cccc(OC)c1O 174108571 BZNPBANECMXYBR-UHFFFAOYSA-N 296.367 2.017 10 20 CECD COc1ccc(O)c(CNC[C@@H]2Cc3ccccc3O2)c1 38009538 PTIZQWLWAFOASY-HNNXBMFYSA-N 285.343 2.494 10 20 CECD Oc1ccc(Cl)cc1CNC[C@@H]1CC[C@@H](O)C1 188831478 KYQGWEAAYZBLKK-BXKDBHETSA-N 255.745 2.296 10 20 CECD COc1ccc(N2CCN(C(=O)C3CCC3)CC2)cc1F 84815349 PLILUAOHERTGAQ-UHFFFAOYSA-N 292.354 2.283 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@@H]1CCCCO1 140110563 FVAJFEWOQHUPDI-ZDUSSCGKSA-N 278.352 2.103 10 20 CECD CN(C)c1ccc(CN2CCO[C@@H]([C@H]3CCCO3)C2)cc1 246477842 OSTWOFGMMULVDC-IAGOWNOFSA-N 290.407 2.132 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H](CCO)COC)cc1 268995710 IHPWXTVHGRSLDK-HIFRSBDPSA-N 280.412 2.191 10 20 CECD COCCN1CC[C@H](N[C@H](C)c2ccc(N(C)C)cc2)C1 268966084 YMWHPEMLZUMHCZ-ZBFHGGJFSA-N 291.439 2.124 10 20 CECD C[C@H]1C(=O)CC[C@@H]1CC(=O)NCc1ccccc1O 279858377 KNYXFZVSMKPPAX-GHMZBOCLSA-N 261.321 2.014 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](O)C(C)C 285722463 QGRQQCYILUQBGT-CQSZACIVSA-N 265.353 2.148 10 20 CECD Cc1ccc(C(=O)N2CCC[C@H]2[C@@H]2CCCO2)c(O)c1O 375976002 SPTALUMAVYUMSQ-STQMWFEESA-N 291.347 2.190 10 20 CECD NCc1ccc2c(c1)CCCN2C[C@H](O)CC(F)(F)F 700922680 GEPXTHQFBCMVLK-GFCCVEGCSA-N 288.313 2.211 10 20 CECD CN(Cc1ccccc1O)c1nnc([C@@H]2CCCO2)n1C 295802987 AKIAHTQAMVCHKB-ZDUSSCGKSA-N 288.351 2.009 10 20 CECD CCCN(CCN1CCCC1)C(=O)c1cc(O)cs1 807690896 XUQUWJCQBSVXML-UHFFFAOYSA-N 282.409 2.402 10 20 CECD CN(C)CCN(C)Cc1ccc(Br)cc1O 700928353 MNSRSDJRJZLBRN-UHFFFAOYSA-N 287.201 2.148 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H](C)C(F)(F)F)c1O 290117326 IQISRSGXDLEGMA-ZCFIWIBFSA-N 294.229 2.349 10 20 CECD C[C@H]1C[C@@H](NCC(F)(F)CN)c2c(O)ccc(F)c21 817965865 DPCZFKXUGYIERA-IONNQARKSA-N 274.286 2.263 10 20 CECD N[C@@H](CC(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 827004799 OOISBJXWUDJPGB-INIZCTEOSA-N 287.407 2.030 10 20 CECD CC(C)N1CCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O 828539546 PYHMEOAXEODIPM-TZMCWYRMSA-N 276.380 2.442 10 20 CECD CCN(CCOCCO)Cc1cc(Cl)c(C)cc1O 825774573 YPABQDWLIQDMOY-UHFFFAOYSA-N 287.787 2.185 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCN2C2CCCC2)c1 824904623 UBRJLDVDTNLGHY-HNNXBMFYSA-N 288.391 2.334 10 20 CECD CSC1(CN(C)c2ccc(OCC(=O)O)cc2)CC1 902017597 XEURUPDRJIZBIN-UHFFFAOYSA-N 281.377 2.482 10 20 CECD CCC[C@H](OC)C(=O)N[C@H](C)c1cc(OC)ccc1O 825736529 BKASWKVXGPAWQS-YGRLFVJLSA-N 281.352 2.393 10 20 CECD C[C@@H](NC(=O)CCn1cccc1)c1ccccc1O 827937090 KCLGENDXVMZCKG-GFCCVEGCSA-N 258.321 2.461 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@H](C)c1c(O)cccc1F 903338049 BDPZICQONKUCSN-OLZOCXBDSA-N 296.386 2.293 10 20 CECD CCOCCNCc1cc(Br)ccc1O 163756869 LZTLAMCCVOTJOK-UHFFFAOYSA-N 274.158 2.281 10 20 CECD C[C@@](O)(CNCc1ccc(N2CC=CC2)cc1)C(F)F 905133952 NBMYERXGPULEQN-OAHLLOKOSA-N 282.334 2.169 10 20 CECD Cn1c(=O)oc2cc(NC(=O)c3cc(O)cs3)ccc21 732285462 HGHPBBXXVJOWOE-UHFFFAOYSA-N 290.300 2.151 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H](CC(N)=O)C1 840917321 RNGPTIMDUXLOCB-CQSZACIVSA-N 289.423 2.148 10 20 CECD CC[C@@H](SC)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 844163223 VVDSKXPACXIPDT-UONOGXRCSA-N 295.452 2.010 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)C(=O)O)cc1F 842628993 SXFAJNIMMPJCTQ-JTQLQIEISA-N 296.342 2.009 10 20 CECD COc1ccc(CNC(=O)C[C@@H](CN)CC(C)C)c(O)c1 852825423 KCBCQPWICKANPB-LBPRGKRZSA-N 294.395 2.028 10 20 CECD CNC[C@H](C)NCc1ccc(N2CCCCC2)cc1 853249409 FELNMDMNPCFNIF-AWEZNQCLSA-N 261.413 2.374 10 20 CECD CN(C(=O)/C=C/c1ccc(Cl)nc1)c1cn[nH]c1 759243432 TYTSWBXZTFLARP-HWKANZROSA-N 262.700 2.134 10 20 CECD C[C@H](C(=O)NCCc1ccc(O)c(O)c1)c1ccco1 762264330 SZDLUKQJGZZIRB-JTQLQIEISA-N 275.304 2.153 10 20 CECD CO[C@H](C)[C@@H](C)NC(=O)N[C@H](C)c1ccccc1O 868627310 UITWSWHAUBOAHY-GMTAPVOTSA-N 266.341 2.176 10 20 CECD CO[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862246646 LYELFXGDIVYPMH-NSHDSACASA-N 270.323 2.252 10 20 CECD Cc1cnc(N[C@@H](C)Cc2ccc(O)c(O)c2)nc1 762800005 HFIJZLYGPPTFMP-JTQLQIEISA-N 259.309 2.239 10 20 CECD Cc1ccc(O)c(CNC(=O)C2CCN(C3CC3)CC2)c1 862755349 FJOSWNMWOBYQPX-UHFFFAOYSA-N 288.391 2.191 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(c3cccnc3)CC2)c1 862757493 WJXJGRUKCQZTBT-UHFFFAOYSA-N 282.343 2.444 10 20 CECD OC1CCN(Cc2ccc(N3CCCC3)cc2)CC1 1116439157 KPIJLIIFFZXVST-UHFFFAOYSA-N 260.381 2.244 10 20 CECD C[C@@]1(O)CCN(Cc2cc(Cl)cc(F)c2O)C1 775734149 LUHDCBKXQDPUJB-GFCCVEGCSA-N 259.708 2.141 10 20 CECD COc1ccc(N2CC[C@@H](CNCc3ccon3)C2)cc1 873132511 WJIXAGFHNJHHHX-ZDUSSCGKSA-N 287.363 2.299 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](C(C)(C)O)C2)c1 877797300 SSLMTWBBXRJRHH-ZDUSSCGKSA-N 279.380 2.384 10 20 CECD C[C@H](N[C@H](C)c1c(O)cccc1F)c1ncnn1C 886598578 FROCYSIEXGOUDN-BDAKNGLRSA-N 264.304 2.072 10 20 CECD CC(C)[C@H]1NC(=O)N(CCCSc2nccs2)C1=O 777649076 CUFHKXQIXIFMGM-SECBINFHSA-N 299.421 2.202 10 20 CECD CCCN1C[C@@H](CN[C@@H](C)c2c(O)cccc2F)CC1=O 886628615 XIFZNOLIJZLSEX-NWDGAFQWSA-N 294.370 2.440 10 20 CECD Cc1ccc(C(=O)Nc2cccc3c2OCO3)c(O)c1O 782829400 UAKZZPCZVFYHCP-UHFFFAOYSA-N 287.271 2.387 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1cc(C)cc(OC)c1O 894470573 NICLJDGQEYERAV-CYBMUJFWSA-N 293.363 2.237 10 20 CECD CN(C)c1cccc(NC(=O)c2cc(O)cs2)n1 782132002 FILNXHIGIVGJQQ-UHFFFAOYSA-N 263.322 2.167 10 20 CECD COc1cccc(CN2c3ccccc3C[C@@H]2CO)c1O 895245139 VZKQRMRYAASEJH-CQSZACIVSA-N 285.343 2.324 10 20 CECD CC[C@@H](NCC(=O)N(CC)CC)c1ccc(F)cc1O 796704298 NKFXEQBQEXMTTL-CYBMUJFWSA-N 282.359 2.440 10 20 CECD Oc1ccccc1CN1CCCC[C@@H]1[C@@H]1CCCN1 63188446 VIBSKIJIGGZIKY-LSDHHAIUSA-N 260.381 2.499 10 20 CECD Cc1n[nH]c(C)c1[C@@H]1COCCN1Cc1ccc(N)cc1 1336284626 AWGKJQAFGFSLQH-HNNXBMFYSA-N 286.379 2.182 10 20 CECD CN(C(=O)c1ccc(-c2cn[nH]c2)cn1)c1ccc(N)cc1 1578389262 ANIWRRUOIAPPHE-UHFFFAOYSA-N 293.330 2.331 10 20 CECD COc1ccc(O)c(CN2C[C@@H]3CCC[C@]3(C(=O)O)C2)c1 1599598205 HZPHBKIZSDMEJL-LRDDRELGSA-N 291.347 2.088 10 20 CECD COc1ccc(O)c(CNCCCCCC(=O)O)c1 1599598440 MMHNKMVIAPQWBY-UHFFFAOYSA-N 267.325 2.135 10 20 CECD CCOCCNC1CCN(c2ccc(OC)cc2)CC1 161920961 DLRSAFGNAWYGMC-UHFFFAOYSA-N 278.396 2.290 10 20 CECD CN1CCC[C@H]2CN(C(=O)Nc3ccc(N)cc3)CC[C@@H]21 166707701 SHQWCRYRQKEMHE-WFASDCNBSA-N 288.395 2.217 10 20 CECD C[C@H](NCC[C@@H](O)C1CC1)c1ccc(F)cc1O 903406597 JZMIYCNIWHVLJF-TVQRCGJNSA-N 253.317 2.343 10 20 CECD COc1cccc(CN(CCN)Cc2ccccc2)c1O 220351972 QRNAZSXBVWDWBE-UHFFFAOYSA-N 286.375 2.362 10 20 CECD COC[C@@H](CN[C@@H](C)c1ccc(C)cc1O)OC 230672245 WHVWBJBMGHMEKN-NWDGAFQWSA-N 253.342 2.013 10 20 CECD CCN1CCC(NCc2ccc3c(c2)CCO3)CC1 38051771 ATICQWCCPMAHBG-UHFFFAOYSA-N 260.381 2.195 10 20 CECD CC[C@H](NCCCCS(C)(=O)=O)c1ccccc1O 692842332 NNLSBBDMBVDXCF-ZDUSSCGKSA-N 285.409 2.258 10 20 CECD CCOc1cccc(CNCc2nn(C)cc2Cl)c1O 393323219 RBEGAABWGCMYOT-UHFFFAOYSA-N 295.770 2.468 10 20 CECD C[C@@H](NC(=O)c1cnn2c1CCC2)c1ccccc1O 827952384 QOOITRULGFCBBF-SNVBAGLBSA-N 271.320 2.026 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCCCNC2=O)cc1 36976605 NVPOBXIHFFCKMB-INIZCTEOSA-N 289.423 2.291 10 20 CECD CNC(=O)[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 125075978 VOQVACIDKHHYNO-SNVBAGLBSA-N 282.771 2.004 10 20 CECD COC(=O)CN(Cc1ccco1)Cc1ccccc1O 72952715 YGSHADUDWPRLNR-UHFFFAOYSA-N 275.304 2.160 10 20 CECD C[C@@H](NCCCOCCO)c1cc(Cl)ccc1O 186513888 HDQUITMSZLWVKY-SNVBAGLBSA-N 273.760 2.095 10 20 CECD Cc1noc(C)c1[C@H](C)CNC(=O)c1cccc(O)c1O 185881780 NYBSOWSSWJPEMW-MRVPVSSYSA-N 290.319 2.236 10 20 CECD CC(=O)Nc1ccc(CC(=O)Nc2ccc(N)cc2)cc1 236789875 JVVHSQIXOVAVOW-UHFFFAOYSA-N 283.331 2.408 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)NCCCN)c2C)c1 237730561 CHCCAUKTFRFOOE-UHFFFAOYSA-N 285.391 2.481 10 20 CECD O=C1COc2ccc(CNCc3ccccc3O)cc2N1 231644815 ZWUUVMLAGKWBLB-UHFFFAOYSA-N 284.315 2.013 10 20 CECD O=C(C1CC1)N(Cc1ccccc1O)C[C@H]1CCCO1 248072963 YOUPIBLXOFHQAX-CQSZACIVSA-N 275.348 2.310 10 20 CECD CC(C)[C@@H](O)C1(CNCc2cc([N+](=O)[O-])ccc2O)CC1 271921562 CCAHBRNYAMINOO-CQSZACIVSA-N 294.351 2.187 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1cccc(F)c1O 272367510 GLTRFSBKDJIEFE-AWEZNQCLSA-N 266.316 2.152 10 20 CECD CC(C)ONC(=O)NCc1ccc(N2CC=CC2)cc1 296453551 PDRVOFJROWNEMP-UHFFFAOYSA-N 275.352 2.202 10 20 CECD CC(=O)C(=O)COC(=O)c1cc2c(s1)CCCCC2 808484987 JIIVTRFRXNTWOL-UHFFFAOYSA-N 280.345 2.332 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCSC1 813513366 LTIFCJDSEZCXGQ-JQWIXIFHSA-N 295.404 2.288 10 20 CECD C[C@H](N[C@@H]1CCCC[C@H]1CN)c1cc([N+](=O)[O-])ccc1O 817959844 JREXJMCJCDWLFS-COPLHBTASA-N 293.367 2.469 10 20 CECD COc1cccnc1NC(=O)c1cc(O)cs1 732281505 MMVGIMOWYDHXOQ-UHFFFAOYSA-N 250.279 2.110 10 20 CECD Cc1cnc([C@@H](C)CNC(=O)Cc2ccc(N)cc2)s1 832032343 MWBWSOZZNJBYBB-JTQLQIEISA-N 289.404 2.496 10 20 CECD CN(CCCCNCc1cc2c(cc1O)OCO2)C1CC1 835061526 HZBCGCBMUDHXCI-UHFFFAOYSA-N 292.379 2.085 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@]1(C(=O)O)CC=CCC1 846706063 LRTSZZPNZKDNSS-INIZCTEOSA-N 289.331 2.162 10 20 CECD O=C(NCC[C@@H]1C[C@H]2C=C[C@H]1C2)c1cccc(O)c1O 848292691 OZJDGFYXZXYEBA-SDDRHHMPSA-N 273.332 2.430 10 20 CECD CCOc1ccc(O)c(CNCCCNC2CC2)c1 841091996 JDENZNDUTHLZLA-UHFFFAOYSA-N 264.369 2.023 10 20 CECD C[C@@H]1C[C@H](N)CCN1Cc1cc(Cl)cc(F)c1O 846705374 ZEUXJMNSINYTDW-LDYMZIIASA-N 272.751 2.496 10 20 CECD C[C@@]1(C(=O)O)CCN(Cc2c(O)ccc(Cl)c2F)C1 840998808 SMPWAWVKDAMYEU-CYBMUJFWSA-N 287.718 2.481 10 20 CECD NC[C@@H]1CC[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 841084948 QTDLUFHCWMKKCP-KCJUWKMLSA-N 299.758 2.171 10 20 CECD C[C@@H](COCC1CC1)NCc1cc([N+](=O)[O-])ccc1O 846073777 ROVOGEPJOHCOCZ-JTQLQIEISA-N 280.324 2.205 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CC12CCNCC2 841079328 MJFVWNFRAYEDFW-INIZCTEOSA-N 273.424 2.293 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H](OCCO)C1 840917100 FFTHZALNLPNPBG-KRWDZBQOSA-N 292.423 2.034 10 20 CECD C[C@H](NC(=O)N(C)[C@H](C)CCO)c1ccc(N(C)C)cc1 845123721 DFMXDMMJRVPKGH-OLZOCXBDSA-N 293.411 2.226 10 20 CECD CCOc1ccc(CN2C[C@H](C)OC[C@H]2C)c(O)c1 768537649 RIQGHVZKIQCGOW-NEPJUHHUSA-N 265.353 2.400 10 20 CECD C[C@H](NC(=O)CCc1cn[nH]c1)c1ccc(N(C)C)cc1 863906780 WNCDIXWUHWGEQW-LBPRGKRZSA-N 286.379 2.286 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccsn1 935945726 INKKMVCVMQFHMU-UHFFFAOYSA-N 283.349 2.264 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCN(C2CC2)C1 766030738 WYOLXCACJCDZOF-HNNXBMFYSA-N 273.424 2.387 10 20 CECD Cc1nn(C)c(C)c1CCC(=O)N(C)c1ccc(N)cc1 877077357 FIKGRMPESZAGQF-UHFFFAOYSA-N 286.379 2.215 10 20 CECD Cc1cc(O)c(CNCc2ncc[nH]2)cc1Cl 877674414 VOLRJKHYFLZDPQ-UHFFFAOYSA-N 251.717 2.367 10 20 CECD COc1cc(OC)nc(NCc2ccc(N(C)C)cc2)n1 772955040 BAWHBJCWIQABFL-UHFFFAOYSA-N 288.351 2.172 10 20 CECD CC(C)Cn1ccc(C(=O)N(C)c2ccc(N)cc2)n1 884441198 BWMYLBBXKSYBIY-UHFFFAOYSA-N 272.352 2.398 10 20 CECD O=C(Nc1cc(-c2cccnc2)[nH]n1)c1cc(O)cs1 1123999752 CHUCKGAYZKGPGX-UHFFFAOYSA-N 286.316 2.491 10 20 CECD Cc1cc(C)c(C(=O)OCC(=O)c2ccc(O)c(O)c2)o1 783996417 BIPDSFMFWSMLEG-UHFFFAOYSA-N 290.271 2.347 10 20 CECD CC[C@@H](NC(=O)c1cc(O)cs1)c1ncc[nH]1 781990863 KUHGKPLGANKYIZ-MRVPVSSYSA-N 251.311 2.058 10 20 CECD COc1ccc(N2CCN(C(=O)[C@H](F)C(C)C)CC2)cc1 784018385 WNRKEOWKBDYJMI-OAHLLOKOSA-N 294.370 2.338 10 20 CECD Oc1c(Cl)cccc1CN1C[C@H]2CC[C@@H](O)[C@H]2C1 895781436 SOEMYOMNEPVXJK-SUZMYJTESA-N 267.756 2.248 10 20 CECD Oc1c(F)cc(F)cc1CN1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 894904435 OSMWKPTTYKVSJH-HBJVGIJOSA-N 279.286 2.056 10 20 CECD CCN(CC(=O)N(C)C)Cc1c(O)ccc(Cl)c1F 792163367 XHFFTGISWHYABD-UHFFFAOYSA-N 288.750 2.095 10 20 CECD CCN(CC)c1ccc(CNC(=O)COC(F)F)cc1 795346840 YNFFOUZLFNEJEJ-UHFFFAOYSA-N 286.322 2.388 10 20 CECD CCC[C@H](O)CNCc1c(O)cccc1Br 706875337 VKFPIMKIACOROG-VIFPVBQESA-N 288.185 2.405 10 20 CECD COc1ccc(CN[C@H]2C[C@H](C)O[C@H](C)C2)c(O)c1 694811062 XVZHORCNWUXILT-PTEHBNRSSA-N 265.353 2.446 10 20 CECD Cc1ccc([C@H](C)NCC(=O)NCC(C)C)c(O)c1C 1254730559 VZJDAOYQALWBKL-ZDUSSCGKSA-N 278.396 2.432 10 20 CECD CCO[C@H]1CCCN(Cc2c(O)cccc2OC)C1 771935086 KTWSIRJLSPGUBZ-LBPRGKRZSA-N 265.353 2.402 10 20 CECD O=C1CCCCC[C@@H](C(=O)NCc2cccc(O)c2O)C1 1263894430 GLWFJGQOHSGATF-LLVKDONJSA-N 291.347 2.254 10 20 CECD COC(=O)c1cnc(SC[C@@H]2CCCOC2)s1 829680554 AWNJHDIBIPIFTL-MRVPVSSYSA-N 273.379 2.448 10 20 CECD CCCN1CCC(NCc2cccc(OC)c2O)CC1 20189709 FWUHMAXCYWZPHL-UHFFFAOYSA-N 278.396 2.365 10 20 CECD C[C@@H](Nc1cnc(C(=O)O)cn1)c1ccc(N(C)C)cc1 1776456506 DZOJIZWVCSQEFW-SNVBAGLBSA-N 286.335 2.414 10 20 CECD CC(C)C[C@H](N)CC(=O)N(C)Cc1ccccc1O 1263074262 CHTINPRKWPPUKI-ZDUSSCGKSA-N 264.369 2.114 10 20 CECD CCOc1cccc(CN2CCC[C@@H](CNC)C2)c1O 40592629 FQWKBZRWVNTQOB-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cnc(C)cn2)c1 61320125 ZSIUWJOSPBYAKE-LLVKDONJSA-N 273.336 2.350 10 20 CECD CC(C)N1CC[C@@H](N[C@H](C)c2ccc(F)cc2O)C1=O 186047904 XHZZLJZVJIJIFI-ZWNOBZJWSA-N 280.343 2.191 10 20 CECD CC[C@@H](COC)NCc1ccc(N2CCOCC2)cc1 79737181 OVESWIIWKJWISV-HNNXBMFYSA-N 278.396 2.038 10 20 CECD CN(C)CC(C)(C)CNCc1cc(F)cc(F)c1O 708516489 IVJCGBMKGZLYDF-UHFFFAOYSA-N 272.339 2.348 10 20 CECD CCCN1CC[C@H](NCc2ccc3c(c2)CCO3)C1 389412727 SLLWGCWPKBQZCA-HNNXBMFYSA-N 260.381 2.195 10 20 CECD CCOc1cccc(CN[C@H](CC)CCO)c1O 134986468 BFVOURQGHWAGOF-GFCCVEGCSA-N 253.342 2.042 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCOC2)c1 103528317 LWIIIAICJUYIMM-GHMZBOCLSA-N 279.336 2.005 10 20 CECD O=C(NCc1ccccc1O)c1cc(=O)c2ccccc2o1 319145064 GJSVRVRPBNQTMW-UHFFFAOYSA-N 295.294 2.429 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](CCO)C2)c1O 79436158 GHOHVALJQCCHRI-LBPRGKRZSA-N 295.354 2.328 10 20 CECD C[C@@H](NCCCOC[C@H]1CCOC1)c1ccccc1O 183525367 YSWSEWDWNTZPGL-ZIAGYGMSSA-N 279.380 2.486 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](CCO)CSC)c1 185530351 BIRAITGTEBUKGF-WDEREUQCSA-N 285.409 2.165 10 20 CECD COC[C@H](NCc1ccc(N2CCOCC2)cc1)C(C)C 86697470 KEWXZRDKSKTRCU-KRWDZBQOSA-N 292.423 2.284 10 20 CECD C[C@@H](O)CN1CCCc2cc(OC(F)F)ccc21 192752580 OBFDUFXXWRFZTF-SECBINFHSA-N 257.280 2.421 10 20 CECD COCCCN(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 92537090 GCURIBSPTUHRPH-UHFFFAOYSA-N 288.731 2.422 10 20 CECD O=C(Cc1ccccc1F)NCCc1ccc(O)c(O)c1 98074686 UDKWZBXGCKOOBS-UHFFFAOYSA-N 289.306 2.138 10 20 CECD CC[C@@H](NCc1cnnn1CC)c1ccc(F)cc1O 527915754 MSBLNYNGEXADCH-CYBMUJFWSA-N 278.331 2.384 10 20 CECD Cn1ncc(C(=O)Nc2ccc(N)cc2)c1C1CC1 269139164 UEHPSUBQEGQVHX-UHFFFAOYSA-N 256.309 2.132 10 20 CECD C[C@@H](NCC1(O)CCN(C)CC1)c1cc(Cl)ccc1O 273366803 BQNBIZULXPOOGV-LLVKDONJSA-N 298.814 2.153 10 20 CECD Cn1cc(C[C@H]2CCN(Cc3cc(F)ccc3O)C2)cn1 376534868 IQPNZIIKLHBNCH-GFCCVEGCSA-N 289.354 2.329 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@]2(C)CCOC2=O)c1O 289580002 OZZDKJVNHUNMLC-AWEZNQCLSA-N 297.738 2.043 10 20 CECD CCSCCCNC(=O)NCc1ccccc1O 282743661 FQLMHOWEIOPRKX-UHFFFAOYSA-N 268.382 2.335 10 20 CECD CCn1c(SCC(=O)C(C)=O)nnc1-c1ccccc1 288287494 BMRDQHFFQTWPBQ-UHFFFAOYSA-N 289.360 2.215 10 20 CECD CN(C)[C@]1(CN[C@H]2CCc3cccc(O)c32)CCSC1 297507168 CIXRNGJQIVTLAC-BBRMVZONSA-N 292.448 2.406 10 20 CECD NC(=O)C1(CN[C@H]2CCc3cccc(O)c32)CCCC1 297651865 KFWKSASYKRPRHY-LBPRGKRZSA-N 274.364 2.015 10 20 CECD C[C@H]1NCCC[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 290435796 VICBJQMRMKFCEK-CZUORRHYSA-N 289.423 2.099 10 20 CECD CCN(CC)c1ccc(CNC[C@H](O)CSC)cc1 818965034 ODNDLIYPANDELL-HNNXBMFYSA-N 282.453 2.346 10 20 CECD Cc1c(C)n(C)c2ccc(OC(=O)CC3OCCO3)cc12 817761775 OYUYMVRVYHGURV-UHFFFAOYSA-N 289.331 2.464 10 20 CECD C[C@@H](C(=O)N[C@H](C)c1ccccc1O)N1CCSCC1 827941867 ZBDUWSDYOOCPSZ-NEPJUHHUSA-N 294.420 2.007 10 20 CECD CC[C@@H]1C[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 824783083 CVVWEPQHBLJDMY-ZJUUUORDSA-N 250.298 2.436 10 20 CECD CC/C=C/CNCc1ccc(N2CCN(C)CC2)cc1 824701980 FMVXXJNGHSOYJQ-SNAWJCMRSA-N 273.424 2.494 10 20 CECD C[C@H](N)C[C@@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 902519210 XYWGMOCLUSVOQX-VBQJREDUSA-N 292.471 2.071 10 20 CECD NCC[C@@H](NCc1ccc2c(c1)CCCO2)C(F)F 904355468 RZRSZDPOAQWVBH-GFCCVEGCSA-N 270.323 2.084 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2CC[C@@H](C)O2)c1 834915809 UEBNZWONGJISKD-NTZNESFSSA-N 293.363 2.397 10 20 CECD Cn1c(=NC(=O)Cc2ccc(N)cc2)sc2ccccc21 746407424 PONFKNDCFJPOQI-UHFFFAOYSA-N 297.383 2.492 10 20 CECD CN[C@@H]1CCN(Cc2cc(C)cc(Br)c2O)C1 843045823 XISQREZZKSUCAM-LLVKDONJSA-N 299.212 2.257 10 20 CECD C[C@@H](CC(=O)NCc1ccc(O)cc1O)c1ccncc1 910944041 QJYNNRYIBNDUCQ-NSHDSACASA-N 286.331 2.303 10 20 CECD O=C(NCc1ccccc1O)Nc1ccc2c(c1)OCO2 748325731 UVLMJDQWVVORBY-UHFFFAOYSA-N 286.287 2.443 10 20 CECD CC[C@@H](CCO)NCc1ccc(N(C)C)cc1C 840933235 FXXCGIVLEFERDH-AWEZNQCLSA-N 250.386 2.312 10 20 CECD CC(C)CNC(=O)[C@@H](C)N1CCCc2cc(CN)ccc21 843350212 PLXJGLXOPIDQST-CYBMUJFWSA-N 289.423 2.059 10 20 CECD C[C@H](O)CN(Cc1cccc(Cl)c1O)C1CC1 848928969 QNLSPRNSRGQDOT-VIFPVBQESA-N 255.745 2.391 10 20 CECD CC(C)NC(=O)[C@H](C)NCc1cc(Cl)c(F)cc1O 840974629 LTZZOUNMOROADN-QMMMGPOBSA-N 288.750 2.187 10 20 CECD CCCN1CC(=O)N[C@@H]1c1cc(Cl)c(F)cc1O 840826298 KIDHCZZAQNQFPA-LBPRGKRZSA-N 272.707 2.025 10 20 CECD COCCOCCN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756462679 YPCKEVUJOZSPIO-CMPLNLGQSA-N 283.343 2.332 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@H](C)c1cc(F)cc(F)c1O 756742352 KYKKMGDOHDIDQU-IXGDSRDXSA-N 291.363 2.478 10 20 CECD COC(=O)c1cc(CNCc2cc(C)ccc2O)cn1C 858240009 YTCHDJWVNKFDBH-UHFFFAOYSA-N 288.347 2.116 10 20 CECD CC(=O)c1cc(F)cc(CN(C)Cc2cnc[nH]2)c1O 852287345 VBHOSNLSHVIREA-UHFFFAOYSA-N 277.299 2.089 10 20 CECD C[C@H](NC/C=C\CO)c1cc(Br)ccc1O 850507859 IJRGBSFOLWUEFH-XADBCAIWSA-N 286.169 2.354 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@](C)(O)C2CC2)c1 756767597 VFNMRFMZDITSMP-QFYYESIMSA-N 293.363 2.129 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(C(C)C)COC1 935943806 FJKGTAXUOIFBPZ-UHFFFAOYSA-N 298.379 2.167 10 20 CECD Cc1cccc(CN2CC[C@H](C(=O)O)[C@H](C)C2)c1O 863738378 AFVNTCHWLMXPKR-YPMHNXCESA-N 263.337 2.243 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H]3CC[C@H](C2)N3)c1O 866681252 YHCBIBMBMDESLG-BETUJISGSA-N 294.782 2.184 10 20 CECD C[C@@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)[C@@H](C)O1 875988840 NJXCBGALKNWOCR-NQBHXWOUSA-N 278.352 2.100 10 20 CECD COCCN(CCOC)Cc1cc(Cl)cc(F)c1O 775638236 DMRGTMTXTJXEJE-UHFFFAOYSA-N 291.750 2.280 10 20 CECD Cc1ccc(CNCc2nnc3n2CCCCC3)c(O)c1 876883399 AQXRDRWJSMOOMH-UHFFFAOYSA-N 286.379 2.308 10 20 CECD CC(C)(C)OCCn1cc(COc2ccc(N)cc2)nn1 881275686 IXZYNIQYSXHNPR-UHFFFAOYSA-N 290.367 2.254 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(C)cc(C)c2O)[C@H]1C 787247284 SOBTUBHZQVQKGT-JSGCOSHPSA-N 277.364 2.392 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCC(=O)c2cccn21 789982112 IGALAKHBNVXOIX-AWEZNQCLSA-N 298.342 2.370 10 20 CECD COc1cc(C)cc(CN[C@@H](C)c2cnn(C)c2)c1O 894295468 ZNEDTJPYPOYNOC-NSHDSACASA-N 275.352 2.294 10 20 CECD COc1ccc(CNC(C)(C)C(=O)N2CCCC2)cc1C 793394568 DXOAVDUAWKQBLN-UHFFFAOYSA-N 290.407 2.494 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@@H]1F 1143437049 AEZXWZVKOWKSEZ-KBPBESRZSA-N 264.344 2.459 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)c2noc(C)n2)c1O 1323795835 BDUWOGTZDOKSPZ-SSDOTTSWSA-N 293.298 2.276 10 20 CECD COc1cccc(CN[C@H]2C[C@H](C)O[C@H](C)C2)c1O 694807414 JCHOIVCGEIQKMH-PTEHBNRSSA-N 265.353 2.446 10 20 CECD C[C@@H]1CN(Cc2ccc(N)cc2)CCN1CC(F)(F)F 1334774829 PUMXRABAPNETSG-LLVKDONJSA-N 287.329 2.337 10 20 CECD COC[C@H]1CCCCN(C(=O)NCc2ccc(N)cc2)C1 1335726677 VLURWMRHFSOVOE-AWEZNQCLSA-N 291.395 2.227 10 20 CECD C[C@H]1C[C@H]1C(=O)CSc1ncc(C(=O)O)s1 1604682081 PIKPJEPXSSVACL-NTSWFWBYSA-N 257.336 2.159 10 20 CECD Cc1cc(CN[C@@](C)(C(=O)O)C2CC2)ccc1N(C)C 1610460049 SSJAKBOHTMFVOZ-MRXNPFEDSA-N 276.380 2.404 10 20 CECD C[C@@H]1OC[C@]2(CC[C@H](CNCc3ccc(N)cc3)O2)[C@H]1C 1576902585 BEYVPMIQEIMCOR-WRFANHODSA-N 290.407 2.331 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CCCC(=O)O 1594311835 OVFWLAURUPLQNT-UHFFFAOYSA-N 264.369 2.358 10 20 CECD COC(=O)CN1CCCc2cc(OC(F)F)ccc21 159563613 LDEOSRUUERGYQW-UHFFFAOYSA-N 271.263 2.214 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@]1(C)CC1(F)F 817546060 BVDZNAASQHJSSN-LBPRGKRZSA-N 255.264 2.396 10 20 CECD C[C@@H]1CCCN(Cc2cc(F)ccc2O)[C@@H]1CN 220222014 WACQIORMFRQBBX-ZWNOBZJWSA-N 252.333 2.091 10 20 CECD Cc1ccc(C)c(S(=O)(=O)NCc2ccccc2O)c1 158586502 FVROOFCGVNLYBL-UHFFFAOYSA-N 291.372 2.488 10 20 CECD c1cc2c(cc1CNC1CCN(C3CC3)CC1)CCO2 37363538 CDVDQJKLSZWVMH-UHFFFAOYSA-N 272.392 2.338 10 20 CECD CCC[C@@]1(NCc2cccc(OC)c2O)CCOC1 285429774 HIAKHWPWIRDNGV-OAHLLOKOSA-N 265.353 2.450 10 20 CECD CCC[C@@H](CNCc1cccc(OC)c1O)OC 293537171 AHTNWNXEWFMXTG-LBPRGKRZSA-N 253.342 2.306 10 20 CECD CCc1cccc(CN[C@H]2CCN(C(C)C)C2=O)c1O 708695495 PAZQTHUCJJKUAD-AWEZNQCLSA-N 276.380 2.054 10 20 CECD C[C@H](N[C@@H](CO)CC(F)(F)F)c1ccccc1O 717816832 BKWWDRVYHNGXAW-DTWKUNHWSA-N 263.259 2.356 10 20 CECD CN(C)[C@@H](CCNCc1ccc(N)cc1)C(F)(F)F 1578406502 UOXHQFDMHJVYGS-LBPRGKRZSA-N 275.318 2.241 10 20 CECD CCN1CCC(N(C)Cc2cc3c(cc2O)OCO3)CC1 106141055 CYSUQHOCNDKQBI-UHFFFAOYSA-N 292.379 2.037 10 20 CECD CC1CCN(C(=O)CSc2nccs2)CC1 60740607 JUWAALSHRXYPOG-UHFFFAOYSA-N 256.396 2.494 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CC2(O)CCCC2)c1O 124243794 MTENDANSCNMSDJ-UHFFFAOYSA-N 295.354 2.471 10 20 CECD CCOc1ccc(C(=O)NCc2ccc(N(C)C)cc2)cn1 39264253 YXCCSWJLDGHXRN-UHFFFAOYSA-N 299.374 2.476 10 20 CECD CCOc1ccc(O)c(CNC[C@H]2CC[C@@H](O)C2)c1 188828764 NUQQIBWYSALXNZ-WCQYABFASA-N 265.353 2.042 10 20 CECD CC[C@@H](CSC)N(C)C(=O)c1cccc(O)c1O 126523145 BQNPDQPLCCDSCI-VIFPVBQESA-N 269.366 2.311 10 20 CECD CN(Cc1ccc(N(C)C)nc1)Cc1ccccc1O 120070092 XTCFTZIYXBJAFA-UHFFFAOYSA-N 271.364 2.485 10 20 CECD COc1ccc(N2CCN(C[C@@H]3CC[C@@H](C)O3)CC2)cc1 188535320 NOIMNTOFLLAMJY-PBHICJAKSA-N 290.407 2.385 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCCCO2)c1 42814608 OMIOBCDNGYYNRB-ZDUSSCGKSA-N 251.326 2.060 10 20 CECD NC1(CC(=O)NCCCSc2nccs2)CCC1 237811052 RRQBWTOYGNPPEL-UHFFFAOYSA-N 285.438 2.013 10 20 CECD COc1ccc(N2CCCN(C[C@H]3CCCO3)CC2)cc1 249708945 CJUQKUWABPMGMI-QGZVFWFLSA-N 290.407 2.386 10 20 CECD CCOc1ccc(O)c(CNC[C@@](C)(O)c2ccco2)c1 266165105 PBWVOMOAGWKXFB-MRXNPFEDSA-N 291.347 2.381 10 20 CECD CCN(CC)CCSCC(=O)NCc1ccccc1O 269104085 ABFSYDHHMDFKMN-UHFFFAOYSA-N 296.436 2.083 10 20 CECD CCN(CCC1OCCO1)c1ccc(OC)c(OC)c1 274483419 QTHFRHYHBJWOSS-UHFFFAOYSA-N 281.352 2.293 10 20 CECD C[C@H]1CCCN(c2ccc(CNC(=O)CO)cc2Cl)C1 282396939 ZSTOXSNIBOJDPC-NSHDSACASA-N 296.798 2.185 10 20 CECD C[C@@H](NC(=O)COC(F)F)c1ccc(N(C)C)cc1 803119988 DCFISRYCRCNBBP-SECBINFHSA-N 272.295 2.169 10 20 CECD O=C1CC(C(=O)NCc2cc(Cl)cc(Cl)c2O)C1 807837809 CQBSFHLSPOYBLO-UHFFFAOYSA-N 288.130 2.294 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCCCOCCO)c1O 808714087 SGCRWDSSIXZERA-LLVKDONJSA-N 287.787 2.404 10 20 CECD CO[C@@]1(CNCc2cc(Cl)c(F)cc2O)CCOC1 816570594 ZQHQTDGKGDVOMB-CYBMUJFWSA-N 289.734 2.080 10 20 CECD C[C@@H](CN)CN[C@H](C)c1ccc(Br)cc1O 817963017 QFUTXYMEFYOXBG-DTWKUNHWSA-N 287.201 2.400 10 20 CECD CC(C)OC(=O)[C@H](C)NCc1cc(Cl)ccc1O 825117526 GLZUUTCMTXEVHB-VIFPVBQESA-N 271.744 2.475 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCCCN)cc1 827340794 LEOQFSYYAQDKTB-UHFFFAOYSA-N 277.412 2.278 10 20 CECD C[C@@H](NC(=O)C1CCN(C2CC2)CC1)c1ccccc1O 827946558 LXTHGFIUTGRIJR-GFCCVEGCSA-N 288.391 2.444 10 20 CECD COC(=O)c1cnc(SCc2nnc(C3CC3)o2)s1 829683981 FKACSOPNKLEGNK-UHFFFAOYSA-N 297.361 2.482 10 20 CECD O=C(O)[C@@H]1CCCCN1Cc1cccc(Cl)c1O 821510194 CNXHGEWGIFDZML-NSHDSACASA-N 269.728 2.485 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@H](C)c1ccccc1O 903343202 NMUCIGPNYHIDTD-KGLIPLIRSA-N 278.396 2.154 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)C2CCC2)c(O)c1 837592065 JOFXLHBPMIHIJO-JTQLQIEISA-N 263.337 2.453 10 20 CECD Cc1cc(C2CCN(C(=O)Cc3ccc(N)cc3)CC2)n[nH]1 832140762 SHWLKFCXXZOMHH-UHFFFAOYSA-N 298.390 2.249 10 20 CECD COc1cccc(O)c1CN[C@H]1C[C@@H](OC(C)C)C1 839147051 CBXATOPBUPBKFO-TXEJJXNPSA-N 265.353 2.446 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=N)NC(C)C)C2)cc1 849044096 SZMKNOXITGXAHF-ZDUSSCGKSA-N 290.411 2.044 10 20 CECD C[C@H](Cc1ccncc1)NCc1cc2c(cc1O)OCO2 749294321 GIZOZBAVDJLIFM-LLVKDONJSA-N 286.331 2.237 10 20 CECD C[C@H]1CN=C(NCc2cc(Cl)cc(Cl)c2O)N1 849028162 DAXHSSZLNQDYQF-LURJTMIESA-N 274.151 2.136 10 20 CECD CO[C@@H]1[C@H](C)[C@@H](NC(=O)Nc2ccc(N)cc2)C1(C)C 841296840 ZTORSGNBAVXYGX-OASPWFOLSA-N 277.368 2.450 10 20 CECD Cc1cc(N(C)C)ccc1CNCCc1cnn(C)c1 840930177 SDHUSTHEPSAPOM-UHFFFAOYSA-N 272.396 2.127 10 20 CECD C[C@H](Cc1ccncc1)NC(=O)c1cc(O)cs1 749543277 DNMSUCCBRPKFNG-SECBINFHSA-N 262.334 2.210 10 20 CECD CN(C)c1ccc(CNC(=O)c2c(C3CC3)cnn2C)cc1 854271430 GVJJGTIQMVTORB-UHFFFAOYSA-N 298.390 2.294 10 20 CECD COC(=O)c1cnc(SC[C@H](O)c2ccccn2)s1 853064763 PYUWCMLOYZELJF-VIFPVBQESA-N 296.373 2.150 10 20 CECD C[C@@H](NCC1(CO)CC1)c1cc(F)cc(F)c1O 756638104 RRLLIWLUAKOORQ-MRVPVSSYSA-N 257.280 2.094 10 20 CECD OC[C@H](CN[C@H]1CCc2cccc(O)c21)CC1CC1 850546421 ZPSCJIIKKAXUTB-JSGCOSHPSA-N 261.365 2.378 10 20 CECD C[C@@H](NC(=O)NOC/C=C\Cl)c1ccccc1O 868633188 YPWVJONGEIBGFJ-WQAKUFEDSA-N 270.716 2.437 10 20 CECD C[S@](=O)Cc1noc(-c2ccc(-n3cccc3)cc2)n1 762118763 FZVOCEPVHBVFSJ-FQEVSTJZSA-N 287.344 2.406 10 20 CECD CNC(=O)[C@H]1CCC[C@@H]1NCc1cc(C)c(C)cc1O 765796070 MLZXRRWJIJIUKC-KBPBESRZSA-N 276.380 2.013 10 20 CECD Cc1ncc(/C=C/C(=O)N2CCc3ncccc32)s1 770219097 FLUZDDXSONVENX-SNAWJCMRSA-N 271.345 2.449 10 20 CECD CCOc1ccc(CN[C@H](CO)C(C)(C)C)c(O)c1 775058954 FOTDUFSNJLOHFO-CQSZACIVSA-N 267.369 2.288 10 20 CECD CC(=O)NC[C@H]1CCCCN1Cc1cc(C)c(C)cc1O 877673312 DGKVXBJIXKSXJZ-MRXNPFEDSA-N 290.407 2.500 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CCC[C@H]1OC 774828517 CQLDPMDJIWFPLN-SMDDNHRTSA-N 265.353 2.306 10 20 CECD C[C@H](NC(=O)c1cnsn1)c1ccc(N(C)C)cc1 773016394 CNNHZARNIJWCNL-VIFPVBQESA-N 276.365 2.095 10 20 CECD C[C@@H](NCC(=O)N(C)C1CC1)c1ccc(N(C)C)cc1 775832341 ZGSCSSGRLWTPLJ-GFCCVEGCSA-N 275.396 2.024 10 20 CECD C[C@@H](COCC(F)(F)F)NCc1ccc(N)cc1 1120269230 OWAHGJDUGYCPDK-VIFPVBQESA-N 262.275 2.326 10 20 CECD C[C@H]1CCN(Cc2cc(F)cc(F)c2O)CC[S@]1=O 894567039 PHGVUGFMUGIYKP-ZRNGKTOUSA-N 289.347 2.013 10 20 CECD COc1ccc(CNC(=O)c2cc(C(C)C)on2)c(O)c1 794379419 NPOVDLZSHIUKDJ-UHFFFAOYSA-N 290.319 2.442 10 20 CECD COc1ccc(CNc2c(C)c(C)nc3ncnn23)c(O)c1 795285687 UPQLSLKTSJIPPG-UHFFFAOYSA-N 299.334 2.067 10 20 CECD Cn1cnc(CNCc2cc(Cl)cc(Cl)c2O)n1 92851613 DRRRCWPUEZWCSX-UHFFFAOYSA-N 287.150 2.117 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc3c(cn2)OCCC3)c1 1329086738 NBRWFFZMYKBUTJ-UHFFFAOYSA-N 298.342 2.351 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@H](C)c1cc(F)ccc1O 188494583 VNCAPQCYUJVBIB-NXEZZACHSA-N 268.332 2.049 10 20 CECD CCN(C)c1ccc(CN2CC[C@](O)(C3CC3)C2)cc1 1324212543 DFTSBIVBJPDOFR-QGZVFWFLSA-N 274.408 2.490 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2ccc(F)cc2O)C1=O 722357599 PWGQWVONSXYCIG-GWCFXTLKSA-N 280.343 2.193 10 20 CECD COc1cccc(CN2CCO[C@H](C)[C@H]2C)c1O 93418395 VDUKULACYWXALT-GHMZBOCLSA-N 251.326 2.010 10 20 CECD CO[C@H]1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1516718591 AQVLVDGZQONWIV-WFASDCNBSA-N 294.370 2.323 10 20 CECD COc1cccc(CNC(C)(C)CCC(=O)O)c1O 1607323171 AEBDJVYDPXDMKS-UHFFFAOYSA-N 267.325 2.134 10 20 CECD CN(CCCCC(=O)O)c1ccc2c(c1)OCO2 258819140 GBBSIYXBLNDTRU-UHFFFAOYSA-N 251.282 2.106 10 20 CECD COc1nscc1NC(=O)NCCc1ccc(N)cc1 1579330061 WLBTXEJZKUFTKV-UHFFFAOYSA-N 292.364 2.098 10 20 CECD Nc1ccc(CCNC(=O)Nc2cnc3ccccn23)cc1 1580443576 QSFWELIUHOSSPL-UHFFFAOYSA-N 295.346 2.281 10 20 CECD CCCC[C@H](NCc1cc(F)ccc1O)C(=O)O 1595638553 WZNQIRKVAWHDEO-NSHDSACASA-N 255.289 2.264 10 20 CECD O=C1NC(=S)S/C1=C\c1ccc(F)c(C(=O)O)c1 1777698857 CXRFWKQRADSIAX-YWEYNIOJSA-N 283.305 2.013 10 20 CECD CN(Cc1ccccn1)c1ccc(OCC(=O)O)cc1 1777077166 LJOKWJONOSCKFN-UHFFFAOYSA-N 272.304 2.181 10 20 CECD CCOCc1cc(CNC[C@H](C)C(=O)O)ccc1OC 1776909152 SSEDMNPOAZALAX-NSHDSACASA-N 281.352 2.042 10 20 CECD COc1ccc(O)c(CN[C@H]2CCN3CCC[C@@H]3C2)c1 128094210 KPYGUAVDDCEKSU-UONOGXRCSA-N 276.380 2.117 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1ccc(F)cc1F 33617133 JLOCDVFWZMJBEY-UHFFFAOYSA-N 285.271 2.471 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@@H](C)C(=O)N(C)C 36794347 GVCYOPSCDPAFQH-WOPDTQHZSA-N 276.380 2.315 10 20 CECD CS(=O)(=O)c1ccccc1NCc1ccccc1O 37075868 OXVJIDVIJDYHTC-UHFFFAOYSA-N 277.345 2.408 10 20 CECD CC(=O)N1CCC(N[C@@H](C)c2ccc(C)cc2O)CC1 37138307 KWCMVNIZXIZGDJ-LBPRGKRZSA-N 276.380 2.362 10 20 CECD C[C@@H](NCc1cc(F)cc(F)c1O)[C@@H]1CCOC1 708438582 WURUMJUNYLBWJH-RKDXNWHRSA-N 257.280 2.185 10 20 CECD CC[C@@H](C)NC(=O)CN(C)c1ccc(OC)cc1OC 179005579 OOZCNCGLXZVECY-LLVKDONJSA-N 280.368 2.055 10 20 CECD Fc1cc(CNCc2cc[nH]c2)ccc1N1CCOCC1 175698998 RMKRIBOXGYDSOT-UHFFFAOYSA-N 289.354 2.280 10 20 CECD COc1ccc(O)c(CNC(=O)Cc2ccsc2)c1 114543222 DWCVNLBPOMSSPY-UHFFFAOYSA-N 277.345 2.321 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2cc(C)c(C)cc2O)C1 67382635 MZLZQJGBBDMULN-OAHLLOKOSA-N 290.407 2.357 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccc[n+]([O-])c1 66096753 GCSJNVBFFQOVDI-UHFFFAOYSA-N 286.331 2.078 10 20 CECD CCc1[nH]ncc1C(=O)NCc1ccc2c(c1)CCCN2C 60457211 TWSHFNZANNYHSY-UHFFFAOYSA-N 298.390 2.285 10 20 CECD CCCCc1cc(NC(=O)c2cccc(O)c2O)[nH]n1 187042219 ACOMUYHGODZFEN-UHFFFAOYSA-N 275.308 2.416 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CCOC2)c1 37738139 FYEHUCFLVKLYDN-QWRGUYRKSA-N 251.326 2.088 10 20 CECD C[C@H](O)c1ccc(CNC(=O)c2cccc(O)c2O)cc1 192989773 MCMAOCBREYWMNS-JTQLQIEISA-N 287.315 2.081 10 20 CECD O=C(NCc1ccccc1O)NC[C@H]1CSCCS1 267838194 KMSGZXKOQCNXQG-NSHDSACASA-N 298.433 2.040 10 20 CECD CO[C@@H](C(=O)N1CCOc2cc(N(C)C)ccc21)C(C)C 356049952 ZDVOLCGUDGESOQ-OAHLLOKOSA-N 292.379 2.149 10 20 CECD COc1ccnc(N(C)Cc2ccc(N(C)C)cc2)n1 266575255 PBTNZWHSDJPYAH-UHFFFAOYSA-N 272.352 2.188 10 20 CECD C[C@H](NC[C@@H](C)N(C)C)c1ccc(F)c(F)c1O 276969772 UBDMWVIXOLRKBY-BDAKNGLRSA-N 258.312 2.271 10 20 CECD C[C@@H](Cn1cncn1)N[C@H](C)c1ccc(F)c(F)c1O 276003711 AVQIDZKADIRSOF-DTWKUNHWSA-N 282.294 2.001 10 20 CECD O[C@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 271099462 OPQHTWZDDJWVML-INIZCTEOSA-N 260.381 2.244 10 20 CECD CCOc1ccc(O)c(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c1 271192910 MLPKOTCCMZCGIQ-ZBUHCNDUSA-N 297.420 2.132 10 20 CECD COC1(CC(=O)NCc2ccc(N(C)C)cc2)CCC1 276648828 OPIOMLWBQNOCAR-UHFFFAOYSA-N 276.380 2.328 10 20 CECD CCc1nn(C)c(N(C)Cc2ccccc2O)c1[N+](=O)[O-] 276291768 LYDSVSLEQURHBE-UHFFFAOYSA-N 290.323 2.233 10 20 CECD Cc1ccc(O)c(CN2CCC(NC(=O)C(C)C)CC2)c1 271063428 HSJNZLNIGBOAIS-UHFFFAOYSA-N 290.407 2.437 10 20 CECD C[C@]1(NCc2cc(Cl)cc(Cl)c2O)CCOC1=O 289421849 BMWCNLMOCDMRJZ-LBPRGKRZSA-N 290.146 2.494 10 20 CECD CC[C@H](NCCNC(=O)C1CC1)c1ccc(C)cc1O 280022411 HOKUEAVPTNJLSQ-AWEZNQCLSA-N 276.380 2.268 10 20 CECD CN(C)CCN(C(=O)/C=C/c1c[nH]cn1)c1ccccc1 283351018 COCLXGOTDBOJTA-CMDGGOBGSA-N 284.363 2.018 10 20 CECD CCC[C@@]1(NC(=O)c2ccc(C)c(O)c2O)CCOC1 287932388 QZRBASMTRGWTOJ-OAHLLOKOSA-N 279.336 2.095 10 20 CECD Oc1ccc(F)cc1CN[C@H]1COc2ccccc2[C@@H]1O 290270829 XVULRCQUPRLMSQ-BBRMVZONSA-N 289.306 2.116 10 20 CECD COc1cccc(O)c1CN1CCC2(CCO2)CC1 800538445 YHQDMGUJMYACAK-UHFFFAOYSA-N 263.337 2.156 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C(=O)CC1CC1 298267735 BVKWBERUJFOMOY-UHFFFAOYSA-N 288.391 2.282 10 20 CECD CC(=O)NCC[C@@H]1CCCN(Cc2cc(C)ccc2O)C1 809778156 LBFQDFFNHQNYHA-HNNXBMFYSA-N 290.407 2.439 10 20 CECD CN(CC(=O)NC1CC1)Cc1ccc2ccccc2c1O 816482595 LXCJFBGAXGNRTH-UHFFFAOYSA-N 284.359 2.256 10 20 CECD COC(=O)[C@](C)(NCc1ccc(N(C)C)c(C)c1)C1CC1 815080387 ATQWQTHJCPNUCV-QGZVFWFLSA-N 290.407 2.492 10 20 CECD COc1ccc(N2CCN([C@H]3CC[C@@H](OC)C3)CC2)cc1 821386703 MXPTUYABFQFZDN-DOTOQJQBSA-N 290.407 2.385 10 20 CECD C[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)c2nccn21 825017916 ZVHGVAUKFHEACN-JOYOIKCWSA-N 288.307 2.293 10 20 CECD Cc1cc(O)c(CN[C@H]2CC(=O)N(C3CC3)C2)cc1Cl 825429649 NTFRZCKLANHOHQ-NSHDSACASA-N 294.782 2.207 10 20 CECD COc1ccc(CN[C@@H](CC(F)F)C(=O)O)cc1C 901810761 BTSKVEPTOUDFAS-JTQLQIEISA-N 273.279 2.202 10 20 CECD O=C(NCCCSc1nccs1)NOCC1CC1 838609168 VCMHBQTYPWEELR-UHFFFAOYSA-N 287.410 2.266 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1cc(F)cc(C(C)=O)c1O 844838853 IBIGYQDPBGCIIJ-LBPRGKRZSA-N 283.299 2.029 10 20 CECD CS[C@@H](C)CC(=O)NC[C@H](N)c1ccc(N(C)C)cc1 844163326 YZIXQPUVHOVVDC-FZMZJTMJSA-N 295.452 2.010 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@@H](C)CCO 846111027 MBXRTAYWFQGFGZ-ZDUSSCGKSA-N 250.386 2.264 10 20 CECD CCN(CC)c1ccc(CN[C@H](CO)CCF)cc1F 846096636 JGRVFHVJPHPKLF-ZDUSSCGKSA-N 286.366 2.482 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1cc(CO)on1 924861984 NNMSORCKWIFOLC-SNVBAGLBSA-N 293.342 2.223 10 20 CECD COC(=O)c1cc(/C=C2/C(=O)Nc3ccccc32)c[nH]1 753135042 MUCOZLYAJCFZNM-IZZDOVSWSA-N 268.272 2.294 10 20 CECD Cc1ccncc1/C=C/C(=O)NCc1ccc(O)c(O)c1 752599644 IWSCBVSVKUZDAZ-HWKANZROSA-N 284.315 2.131 10 20 CECD CN(C)CCCC(C)(C)NC(=O)c1cc(O)cs1 854829389 FYJGKTXMDPFQQK-UHFFFAOYSA-N 270.398 2.304 10 20 CECD N[C@@]12CCC[C@@H]1CN(Cc1c(O)ccc(Cl)c1F)C2 857226148 FXGYTODPOUGUTD-YMTOWFKASA-N 284.762 2.498 10 20 CECD O=C(NCc1ccccc1O)c1cnn(C2CCC2)c1 934935930 PLUCQMVQDCRVDR-UHFFFAOYSA-N 271.320 2.244 10 20 CECD Cc1cc(O)c(CN2CCc3c[nH]nc3C2)cc1C 769469055 QVPGFDYYBSGLLC-UHFFFAOYSA-N 257.337 2.290 10 20 CECD CCOc1ccc(CN2CCN(C3CCC3)CC2)c(O)c1 769410401 CCNOZHYXYTYSEL-UHFFFAOYSA-N 290.407 2.461 10 20 CECD CCC(=O)N1CCCC[C@@H]1C(=O)N(C)c1ccc(N)cc1 877081121 VAWAUCDSUKKABH-CQSZACIVSA-N 289.379 2.023 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCCN1C)c1ccc(N(C)C)cc1 775402506 DUDLSUAQDJCDGF-CJNGLKHVSA-N 289.423 2.414 10 20 CECD COCC[C@]1(NCc2ccc(N(C)C)cc2)CCOC1 775032242 GRAIACUNXUDRRN-INIZCTEOSA-N 278.396 2.038 10 20 CECD Cc1cccc(O)c1CN1CCN(C(=O)C(C)(C)C)CC1 876566320 GILJSAACEZNZGE-UHFFFAOYSA-N 290.407 2.391 10 20 CECD COC(=O)[C@@H](COC(C)C)N(C)Cc1c(C)cccc1O 876810689 BYTOMLHQTXHIAJ-CQSZACIVSA-N 295.379 2.099 10 20 CECD Cc1ccc(CN2CCO[C@@H](COC(C)C)C2)c(O)c1 877402265 AWCSHTLJROJSHS-OAHLLOKOSA-N 279.380 2.326 10 20 CECD Cc1cc(Cn2cc(CC[C@H](C)O)nn2)ccc1N(C)C 881377657 RWVMBNQHYHWOGY-ZDUSSCGKSA-N 288.395 2.014 10 20 CECD C[C@H](NC(=O)Nc1ncccn1)c1ccc(N(C)C)cc1 888693071 RREGOWURNGIKGI-NSHDSACASA-N 285.351 2.425 10 20 CECD O=C(NCCOC1CCSCC1)c1cc(O)cs1 891224352 HVXZYKUBHFVDHB-UHFFFAOYSA-N 287.406 2.096 10 20 CECD C[C@H](NC(=O)NCCC[C@@H](C)O)c1ccc(N(C)C)cc1 789213625 REFGVMQHAAQYSO-OLZOCXBDSA-N 293.411 2.274 10 20 CECD CC[C@H]1CN(C)CCN1Cc1cc(F)cc(F)c1O 894865508 XOUFALZSVYYDOI-LBPRGKRZSA-N 270.323 2.196 10 20 CECD OCCN(Cc1cccnc1)Cc1cc(F)cc(F)c1O 894000731 ABXSLKBKHDXGKR-UHFFFAOYSA-N 294.301 2.060 10 20 CECD C[C@H](N[C@H](C)c1cc(F)cc(F)c1O)c1ncn(C)n1 783300784 XNMXFZGGWDMTSG-SFYZADRCSA-N 282.294 2.211 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCC(=O)[C@@H](C)C2)c(O)c1 794386778 AEOBCKZSPVEEEV-WDEREUQCSA-N 291.347 2.022 10 20 CECD Oc1cc2c(cc1CN[C@@H]1C[C@H]1C(F)(F)F)OCO2 865754683 ZKUHEOLAQIIYRO-HTQZYQBOSA-N 275.226 2.161 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)CCS(C)(=O)=O)c(O)c1 185791293 ZNTZQFOTXADCFR-RYUDHWBXSA-N 285.409 2.174 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@@H]2CCO)cc1 189948342 UXEKRKWETWBVGB-GDBMZVCRSA-N 262.397 2.393 10 20 CECD CN(Cc1ccccc1O)C(=S)NCC1CCC1 1322377469 RVUOGCLHNYNZTM-UHFFFAOYSA-N 264.394 2.499 10 20 CECD O=C(COC1CCCCC1)NCc1ccccc1O 748346456 XPTRIZYEPVRFEU-UHFFFAOYSA-N 263.337 2.358 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H]1COC(C)(C)O1 1336723796 YBUZDVFGWCOGMN-HNNXBMFYSA-N 278.396 2.302 10 20 CECD CN(Cc1ccccc1O)c1nnc(C(C)(C)F)n1C 1338515438 VRHZIVDNLDQVLU-UHFFFAOYSA-N 278.331 2.362 10 20 CECD Nc1ccc(CNC(=O)C2(c3cccnc3)CC2)cc1 1515333622 UADMVQWZEFBRQW-UHFFFAOYSA-N 267.332 2.012 10 20 CECD CC(C)(CCC(=O)O)NCc1cccc(F)c1O 1603598272 GEGIDOIYLUHPKQ-UHFFFAOYSA-N 255.289 2.264 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C(=O)O)[C@@H]1C 1600236817 MXUJLJPTOWEZQQ-WFASDCNBSA-N 276.380 2.356 10 20 CECD CCc1oc(/C=C2\SC(=S)NC2=O)cc1C(=O)O 1610079752 NFXWNOSEDSVHIA-YWEYNIOJSA-N 283.330 2.029 10 20 CECD COc1ccccc1NCC(=O)NCc1ccc(N)cc1 1579309794 NWEGSXXXUBZWTP-UHFFFAOYSA-N 285.347 2.006 10 20 CECD CC(C)c1nccn1CC(=O)Nc1ccc(N)cc1 20030176 RCMSMBVHFNYPSR-UHFFFAOYSA-N 258.325 2.227 10 20 CECD Cc1nnc(CNCc2ccc3c(c2)CCCO3)s1 921979980 JCDCHBHURGRQEX-UHFFFAOYSA-N 275.377 2.461 10 20 CECD O=S(=O)(CCc1ccccc1)Nc1ccc(O)cc1 108261394 HMOROXONFHKVSA-UHFFFAOYSA-N 277.345 2.377 10 20 CECD CO[C@]1(C)CCCN(Cc2cc3c(cc2O)OCO3)C1 230299911 AZSGMJQTWINAAZ-OAHLLOKOSA-N 279.336 2.122 10 20 CECD C[C@@H]1CN(C(=O)Nc2ccc(N)cc2)CC(C)(C)O1 41681704 BAHULVFSUJBMJX-SNVBAGLBSA-N 263.341 2.300 10 20 CECD COc1cccc(CN(C)[C@H]2CCCOC2)c1O 401584282 RTJPIORAXZPEDJ-LBPRGKRZSA-N 251.326 2.012 10 20 CECD COc1ccc(O)c(CN(C)CC(C)(C)OC)c1 404296080 DXVBITNTLITEJY-UHFFFAOYSA-N 253.342 2.258 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2=CCCOC2)c1 379883016 VXGQPRQTMCJNTH-LLVKDONJSA-N 263.337 2.398 10 20 CECD CCOc1cccc(CNC[C@]2(C)CCOC2)c1O 397119663 LWNDKJUEUSJARC-HNNXBMFYSA-N 265.353 2.307 10 20 CECD CCOCCNC(=O)NCc1c(O)ccc2c1CCCC2 175381393 QFOJCYDMNWNMRE-UHFFFAOYSA-N 292.379 2.107 10 20 CECD CCOc1cccc(CNCC[C@H](O)CC)c1O 127403379 CAUXUSUHIGOZKK-GFCCVEGCSA-N 253.342 2.042 10 20 CECD NC(=O)CCOc1ccccc1NCc1ccccc1O 37091586 YPDBPAVBKNXPEK-UHFFFAOYSA-N 286.331 2.259 10 20 CECD COC(=O)[C@@]1(C)CCN(Cc2cccc(C)c2O)C1 180567385 HIWAFVUKBFARNF-HNNXBMFYSA-N 263.337 2.086 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1cccc(F)c1F 182412758 AMRXVRLRMCHGMO-UHFFFAOYSA-N 285.271 2.471 10 20 CECD COC[C@@H]1CN(Cc2cc(C)c(C)cc2O)C[C@H](C)O1 190214893 CKTBPRCVQOILND-ZFWWWQNUSA-N 279.380 2.245 10 20 CECD COc1ccc(N2CCC(NC(=O)C(F)F)CC2)cc1 194527180 UDQXNVRKUINQPZ-UHFFFAOYSA-N 284.306 2.045 10 20 CECD COCC[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 81708028 NBIWOEVZHJPEJJ-MNOVXSKESA-N 253.342 2.476 10 20 CECD Cc1ccc(O)c(CN2CC[C@H](Cc3cnn(C)c3)C2)c1 93870480 QOTHDXCLCIDDPQ-CQSZACIVSA-N 285.391 2.499 10 20 CECD CC[C@H](O)CN(Cc1ccc(N(C)C)cc1)C1CC1 264471524 RVVDFGGDCDTABY-INIZCTEOSA-N 262.397 2.488 10 20 CECD CC(C)N1C[C@@H](NCc2c(O)cccc2Cl)CC1=O 271840753 QRGNKOVVMPWSDO-JTQLQIEISA-N 282.771 2.145 10 20 CECD Cc1ccc([C@@H](C)NCc2nnc3n2CCC3)c(O)c1 273446085 ZXVYFRSUURZXIR-LLVKDONJSA-N 272.352 2.089 10 20 CECD C[C@@H](NC[C@@H]1CCCOC1)c1cc([N+](=O)[O-])ccc1O 273414018 QLTGTAGSWGBOOP-MNOVXSKESA-N 280.324 2.378 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](O)C(C)(C)C2)cc1F 276020162 QSSSCCFIQYVTFG-OAHLLOKOSA-N 280.387 2.485 10 20 CECD COc1ccc(O)c(CN2CCCc3n[nH]cc32)c1 291528197 JTVNCVUSYJFSSI-UHFFFAOYSA-N 259.309 2.077 10 20 CECD CC(=O)C(=O)COc1ccc(C(=O)c2ccccc2)cc1 808012974 VUDOMQQVVXAGJY-UHFFFAOYSA-N 282.295 2.455 10 20 CECD CCOc1ccc(O)c(CNC[C@@H](CO)C(C)C)c1 808422253 ZRJKJPOOUYYYIO-ZDUSSCGKSA-N 267.369 2.145 10 20 CECD Cc1cc(CN(C)[C@@H](C)C[S@@](C)=O)ccc1N(C)C 294751506 XRDAQTIXPXUOCJ-ORAYPTAESA-N 282.453 2.260 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCN[C@@H](C)C2)c1 817970772 DWGUFMMGPJRVTO-SRVKXCTJSA-N 264.369 2.192 10 20 CECD CCN(CC(=O)NC)Cc1ccc2ccccc2c1O 816486118 PFVMSVVCYNGRMO-UHFFFAOYSA-N 272.348 2.113 10 20 CECD C[C@@H]1CC2(CCNCC2)CN1Cc1ccccc1O 818431356 JTXZYJLALBWMRQ-CYBMUJFWSA-N 260.381 2.356 10 20 CECD CCOc1ccc(CN2C[C@@H](C)C[C@H](C(=O)O)C2)c(O)c1 817881838 PTDSIZIPEATBHL-AAEUAGOBSA-N 293.363 2.334 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@H]2CNCCCO2)c1O 817981411 JANJIQKRVWPGCO-DGCLKSJQSA-N 298.814 2.383 10 20 CECD COc1ccc(O)c(CNc2nnc(C(F)F)o2)c1 814362220 UIBLFSZHUDNAQL-UHFFFAOYSA-N 271.223 2.334 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCCCN(C)C)c1 729534654 AEYISZIYGZNOQB-LBPRGKRZSA-N 294.395 2.310 10 20 CECD CCc1cccc(CN2CC[C@@H]3NC(=O)CC[C@@H]3C2)c1O 827134022 ZRPPCKDBSYRAAW-HIFRSBDPSA-N 288.391 2.055 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC(C(F)F)C2)c1O 839140602 HNKGLRNLBRIUFZ-UHFFFAOYSA-N 288.250 2.006 10 20 CECD CCC(=O)C1(C(=O)NCc2cc(Cl)ccc2O)CC1 846476371 KTBYKDKMBPTBSG-UHFFFAOYSA-N 281.739 2.421 10 20 CECD COc1cccc(CN(C)[C@H](C)c2nc(C)no2)c1O 848926440 XTVSLIHQTLKBCF-SECBINFHSA-N 277.324 2.285 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1N 843052262 RGCUOZWOCKUNFT-RISCZKNCSA-N 265.376 2.061 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCCNCC1 841058312 PITOJKMTNLKPRD-OAHLLOKOSA-N 261.413 2.293 10 20 CECD C[C@H](O)C[C@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 757655785 KZOSECAAQBWSSE-CIUDSAMLSA-N 259.296 2.480 10 20 CECD C[C@@H](N[C@@H](CCO)C1CC1)c1cc(F)cc(F)c1O 756739387 MUAOXPLCMGQPJT-OQPBUACISA-N 271.307 2.482 10 20 CECD C[C@@H](NC[C@H](C1CC1)N(C)C)c1cc([N+](=O)[O-])ccc1O 756433062 MPFCBLQYSDOFAQ-QMTHXVAHSA-N 293.367 2.291 10 20 CECD CCCNC(=O)CCNCc1cc(F)c(N(C)C)cc1F 858104319 GMGLTCKWUAHNOQ-UHFFFAOYSA-N 299.365 2.037 10 20 CECD CCn1cc(C(=O)N(C)c2ccc(N)cc2)c(C)n1 877074258 DVGJLWXBBRHJSM-UHFFFAOYSA-N 258.325 2.070 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC(F)(F)C1 763704769 NWQMJDVFOHWTNF-SNVBAGLBSA-N 270.279 2.379 10 20 CECD OC[C@H]1CCCN1Cc1c(O)cccc1Br 862215221 FKPAOQVUNKBRIP-SECBINFHSA-N 286.169 2.111 10 20 CECD Cc1cccc(CN[C@H](C)[C@H](O)C(F)(F)F)c1O 877693801 QYMQSPBZSJYRAO-KCJUWKMLSA-N 263.259 2.102 10 20 CECD COc1cc(O)c(CN2CC(C)(C)C2)cc1OC 877717078 FQCJGVXHMBRTTR-UHFFFAOYSA-N 251.326 2.251 10 20 CECD CC1(F)CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 871074183 CXBWFKKIBRHKRP-HYXAFXHYSA-N 279.311 2.462 10 20 CECD COc1ccc(O)c(CN(C)[C@@H](C)C(=O)NC(C)(C)C)c1 777218565 BLVDLSPYBDZNBS-NSHDSACASA-N 294.395 2.136 10 20 CECD CCc1ccc(O)c(C(=O)NCc2ccc(O)c(O)c2)c1 778916296 BGWGBRFECMBYJQ-UHFFFAOYSA-N 287.315 2.296 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H]3CNC[C@@H]3C2)cc1 770395635 TVYBNTLTEOGYHS-IYBDPMFKSA-N 273.424 2.184 10 20 CECD CC[C@@](C)(CC(=O)OC)NCc1cc(F)cc(F)c1O 883027596 GZWYRMVGNRWYPO-AWEZNQCLSA-N 287.306 2.492 10 20 CECD C[C@@H](N[C@@H]1CCc2c[nH]nc2C1)c1c(O)cccc1F 886538546 JROVPVQZRMNZSH-MWLCHTKSSA-N 275.327 2.463 10 20 CECD COC[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H](C)O1 784668561 QLZGUCKJTKYALC-JSGCOSHPSA-N 296.386 2.127 10 20 CECD COc1ccc(CN(C)CC2=CCCOC2)c(O)c1OC 895371714 SYPVHHRQQCGUBH-UHFFFAOYSA-N 293.363 2.188 10 20 CECD CN1CCN(c2ccc(CN(C)CCCF)cc2)CC1 895898061 JCACYJOPCOCWGL-UHFFFAOYSA-N 279.403 2.230 10 20 CECD O=C(NCc1ccc(F)cc1)c1c(F)ccc(O)c1O 789942678 WLYXHQDVUAIJJY-UHFFFAOYSA-N 279.242 2.306 10 20 CECD CC1(O)CCN(Cc2cc(F)cc(F)c2O)CC1 894029675 BJHAHRQADOMUHJ-UHFFFAOYSA-N 257.280 2.017 10 20 CECD CCN(C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 899101890 NAHVDHRJMMLCTP-HNNXBMFYSA-N 292.427 2.017 10 20 CECD COc1ccc(CN[C@H]2CCCOCC2)c(O)c1OC 893309212 PBTHTHGIJXUMKZ-LBPRGKRZSA-N 281.352 2.068 10 20 CECD C[C@H]1CCSCCN1Cc1cc2c(cc1O)OC[C@@H]2O 790477315 JILOWLYIWHWMBC-HZMBPMFUSA-N 295.404 2.145 10 20 CECD CNC(=O)[C@H]1CCCCN1Cc1cc(Cl)ccc1O 133039866 CBNLYSPDFNLOFJ-GFCCVEGCSA-N 282.771 2.146 10 20 CECD COC(=O)C(C)(C)CCNCc1ccc(OC)cc1O 793385610 CYEQDGRZTACBFA-UHFFFAOYSA-N 281.352 2.080 10 20 CECD COC1CC(NCCCSc2nccs2)C1 390624900 JMMPKUXCEVBQDS-UHFFFAOYSA-N 258.412 2.392 10 20 CECD CCN(CCOCCO)Cc1ccc(N2CCCC2)cc1 1321201222 OXAFHEWFQDTXML-UHFFFAOYSA-N 292.423 2.118 10 20 CECD CCC[C@@](C)(NCc1cccc(OC)c1O)C(=O)O 86731959 SOMBCEACQDVNIP-CQSZACIVSA-N 267.325 2.134 10 20 CECD CN1CCCc2cc(CNC(=O)c3occc3N)ccc21 1328594461 VQXLEVRLCCXDHT-UHFFFAOYSA-N 285.347 2.174 10 20 CECD COc1cc(Cl)cc(CNCCN2CC[C@@H](C)C2)c1O 761215280 JAVJZCZYDIUXHE-LLVKDONJSA-N 298.814 2.486 10 20 CECD Cc1ccsc1C(=O)NCCc1ccc(O)c(O)c1 98074439 IYCYDSRZPLMZFN-UHFFFAOYSA-N 277.345 2.440 10 20 CECD O=C(O)[C@@H]1CCCC[C@@H]1C(=O)N1Cc2cccc(O)c2C1 1602172772 PZZLLMWNFNZPKT-NWDGAFQWSA-N 289.331 2.125 10 20 CECD O=C(O)[C@H]1CC[C@@H](NCc2cccc(Cl)c2O)C1 1601796625 XWQFIHYJQSIETF-WCBMZHEXSA-N 269.728 2.389 10 20 CECD O=C(O)c1cnc(SCn2nnc3ccccc32)s1 1608978986 CGDABWHQLAMSLS-UHFFFAOYSA-N 292.345 2.336 10 20 CECD Cc1cc(CN(C)c2ccc(OCC(=O)O)cc2)ccn1 1600190450 LPQIFRAIMXCXLF-UHFFFAOYSA-N 286.331 2.490 10 20 CECD Cn1nc(NC(=O)Cc2ccc(N)cc2)c2ccccc21 1579996441 CNMBRSIXJZNRCD-UHFFFAOYSA-N 280.331 2.337 10 20 CECD Nc1ccc(CNC2CCN(CC3CC3)CC2)cc1 1580445716 RFBZXOCXHFILTB-UHFFFAOYSA-N 259.397 2.233 10 20 CECD C[C@H](NCCCn1cccn1)c1cc(C(=O)O)ccc1O 1593267000 INXWNOMGABCQSY-NSHDSACASA-N 289.335 2.028 10 20 CECD CC(C)(CNCc1ccc2c(c1)CCCO2)C(=O)O 258788598 JAEFLUIBNSRKQK-UHFFFAOYSA-N 263.337 2.212 10 20 CECD CCOc1cccc(CNC[C@H]2CCC[C@@H](O)C2)c1O 230670176 BEOSBYUVAOYIMV-GXTWGEPZSA-N 279.380 2.432 10 20 CECD CC[C@H](NCc1cccc(OC)c1O)C(C)(C)O 292929978 GWSSZZGIZBJFCD-LBPRGKRZSA-N 253.342 2.040 10 20 CECD CC(C)n1cc(NC(=O)Cc2ccc(N)cc2)cn1 61682246 OBKJTSAXLBDPHL-UHFFFAOYSA-N 258.325 2.227 10 20 CECD CCOc1cccc(CNCCOC(F)(F)F)c1O 398295220 CJEFRJWUTNJTOH-UHFFFAOYSA-N 279.258 2.417 10 20 CECD COc1ccc(O)c(CNC(=O)NCc2ccsc2)c1 172068021 GSGBMZGJUKEUCQ-UHFFFAOYSA-N 292.360 2.462 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)CC[C@H]1N 251669781 HHVLUBIWWPDUAK-JOYOIKCWSA-N 254.761 2.215 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccs2)c1 114544243 WSECUWMITDOSPP-UHFFFAOYSA-N 263.318 2.392 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccc[nH]1 173192371 FNLHGIWIIVFVHD-UHFFFAOYSA-N 271.320 2.120 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1cccc(C)c1O 180763698 ZMZGRISQWLOYLX-CYBMUJFWSA-N 263.337 2.228 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2ccc(F)c(F)c2O)C1 187761289 HXFPLFGTRYUNIV-ZJUUUORDSA-N 298.333 2.332 10 20 CECD Oc1c(Br)cccc1CNC1CCOCC1 42411951 IGCDSZHBRKRUPO-UHFFFAOYSA-N 286.169 2.423 10 20 CECD COc1cncc(CN(C)Cc2ccccc2O)c1 289950377 PDTMSPNZHANBJB-UHFFFAOYSA-N 258.321 2.428 10 20 CECD C[C@H](N[C@H](C)[C@H](C)N1CCOCC1)c1ccccc1O 248384381 DRWMFKZCMWEPPH-RDBSUJKOSA-N 278.396 2.152 10 20 CECD COC1CCC(N(C)C(=O)c2ccc(C)c(O)c2O)CC1 272720832 HCJQSCPXOVMPAF-UHFFFAOYSA-N 293.363 2.436 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)C[C@H](CO)C2)c1O 398774039 BCDLTAGMJSOHOC-JQWIXIFHSA-N 295.354 2.184 10 20 CECD C[C@@H](N[C@H]1C[C@@H](O)C1)c1cc2c(cc1O)CCCC2 295874219 GMBYVQRSUZESHF-HONMWMINSA-N 261.365 2.445 10 20 CECD CC(C)NC(=O)OC1CN(Cc2cccc(Cl)c2O)C1 297529563 ZDMXSNMRVPFISV-UHFFFAOYSA-N 298.770 2.364 10 20 CECD C[C@@H]1C[C@@H](C)N(Cc2cccc(F)c2O)C[C@@H]1CN 817866289 WWHDCIZOHXOKFR-WZRBSPASSA-N 266.360 2.337 10 20 CECD C[C@@H]1C[C@@H](CO)CN(Cc2cccc(Cl)c2O)C1 817412436 LIMMRGKHNSLBEV-GHMZBOCLSA-N 269.772 2.496 10 20 CECD C[C@H](NCC1CCNCC1)c1ccc(F)cc1O 817940166 GLSNDXLGXMVTBO-JTQLQIEISA-N 252.333 2.182 10 20 CECD C[C@H](NC[C@@H]1CCCNC1)c1cc(F)cc(F)c1O 817946281 VEIUSOQIPROIJD-VHSXEESVSA-N 270.323 2.321 10 20 CECD Cc1c(C)n(C)c2ccc(OC(=O)c3cnn(C)n3)cc12 817762471 VJUQMBSAUPLMPY-UHFFFAOYSA-N 284.319 2.143 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1CCOC2(CCC2)C1 901133866 ZGORVQSGSBCANI-GFCCVEGCSA-N 291.347 2.063 10 20 CECD CO[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)C12CCC2 839182690 PAXABGJZFBMALA-LSDHHAIUSA-N 291.347 2.168 10 20 CECD C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1ccc(N)cc1 841299988 PSDACFVRJOAKHV-SWLSCSKDSA-N 288.395 2.359 10 20 CECD CC[C@H](NCc1cc(F)ccc1O)[C@@H](O)C(C)C 840967050 CSMABXLGPBWROL-JSGCOSHPSA-N 255.333 2.416 10 20 CECD Oc1ccc(Cl)cc1CN[C@H]1CC12CCNCC2 841078743 JPMROXMIXAZOQP-ZDUSSCGKSA-N 266.772 2.277 10 20 CECD CN(C)c1ccc(CNC[C@H]2CCCCN2)cc1F 841032601 HMAZPRHVRXPTCW-CYBMUJFWSA-N 265.376 2.123 10 20 CECD C[C@@H](NC[C@H]1CNC(=O)C1)c1cc2c(cc1O)CCCC2 840834648 YZEVLBDOJIMMES-NEPJUHHUSA-N 288.391 2.058 10 20 CECD CCc1cccc(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c1O 848887720 CKPQMATXDSPTBS-UFYHVXEKSA-N 281.421 2.296 10 20 CECD COc1cccc([C@H](C)N[C@@H]2CCc3c[nH]nc3C2)c1O 846144267 BXJMPEDPLYTPEZ-CMPLNLGQSA-N 287.363 2.332 10 20 CECD CCOc1ccc(CN(C)Cc2nc(C)no2)c(O)c1 848927621 JHZZZNLFSYVBNE-UHFFFAOYSA-N 277.324 2.114 10 20 CECD CN(C)c1ccc([C@@H](N)CNC[C@H]2CCSC2)cc1 841046258 YQKPPYSBDZGIAR-DOMZBBRYSA-N 279.453 2.095 10 20 CECD Nc1ccc(NC(=O)NC2CCN(C3CCC3)CC2)cc1 841298600 RCRBKKOOKWUPRF-UHFFFAOYSA-N 288.395 2.407 10 20 CECD C[C@@H](NC(=O)[C@@H](F)C(F)(F)F)c1ccccc1O 827947060 ZUAYFNSHOLAGKI-HZGVNTEJSA-N 265.206 2.470 10 20 CECD Cc1csc(CNC(=O)NCCc2ccc(N)cc2)n1 841673580 VWPQCGRJLBLLCN-UHFFFAOYSA-N 290.392 2.076 10 20 CECD CC[C@@H](NC[C@H]1CCCNC1=O)c1ccc(C)cc1O 840825808 MOTWYCXWAWUPDL-TZMCWYRMSA-N 276.380 2.268 10 20 CECD C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)CS1 840415835 IPWFSNJIPSAACB-PWSUYJOCSA-N 280.393 2.428 10 20 CECD CCCN1CC(=O)N[C@@H]1c1cc(Cl)cc(F)c1O 840824430 LYDPVDANIXMJKB-LBPRGKRZSA-N 272.707 2.025 10 20 CECD CCNC(=S)NCc1ccc(N2CC=CC2)cc1 740632465 SALSTIOJPFASPI-UHFFFAOYSA-N 261.394 2.047 10 20 CECD CCCOC(=O)NCc1ccc(N2CCC(O)CC2)cc1 859229610 MOOJIBLSHDSASN-UHFFFAOYSA-N 292.379 2.284 10 20 CECD Cc1ncoc1CNC(=O)N(C)Cc1ccccc1O 923807544 KBNJTNAINQYUNV-UHFFFAOYSA-N 275.308 2.030 10 20 CECD Cc1nonc1[C@H](C)NCc1ccc(N(C)C)cc1 924572768 DPWGEBVIXLKZOF-JTQLQIEISA-N 260.341 2.295 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CNC)cc1F 853248423 GCPYQJXQMRZVJI-LBPRGKRZSA-N 267.392 2.369 10 20 CECD Cc1ccnc(NC(=O)NCc2ccccc2O)c1 752808119 OUSIQKIIENWFEH-UHFFFAOYSA-N 257.293 2.417 10 20 CECD COCCN(C)CCCNCc1ccc2c(c1)CCCO2 921524368 MEPYSXCRLAXDMC-UHFFFAOYSA-N 292.423 2.070 10 20 CECD C[C@H]1C[C@@H](N[C@H]2C[C@H](O)C2)c2c(O)ccc(F)c21 850577578 ANMUZPOEPFPZJQ-FTYOSLGDSA-N 251.301 2.193 10 20 CECD COC1CC(CN(C)c2ccc(OCC(=O)O)cc2)C1 863467110 NMGLCAATSDFUMD-UHFFFAOYSA-N 279.336 2.011 10 20 CECD Cc1conc1C(=O)N(C)Cc1ccc(N(C)C)cc1 864632679 NCBIGXHPHCAKAO-UHFFFAOYSA-N 273.336 2.321 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H](O)CCc2ccccc2)c1 862757858 GTLLLLVVNQBYIU-KRWDZBQOSA-N 299.370 2.311 10 20 CECD C[C@H]1OCC[C@@H]1C(=O)NCc1ccc(N2CCCC2)cc1 770642554 UHNIVYSTPMWOLI-CJNGLKHVSA-N 288.391 2.328 10 20 CECD CC[C@H](N[C@H](C)CC(N)=O)c1cc(Cl)ccc1O 775514003 QMVCMVOXGVYEOJ-KCJUWKMLSA-N 270.760 2.350 10 20 CECD Cc1cccc(O)c1CN1CCS[C@H]2COCC[C@H]21 876798149 FHHQRIOSJPFQPR-HIFRSBDPSA-N 279.405 2.407 10 20 CECD CN(C)c1cccnc1CNCc1cc(F)cc(F)c1O 883122516 QNWISRIYWMZHFU-UHFFFAOYSA-N 293.317 2.421 10 20 CECD COc1ccc(CN(C)Cc2nccs2)c(O)c1OC 892095987 QNDOSFLITSCYHS-UHFFFAOYSA-N 294.376 2.498 10 20 CECD Cc1ccc(C(=O)OC[C@H]2CC[C@@H](C)O2)c(O)c1O 789042615 OBDGJWBTPGPZFW-NXEZZACHSA-N 266.293 2.131 10 20 CECD CCOc1cccc(CN[C@@H](C)[C@@H]2CCOC2)c1O 135213458 MFLDAFWLCXNSQP-WCQYABFASA-N 265.353 2.306 10 20 CECD CC[C@H](NCc1c(O)cccc1Br)[C@H](C)O 706831397 CKAVPEPDDAPNOQ-KWQFWETISA-N 288.185 2.404 10 20 CECD Oc1ccc(Br)cc1CNC[C@H]1C[C@@H](O)C1 720984412 GLPWFQVZCPBZLE-DKTWLAJQSA-N 286.169 2.015 10 20 CECD Cn1ncc(Cl)c1CNCc1ccc2c(c1)CCO2 780522020 YGMRJYCMZAEBNA-UHFFFAOYSA-N 277.755 2.298 10 20 CECD CCC[C@@H]1CN(Cc2ccc(N)cc2)CCN1CCOC 1335284570 DOTJHEMXMKGKHK-QGZVFWFLSA-N 291.439 2.202 10 20 CECD O=C(O)c1cncc(Sc2ncc(Cl)s2)n1 1602545736 JEJNYWVYUWKILP-UHFFFAOYSA-N 273.726 2.436 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NC2(C(=O)O)CC2)cc1 1607765827 ILCMXSUTSMISDU-UHFFFAOYSA-N 298.342 2.441 10 20 CECD O=C(C[C@@H]1NCc2ccccc21)N1Cc2cccc(O)c2C1 1580522530 JPGBLTGLMPURHR-INIZCTEOSA-N 294.354 2.469 10 20 CECD Nc1ccc(CNCc2cnn(C3CCC3)c2)cc1 1580446587 BKGXEIHUDUQLIM-UHFFFAOYSA-N 256.353 2.480 10 20 CECD Oc1cc(Cl)ccc1CNCCC1=CCNCC1 1580887931 BERDDLOXXRDBJI-UHFFFAOYSA-N 266.772 2.445 10 20 CECD CCN1CCc2cc(CN[C@@H](C(=O)O)C3CCC3)ccc21 1776884662 GPOHIUVTRFXSKD-MRXNPFEDSA-N 288.391 2.412 10 20 CECD CC[C@@H](N[C@@H](C)CN1CCN(C)CC1)c1ccccc1O 155739954 JECCOCMWKMKBRY-GOEBONIOSA-N 291.439 2.069 10 20 CECD C[C@@H](Cc1cnn(C)c1)N[C@H](C)c1ccccc1O 834895401 BHQKRNMIWFEYIT-NWDGAFQWSA-N 259.353 2.408 10 20 CECD CCC(CC)[C@H](O)CNCc1cc(OC)ccc1O 224831787 HMJHOKVHYWZLEJ-OAHLLOKOSA-N 267.369 2.288 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1ccc(N(C)C)cc1 36980249 IUAHIYBASKQEGL-HNNXBMFYSA-N 278.396 2.430 10 20 CECD C[C@H]1CCCC[C@H]1NC(=O)CN(C)c1ccc(N)cc1 702070220 XMIMHYMHEDGCNZ-SWLSCSKDSA-N 275.396 2.400 10 20 CECD CO[C@@H](C1CC1)[C@@H](C)NCc1cc(F)ccc1O 388278597 KNCIOTGZYAIBOL-YMTOWFKASA-N 253.317 2.434 10 20 CECD CC1(C(=O)NCCc2ccc(N)cc2)CC(F)(F)C1 720493174 RDFDMDDFTGGTTH-UHFFFAOYSA-N 268.307 2.363 10 20 CECD C[C@@H]1CSC[C@H]1NC(=O)Nc1ccc(N)cc1 397900729 SHSJTZYOHSGBPV-LDYMZIIASA-N 251.355 2.142 10 20 CECD Cc1ccc(C(=O)NOCc2ccccc2)c(O)c1O 177669260 OICALJWMNPSFEA-UHFFFAOYSA-N 273.288 2.268 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H](C)CO 125601166 CCPGWJNLYISPIX-VIFPVBQESA-N 278.377 2.266 10 20 CECD COc1ccc(O)c(CN[C@](C)(CO)c2ccccc2)c1 128583252 RMILOLXSBZAKJY-QGZVFWFLSA-N 287.359 2.398 10 20 CECD COCCC[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1 182253492 HQPWFQWJXUYEPD-CYBMUJFWSA-N 278.396 2.432 10 20 CECD CC(C)Cn1cc(/C=C2/SC(=S)NC2=O)cn1 180693298 PWGAIRAHMQDVCT-YCRREMRBSA-N 267.379 2.028 10 20 CECD Cc1occc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183424594 MAUVMTGQXAKDBQ-SECBINFHSA-N 275.304 2.360 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 126797023 XRVWDFNPFVPVKY-NXEZZACHSA-N 254.761 2.215 10 20 CECD CCN1CCCC[C@H]1CNC(=O)c1ccc(C)c(O)c1O 182423150 FKFYULUECRDVRD-LBPRGKRZSA-N 292.379 2.010 10 20 CECD CCCCNC(=O)/C=C/c1ccc(N2CCOCC2)cc1 264747321 NUHNSAYXCPGMGI-RMKNXTFCSA-N 288.391 2.453 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H](CCO)COC)cc1 268995711 IHPWXTVHGRSLDK-UKRRQHHQSA-N 280.412 2.191 10 20 CECD CCC(C)(C)N[C@H](C)C(=O)NCc1ccccc1O 275019772 ZUXKWVZICGEBHY-LLVKDONJSA-N 264.369 2.175 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCCSC2)c(O)c1O 272772175 SPIUCCHQRZDLAT-SECBINFHSA-N 267.350 2.032 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCC(=O)N[C@H]2C(C)(C)C)c1 285573325 UNNJBRQIFURYBV-CZUORRHYSA-N 290.407 2.484 10 20 CECD C[C@H](NCCN1CC=CCC1)c1cc([N+](=O)[O-])ccc1O 280993244 MZAMWVXJXRHDNL-LBPRGKRZSA-N 291.351 2.213 10 20 CECD CC(C)(O)CC(=O)NCc1cc(Cl)cc(Cl)c1O 807839007 FMYUHMKDIPBFCR-UHFFFAOYSA-N 292.162 2.476 10 20 CECD CC[C@H](N[C@@H](C(N)=O)c1ccccn1)c1ccc(C)cc1O 296639294 BYABNYRLPRWFOO-XJKSGUPXSA-N 299.374 2.363 10 20 CECD CC(C)C(=O)NCCNCc1ccc2ccccc2c1O 816529006 CBJLISPHSARANS-UHFFFAOYSA-N 286.375 2.407 10 20 CECD COc1cccc(CNC(=O)[C@H]2CCC[C@@H](OC)C2)c1O 815834762 YFIDBDVRTUJYPO-WCQYABFASA-N 293.363 2.222 10 20 CECD COc1cccc(CNCCN2CCCC2(C)C)c1O 825325541 DTWQNQZWPLTJEA-UHFFFAOYSA-N 278.396 2.365 10 20 CECD C[C@@]1(C(=O)NCc2ccc(O)c(O)c2)CC=CCC1 827317088 OBXGCBRDGZHBIB-OAHLLOKOSA-N 261.321 2.460 10 20 CECD C/C=C/C(=O)N(CC(=O)OC)Cc1cc(Cl)ccc1O 828519748 ZUFDHIQZZVXWNX-ONEGZZNKSA-N 297.738 2.123 10 20 CECD C[C@H](NCC[C@H](O)C1CC1)c1cc(F)cc(F)c1O 903408906 VIARKRFMUPCZSE-SDBXPKJASA-N 271.307 2.482 10 20 CECD C[C@@H](NCCN1CCCOCC1)c1cc(Cl)ccc1O 903227312 LIOFMTPDDFDGES-GFCCVEGCSA-N 298.814 2.419 10 20 CECD CC(C)(C)c1n[nH]cc1/C=C1/SC(=S)NC1=O 918749377 URBNBOYDOQEBEE-QPJJXVBHSA-N 267.379 2.196 10 20 CECD CCS(=O)(=O)CCCN[C@H](C)c1cc(C)ccc1O 840888222 DCGNZAPWZAJIDG-GFCCVEGCSA-N 285.409 2.176 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H](CO)[C@H]2C)c1 840978703 PBTYSTMFUAKEIR-OLZOCXBDSA-N 279.380 2.384 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCC(C)(C)N)c1 843490064 WZSDIFSPMJJYDI-SNVBAGLBSA-N 280.368 2.096 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCCN3C)c2ncnn21 924868715 CYTWQZPKXUOOBG-IUODEOHRSA-N 297.406 2.456 10 20 CECD COc1cc(C)cnc1C(=O)NCc1ccccc1O 754207363 KYHQEJBWJQOZOO-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COc1ccc(N(C)Cc2cnon2)cc1Cl 851808464 NFLJSHJCXNDUTL-UHFFFAOYSA-N 253.689 2.368 10 20 CECD COc1ccc(CNC(=O)NCCc2ccoc2)c(O)c1 852559363 PDOGIYSYGYDGNU-UHFFFAOYSA-N 290.319 2.036 10 20 CECD C[C@@H]1C[C@H](NC/C=C/CO)c2c(O)ccc(F)c21 850507737 HPGJXTGHONBQET-GZWSGWKISA-N 251.301 2.218 10 20 CECD CC(C)(CN1CCCC1)NC(=O)c1cc(O)cs1 854894093 OQGUCHPFDUNEPE-UHFFFAOYSA-N 268.382 2.058 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ocnc2C)c1 751061238 UYTOUIDDUGGQOS-QMMMGPOBSA-N 276.292 2.188 10 20 CECD CCCN1CC[C@@H](NCc2ccc(N(C)C)c(F)c2)C1 850395263 QGZRYIGUTMTRRS-CQSZACIVSA-N 279.403 2.466 10 20 CECD CCN(CC)c1ccc(CN(C)CC[N+](=O)[O-])cc1 929184943 OFMGKHBLOCUXSV-UHFFFAOYSA-N 265.357 2.241 10 20 CECD O=C1CCN1CN1CCCc2cc(OC(F)F)ccc21 857233213 AHKBQGXQTHXEHR-UHFFFAOYSA-N 282.290 2.230 10 20 CECD C[C@@H](NCc1c(O)ccc(Cl)c1F)C1(CO)CC1 850361446 RZCXRAVZHIEACP-MRVPVSSYSA-N 273.735 2.435 10 20 CECD COc1cc(CN2CCCOC[C@H]2C)c(O)cc1C 768463636 VFYNOOTVVLYMGK-GFCCVEGCSA-N 265.353 2.320 10 20 CECD Cc1ccc(CN[C@H](CO)CC(F)(F)F)c(O)c1 877124354 VSEJAUXUFVHZHF-JTQLQIEISA-N 263.259 2.104 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(C)CCOCC2)c1 862758877 OYMICAVDOBJUAH-UHFFFAOYSA-N 263.337 2.134 10 20 CECD CC[C@@H](NC[C@H]1COCCO1)c1ccc(N(C)C)cc1 765250310 JCCMBIGQXUVDHI-JKSUJKDBSA-N 278.396 2.209 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1cccc(Cl)c1O 761222468 JCJPYBZWUSGKCB-QWHCGFSZSA-N 285.771 2.329 10 20 CECD CC(=O)OC(C)(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 779846672 WVIBNGKQPYMVFN-LLVKDONJSA-N 292.379 2.272 10 20 CECD CCOc1ccc(CNCC2=CCN(C)CC2)c(O)c1 776256891 HAMTYDUDDUUJOE-UHFFFAOYSA-N 276.380 2.142 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1C[C@H]2CC[C@H]1O2 1117507953 ZKDDZVGGUKWYAX-MATHAZKKSA-N 293.710 2.382 10 20 CECD COc1cc(C)cc(CN2CCC[C@H](O)CC2)c1O 894866287 NCBRWTWGDMRSHC-ZDUSSCGKSA-N 265.353 2.056 10 20 CECD CCC[C@@H](CCO)NCc1ccc(OC)c(OC)c1O 895697005 QNCVBJCSIPRKFU-LBPRGKRZSA-N 283.368 2.050 10 20 CECD COc1ccc(CNc2ncnc3onc(C)c23)c(O)c1 799962542 YFDCBZTUNFECOM-UHFFFAOYSA-N 286.291 2.253 10 20 CECD C[C@@H](CCCNCc1ccc(N(C)C)cc1)C(=O)O 1321907530 RRIIOIXFPYWHPB-LBPRGKRZSA-N 264.369 2.343 10 20 CECD CC[C@H](O)CNCc1cc(Br)cc(F)c1O 715723941 XTECINJZVBVNTF-VIFPVBQESA-N 292.148 2.154 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCC[C@H]1CCO 778216497 OSOQNJZAKWYOBM-WCQYABFASA-N 265.353 2.042 10 20 CECD Nc1ccc(CNC(=O)N2CC3(CCCC3)C2)cc1 1337017837 DHCRPFKXHOTORW-UHFFFAOYSA-N 259.353 2.354 10 20 CECD CC[C@H](NCc1c(O)cccc1Br)C(=O)O 1331845118 HPJCTAPIXOCEIX-VIFPVBQESA-N 288.141 2.108 10 20 CECD COC(=O)[C@H]1C[C@H](C)CCN1Cc1cc(F)cc(F)c1O 1262110547 HMTHKXJLIFKZEJ-NOZJJQNGSA-N 299.317 2.444 10 20 CECD COc1ccc(N2CCCN(C(=O)[C@H]3C[C@@H]3F)CC2)cc1 1348487395 LMVQYSQARVWNBD-GJZGRUSLSA-N 292.354 2.092 10 20 CECD O=C(O)[C@@H](CC(F)F)NCc1ccc(Cl)cc1O 1601639195 NGYSVCGCILRWOI-MRVPVSSYSA-N 279.670 2.244 10 20 CECD C[C@H](O)C[C@@H](C)CN[C@H](C)c1cc(C(=O)O)ccc1O 1609789242 YWJUGLOUWGSERD-OUAUKWLOSA-N 281.352 2.148 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@H](C(=O)O)C2)cc1 1606056000 SCZVGKAASMIDMT-OLZOCXBDSA-N 262.353 2.096 10 20 CECD CO[C@@H]1CC[C@@H](N[C@@H](C)c2cc(C(=O)O)ccc2O)C1 1599104437 NVXYFOOUPHRZHK-MVWJERBFSA-N 279.336 2.309 10 20 CECD C[C@H](N[C@@H]1CO[C@@H](C2CC2)C1)c1cc(C(=O)O)ccc1O 1593234328 YLXJJIGWTKGJBX-ONENECBXSA-N 291.347 2.309 10 20 CECD CC[C@@H](C)N(C)CCNCc1cccc(OC)c1O 217386508 QDQFNYZMZVYPBM-GFCCVEGCSA-N 266.385 2.221 10 20 CECD Cc1ccc([C@H](C)NCCCN2CCOCC2)c(O)c1 20142025 OJZYIYLJIPEKDG-AWEZNQCLSA-N 278.396 2.074 10 20 CECD CN(C)c1ccc(CNC2CC(CCC(=O)O)C2)cc1 1777039966 NZRDDNBNWFOYTB-UHFFFAOYSA-N 276.380 2.486 10 20 CECD CCN(C)c1ccc(CN[C@@H]2C[C@@]3(C(=O)O)C[C@@H]23)c(C)c1 1776856638 WMVHWLQMESDWMZ-UXLLHSPISA-N 288.391 2.404 10 20 CECD CC[C@H](NCC(=O)NC(C)C)c1ccc(N(C)C)cc1 160953634 YMJPHAWQFDQAFY-HNNXBMFYSA-N 277.412 2.318 10 20 CECD COc1ccc(N(C)CC(=O)Nc2cc(C)on2)cc1 844353774 ZYFCZFVIWPPDNW-UHFFFAOYSA-N 275.308 2.067 10 20 CECD Oc1cc2c(cc1CNC[C@H]1CSCCS1)OCO2 125228103 BQALFBQRSMMLBP-JTQLQIEISA-N 299.417 2.059 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)Cn2cccn2)c1 37155345 PYSBDYJKCMVGAY-VXGBXAGGSA-N 275.352 2.337 10 20 CECD CC(C)NC(=O)CCN[C@@H](C)c1cc(F)ccc1O 181270397 YFTRVFXAQXNITG-JTQLQIEISA-N 268.332 2.097 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@H](C)c1cc(C)ccc1O 188484137 GGOYIHRRKPOPEL-NEPJUHHUSA-N 264.369 2.218 10 20 CECD COc1cccc(CNC[C@@H](OC)C(C)C)c1O 72924437 CHAWRVVRMLUNQW-CYBMUJFWSA-N 253.342 2.161 10 20 CECD C[C@@H](NCCC1(CO)CC1)c1ccc(F)cc1O 396025486 YFYYDFQPWSLAJH-SNVBAGLBSA-N 253.317 2.345 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]2C(C)(C)O)c1O 305734066 LHQDZGHAOQVYSU-CQSZACIVSA-N 295.354 2.469 10 20 CECD CC[C@@H](CO)NC1CCN(c2ccc(OC)cc2)CC1 305071281 LMBJJWHILDMXQQ-ZDUSSCGKSA-N 278.396 2.025 10 20 CECD COc1cccc(CN2CCC3(CC2)C[C@H]3C(=O)O)c1O 405339389 MFUCTOCWYOWRTB-LBPRGKRZSA-N 291.347 2.088 10 20 CECD CCc1ncc(C(=O)NCCc2ccc(O)c(O)c2)s1 122618663 GEVVNSQOEJWTIF-UHFFFAOYSA-N 292.360 2.089 10 20 CECD CC(=O)OC1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 127029014 NTMVQPSAGYXCRU-UHFFFAOYSA-N 294.370 2.419 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)c1nncn1C 124800127 HFBXRDXDEXYOCW-QMMMGPOBSA-N 266.732 2.025 10 20 CECD CCC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)CCO1 182943670 GKOJOZCGPQNVIR-LLVKDONJSA-N 279.336 2.047 10 20 CECD COC[C@H](O)CCN[C@@H](C)c1cc2c(cc1O)CCCC2 186203096 YKBYBKNKYOZDON-SWLSCSKDSA-N 293.407 2.319 10 20 CECD Cc1ocnc1C(=O)NCc1ccc2c(c1)CCCN2C 121924040 WKESKJWMNWOKFE-UHFFFAOYSA-N 285.347 2.295 10 20 CECD COC(=O)[C@H]1CCN(Cc2cccc(OC)c2O)C[C@H]1C 188121855 MZRWIYFWOFVVNW-YPMHNXCESA-N 293.363 2.032 10 20 CECD Cc1cncc(CNC(=O)c2ccc(C)c(O)c2O)c1 182944408 YRSPEMCOROCKPJ-UHFFFAOYSA-N 272.304 2.040 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc[n+]([O-])cc1 73029416 FXBGWEQZLFMULH-UHFFFAOYSA-N 299.374 2.048 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@@H](C)O)cc1F 130710710 HXXMAWMANFQUKX-GFCCVEGCSA-N 268.376 2.485 10 20 CECD CN(C)c1ccc(CNCCCCCCO)cc1 83383750 GVLHIRYWHMWJLR-UHFFFAOYSA-N 250.386 2.395 10 20 CECD Cc1cc(O)c(CN[C@H]2C[C@H]3CC[C@H]2NC3)cc1C 530246623 QNKOMZMZNCGTHS-YUELXQCFSA-N 260.381 2.239 10 20 CECD Cc1ccc(CN[C@H](C)c2ccccc2O)c(=O)n1C 279442254 HOCHFEWXWXBZDA-GFCCVEGCSA-N 272.348 2.250 10 20 CECD CC(C)N1C[C@H](N[C@@H](C)c2ccc(F)c(F)c2O)CC1=O 276898532 ISWRPQBSDVKHPX-VHSXEESVSA-N 298.333 2.330 10 20 CECD CC1(C)[C@H]2OCCC[C@@H]2[C@H]1NC(=O)c1cccc(O)c1O 370498572 HQOCBVIREAQORZ-HONMWMINSA-N 291.347 2.031 10 20 CECD CCCCN(Cc1ccccc1O)[C@H]1CCOC1=O 282492351 PXJKIWRYBLMCID-ZDUSSCGKSA-N 263.337 2.310 10 20 CECD CCC1(CC)CN(C(=O)c2c(F)ccc(O)c2O)C1 295685349 VZMMBBWTPUXYQL-UHFFFAOYSA-N 267.300 2.499 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cccc(OC)c2O)[C@@H]1SC 298198591 XQTMMHFBWKJNCI-KYOSRNDESA-N 297.420 2.399 10 20 CECD C[C@@H](NC[C@@]1(C)CCCNC1)c1cc([N+](=O)[O-])ccc1O 817965790 CISCEAJOBLOGJQ-ABAIWWIYSA-N 293.367 2.341 10 20 CECD Oc1cccc(Cl)c1CN1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 824839003 UUODOZBCDHEJAU-XEQNPHJVSA-N 277.751 2.431 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H]2C=CCC2)c1O 826940754 FPSALFWSAYTTRW-JTQLQIEISA-N 264.281 2.117 10 20 CECD Oc1cc(Br)ccc1CN1CCC[C@@H](O)C1 824491008 LDUPVJSPNUNLGJ-LLVKDONJSA-N 286.169 2.111 10 20 CECD COCCOC1CN(Cc2cc(Cl)cc(F)c2O)C1 838988535 YSAYSLFNUQUBOJ-UHFFFAOYSA-N 289.734 2.032 10 20 CECD COCCOC[C@@H](C)N[C@H]1CCc2cccc(O)c21 834667883 CPLIKRGHCCOIDC-YPMHNXCESA-N 265.353 2.021 10 20 CECD CC[C@H](NC[C@@H]1CCN1C)c1ccc(N(C)C)cc1 903321427 FCRDFGGLGADUSA-HOTGVXAUSA-N 261.413 2.497 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 903299191 HIGAPYSIQGGLOT-XIDUGBJDSA-N 295.354 2.473 10 20 CECD COCC1(C(=O)NCc2ccc(OC)cc2O)CCCC1 837592209 LOWDTXOCRCMIOW-UHFFFAOYSA-N 293.363 2.224 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 834902844 DJXLJJXOXZSQDA-RFVSLCSESA-N 295.354 2.473 10 20 CECD C/C=C\C(=O)NCc1ccc(N2CCC(CO)CC2)cc1 737857516 NNGUWJCQQZTJDC-IHWYPQMZSA-N 288.391 2.088 10 20 CECD O=S(=O)(CCCCF)Nc1ccc(O)c(F)c1F 830185257 YHFZSTBVCCUVBQ-UHFFFAOYSA-N 283.271 2.162 10 20 CECD COc1ccc(N(C)CCN(C)C(=S)NC(C)C)cc1 844583397 VVTVFNIGSGYOPP-UHFFFAOYSA-N 295.452 2.346 10 20 CECD CC(=O)NCCCSc1ncc(Cl)s1 849999805 YQTQDBFEKJGYMV-UHFFFAOYSA-N 250.776 2.415 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCC[C@H]2CN)cc1F 841030950 PYTWKAJEYPIBEK-DZGCQCFKSA-N 279.403 2.499 10 20 CECD CO[C@@H](CC(=O)N(C)Cc1ccccc1O)C(F)(F)F 845792358 UTTBMEJKQQWIOA-NSHDSACASA-N 291.269 2.318 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H](C)CCN 841966915 HRXDVXZIDDWZDO-CYBMUJFWSA-N 292.427 2.021 10 20 CECD O=C(NCC[C@H](O)c1ccccc1)c1cc(O)cs1 754907598 NNFPJTFHYCBQES-LBPRGKRZSA-N 277.345 2.307 10 20 CECD CC(C)NCC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 851637127 DHXHXQUAQIXJKD-UHFFFAOYSA-N 291.439 2.488 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc2n1CCC2 854324144 HYKXVPGSPONYRT-UHFFFAOYSA-N 298.390 2.168 10 20 CECD C[C@H](N[C@H](CCO)C1CC1)c1cc(F)cc(F)c1O 756739385 MUAOXPLCMGQPJT-ISVAXAHUSA-N 271.307 2.482 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@H]1CCCO1 935946916 PUJDEUDBUYETSF-NSHDSACASA-N 284.352 2.063 10 20 CECD C[C@H](NCCn1ccnc1)c1cc(F)cc(F)c1O 756371628 MDKZOSJXZGITFM-VIFPVBQESA-N 267.279 2.218 10 20 CECD CCCN(CC(=O)OCC)Cc1cc(OC)c(C)cc1O 768443163 QCZVWCSOUUFHHM-UHFFFAOYSA-N 295.379 2.484 10 20 CECD O=C(Cc1n[nH]c2ccccc12)NCc1ccccc1O 769365790 SIPLYRGWAJDLGC-UHFFFAOYSA-N 281.315 2.127 10 20 CECD CCOCCO[C@H]1CCN(Cc2ccc(C)cc2O)C1 876814487 NMKUNCPBHSVDEG-HNNXBMFYSA-N 279.380 2.328 10 20 CECD Cc1ncsc1/C=C/C(=O)N1CCc2ncccc21 776874880 PFOKMUMYESNOKG-SNAWJCMRSA-N 271.345 2.449 10 20 CECD Nc1ccc(CNC(=O)c2cccnc2N2CCCC2)cc1 1122535736 GTHIOKPMADJKAG-UHFFFAOYSA-N 296.374 2.194 10 20 CECD C[C@H](NCc1ccnc(N(C)C)n1)c1ccccc1O 783525760 NVKQPUAZHSVFQA-NSHDSACASA-N 272.352 2.099 10 20 CECD COCCOC(=O)CSc1ncc(Cl)s1 784648049 VXVZQALWOYEASS-UHFFFAOYSA-N 267.759 2.078 10 20 CECD Cc1ccc(C(=O)NCCc2ccc(O)cc2)c(O)c1O 780984694 LVDPFEMHKWEJRT-UHFFFAOYSA-N 287.315 2.084 10 20 CECD C[C@@H]1C[C@@H]1C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891257425 HBCSCXWJNPQPPY-KCXAZCMYSA-N 289.423 2.128 10 20 CECD CC(C)(O)CCC(=O)NCc1ccc(N2CCCC2)cc1 786956795 WJUCMGUICUNOSM-UHFFFAOYSA-N 290.407 2.454 10 20 CECD COc1cc(O)cc(NC(=O)c2ccc(C)c(O)c2O)c1 781023721 DOBLOCFISNUQLP-UHFFFAOYSA-N 289.287 2.373 10 20 CECD C[C@H]1C[C@@H](O)CN1Cc1cc(Cl)cc(F)c1O 788270791 RURAHZQUSDUWCY-OIBJUYFYSA-N 259.708 2.140 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@]2(C)CCCOC2)c1 781352014 RVZVARAHDUCUJV-ZBEGNZNMSA-N 293.363 2.395 10 20 CECD COc1cc(C)cc(CN2CCCC3(C2)OCCO3)c1O 894425327 UPOSBLRBKLOPDC-UHFFFAOYSA-N 293.363 2.048 10 20 CECD COc1cc(Cl)cc(CNCC2(O)CCC2)c1O 169087778 MXAYHWAMTKXMST-UHFFFAOYSA-N 271.744 2.059 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2CC=C(C(=O)O)C2)cc1F 1329681640 ITYCFBDDKGEIES-LLVKDONJSA-N 296.317 2.294 10 20 CECD CSC[C@@H]1CCCN1C(=O)c1cccc(O)c1O 193138657 CDDJMWCIRSYPNC-VIFPVBQESA-N 267.350 2.065 10 20 CECD CCc1cccc(CN2CC[C@](O)(C3CC3)C2)c1O 1329170635 ZIUXTXYMKFQCAU-MRXNPFEDSA-N 261.365 2.301 10 20 CECD CCc1cccc(CN[C@H](CO)CC(F)F)c1O 717734600 CDCNFQJJJUPKRY-NSHDSACASA-N 259.296 2.060 10 20 CECD C[C@@H]1COC[C@@H]1NCc1ccc(Br)cc1O 691469698 ZPRJTWIFBUVRQY-KCJUWKMLSA-N 286.169 2.279 10 20 CECD COc1cc(C)cc(CNCC2([S@](C)=O)CCC2)c1O 1334368462 VJUVIMMIZHAXCF-FQEVSTJZSA-N 297.420 2.100 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H]2OCCC[C@@H]2C1 1347321906 DSOZSDSKHQPGTI-MWLCHTKSSA-N 267.350 2.095 10 20 CECD Cc1cccc(CN(C)C(=O)NCc2ccc(N)cc2)n1 1357792080 SDVCIDQSAGBTLM-UHFFFAOYSA-N 284.363 2.314 10 20 CECD NC(=O)c1ccc(NCc2ccccc2O)c([N+](=O)[O-])c1 163774123 KTECLFGJGNTFHM-UHFFFAOYSA-N 287.275 2.011 10 20 CECD COc1ccc(N(C)CC[C@H]2CCNC2)cc1F 259128440 WISSIYRNAGCQAM-LLVKDONJSA-N 252.333 2.270 10 20 CECD COc1cccc(CNC[C@H](O)CC(C)(C)C)c1O 227372892 XWCGXFOJAOPPEM-GFCCVEGCSA-N 267.369 2.288 10 20 CECD COC(C)(C)CC(=O)N(C)Cc1ccccc1O 279946437 RUSZDZOXJOZGCH-UHFFFAOYSA-N 251.326 2.166 10 20 CECD C[C@H](CNCc1ccc2c(c1)CCO2)CN1CCCC1 58062696 QYYDUUQCHVLCSP-CQSZACIVSA-N 274.408 2.443 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@]2(C)CCOC2)c1 397117929 JYCGYJHRZLWNEQ-IAQYHMDHSA-N 265.353 2.478 10 20 CECD C[C@@H](CCO)CCNCc1ccc(N(C)C)cc1 397612621 CVYFQOSXTIBIPJ-CYBMUJFWSA-N 250.386 2.251 10 20 CECD CCN(C)C(=O)NCc1ccc(N2CCSCC2)cc1 101794835 WVFTWIYAZIVRLY-UHFFFAOYSA-N 293.436 2.401 10 20 CECD CCc1nnc(CN(C)c2ccc(OC)c(OC)c2)o1 64517727 RVULHJUUAQGCBS-UHFFFAOYSA-N 277.324 2.286 10 20 CECD COc1ccc(O)c(CNC(=O)/C=C(\C)C2CC2)c1 172042597 FRYXOLTWXDHBOI-JXMROGBWSA-N 261.321 2.373 10 20 CECD CCCN(CCCNC(C)=O)Cc1ccccc1O 174372959 SLKIYAIIWUTEFH-UHFFFAOYSA-N 264.369 2.130 10 20 CECD C[C@@H]1CCN[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 126567910 QJQUTXNVHFJQCX-CZUORRHYSA-N 289.423 2.099 10 20 CECD C[C@H](CC[S@](C)=O)NCc1cc(Cl)ccc1O 125469387 KVECOXRJMLBEIF-VVVCHXIZSA-N 275.801 2.292 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1cccs1 180592386 BPOXQJVYKLTVKB-GQCTYLIASA-N 275.329 2.489 10 20 CECD Cc1ccc(O)c(CN2CCN(Cc3ccncc3)CC2)c1 184714551 NJVHNTHPNMDIFU-UHFFFAOYSA-N 297.402 2.413 10 20 CECD CC(C)[C@@H](Sc1nccs1)C(=O)N1CCOCC1 133248482 FQJAYXZZLWUCOX-SNVBAGLBSA-N 286.422 2.119 10 20 CECD CN(Cc1ccccc1O)C(=O)Nc1ccncc1 48954439 ZDJDDLCJWZALHO-UHFFFAOYSA-N 257.293 2.451 10 20 CECD CCCCN(CC)CC(=O)NCc1ccc(N(C)C)cc1 131880231 WNHNXNDMHYWGPE-UHFFFAOYSA-N 291.439 2.491 10 20 CECD CNC(=O)CC1CCN(Cc2cccc(C)c2O)CC1 180378714 YBTJAFCVZUUXPN-UHFFFAOYSA-N 276.380 2.049 10 20 CECD CCCN(CCC)C(=O)c1c(F)ccc(O)c1O 276767862 XWEMFCMVCBRNNC-UHFFFAOYSA-N 255.289 2.499 10 20 CECD CN(C)c1ccc(CNC(=O)NC[C@@H]2CCSC2)cc1 279125022 MAGAPCKIMAUUTC-ZDUSSCGKSA-N 293.436 2.305 10 20 CECD Cc1cc(O)c(CN2CCO[C@@]3(CCO[C@H]3C)C2)cc1C 377272321 BLQAYBTWSHZDKF-YOEHRIQHSA-N 291.391 2.389 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1cccc(OC)c1O 281306568 QEBODPFSOOWWMZ-LLVKDONJSA-N 281.352 2.174 10 20 CECD CC[C@@H](NC[C@H]1CC[C@@H](CO)O1)c1ccc(C)cc1O 293708324 MPKSXSBQNPFGSR-VNHYZAJKSA-N 279.380 2.281 10 20 CECD COc1cc(O)c(CN[C@H](CO)C2CCCC2)cc1OC 291010238 WTQOFIFUVFWOEL-CYBMUJFWSA-N 295.379 2.050 10 20 CECD CC(C)COCCOC(=O)/C=C/c1ccc(O)c(O)c1 800186638 GBQOOFLDWRVDTN-GQCTYLIASA-N 280.320 2.327 10 20 CECD Cc1nccnc1[C@@H](C)NCCc1ccc(N)cc1 817957165 JTCSSSMTVWCAQN-LLVKDONJSA-N 256.353 2.261 10 20 CECD C[C@H](N)[C@H](Cc1ccccc1)NCCc1ccc(N)cc1 817958471 WHMWMAGYRYSTJE-KSSFIOAISA-N 283.419 2.359 10 20 CECD CCOc1ccc(CNc2nc(CC)no2)c(O)c1 814255263 DPPGUQMZJLNDPL-UHFFFAOYSA-N 263.297 2.348 10 20 CECD Cn1ccc(CNCc2cc(Cl)c(F)cc2O)n1 816559405 JIDJOWJHJWXXAR-UHFFFAOYSA-N 269.707 2.208 10 20 CECD C[C@H](NCC1CNC1)c1cc(Br)ccc1O 817965333 OMOWXBYTZPQBHZ-QMMMGPOBSA-N 285.185 2.025 10 20 CECD CCCN1C[C@H](CN[C@H](C)c2ccccc2O)CC1=O 817590159 UYYSORBSIZSHAG-OLZOCXBDSA-N 276.380 2.301 10 20 CECD COc1cccc(CN2CCNC(=O)c3ccccc32)c1O 811508522 UUXNCHCPADXTIS-UHFFFAOYSA-N 298.342 2.151 10 20 CECD CNCCC(=O)NCc1ccc(N2CCC(C)CC2)cc1 828988092 MAZMYXHCRXKPHT-UHFFFAOYSA-N 289.423 2.149 10 20 CECD C[C@@H](NC(=O)[C@H]1CCc2ncncc2C1)c1ccccc1O 827951972 BBOAMVYXPSBJKX-NEPJUHHUSA-N 297.358 2.165 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@H](O)C1CC1 824261757 KVQOCIDKKGIPDM-MRXNPFEDSA-N 288.391 2.064 10 20 CECD O=C(CN(Cc1ccccc1O)C1CCCC1)NC1CC1 731847466 LDWPLCYPBDMJLV-UHFFFAOYSA-N 288.391 2.415 10 20 CECD Cc1cnn(C)c1C(=O)NCc1ccc2c(c1)CCCN2C 839606455 QASUDRQQMBWZRD-UHFFFAOYSA-N 298.390 2.041 10 20 CECD CC(C)(CC(=O)O)NCc1cc(Cl)ccc1O 736311536 XCPPUXUROGJVNO-UHFFFAOYSA-N 257.717 2.389 10 20 CECD C[C@H](O)C[C@H]1CCCCN1C(=O)c1cc(O)cs1 834740832 YSMKRNBAQRUJBK-VHSXEESVSA-N 269.366 2.219 10 20 CECD Cc1ccc(CCNCc2cc([N+](=O)[O-])ccc2O)nc1 835066607 YXDLPKCRBJUJHC-UHFFFAOYSA-N 287.319 2.336 10 20 CECD C[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)[C@@H]1CN 843051089 DZLMRASTASBHQQ-MLGOLLRUSA-N 279.403 2.451 10 20 CECD CC[C@H](CO)N(C)Cc1ccc(N(C)C)cc1C 840950636 MEAZYZOWDYACOY-CQSZACIVSA-N 250.386 2.264 10 20 CECD Cc1cc(C(=O)OCC(=O)c2ccc(O)c(O)c2)c(C)o1 916590206 JFUBRLKJWYHDAD-UHFFFAOYSA-N 290.271 2.347 10 20 CECD COC[C@@H](C)CN[C@H](C)c1cccc(OC)c1O 846147065 VIDNGIXKICSSIG-WDEREUQCSA-N 253.342 2.334 10 20 CECD Cc1cc(O)c(CN2CCN[C@@H](C(C)C)C2)cc1C 843103928 DZBPICLJOSKHKU-OAHLLOKOSA-N 262.397 2.439 10 20 CECD COc1cc(C)cc(CN2C[C@H]3[C@H](C2)C3(F)F)c1O 844754748 YQHDVFUGLTZACY-QWRGUYRKSA-N 269.291 2.406 10 20 CECD C[C@@H]1C[C@H](CN)CN1Cc1cccc(Br)c1O 843057871 NFFQESDXLDGPEL-NXEZZACHSA-N 299.212 2.324 10 20 CECD COc1ccc(N(C)CCOC[C@@H]2CCCO2)cc1OC 741243871 ALDGWIHYMFVBLH-AWEZNQCLSA-N 295.379 2.336 10 20 CECD Cc1ccc(CNC[C@@H](N)c2ccc(N(C)C)cc2)nc1 841041187 BNZSFXVLIPSVQO-QGZVFWFLSA-N 284.407 2.246 10 20 CECD COc1ccc(N(C)Cc2nc(C(C)(C)N)no2)cc1F 843359174 JNXPMLPTNYKWAE-UHFFFAOYSA-N 294.330 2.048 10 20 CECD COc1cccc(CNC(=O)c2c[nH]c3ncccc23)c1O 741282816 PLKVEUPNASNYBA-UHFFFAOYSA-N 297.314 2.207 10 20 CECD C[C@@H](NC[C@H](O)CN1CCCC1)c1ccc(Cl)cc1O 841744522 IHVAKDHUHVLCOP-YPMHNXCESA-N 298.814 2.153 10 20 CECD CN1C(=O)C2(CCCC2)N[C@H]1c1cc(Cl)ccc1O 742441770 HPFRDSOPMUBSPF-GFCCVEGCSA-N 280.755 2.419 10 20 CECD CN(C)c1cc(F)c(CNC[C@H](O)C(F)(F)F)cc1F 858106424 ISEHHGYGLVBVOG-NSHDSACASA-N 298.255 2.044 10 20 CECD CCOc1ccc(CN2CCO[C@@H](C)C2)c(O)c1 768226691 AUNIAIQMSLQGHT-NSHDSACASA-N 251.326 2.012 10 20 CECD CCCOc1ccc(CNCCCNC(C)=O)cc1C 873008450 LLLPZUKGJCNAQD-UHFFFAOYSA-N 278.396 2.400 10 20 CECD COC1(C)CCN(C(=O)c2cc(O)cs2)CC1 775619141 RKAAURSPPNRKQN-UHFFFAOYSA-N 255.339 2.095 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCO[C@]2(CCOC2)C1 883081887 QSZNTXKTOKOVGA-IUODEOHRSA-N 299.317 2.098 10 20 CECD Cc1ccc(C(=O)N[C@H](C)Cc2cccnc2)c(O)c1O 889667032 JOVGWSTWYKYKGH-LLVKDONJSA-N 286.331 2.162 10 20 CECD Oc1c(F)cc(Cl)cc1CN1C[C@H]2CC[C@@H](O)[C@H]2C1 895781357 PYUCWXLAKFALDP-YDEJPDAXSA-N 285.746 2.387 10 20 CECD OC1CCN(c2ccc(CNC/C=C\Cl)cc2)CC1 898427641 DJBGNNKGQUUOGU-QPIMQUGISA-N 280.799 2.490 10 20 CECD Cc1ccc(C(=O)Nc2cncc(F)c2)c(O)c1O 799012952 ZUNSECZZNPMILO-UHFFFAOYSA-N 262.240 2.193 10 20 CECD C[C@@H](CNCc1c(O)ccc(Cl)c1F)N(C)C 790959059 DMQNZNJOQPVELU-QMMMGPOBSA-N 260.740 2.224 10 20 CECD COC(=O)c1cnc(S[C@@H](C)c2nccc(N)n2)s1 1327220220 RGPUUBDPHBNVEQ-LURJTMIESA-N 296.377 2.155 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCN2CCCC[C@H]12 708481630 RWSXYHXSFWCBFA-ZIAGYGMSSA-N 282.334 2.387 10 20 CECD Oc1cc(Br)ccc1CNC1CCOCC1 691429104 OSDGYAYMUZIJLF-UHFFFAOYSA-N 286.169 2.423 10 20 CECD COc1ccc(O)c(CN[C@H]2CCC[C@H](OC)C2)c1 776252578 GZEXEZBVEQXRJS-STQMWFEESA-N 265.353 2.448 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC[C@H](F)C1 1345723966 VBHZRKPMXGHHPX-NWDGAFQWSA-N 266.316 2.472 10 20 CECD CCOC(=O)C[C@H]1CCCN1Cc1ccc(N)cc1 1262486793 APPRBDZIGHUZQD-CQSZACIVSA-N 262.353 2.186 10 20 CECD Cc1ccc(O)c(CN(C[C@H](C)C(=O)O)C2CC2)c1 1600465010 MZOVLPOCYAIQLZ-NSHDSACASA-N 263.337 2.386 10 20 CECD Cc1nc(NCc2ccccc2O)ccc1C(=O)O 1600717637 JYJBLGUADUJNCK-UHFFFAOYSA-N 258.277 2.406 10 20 CECD CCN(CC(=O)O)Cc1cc(Cl)c(F)cc1O 1609992633 MXBHEMBFRVQWPE-UHFFFAOYSA-N 261.680 2.091 10 20 CECD CCCN(Cc1cc(F)c(F)cc1O)[C@@H]1CCNC1 1577526989 LQFCGOJWVACBLA-LLVKDONJSA-N 270.323 2.244 10 20 CECD CN(Cc1nccs1)c1ccc(OCC(=O)O)cc1 1598538960 DJHNDHPJIUPALO-UHFFFAOYSA-N 278.333 2.243 10 20 CECD CN(Cc1ccc(C(=O)O)cn1)Cc1ccccc1O 1598515743 RQMVIKBTASKNLM-UHFFFAOYSA-N 272.304 2.117 10 20 CECD Cc1ccc(CN2CC[C@@H](C)[C@@H](C(=O)O)C2)c(O)c1 1594360372 WXEOCMFMHZYRRR-YPMHNXCESA-N 263.337 2.243 10 20 CECD C[C@H](C(=O)O)[C@@H]1CCCN1Cc1ccc(N(C)C)cc1 1776224911 VBDQQURIBTYKBN-WFASDCNBSA-N 276.380 2.438 10 20 CECD CCN1CCc2cc(CNC(C)(C)C(=O)O)ccc21 1776884778 TYBANNBTBKKKFQ-UHFFFAOYSA-N 262.353 2.022 10 20 CECD CCOc1ccc(N(C)CC(=O)Nc2cc(C)on2)cc1 150733096 RUKLXEBROXBNPV-UHFFFAOYSA-N 289.335 2.457 10 20 CECD CC(C)C[C@H](CN)NCc1ccc2c(c1)CCCO2 904354377 WSAQFOWDHHGATQ-OAHLLOKOSA-N 262.397 2.475 10 20 CECD N[C@@H]1CCCCC[C@H]1NCc1ccc2c(c1)CCO2 817901282 AQKZOKVDZOIHIH-HUUCEWRRSA-N 260.381 2.371 10 20 CECD CCON1CCC(NCc2ccc3c(c2)CCO3)CC1 924902410 YSQLVWCLGHXQLQ-UHFFFAOYSA-N 276.380 2.127 10 20 CECD CCN(CC)C(=O)CN[C@H](C)c1ccc(C)cc1O 228792788 QIAVARXIVRJORH-GFCCVEGCSA-N 264.369 2.220 10 20 CECD CC[C@@H](NCCN)c1cc(Br)ccc1O 37712453 GVBOUTOGFRZOEJ-SNVBAGLBSA-N 273.174 2.154 10 20 CECD O=C(CCNCc1ccc2c(c1)CCO2)N1CCCCC1 77329431 HGFWQNZTSCPRPC-UHFFFAOYSA-N 288.391 2.114 10 20 CECD C[C@@H]1SCC[C@H]1NCc1cc2c(cc1O)OCO2 381036922 UUDQIDPWVNUDRK-WCBMZHEXSA-N 267.350 2.105 10 20 CECD Cc1ccc(O)c(CN2CCC(c3nncn3C)CC2)c1 91795540 ZJSJZDBTZYRDPJ-UHFFFAOYSA-N 286.379 2.209 10 20 CECD Cc1nn(C)c(C)c1C[C@@H](C)C(=O)Nc1ccc(N)cc1 237461705 OLPDWQQEPBWGBX-SNVBAGLBSA-N 286.379 2.436 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCC2CCC2)c1O 278640010 HSQQSMIEPJREAR-UHFFFAOYSA-N 266.297 2.199 10 20 CECD CC(C)N1CCN(Cc2cccc(Cl)c2O)CC1=O 272479846 BUWKIQAEIQJAAK-UHFFFAOYSA-N 282.771 2.098 10 20 CECD CCC[C@](C)(N)C(=O)NCc1ccc(N2CCCC2)cc1 272399902 ZHRDKJATZQHAGU-KRWDZBQOSA-N 289.423 2.421 10 20 CECD COC(=O)[C@@H](NCc1ccc(OC)c(C)c1)C1CC1 272785693 BTXJDPBBARLWRN-AWEZNQCLSA-N 263.337 2.045 10 20 CECD CCN(CC1CCS(=O)(=O)CC1)c1ccc(OC)cc1 271306364 PZUNGSAWJHIXPQ-UHFFFAOYSA-N 297.420 2.346 10 20 CECD CCCN(CCC)c1ccc(CNC[C@@H](O)COC)cc1 282657184 MNXAFHWYAOMJGU-QGZVFWFLSA-N 294.439 2.410 10 20 CECD CN(Cc1n[nH]c(C(C)(C)C)n1)c1ccc2c(c1)OCO2 292853319 GHJTWXCOQVFEJF-UHFFFAOYSA-N 288.351 2.467 10 20 CECD CC(=O)NCCCCCC(=O)N(C)Cc1ccccc1O 299253308 FAKUEMRTQRMQED-UHFFFAOYSA-N 292.379 2.047 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H](C3CC3)C1)[C@H](O)CO2 808230837 RBAQYQOZOGFQKZ-MLGOLLRUSA-N 289.375 2.440 10 20 CECD O=C(Nc1nccc2ccncc12)c1cccc(O)c1O 802615907 OKZXCOZINXVYAX-UHFFFAOYSA-N 281.271 2.293 10 20 CECD Cc1cnc(C(=O)NCc2ccc3c(c2)CCCN3C)o1 813810149 FHLJNJOGKGBWLC-UHFFFAOYSA-N 285.347 2.295 10 20 CECD CCN(Cc1ccc(N2CCOCC2)cc1)C[C@H](C)OC 812808776 LSFDUPQGDOKYFT-HNNXBMFYSA-N 292.423 2.380 10 20 CECD OCCCCNCc1cc(Br)cc(F)c1O 715721999 QORJWYILESWVRK-UHFFFAOYSA-N 292.148 2.156 10 20 CECD COC(=O)[C@@H](CNCc1cccc(OC)c1O)CC(C)C 813331444 JCAJBCNACODVFN-CYBMUJFWSA-N 295.379 2.326 10 20 CECD Cc1cc(CN(C)[C@@H](CO)COC(C)C)ccc1N(C)C 815101765 AKCUPTIGOYEIPA-INIZCTEOSA-N 294.439 2.279 10 20 CECD CC[C@H](N)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 826019830 LDEXJOJQDMQTPY-HNNXBMFYSA-N 277.412 2.229 10 20 CECD Cc1ccncc1/C=C\C(=O)N(C)c1ccccn1 492503436 QUOKQAPBDIXWKL-SREVYHEPSA-N 253.305 2.461 10 20 CECD CCC[C@@H](OC)C(=O)N[C@H](C)c1ccccc1O 827952479 UIQWBFGJZTZGTF-ZWNOBZJWSA-N 251.326 2.385 10 20 CECD CN(Cc1ccccc1O)c1ccc(-c2nn[nH]n2)cc1 825981202 QHUZTIZBJKZGBZ-UHFFFAOYSA-N 281.319 2.209 10 20 CECD Cc1cc(N(C)C)ccc1CNC1CC(C(=O)O)C1 901794776 BGDZKQPAUUINGW-UHFFFAOYSA-N 262.353 2.014 10 20 CECD CCOc1cccc(CN[C@@H]2CCC[C@@H]2C(=O)O)c1O 904268775 ISPYTNSVEKWMNN-NWDGAFQWSA-N 279.336 2.134 10 20 CECD CCN1C[C@H](CN[C@H](C)c2ccc(C)cc2O)CC1=O 846207826 GHOOPGDEBHWPOF-OLZOCXBDSA-N 276.380 2.220 10 20 CECD C[C@H]1CN(C(=O)NCCc2ccc(N)cc2)CC(C)(C)O1 841957050 MIRGYGKMLNARJJ-LBPRGKRZSA-N 291.395 2.020 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CC2(CCC2)O1 842644711 TZCDLADTVGIMAS-LLVKDONJSA-N 291.347 2.264 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Br)ccc2O)CCN1 841062825 YBAQWEMDUFOMEY-SKDRFNHKSA-N 299.212 2.385 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1cc(Cl)cc(F)c1O 841065110 NFSPPKSTCHLDMG-UFBFGSQYSA-N 272.751 2.415 10 20 CECD CC[C@@H](N[C@H]1C[C@H](CO)C1)c1ccc(F)cc1O 927149005 WRKZTPJIBPXPSB-IRUJWGPZSA-N 253.317 2.343 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@]3(N)C2)cc1F 857225905 AFIKYEQGVHFBQB-BBRMVZONSA-N 277.387 2.205 10 20 CECD COc1ccccc1[C@@H]1C[C@H]1NC(=O)Cc1ccc(N)cc1 851645358 FUVNOAKHQLLALT-JKSUJKDBSA-N 296.370 2.492 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCn2cccc2)c1 751060710 KQIOWEDCECLQAC-LBPRGKRZSA-N 288.347 2.470 10 20 CECD CO[C@@H]1CCN(C(=O)c2cc(C)n(-c3ccccn3)c2C)C1 752473058 QHCNAUICQWOTBB-CQSZACIVSA-N 299.374 2.350 10 20 CECD CCOc1ccc(CN2CC[C@H](CN(C)C)C2)c(O)c1 769405491 WSAKXZASOAQDBK-CYBMUJFWSA-N 278.396 2.174 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2c2nc[nH]n2)cc1 931139796 CCCFHXYPHCTEDD-AWEZNQCLSA-N 271.368 2.208 10 20 CECD Cc1ccc(O)c(CNC(=O)c2nn(C)c3c2CCCC3)c1 862754375 BZJKZZASGYHSCL-UHFFFAOYSA-N 299.374 2.243 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1SCCS1 761169817 TZNAMWSJMRAAJT-UHFFFAOYSA-N 296.461 2.483 10 20 CECD C[C@@H]1C(=O)N(Cc2ccc(N(C)C)cc2)C(=O)N1C1CC1 760950417 PSQDUKCJBWMECW-LLVKDONJSA-N 287.363 2.068 10 20 CECD CCN1CC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 761578044 JQEAUPGYFANOLR-NSHDSACASA-N 275.352 2.098 10 20 CECD Cc1ccc(CNCC(=O)NC2CCCCC2)c(O)c1 877010373 WKAODUSOJSOPDI-UHFFFAOYSA-N 276.380 2.239 10 20 CECD Cc1ccc(CNc2ccc(CCO)nc2)c(O)c1 877533664 UZVWUDSCWDVLDI-UHFFFAOYSA-N 258.321 2.243 10 20 CECD CC[C@@H](C)[C@@](C)(O)CNCc1cc(OC)c(OC)cc1O 776173869 BXPMDJMVAZCXNZ-BZNIZROVSA-N 297.395 2.296 10 20 CECD CN(CCNCc1cc(F)cc(F)c1O)CC(F)(F)F 882993292 OCMIHSAILLMTOX-UHFFFAOYSA-N 298.255 2.254 10 20 CECD CN(Cc1ccccc1O)c1nnc(C(C)(F)F)n1C 1121336055 HGCVRCDXNKQPMH-UHFFFAOYSA-N 282.294 2.269 10 20 CECD CN(Cc1ccccc1O)C(=O)C1(c2cccnc2)CC1 789988541 IIHOIJQPDRZISQ-UHFFFAOYSA-N 282.343 2.477 10 20 CECD COc1cc(C)ccc1C(=O)NCc1ccc(O)c(O)c1 780935940 PHZLAHUXEYIYDW-UHFFFAOYSA-N 287.315 2.345 10 20 CECD COc1cccc(CNc2ccc(C(N)=O)c(C)c2)c1O 798085728 WTTJKTMURGONBY-UHFFFAOYSA-N 286.331 2.420 10 20 CECD OC[C@@]1(F)CCN(Cc2ccc(N3CCCC3)cc2)C1 1204324588 NNNYPNANPGODSI-MRXNPFEDSA-N 278.371 2.193 10 20 CECD CCO[C@@H]1COC[C@H]1NCc1ccc(N2CCCC2)cc1 1330532592 IERNLLPVJKLWGV-IAGOWNOFSA-N 290.407 2.180 10 20 CECD Cc1ccc(CNC[C@@H](CO)CC2CCOCC2)c(O)c1 1336754933 NPCUWXDDAFTAFC-HNNXBMFYSA-N 293.407 2.215 10 20 CECD CC[C@H](C(=O)NCc1ccc(N)cc1)N(CC)CC 1342018767 BIGHCCWCNKSHMH-CQSZACIVSA-N 263.385 2.005 10 20 CECD Cc1c(C(=O)O)cc(CNCc2cccc(F)c2O)n1C 1607517325 YHGUDHCTFMLCTD-UHFFFAOYSA-N 292.310 2.166 10 20 CECD CCOC(=O)/C=C\CSc1ncc(C(=O)O)s1 1596583495 NFTOTCANHVIWCM-ARJAWSKDSA-N 273.335 2.053 10 20 CECD CN(Cc1cc(C(=O)O)co1)c1ccc2c(c1)OCCO2 1777066471 LGAVISCEJNWPPV-UHFFFAOYSA-N 289.287 2.385 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)Nc2ncnn2C)cc1 151145238 NSUKUYNQSCGUSW-UHFFFAOYSA-N 295.346 2.475 10 20 CECD c1cc(N2CCOCC2)ccc1CNCC1CCC1 37179536 HUMCZVOFMOJJGZ-UHFFFAOYSA-N 260.381 2.413 10 20 CECD COc1ccc(O)c([C@H](C)NCCn2ccnc2C)c1 271810275 LWSHNMHZIGSTLQ-NSHDSACASA-N 275.352 2.257 10 20 CECD COc1cccc(CNC(=O)NCC2CCCC2)c1O 57881860 JEPRTWGZYQFZIV-UHFFFAOYSA-N 278.352 2.390 10 20 CECD CSC1CCN(C(=O)Cc2ccc(N)cc2)CC1 306017115 SCNMPEMYZDGAIW-UHFFFAOYSA-N 264.394 2.165 10 20 CECD CCSCC[C@@H](C)NC(=O)c1cccc(O)c1O 126566014 MIGFOMYVNOFINC-SECBINFHSA-N 269.366 2.359 10 20 CECD CCc1nnc(CN[C@@H](C)c2cc(OC)ccc2O)o1 182315350 OQSVLNGUARYXKH-VIFPVBQESA-N 277.324 2.197 10 20 CECD CN1CCC(C(=O)NCCCSc2nccs2)CC1 74676003 LZLGWLNQYFVISV-UHFFFAOYSA-N 299.465 2.083 10 20 CECD CCCS(=O)(=O)NCc1ccc(N(CC)CC)cc1 193901637 UHKQMRKHAMUHAR-UHFFFAOYSA-N 284.425 2.362 10 20 CECD COc1cccc(CN2CCC(CCC(=O)O)CC2)c1O 86755867 YGRPSBDMTWFUDY-UHFFFAOYSA-N 293.363 2.478 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@]1(C)CCCNC1 237084408 SUYGBSXYFBOJPU-KRWDZBQOSA-N 289.423 2.067 10 20 CECD Cc1n[nH]cc1CNCc1c(O)cccc1Cl 90715355 QWGXQRLIHBLIPD-UHFFFAOYSA-N 251.717 2.367 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2nonc2C)cc1 265110584 WTLUKNCHNIFAIL-UHFFFAOYSA-N 288.351 2.154 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CC(=O)N(C(C)C)C2)c(O)c1 273529602 WANXKJKSXCRVFW-STQMWFEESA-N 276.380 2.361 10 20 CECD COC(=O)[C@H]1C[C@H](C)CCN1Cc1cc(F)ccc1O 274895484 FSDKHJHPBZQUHO-ZWNOBZJWSA-N 281.327 2.305 10 20 CECD COc1ncccc1CCNCc1ccccc1O 289922121 VLYQYLAKFMOIDC-UHFFFAOYSA-N 258.321 2.128 10 20 CECD CCC[C@](C)(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 284299291 RNCRZQSMZDBNFU-ZDUSSCGKSA-N 282.296 2.033 10 20 CECD C[C@@H](CO)NCc1ccc(N(C)C)cc1C(F)(F)F 280288901 NIVZUYFSYIQLNB-VIFPVBQESA-N 276.302 2.242 10 20 CECD Cc1nc(NCc2ccc(N(C)C)cc2)ncc1[N+](=O)[O-] 296651453 XLGZOFHWYVTETG-UHFFFAOYSA-N 287.323 2.371 10 20 CECD COC(=O)N1CCC(CNCc2cc(F)ccc2O)CC1 809710554 RYNISQIJUULTJA-UHFFFAOYSA-N 296.342 2.099 10 20 CECD COc1ccc(N2CC[C@H](CNc3ncccn3)C2)cc1 819936717 VTZAHHBJQPZWFD-CYBMUJFWSA-N 284.363 2.424 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)c(C)c2)[C@@H]1C 815100766 UPTBBQKQUNYUAN-UKRRQHHQSA-N 290.407 2.444 10 20 CECD CC(C)C[C@@H]1C[C@H]1C(=O)NCc1ccc(O)c(O)c1 827316462 BWSQERKHXUUNIM-VXGBXAGGSA-N 263.337 2.396 10 20 CECD CC[C@@H](CNCc1c(O)ccc(Cl)c1F)C(=O)O 903710461 VXTHAQIROAXBRG-ZETCQYMHSA-N 275.707 2.385 10 20 CECD C[C@@H](COCC(F)(F)F)NC(=O)c1cc(O)cs1 732280036 SLZJGABQFWLFKE-LURJTMIESA-N 283.271 2.151 10 20 CECD O=C(O)CCc1csc(NC(=O)c2cc(O)cs2)n1 833239867 ACFRFFZHQMLRRA-UHFFFAOYSA-N 298.345 2.180 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H]2C2OCCO2)cc1C 902623187 VHUICNPYEIKVEQ-CQSZACIVSA-N 277.364 2.346 10 20 CECD O=C(O)[C@@H]1CCCC[C@@H]1NCc1ccc2c(c1)CCO2 843306783 YYDIDNKVSNMFAL-KGLIPLIRSA-N 275.348 2.355 10 20 CECD Cc1cc(Br)c(O)c(CN2CC[C@H](CN)C2)c1 843048407 QKSJRUQPOLCGNI-SNVBAGLBSA-N 299.212 2.244 10 20 CECD CO[C@H](CC(C)C)C(=O)NCc1ccc(N(C)C)cc1 841018299 SEZJJQSOWJNPEL-OAHLLOKOSA-N 278.396 2.430 10 20 CECD CSC1(CNC(=O)NCCc2ccc(N)cc2)CCC1 841889002 WUBKMWCSUNQQIR-UHFFFAOYSA-N 293.436 2.396 10 20 CECD COCC[C@](C)(O)CN[C@H](C)c1ccc(Cl)cc1O 841763238 LMLHXGIXEALYMC-YGRLFVJLSA-N 287.787 2.484 10 20 CECD C[C@H](N)[C@H]1CCCCN1Cc1cccc(F)c1O 843045890 LMRPJZBWUYTYPX-GXFFZTMASA-N 252.333 2.233 10 20 CECD Cc1cc(Br)c(O)c(CN2C[C@@H](N)[C@H](C)C2)c1 843120418 KDMRMJBLVBBRPS-BXKDBHETSA-N 299.212 2.242 10 20 CECD C[C@@H](NC[C@@]1(C)CCOC1)c1cc([N+](=O)[O-])ccc1O 756575999 SJVIFNCGDIPUCI-QMTHXVAHSA-N 280.324 2.378 10 20 CECD C/C=C\C(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 752152374 XGZKBRXDLCUZOR-OLVMAOTFSA-N 275.348 2.476 10 20 CECD c1cn2c(n1)C[C@@H](NCc1ccc3c(c1)CCCO3)CC2 922016949 KNUQICHLBJUCPC-HNNXBMFYSA-N 283.375 2.313 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1cc(Cl)ccc1O 759174911 ZTDFIXSNHLWKOU-OCCSQVGLSA-N 285.771 2.329 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCCC[C@H]3C1)[C@@H](O)CO2 768465249 YQQMPBBACLSBMJ-OZVIIMIRSA-N 289.375 2.440 10 20 CECD O=C1CN(Cc2ccccc2O)CN1Cc1ccccc1 779033702 NPMDWZFBBHEVAS-UHFFFAOYSA-N 282.343 2.194 10 20 CECD COCC[C@]1(NCc2cc(C)c(C)cc2O)CCOC1 775035235 YAQQGKAVBBQDOE-INIZCTEOSA-N 279.380 2.294 10 20 CECD C[C@@H]1CCN2[C@@H](c3ccc(N(C)C)c(F)c3)NC(=O)[C@H]2C1 777899828 OXEQVLRKIFXTEN-KMUNFCNLSA-N 291.370 2.121 10 20 CECD CC[C@]1(C)COCCN1C(=O)/C=C/c1ccc(O)c(O)c1 779548115 QAKWYDLDWOEGEE-BIENSFFJSA-N 291.347 2.139 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@@H](C)c1c(O)cccc1F 886598575 FMJCOEZPEQBLEX-UWVGGRQHSA-N 268.332 2.049 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@H](C)c1c(O)cccc1F 886619080 RSHLMESLSKJBFU-UHIISALHSA-N 283.343 2.233 10 20 CECD C[C@H](NCCC[C@@H](C)O)c1cc(F)cc(F)c1O 788606329 XOFITZHPJKYWDZ-BDAKNGLRSA-N 259.296 2.482 10 20 CECD COc1cc(C)cc(CNc2cc(CO)ccn2)c1O 895038091 IBJYLHFQUBMECU-UHFFFAOYSA-N 274.320 2.209 10 20 CECD O=C(Nc1cccc(-c2cnn[nH]2)c1)c1cccc(O)c1O 790925658 ANMSLVMOOUVFAB-UHFFFAOYSA-N 296.286 2.135 10 20 CECD COC(=O)[C@H]1CCC[C@H]1NCc1ccc2c(c1)CCO2 1320717906 VWVIVOSOARPWME-UONOGXRCSA-N 275.348 2.053 10 20 CECD COC(=O)[C@H]1CCC[C@H]1NCc1cc(C)c(C)cc1O 1320838198 XKKRPVMDLKFTFI-UONOGXRCSA-N 277.364 2.440 10 20 CECD C[C@H](CN)N(C)Cc1cc(Br)cc(F)c1O 715788791 LUXHKGRMBXXRGF-SSDOTTSWSA-N 291.164 2.073 10 20 CECD COc1cccc(CNC(=O)NC/C=C\C2CC2)c1O 1324693507 CQDFZHBWKLVPQH-ARJAWSKDSA-N 276.336 2.166 10 20 CECD CCC(CC)(CCO)NC(=O)NCc1ccc(N)cc1 1336290607 PYABOTCEXKUNAK-UHFFFAOYSA-N 279.384 2.009 10 20 CECD CC[C@H](NC(=O)NCc1ccc(N)cc1)C1CCOCC1 1336834833 WYXDHXCBRYIGJJ-HNNXBMFYSA-N 291.395 2.273 10 20 CECD CC1(C)C(C(=O)NCc2cccc(O)c2O)C1(C)C 1263894781 VNFHTOWEBHNYSY-UHFFFAOYSA-N 263.337 2.396 10 20 CECD CC1(C)CCC[C@@](O)(C(=O)NCc2cccc(O)c2O)C1 1347542110 ITNJPRYPEVKLJT-INIZCTEOSA-N 293.363 2.045 10 20 CECD CC(C)n1ccc(CC(=O)N(C)c2ccc(N)cc2)n1 1343821682 ZEMIAXVAPMWJJZ-UHFFFAOYSA-N 272.352 2.252 10 20 CECD C[C@@H](CC(=O)NCc1cccc(O)c1O)C(F)(F)F 1520509116 RBDIJIVEDNAUGV-ZETCQYMHSA-N 277.242 2.303 10 20 CECD Cc1ccc(O)c(CNc2cc(C)c(-c3nn[nH]n3)cn2)c1 1605875333 DLTQHTJJQTZOFX-UHFFFAOYSA-N 296.334 2.196 10 20 CECD O=C(O)CN(Cc1cc(F)c(F)cc1O)C1CCCC1 1602057280 RIVLEQASPHPQFP-UHFFFAOYSA-N 285.290 2.500 10 20 CECD Cc1cccc(CN2C[C@@H]3CCC[C@]3(C(=O)O)C2)c1O 1600531893 AHIASUWBOFCCIV-BBRMVZONSA-N 275.348 2.387 10 20 CECD CN(CCCCCCN)c1ccc2c(c1)OCO2 1578465593 CEDSPTWIXUHQNE-UHFFFAOYSA-N 250.342 2.371 10 20 CECD COc1ccc(CNCc2cc(C)c(C(=O)O)[nH]2)c(O)c1 1599573200 UMDAMYGKNATTDQ-UHFFFAOYSA-N 290.319 2.025 10 20 CECD COc1ccc(CN[C@@H](CCSC)C(=O)O)cc1C 1777363209 ANDREVKPGPMAPP-LBPRGKRZSA-N 283.393 2.300 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC=CC[C@@H]2C(=O)O)cc1 1777040182 FIFPEUDAGSQBGR-LSDHHAIUSA-N 274.364 2.262 10 20 CECD CS[C@@H](CO)[C@@H](C)NCc1ccc2c(c1)CCCO2 921764159 GNBZQMWWSUCUDL-ABAIWWIYSA-N 281.421 2.214 10 20 CECD COc1ccc(O)c(CNCCOC2CCCC2)c1 108942682 FQHBQUHYHPQZGF-UHFFFAOYSA-N 265.353 2.450 10 20 CECD OCc1cccc(CNCc2cc(F)ccc2O)c1 226606614 UMKSDOOUVRXNJU-UHFFFAOYSA-N 261.296 2.313 10 20 CECD C[C@H](NC[C@@](C)(O)C(F)(F)F)c1cc(F)ccc1O 273478922 LLYQEOFBYVYROF-WRWORJQWSA-N 281.249 2.495 10 20 CECD C[S@@](=O)C1(CNCc2ccc3c(c2)CCO3)CCC1 280664845 PHNBBPPVIOHCNE-LJQANCHMSA-N 279.405 2.012 10 20 CECD COc1cccc(CNCCc2ccncc2)c1O 48261317 ALLWRATZNSCAAI-UHFFFAOYSA-N 258.321 2.128 10 20 CECD CN(C)c1ccc(CNc2cn[nH]c(=O)c2Cl)cc1F 58545540 QWOBMZJRKJQADA-UHFFFAOYSA-N 296.733 2.241 10 20 CECD Cc1nccc(C(=O)NCc2ccc(N(C)C)cc2C)n1 115280176 GFNZWHBJMYOXKQ-UHFFFAOYSA-N 284.363 2.089 10 20 CECD O=S1CCN(Cc2ccc(N3CCCCC3)cc2)CC1 119380346 CBSQIKSFNDKAMJ-UHFFFAOYSA-N 292.448 2.241 10 20 CECD COCCN(C)CCCN[C@H](C)c1ccc(C)cc1O 185008852 XKJGCELCPGDFKY-CQSZACIVSA-N 280.412 2.320 10 20 CECD C[C@H](NCC(=O)NCC1CC1)c1cc(Cl)ccc1O 186505072 XXUTUSRTLOCXRN-VIFPVBQESA-N 282.771 2.222 10 20 CECD COCCCN(C)CCN[C@H](C)c1ccccc1O 183531186 DXVHRBXYOAEKHA-CYBMUJFWSA-N 266.385 2.011 10 20 CECD CC(=O)c1cc(F)cc(CN2CCO[C@@H]3CCC[C@@H]32)c1O 43426177 HEHKYMDNPCEWQI-LSDHHAIUSA-N 293.338 2.487 10 20 CECD C[C@H](N[C@H]1CC[C@H](O)CC1)c1cc(F)ccc1O 252812387 QAOVZRXWJQODNC-DLOVCJGASA-N 253.317 2.485 10 20 CECD CC(C)Oc1ccc(N(C)C[C@H]2CCS(=O)(=O)C2)cc1 279684431 GYWRAYCGNOBMNJ-CYBMUJFWSA-N 297.420 2.345 10 20 CECD O=C1[C@@H](Sc2nccs2)CCN1C1CCOCC1 365863653 ZQWWYNQCOVBESB-JTQLQIEISA-N 284.406 2.015 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)CC[S@@]1=O 277839927 ZVIAGAIBOJEDCI-DJJJIMSYSA-N 280.437 2.096 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)CC1OCCO1 272194010 ZSGWJIJTIHGRMM-UHFFFAOYSA-N 278.396 2.336 10 20 CECD OCCCN(Cc1ccccn1)Cc1cc(F)ccc1O 289567533 ZHNBUJFGSBPGMC-UHFFFAOYSA-N 290.338 2.311 10 20 CECD CN(CCOCCO)Cc1cc(Cl)cc(Cl)c1O 282650360 FXOOIGKHEJWVKC-UHFFFAOYSA-N 294.178 2.140 10 20 CECD CC[C@H](N[C@H](C)c1ncnn1C)c1ccc(F)cc1O 287385535 ILYAREHWTBIBIW-SKDRFNHKSA-N 278.331 2.462 10 20 CECD COCC1(COC(=O)/C=C\c2ccc(O)c(O)c2)CCC1 812589500 LWCHBJBKWGPCIT-XQRVVYSFSA-N 292.331 2.471 10 20 CECD Cc1ccc(N(C)C(=O)/C=C/c2cccnc2)nc1 493234673 ZWFHKVNQEKTCAI-SOFGYWHQSA-N 253.305 2.461 10 20 CECD COCCN1CCN(Cc2cc(Cl)c(C)cc2O)CC1 824542217 QSHAMPVPOGMLRK-UHFFFAOYSA-N 298.814 2.118 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@H]2C2OCCO2)c1 902623355 XKBUOAJKHIITND-AWEZNQCLSA-N 277.364 2.346 10 20 CECD CCN(CC)c1ccc(CNC[C@]2(C)CCC(=O)N2)cc1 835061723 NLBWEEFODPRTMN-KRWDZBQOSA-N 289.423 2.291 10 20 CECD C[C@H]1[C@H](CO)CCCN1Cc1ccc(N(C)C)cc1 839672812 HOXTWIPCUQONJA-ZFWWWQNUSA-N 262.397 2.345 10 20 CECD CC(C)Oc1cccnc1C(=O)NCc1ccc(N)cc1 837303049 RKJRCCWYOJENBB-UHFFFAOYSA-N 285.347 2.381 10 20 CECD C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)c2cc(O)cs2)C1 731910757 BVAAVTRBXRFYDR-NXEZZACHSA-N 297.376 2.115 10 20 CECD CCOc1ccc(N(C)CCCN2CCOC2=O)cc1 739924434 SDMHHCHDLCSKEX-UHFFFAOYSA-N 278.352 2.364 10 20 CECD C[C@@H](NC[C@@H]1CCCN1CCCO)c1ccc(F)cc1O 834850593 NLWBKYYSDSGBNY-OCCSQVGLSA-N 296.386 2.029 10 20 CECD C[C@@H](C[C@@H](C)N)NC(=O)N(C)Cc1ccc(N(C)C)cc1 831202540 IINUZQORUVJPHZ-OLZOCXBDSA-N 292.427 2.020 10 20 CECD O=C(NCc1ccccc1O)NC[C@H]1CC1(Cl)Cl 748463515 ULFLIUOIQONKSM-SECBINFHSA-N 289.162 2.385 10 20 CECD COc1cccc([C@H](C)NCC(C)(C)CCO)c1O 846144715 INMSFTOBWFPXCW-NSHDSACASA-N 267.369 2.460 10 20 CECD COc1cccc([C@@H](C)NCc2nnc(C)s2)c1O 846166489 XUUVLRSHHIGPFU-MRVPVSSYSA-N 279.365 2.412 10 20 CECD Cc1cccc(CNC[C@H](N)c2ccccc2)c1O 841034245 BNOZVKAIWLVCGW-HNNXBMFYSA-N 256.349 2.490 10 20 CECD COc1cccc([C@@H](C)NCC2(C)COC2)c1O 846144255 KBJARTHOCKMJPC-SNVBAGLBSA-N 251.326 2.088 10 20 CECD C[C@@H](N[C@@H](CO)c1cnn(C)c1)c1ccc(Cl)cc1O 841752460 TVKMKQGUWOHRDW-RNCFNFMXSA-N 295.770 2.163 10 20 CECD C[C@H]1[C@@H](C)SCCN1C(=O)NCCc1ccc(N)cc1 841954417 METJDAKMIICELV-NWDGAFQWSA-N 293.436 2.347 10 20 CECD CCCNCCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 841881953 FSEBNJAZXTVQFN-CYBMUJFWSA-N 292.427 2.112 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1[C@H]2CCCO[C@H]21 846474015 QFNOXAMHSKPAPB-RAIGVLPGSA-N 281.739 2.087 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](C)C[C@H]2CN)c1O 852758910 HBEJUBGINOOHFJ-YGRLFVJLSA-N 294.370 2.293 10 20 CECD Cc1ccc(O)c(CNCc2cn(C(C)C)nn2)c1 858238780 CWKMXVMFJVUOSR-UHFFFAOYSA-N 260.341 2.163 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC2SCCS2)c1 850401551 KSKQSAWXZXDNCX-UHFFFAOYSA-N 286.378 2.196 10 20 CECD COc1cc(CNC[C@H](C)O)c(O)c(C(C)(C)C)c1 850004331 MEUWXBIIDYQCKV-JTQLQIEISA-N 267.369 2.169 10 20 CECD CCOc1ccc(N(C)C(=O)/C=C/c2cn(C)cn2)cc1 933329772 OOPYKCMEPHQHPS-BJMVGYQFSA-N 285.347 2.495 10 20 CECD COc1cc(CN(C)CCCn2ccnc2)c(O)cc1C 768462126 JRJQHIITIQYHLI-UHFFFAOYSA-N 289.379 2.428 10 20 CECD C[C@H]1C[C@@H](NC(=O)N[C@H](C)c2ccccc2O)CCO1 868469662 MNFZHDJGIZPVOA-TUAOUCFPSA-N 278.352 2.320 10 20 CECD OC1CCN(c2ccc(CN3CC[C@@H]4C[C@H]4C3)cc2)CC1 877636374 VJEXYABFMOHODQ-CVEARBPZSA-N 286.419 2.490 10 20 CECD COC(=O)N1CCC(CNCc2ccc(C)cc2O)CC1 877520013 XASBZEQFTMHTTG-UHFFFAOYSA-N 292.379 2.269 10 20 CECD Oc1ccccc1CNCCn1ccc(C(F)(F)F)n1 873158102 QNRWAEUPJNIFIJ-UHFFFAOYSA-N 285.269 2.397 10 20 CECD C[C@@H](NCCC1(O)CCOCC1)c1c(O)cccc1F 886609608 XPCCHGCRCXITRF-LLVKDONJSA-N 283.343 2.114 10 20 CECD COCCCN(CCO)Cc1cc(Cl)cc(F)c1O 783729631 PFPZWOGYBONPTC-UHFFFAOYSA-N 291.750 2.016 10 20 CECD CC[C@@H]1COCCN1Cc1ccc(OC)c(OC)c1O 891716405 PRRBJWODRLYPRT-GFCCVEGCSA-N 281.352 2.020 10 20 CECD COc1ccc(CNC(=O)NCCCOC(C)C)c(O)c1 792777127 IDVYJKQNGKNRCZ-UHFFFAOYSA-N 296.367 2.015 10 20 CECD CC(C)CC[C@@H](N)C(=O)N(C)Cc1ccccc1O 704467092 SVCRQBJSKFTNJN-CYBMUJFWSA-N 264.369 2.114 10 20 CECD CCOC(=O)c1cnc(Sc2n[nH]c(CC)n2)s1 713449321 RSLOTSDGLBSBCN-UHFFFAOYSA-N 284.366 2.152 10 20 CECD COC(=O)[C@@H](C)N(Cc1ccc(N)cc1)C1CCC1 1335287817 BWWBWTMAPBYNKN-LLVKDONJSA-N 262.353 2.185 10 20 CECD C[C@H]1C[C@H](C)CN(C(=O)NCc2ccc(N)cc2)C1 1262604664 ZLPNMZJXBCKUHG-RYUDHWBXSA-N 261.369 2.456 10 20 CECD Cc1noc(C)c1[C@H](C)C(=O)NCc1ccc(N)cc1 1342020292 IVIQOIFSOWSJBZ-VIFPVBQESA-N 273.336 2.294 10 20 CECD Cc1cc(CN[C@@H]2CCC[C@H]2C(=O)O)ccc1N(C)C 1607647692 GXEZTYJKFXEAGQ-ZIAGYGMSSA-N 276.380 2.404 10 20 CECD O=C(O)[C@H]1C[C@@H](NCc2ccc3ccccc3c2O)C1 1574784562 LCJRLVATNXQDQC-BETUJISGSA-N 271.316 2.498 10 20 CECD C[C@@H](NC(=O)[C@H]1CC[C@H]1C(=O)O)c1ccc(N(C)C)cc1 1589114414 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292.360 2.025 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc([N+](=O)[O-])o2)cc1 24378330 FGQXMMOEBXJKOI-UHFFFAOYSA-N 289.291 2.184 10 20 CECD CC[C@@H](CSC)NC(=O)NCc1cccc(OC)c1O 179979468 YXDSQQVXMAWRRD-NSHDSACASA-N 298.408 2.342 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1ccon1 67286771 ABGRYNNDFMJDOQ-UHFFFAOYSA-N 259.309 2.013 10 20 CECD COc1ccc(N(C)CCCS(C)(=O)=O)cc1Cl 121849886 VXBBOQJMTRDFTP-UHFFFAOYSA-N 291.800 2.220 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2nc(C3CC3)n[nH]2)c1 182894751 ASTVTKHCPVVKPY-SECBINFHSA-N 288.351 2.247 10 20 CECD C[C@H](NCCCO)c1cc(Br)c(F)cc1O 134904021 RBZCAUPMNPNJAE-ZETCQYMHSA-N 292.148 2.327 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C[C@@H]1CCCN1 42169147 FAEPDANGDIGWKO-HNNXBMFYSA-N 289.423 2.243 10 20 CECD COc1ccc(O)c(CNc2cc(C)nc(C)n2)c1 132755182 IFPOSGHJSDGOJF-UHFFFAOYSA-N 259.309 2.420 10 20 CECD CCOc1cccc(CN2CC[C@@H](O)C(C)(C)C2)c1O 275862323 JELGDTUHUAQCFB-CQSZACIVSA-N 279.380 2.384 10 20 CECD Cc1cccnc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 274942501 PUDNUWRYRBRYOI-NSHDSACASA-N 286.331 2.162 10 20 CECD CCC1(CNC(=O)c2c(F)ccc(O)c2O)CC1 276514540 FKCXHBLMSFCJSA-UHFFFAOYSA-N 253.273 2.157 10 20 CECD COc1cc(O)c(CN(C)[C@@H]2CCCOC2)cc1OC 809692704 FCUXEPPGVOSWMI-GFCCVEGCSA-N 281.352 2.020 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccncn1 807836215 SBJSHCHEQBUKGI-UHFFFAOYSA-N 298.129 2.419 10 20 CECD CO[C@@H]1[C@H](C)[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1(C)C 295097311 SWGWEQCUBNZCRH-KEMBBXRSSA-N 297.326 2.026 10 20 CECD Cc1cc(C)c([C@@H](C)NCC(F)(F)CN)c(O)c1 817968900 XVIAJPFEBQKWDT-SNVBAGLBSA-N 258.312 2.254 10 20 CECD CNC(=O)CN1C[C@@H](C(C)C)Cc2cc(OC)ccc21 817295525 KEWMILCWNCTKCY-ZDUSSCGKSA-N 276.380 2.076 10 20 CECD CCOC(=O)C[C@@H](NCc1ccccc1O)C(F)(F)F 827005660 IFDUSUCKTBWJLN-LLVKDONJSA-N 291.269 2.366 10 20 CECD CCOc1ccc(CNCc2ncccc2OC)c(O)c1 825249912 QUMQFUMUWFOVRD-UHFFFAOYSA-N 288.347 2.484 10 20 CECD Cc1cc(O)c(CN2CCN3C(=O)CC[C@@H]3C2)cc1Cl 824650904 YMVYPLVXDXHRFK-GFCCVEGCSA-N 294.782 2.161 10 20 CECD COC(=O)c1ccnc(Sc2nccs2)c1[N+](=O)[O-] 820635567 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TXAONCJMKZDDBB-CYBMUJFWSA-N 279.380 2.097 10 20 CECD CN(C)c1ccc(CN2C(=O)[C@@H]3[C@H]4CC[C@H](C4)N3C2=O)cc1 924443992 CNDSBCVMFBWGDM-CFVMTHIKSA-N 299.374 2.068 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC(=O)C1CCCC1 759582003 YENRQFMVYCEMSS-SOFGYWHQSA-N 290.315 2.414 10 20 CECD Cc1ccc(O)c(CNCc2ccc(C(=O)N(C)C)[nH]2)c1 858238402 YYKYQAFADBNYQT-UHFFFAOYSA-N 287.363 2.020 10 20 CECD COCCOC(=O)c1csc(Cc2ccc(N)cc2)n1 751932570 UUOINLCUBGZDEU-UHFFFAOYSA-N 292.360 2.119 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1scnc1Cl 762274092 GWQIIBWMVQRUDY-UHFFFAOYSA-N 298.751 2.180 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CC(c2ccccc2)=NO1 769366397 ZDRISKGVUPEFOE-INIZCTEOSA-N 296.326 2.202 10 20 CECD C[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@]1(C)CO 862418024 KCLMVKZOZUOQNN-BDJLRTHQSA-N 298.377 2.481 10 20 CECD CCCN(Cc1ccccc1O)[C@@H](C(=O)O)C1CC1 873640907 LHYPSPZJLYWUPR-CQSZACIVSA-N 263.337 2.467 10 20 CECD COc1ccc(N2CCC(N[C@@H](CO)C3CC3)CC2)cc1 772989032 WIWAAINAKTVPHU-KRWDZBQOSA-N 290.407 2.025 10 20 CECD CCOC(=O)C1(CNCc2c(O)cccc2Cl)CC1 770665771 OGCKMZRTNNRWPO-UHFFFAOYSA-N 283.755 2.479 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(Cl)ccc2O)[C@@H]1C 787420669 KIVASMJBJVRQBP-BXKDBHETSA-N 283.755 2.429 10 20 CECD CC[C@@]1(C)CN(C(=O)c2cc(O)cs2)CCO1 785420724 ABILIFRQPOGSPN-LBPRGKRZSA-N 255.339 2.095 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)NOCCO)c1C 787293308 NBODPBUJAOFJML-UHFFFAOYSA-N 288.347 2.056 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1ccc(N(C)C)c(F)c1 782981105 XXUBWTOMXYGDPR-GHMZBOCLSA-N 254.349 2.141 10 20 CECD Cc1ncc(NC(=O)c2ccc(C)c(O)c2O)s1 780995150 JBVSGYRTZXAZIR-UHFFFAOYSA-N 264.306 2.423 10 20 CECD COC(=O)C1CCC(NCc2cc(F)ccc2O)CC1 898611170 KPAKAEWOHCQLEJ-UHFFFAOYSA-N 281.327 2.353 10 20 CECD COc1cc(C)cc(CN[C@H](C)[C@H](O)C(F)(F)F)c1O 895445706 VVFGARGLGGIPIC-PELKAZGASA-N 293.285 2.111 10 20 CECD CN(C)c1ccc(CNCC[C@@H](O)C2CC2)cc1F 898202645 KJDHVRYCNTVPGP-OAHLLOKOSA-N 266.360 2.142 10 20 CECD CNc1ccc(C(=O)NCc2ccc(N(C)C)cc2C)cn1 796503471 ZJPUFMYPIQXHPC-UHFFFAOYSA-N 298.390 2.428 10 20 CECD CCOc1cccc(CNC[C@H](C)COC)c1O 45656373 BVOPIQQUBUYVEG-NSHDSACASA-N 253.342 2.163 10 20 CECD COc1cccc(O)c1CNCCc1cccnc1C 898256515 CMJCUCLJVSFNGI-UHFFFAOYSA-N 272.348 2.437 10 20 CECD Nc1ccc(CC(=O)N[C@H]2CCC[C@H](F)C2)cc1 1327122451 ZYGAPDDEIPASHU-AAEUAGOBSA-N 250.317 2.208 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@H](C)c1ccc(C)cc1O 188468505 QZSUNYCROYJZSP-NEPJUHHUSA-N 264.369 2.218 10 20 CECD OC[C@@H](CC(F)F)NCc1ccc(N2CCCC2)cc1 717770136 YUICBDDCBSNCDY-CYBMUJFWSA-N 284.350 2.393 10 20 CECD CCOCCN(CC)c1nnc(-c2sccc2O)n1C 1262854545 OCNNMPMNYXFYIS-UHFFFAOYSA-N 296.396 2.112 10 20 CECD CN(Cc1ccc(N)cc1)[C@H]1CCCC[C@@H]1S(C)(=O)=O 1356083501 QBKQDISWONBABU-GJZGRUSLSA-N 296.436 2.056 10 20 CECD COc1cc(C)cc(CN[C@H]2CC[C@@H](CC(=O)O)C2)c1O 1607149368 KPRVDIGQVJEOGA-YPMHNXCESA-N 293.363 2.442 10 20 CECD CC1CC(CS(=O)(=O)Oc2ccc(N)cc2)C1 1576606034 OTULIRWFDNTTAL-UHFFFAOYSA-N 255.339 2.024 10 20 CECD C[C@@H](NCc1ccc(C(=O)O)[nH]1)c1ccccc1O 1599841483 KMDHZIHMLTWSHB-SECBINFHSA-N 260.293 2.269 10 20 CECD CC(C)(CNCc1cc(Cl)ccc1O)N1CCOCC1 20120677 XORTWQCYZFMPCN-UHFFFAOYSA-N 298.814 2.246 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccncc2F)c1 156229565 LDKUSVYTWPVERA-VIFPVBQESA-N 290.294 2.426 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C1CCNCC1 156729926 MDCBRAHOOLUSHF-UHFFFAOYSA-N 276.380 2.130 10 20 CECD c1cnn(CCCNCc2ccc3c(c2)CCCO3)c1 921519374 GJKJJLSHTAPCHE-UHFFFAOYSA-N 271.364 2.388 10 20 CECD CN(C)c1ccc(CN2CC(C)(C)C[C@@H]2C(=O)O)cc1 1777039351 GRORYGIXMNJZCV-CQSZACIVSA-N 276.380 2.438 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CCC[C@H](O)C2)cc1 230668689 FYWQKBVDQNHOKH-ZBFHGGJFSA-N 262.397 2.393 10 20 CECD CCN1CCC(CNCc2cc(OC)ccc2O)CC1 44517611 JOFICRPBXOZUMN-UHFFFAOYSA-N 278.396 2.222 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CCC1)c1ccccc1O 281125098 SOPYOABRXSYZAR-ADLMAVQZSA-N 267.394 2.344 10 20 CECD Cc1ccc(O)c(CN2C[C@H]3CC[C@H]2[C@H](C(=O)O)C3)c1 394786111 WMNWATROPNVPQG-YUTCNCBUSA-N 275.348 2.386 10 20 CECD O=C(N[C@@H]1CCCC[C@H]1F)c1cccc(O)c1O 839850789 AXSFBFXIKFPOED-NXEZZACHSA-N 253.273 2.108 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](C)OCC2CC2)c1 103529201 ULFIBONWWZTXDV-GHMZBOCLSA-N 293.363 2.393 10 20 CECD CN(CC(=O)NC(C1CC1)C1CC1)Cc1ccccc1O 109773657 CRXZXWSVGZAKPQ-UHFFFAOYSA-N 288.391 2.129 10 20 CECD OCCN(CCc1ccccc1)Cc1ccccc1O 305749889 YBYNSCHZSSZIER-UHFFFAOYSA-N 271.360 2.429 10 20 CECD COc1ccc(O)c(CNCCCOC[C@H]2CCCO2)c1 20146937 IVLPWYONHLIGAI-OAHLLOKOSA-N 295.379 2.076 10 20 CECD COc1ccc(O)c(CN2CCCO[C@H](C)C2)c1 134152194 RATGMYAFBAXZRZ-LLVKDONJSA-N 251.326 2.012 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H]2CC(=O)N(C3CC3)C2)c1 186088366 DJRSHICQWRIMAP-NEPJUHHUSA-N 274.364 2.115 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1O 183613937 HFQRZEQSBQQIEK-RYUDHWBXSA-N 276.380 2.442 10 20 CECD CCN(C)c1ccc([C@H](C)NCC(F)(F)CO)cc1 184693585 OAHSBNADKUJCNH-NSHDSACASA-N 272.339 2.421 10 20 CECD COC(=O)N1CC(N[C@H](C)c2cc(Cl)ccc2O)C1 186137214 ONSYVDLWFPDMGQ-MRVPVSSYSA-N 284.743 2.147 10 20 CECD CN(CCCn1ccnc1)c1ccc2c(c1)OCO2 183065487 LERVMEUYERJKHE-UHFFFAOYSA-N 259.309 2.138 10 20 CECD CCNC(=O)C(C)(C)CN[C@@H](C)c1ccc(F)cc1O 186353990 NMRZSKSMEXBGSG-JTQLQIEISA-N 282.359 2.344 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)CCC(=O)O)c1O 269239876 AVYIIHHLTISUJN-UHFFFAOYSA-N 285.727 2.155 10 20 CECD CCN(Cc1nc(COC)no1)c1ccc(OC)cc1 272108863 PZFFJGUEWYQUCZ-UHFFFAOYSA-N 277.324 2.251 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(C(N)=O)CCCC2)c1 273603127 SJOAVRSLWDPHGQ-GFCCVEGCSA-N 276.380 2.397 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)N1CCCCO1 283707654 SBQFRUQMAGZPPN-UHFFFAOYSA-N 287.363 2.300 10 20 CECD CC[C@H](NC[C@@]1(O)CCO[C@H]1C)c1ccc(C)cc1O 280277972 YGPSQPAXCNQPHK-NOLJZWGESA-N 279.380 2.281 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@@]3(CCO[C@@H]3C)C2)c1O 280370274 DJSZNYLNNUBOJE-VBQJREDUSA-N 291.391 2.469 10 20 CECD CCCCN(Cc1ccccc1O)[C@H](C)c1nnnn1C 282476115 OGEAHLUZHDOAKR-GFCCVEGCSA-N 289.383 2.279 10 20 CECD CCN(CC)CC(=O)NCc1ccc(N2CCCC2)cc1 298705715 IRBMFMRUZBQXMN-UHFFFAOYSA-N 289.423 2.245 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCC(=O)O)cc1 818193814 WMOWHHLKKHUKPC-LLVKDONJSA-N 250.342 2.268 10 20 CECD C[C@H](N[C@H]1CCc2cccc(O)c21)[C@@H]1CCCNC1 817947504 OTMHCDQAECZQQF-YUTCNCBUSA-N 260.381 2.357 10 20 CECD COC[C@H](NCc1ccc(N(C)C)c(C)c1)[C@H]1CCCO1 815104040 XRPCEQSSJAAUCN-DOTOQJQBSA-N 292.423 2.345 10 20 CECD OCCN(Cc1cc(F)ccc1O)C1CCSCC1 825133605 JNKIPHGLDTUHCB-UHFFFAOYSA-N 285.384 2.221 10 20 CECD O=C1OCCN1[C@H]1CCN(Cc2cccc(Cl)c2O)C1 827001040 RONFDGVBVZTHRF-NSHDSACASA-N 296.754 2.072 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](C)CCCO)c1 834871333 NDNKHAWBJHLDMZ-RYUDHWBXSA-N 295.379 2.238 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)C(=O)O)cc1F 842628996 SXFAJNIMMPJCTQ-SNVBAGLBSA-N 296.342 2.009 10 20 CECD CC(C)(C)OC(=O)CCCNC(=O)c1cc(O)cs1 844146154 KIRNPZCTBHCLRZ-UHFFFAOYSA-N 285.365 2.305 10 20 CECD CC(C)C[C@@H](C)C(=O)NCc1ccc(O)cc1O 910948103 UFVYPLUMIWXWMN-SNVBAGLBSA-N 251.326 2.396 10 20 CECD CCOc1ccc(N(CC)CCN2CCOC2=O)cc1 747683922 XWUVKGXWMOAGPH-UHFFFAOYSA-N 278.352 2.364 10 20 CECD Cc1noc([C@@H](C)N(C)Cc2cc(F)ccc2O)n1 848926351 VMDNVMHVDGTZOH-MRVPVSSYSA-N 265.288 2.416 10 20 CECD C[C@@H]1C[C@@H](C)[C@@H](C(=O)NCc2cc(Cl)ccc2O)O1 846477617 UEJXLJUCVDBFNE-KKFJDGPESA-N 283.755 2.475 10 20 CECD CCc1cccc(CN2CCc3n[nH]cc3C2)c1O 857876643 IHKKXEATPJYZPM-UHFFFAOYSA-N 257.337 2.236 10 20 CECD Cc1cc(C)c([C@@H](C)NCCO[C@H]2CCOC2)c(O)c1 927081305 OKJBVEKZYQSUDJ-KGLIPLIRSA-N 279.380 2.465 10 20 CECD c1cc2c(cc1CNCCCO[C@H]1CCOC1)CCCO2 921835000 KZZSSOZGEOKLPR-INIZCTEOSA-N 291.391 2.297 10 20 CECD CC[C@@H](O)CNC(=O)NCc1ccc(N(CC)CC)cc1 853456417 JNEOXPNCTFIEIK-OAHLLOKOSA-N 293.411 2.103 10 20 CECD C[C@@H](NC(=O)N[C@H](C)[C@H]1CCOC1)c1ccccc1O 868314706 VVTNCRLILHJSNY-UTUOFQBUSA-N 278.352 2.177 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)cc2)C[C@@H]1C 769379594 BYKMINZZUCCXKO-AWEZNQCLSA-N 261.413 2.279 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(C)cc2O)[C@H]1C 877466969 UTBPCVCZWGPUJW-AAEUAGOBSA-N 263.337 2.084 10 20 CECD CC[C@H](N[C@@H](CO)C1CCOCC1)c1ccccc1O 775551293 LZNMFBUBJPAWQW-GJZGRUSLSA-N 279.380 2.220 10 20 CECD CC[C@@H](NC[C@@]1(O)CCOC1)c1cc(Cl)ccc1O 775522915 BQDGEZGNEGPESF-OCCSQVGLSA-N 285.771 2.238 10 20 CECD CO[C@@]1(C)C[C@H](NC(=O)NCc2ccc(N)cc2)C1(C)C 1120611339 QVCBSMQPPCCOHT-BBRMVZONSA-N 291.395 2.272 10 20 CECD Cc1nn(C)c(NC(=O)/C=C\c2ccc(O)c(O)c2)c1C 779513541 HLNQMDAKAZJYCZ-ALCCZGGFSA-N 287.319 2.100 10 20 CECD C[C@@H](Cn1cccn1)N[C@H](C)c1c(O)cccc1F 886543189 LMZNOCFXWFOUHW-WDEREUQCSA-N 263.316 2.467 10 20 CECD Cc1cc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)ccc1N(C)C 886573064 QVKPJLQWNPHLBN-UXLLHSPISA-N 274.408 2.264 10 20 CECD COc1ccc(O)c(CN2CC[C@H](C)C[C@@H]2[C@H](C)O)c1 785987208 GJJRDIGHVQWXPO-SLEUVZQESA-N 279.380 2.382 10 20 CECD COc1cc(C)cc(CNC[C@@H](O)CC(C)C)c1O 894211426 PNPDEKXDPDFYLN-ZDUSSCGKSA-N 267.369 2.206 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](O)CCOC(C)C)c1 788276740 UYANTEQZFMHQDV-CHWSQXEVSA-N 297.395 2.227 10 20 CECD CCOc1ccc(CNCC[C@H](O)C2CC2)c(O)c1 898206836 WXCSHLPVGQXWNS-AWEZNQCLSA-N 265.353 2.042 10 20 CECD COC(=O)[C@H]1CCCCN1Cc1cc(F)cc(F)c1O 893914351 GGXQINBQQJYJEW-GFCCVEGCSA-N 285.290 2.198 10 20 CECD CCn1ccnc1C(=O)NCc1ccc(N2CCCC2)cc1 791320586 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WSHVRWHJSIVIDC-VIFPVBQESA-N 289.335 2.014 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@H]1CCCO1 46743090 NKVPKYUCKHXEEB-OAHLLOKOSA-N 276.380 2.280 10 20 CECD CCc1nn(C)cc1NC(=O)N(C)Cc1ccccc1O 91198637 RMOAKOMEEUTQHZ-UHFFFAOYSA-N 288.351 2.352 10 20 CECD Cc1ccc(C(=O)N[C@@H]2[C@H]3Cc4ccccc4[C@H]32)c(O)c1O 248405133 AMOOOVSWESBBRV-RRFJBIMHSA-N 295.338 2.474 10 20 CECD C[C@H]1[C@H](C)CCN1CC(=O)NCc1ccc(N(C)C)cc1 248333279 FRBRFIUXISJAAR-KGLIPLIRSA-N 289.423 2.099 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)Cc1ccco1 268943110 VUBJOBMGAITNSI-UHFFFAOYSA-N 286.331 2.314 10 20 CECD NCC1(CC(=O)NCCc2ccc(N)cc2)CCCCC1 262667234 NWRNOBMEBRUYAV-UHFFFAOYSA-N 289.423 2.227 10 20 CECD CCOC1CC(O)(CN[C@H](C)c2ccc(C)cc2O)C1 278589023 YUGWFFDRBDESDV-VEAWUBTESA-N 279.380 2.281 10 20 CECD CO[C@@H]1[C@@H](C)[C@H](NC(=O)NCc2ccccc2O)C1(C)C 271979422 PVDGHFIMBQMDOU-LEWSCRJBSA-N 292.379 2.251 10 20 CECD CCN(CC)c1ccc(CNC2(C(=O)O)CC2)cc1 283799270 GPKPTCMXWDASIH-UHFFFAOYSA-N 262.353 2.240 10 20 CECD CCNC(=O)C(C)(C)CN[C@@H]1CCc2cccc(O)c21 296249752 BDFWVIIPJSKKRV-GFCCVEGCSA-N 276.380 2.131 10 20 CECD OCC1CCN(c2ccc(CNc3cnccn3)cc2)CC1 298716872 JEMDFYBJWSXKDM-UHFFFAOYSA-N 298.390 2.297 10 20 CECD C[C@@H]1C[C@@H](C)N(Cc2cccc(F)c2O)C[C@H]1CN 817866287 WWHDCIZOHXOKFR-NQBHXWOUSA-N 266.360 2.337 10 20 CECD C[C@@H](NC(=O)C[C@@H](C)n1cccn1)c1ccccc1O 827952357 PEIUZGNOWDOONH-VXGBXAGGSA-N 273.336 2.417 10 20 CECD Cc1ncc(/C=C\C(=O)N2CCc3ccncc32)s1 492510040 VZUVFNKHUVOGMC-IHWYPQMZSA-N 271.345 2.449 10 20 CECD CO[C@@H](C)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 839919110 PLVZEEWKGUJOME-OLZOCXBDSA-N 278.396 2.143 10 20 CECD CCc1nocc1C(=O)N[C@@H](C)c1cc(OC)ccc1O 830540470 KNGVUSNSQFQUMM-VIFPVBQESA-N 290.319 2.442 10 20 CECD C[C@@H]1C[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)c2nccn21 836956550 WKALVVMLWXCGRW-SIIXBRRKSA-N 299.330 2.130 10 20 CECD C[C@@H]1C[C@@H](NC(=O)c2cc(O)cs2)c2nccn21 839785782 IWPNHVHKQVDXCD-VXNVDRBHSA-N 263.322 2.086 10 20 CECD CC[C@H]1CN(C(=O)c2cc(O)cs2)[C@H](CC)CO1 846660665 YXSHUOXJOUGFDV-KOLCDFICSA-N 269.366 2.483 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)CCCCN)c1 841079905 OGELXAUJRVBKFO-LBPRGKRZSA-N 266.385 2.398 10 20 CECD CS[C@@H](CO)[C@@H](C)NCc1ccc(N(C)C)cc1C 840933934 KYYZRAHCGQJVCC-DOMZBBRYSA-N 282.453 2.263 10 20 CECD C[C@@H](NCc1nnn(C(C)(C)C)n1)c1ccc(F)cc1O 848560432 FLEBJDNSZFJTMX-SECBINFHSA-N 293.346 2.124 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)Cc1cnn(C)c1 840909832 LCFYSXSVIZRPJQ-UHFFFAOYSA-N 272.396 2.427 10 20 CECD CCOCc1cc(CN[C@H]2CO[C@H](C)C2)ccc1OC 842774510 IHCLPKBWTKZUCU-IUODEOHRSA-N 279.380 2.499 10 20 CECD CN(C)c1ccc(CN2CCNCC2)c(C(F)(F)F)c1 843043785 BYOVYFOSZFHZHN-UHFFFAOYSA-N 287.329 2.177 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)CCCN)c1O 841078377 CCPYZTQZHSNVOI-VIFPVBQESA-N 272.776 2.271 10 20 CECD CNC[C@@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1 923291891 TXTLZKRIYZBSER-HNNXBMFYSA-N 261.413 2.102 10 20 CECD COc1cccc(O)c1CN(C)Cc1ccccn1 757888974 CHFBLQIJQJNGRZ-UHFFFAOYSA-N 258.321 2.428 10 20 CECD C[C@H]1[C@@H](C)N(Cc2cc(Cl)ccc2O)CC[S@@]1=O 769464685 AABIPSPIBYVNPX-JJQCHNSYSA-N 287.812 2.387 10 20 CECD CC[C@@H]1[C@@H](C(=O)NCc2cc(Cl)ccc2O)CCN1C 869147807 XHQSPHOADYKWJL-QWHCGFSZSA-N 296.798 2.392 10 20 CECD CC[C@@]1(C)CCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768464179 OARHNSSODOJADR-HOCLYGCPSA-N 277.364 2.440 10 20 CECD CCOC(=O)CN(Cc1ccc(OCC)cc1O)C1CC1 768755742 XNTWOUCJFSEDIO-UHFFFAOYSA-N 293.363 2.318 10 20 CECD Cc1ccc([C@H](C)[C@@H](O)C(=O)NCc2ccccc2O)cc1 765178007 QRBCDJCYHOPQOY-SUMWQHHRSA-N 299.370 2.481 10 20 CECD CCOC(=O)[C@H](C)[C@H](C)NCc1ccc(C)cc1O 877323471 PHEITDSTJSQNEF-NEPJUHHUSA-N 265.353 2.378 10 20 CECD C[C@@H](NC(=O)C(=O)OC(C)(C)C)c1ccc(N(C)C)cc1 775432552 IJUHHFIIWVYBQE-LLVKDONJSA-N 292.379 2.272 10 20 CECD Cc1cccc(O)c1CN1CC(O)(c2ccccc2)C1 877536847 BYJVIOBKJUMHEG-UHFFFAOYSA-N 269.344 2.404 10 20 CECD CC1(C)CNCC[C@H](NCc2cc(F)ccc2O)C1 872251793 NFUNZXAKGGPRMJ-ZDUSSCGKSA-N 266.360 2.399 10 20 CECD Cc1ccc(CN2CCC(O[C@H]3CCOC3)CC2)c(O)c1 876783542 GCPPASHXZKSKJM-INIZCTEOSA-N 291.391 2.471 10 20 CECD Cc1cccc(O)c1CN1CCS[C@@H]2COCC[C@H]21 876798150 FHHQRIOSJPFQPR-UKRRQHHQSA-N 279.405 2.407 10 20 CECD Cc1cccc(O)c1CNCCCCN1CCC[C@@H]1CO 877042037 RXBUACGGMCPPKA-OAHLLOKOSA-N 292.423 2.027 10 20 CECD COc1ccc(CN2CCC[C@H](OC)CC2)c(O)c1OC 893512733 WYOAKJBTSRGZEP-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD OC1CCN(c2ccc(CNCc3ccccn3)cc2)CC1 76275555 CHTJUKYXHBNJFM-UHFFFAOYSA-N 297.402 2.333 10 20 CECD COc1ccc(CNCC2(CCNC(C)=O)CC2)cc1C 1163075077 LNEFVUBEVCYXBA-UHFFFAOYSA-N 290.407 2.400 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)O)cc1 77253398 JISBQSCCFPBAFE-UHFFFAOYSA-N 250.342 2.049 10 20 CECD C[C@@H](Cn1ccnc1)N[C@H](C)c1ccc(F)cc1O 62747598 SMLHPDHBPGBXCR-WDEREUQCSA-N 263.316 2.467 10 20 CECD CC(F)(F)C1(C(=O)NCc2ccc(N)cc2)CC1 692844249 VUGRKILJCQIYHC-UHFFFAOYSA-N 254.280 2.320 10 20 CECD C[C@H](CCO)CNCc1ccc(Br)cc1O 691454908 NCKABJTUPNEMMF-SECBINFHSA-N 288.185 2.263 10 20 CECD Cc1ccc(C(=O)N2CC(C)(C)CC[C@@H]2CO)c(O)c1O 1339147007 BYFXTRLAGCKRFP-LLVKDONJSA-N 293.363 2.029 10 20 CECD Nc1ccc(CNC(=O)C2C[C@@H]3CCC[C@H](C2)C3N)cc1 1356228094 NZFNIYYURVVRMH-KKNUOHPOSA-N 287.407 2.039 10 20 CECD C[C@H](CC(=O)NCc1cccc(O)c1O)C(F)(F)F 1520509114 RBDIJIVEDNAUGV-SSDOTTSWSA-N 277.242 2.303 10 20 CECD N[C@@H](CC1CCCCC1)C(=O)NCc1c(O)cccc1O 1580124708 XFRWYOJJODMZHC-ZDUSSCGKSA-N 292.379 2.012 10 20 CECD CN(C)c1ccc(/C=C\c2ncncc2C(=O)O)cc1 1598314560 XUICAZAHNUSIAU-YVMONPNESA-N 269.304 2.411 10 20 CECD COc1ccc(N(C)CC(=O)N2CCC[C@H](C)C2)cc1 844353773 ZXFFOFOMZPZNJG-ZDUSSCGKSA-N 276.380 2.390 10 20 CECD Cc1c(CN[C@@H](C)c2ccc(F)cc2O)cnn1C 186188075 DGIBCHPQEQZONR-VIFPVBQESA-N 263.316 2.424 10 20 CECD CCOc1cccc(CN(C)[C@@H]2CCCOC2)c1O 401621915 QXFKYMMSSXIOMJ-CYBMUJFWSA-N 265.353 2.402 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)C3CC3)C2)cc1 62574817 QOPRTJDQRHOQAU-GFCCVEGCSA-N 274.364 2.048 10 20 CECD Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)[nH]n1 174522210 ZSDXNKZVPBYPGG-UHFFFAOYSA-N 285.347 2.233 10 20 CECD COCCCCNC(=O)N[C@@H](C)c1cc(OC)ccc1O 171735731 PMSDAAHXHVTCEA-NSHDSACASA-N 296.367 2.188 10 20 CECD Cc1ccnc(O)c1C(=O)NCc1ccc(N(C)C)cc1 183570979 QUEDZRQWBBGUDK-UHFFFAOYSA-N 285.347 2.092 10 20 CECD Oc1ccccc1CN1CCC[C@@H]1CN1CCCC1 179563974 XSPKSWYNHHKRRY-OAHLLOKOSA-N 260.381 2.452 10 20 CECD C[C@@H](CC[S@](C)=O)NCc1cc(Cl)ccc1O 125469119 KVECOXRJMLBEIF-HUTHGQBESA-N 275.801 2.292 10 20 CECD C[C@]1(O)CCCN(Cc2cccc(Cl)c2O)C1 180377807 BPLXGSMLMWUMDY-ZDUSSCGKSA-N 255.745 2.392 10 20 CECD COc1ccc(N2CCN(C[C@H]3CC[C@H](C)O3)CC2)cc1 188535296 NOIMNTOFLLAMJY-WMLDXEAASA-N 290.407 2.385 10 20 CECD Cc1cc(O)c(CN2CCC[C@H]2c2nncn2C)cc1C 93809874 SRGAYLLMPFONJG-AWEZNQCLSA-N 286.379 2.475 10 20 CECD C[C@@H](O)CCN(C)Cc1cccc(Br)c1O 93481576 BVVWRWXSOUZAHV-SECBINFHSA-N 288.185 2.357 10 20 CECD CNC(=O)CCCN[C@H](C)c1cc2c(cc1O)CCCC2 273557639 HCDOTNIVUMUEPH-GFCCVEGCSA-N 290.407 2.448 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCO[C@H](C)C2)c1 271315514 XLSMQLXVARTJOZ-YPMHNXCESA-N 265.353 2.448 10 20 CECD Cc1cc(C)c([C@@H](C)NCCNC(=O)C(C)C)c(O)c1 285065103 JAKZGVQRAMKWPX-CYBMUJFWSA-N 278.396 2.432 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCC[C@H](O)C1 294817466 FTCVICPDDGTZBH-VIFPVBQESA-N 259.708 2.141 10 20 CECD COc1cccc(CN2CCN(C3CC3)C[C@H](C)C2)c1O 295946707 GREMDJIAXPEVNQ-CYBMUJFWSA-N 290.407 2.317 10 20 CECD CC[C@@H](CN[C@H](C)c1cc([N+](=O)[O-])ccc1O)OC 810259138 CBQBCRVCKWKGQN-KOLCDFICSA-N 268.313 2.376 10 20 CECD CN(C)c1ccc(CNC(=O)[C@]2(C)CC2(F)F)cc1 817423534 MFAJKMFHGBRWGB-ZDUSSCGKSA-N 268.307 2.414 10 20 CECD CCO/C=C/C(=O)NCc1ccc(N2CCCC2)cc1 816866087 GVLUEZTXOLIJRD-FMIVXFBMSA-N 274.364 2.453 10 20 CECD Cn1c(=O)oc2cc(CNCc3ccccc3O)ccc21 816545215 IHTWWNVVKWWHLR-UHFFFAOYSA-N 284.315 2.127 10 20 CECD CC(=O)NC1CCN(c2ccc(OC(F)F)cc2)CC1 726566634 XFBGWCZYWHIAKP-UHFFFAOYSA-N 284.306 2.393 10 20 CECD COC(=O)[C@H]1C[C@@H](NCc2c(O)ccc(Cl)c2F)C1 827500608 FNIIMGQLJLJWOA-OCAPTIKFSA-N 287.718 2.226 10 20 CECD CCCCNC(=S)NCc1cc(OC)ccc1O 733906750 QMKPTDHRLPMQIF-UHFFFAOYSA-N 268.382 2.165 10 20 CECD C[C@H]1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)CO1 845282544 PKYWWLUKVOCUAE-GZMMTYOYSA-N 284.743 2.022 10 20 CECD COc1ccc(N(C)Cc2nc(C3CC3)nn2C)cc1 844354407 CSDIJRZRLZLPBI-UHFFFAOYSA-N 272.352 2.338 10 20 CECD COC[C@H](NC(=O)NCc1ccc(N(C)C)cc1)C(C)C 743635880 XPEOOIYVSSPLEL-HNNXBMFYSA-N 293.411 2.223 10 20 CECD CC[C@H](C(=O)NCc1ccc(N(C)C)cc1C)[C@@H](C)O 842231598 MIIFBJFMWKYEQA-DOMZBBRYSA-N 278.396 2.084 10 20 CECD Cc1ncsc1CNC[C@H](N)c1ccc(N(C)C)cc1 841045787 QBZFNZIFLJWMGL-AWEZNQCLSA-N 290.436 2.307 10 20 CECD Cc1cc(C(=O)NCc2cnc[nH]2)c(C)n1-c1ccccn1 748322115 KUBTYMPCKONUIX-UHFFFAOYSA-N 295.346 2.142 10 20 CECD NCC1CCN(Cc2cccc(Br)c2O)CC1 843047671 UYVNWBZSVQCPCQ-UHFFFAOYSA-N 299.212 2.325 10 20 CECD COCC1(CN(C)c2ccc(OCC(=O)O)cc2)CCC1 846279616 HSUNLVCFFQKHET-UHFFFAOYSA-N 293.363 2.403 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CCN(CC(F)F)C1 841893234 BYPSNPSGLSHUMX-JTQLQIEISA-N 290.741 2.475 10 20 CECD NC[C@@H]1CC[C@@H](NCc2cccc(Br)c2O)C1 841085053 SVYIYKRXSMRIKO-MWLCHTKSSA-N 299.212 2.372 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NCC(F)F 846711899 RIXZBZUIYXKCHJ-UHFFFAOYSA-N 264.659 2.110 10 20 CECD COC(=O)[C@@]1(F)CCN(Cc2ccc(N(C)C)cc2C)C1 840923350 SSISMDZDUIGWLC-MRXNPFEDSA-N 294.370 2.148 10 20 CECD COC[C@](C)(O)CN[C@@H](C)c1cc(Cl)ccc1O 756576525 NMHGRFZBHKLJLI-TVQRCGJNSA-N 273.760 2.094 10 20 CECD Clc1cnc(SCc2nnc3n2CCOC3)s1 850000566 ZKYXZGBAEBCBIB-UHFFFAOYSA-N 288.785 2.211 10 20 CECD O=C(CCCNCc1ccc2c(c1)CCCO2)NC1CC1 921536833 RXLBWCDMBDVQRE-UHFFFAOYSA-N 288.391 2.160 10 20 CECD CCOc1ccc(CNc2ncccc2CO)c(O)c1 922291475 YKYBEVYJDKSCJC-UHFFFAOYSA-N 274.320 2.290 10 20 CECD CCCN1CC[C@H](NCc2ccc(OCC)cc2O)C1 850395068 NHBGUXYTMIQCDQ-AWEZNQCLSA-N 278.396 2.365 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1ccc(F)cn1 764380269 ZMVYMAZUQUYUCW-UHFFFAOYSA-N 289.310 2.268 10 20 CECD C[C@H]1[C@@H](C)N(Cc2cc(Cl)ccc2O)CC[S@]1=O 769464747 AABIPSPIBYVNPX-AUSHCKSDSA-N 287.812 2.387 10 20 CECD CCOc1ccc(CN(C)C[C@@H]2CCC[C@@H]2O)c(O)c1 770291266 FRMVLVNITDECOV-WFASDCNBSA-N 279.380 2.384 10 20 CECD CCN(C)c1ccc(CN(C)CC[C@@H](C)O)cc1 773752663 IRWQOEZXZBYQER-CYBMUJFWSA-N 250.386 2.345 10 20 CECD CC(=O)N1CCC(N[C@@H](C)c2c(O)cccc2F)CC1 886493441 LJWLOJXDHZKBTP-JTQLQIEISA-N 280.343 2.193 10 20 CECD O=C(/C=C/c1cncc(F)c1)N1CCc2ncccc21 770671971 IHPRXVQOATWLGH-ONEGZZNKSA-N 269.279 2.218 10 20 CECD Cc1cc(Cn2cc(CC(C)(C)O)nn2)ccc1N(C)C 881379105 YHXRWXFPWDBBRU-UHFFFAOYSA-N 288.395 2.014 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1ccccc1O 783518690 NQWFHYGNYOOFQQ-NWDGAFQWSA-N 253.342 2.094 10 20 CECD COc1cc(C)cc(CNCc2cc(C)no2)c1O 894391088 DVNOFXKWFZBYCP-UHFFFAOYSA-N 262.309 2.295 10 20 CECD CC[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccc(F)cc1O 796790597 SJRPIJGMEPBHTP-CHWSQXEVSA-N 280.343 2.193 10 20 CECD CN(C(=O)c1cccc(O)c1O)C1Cc2ccccc2C1 790572465 JUENQKWHVMZXLC-UHFFFAOYSA-N 283.327 2.337 10 20 CECD COC(=O)c1cnc(S[C@H](C)c2nccc(N)n2)s1 1327220221 RGPUUBDPHBNVEQ-ZCFIWIBFSA-N 296.377 2.155 10 20 CECD CCc1cccc(CNC[C@H](C)C[C@@H](C)O)c1O 709492905 VSGHLGCSONIPOC-VXGBXAGGSA-N 251.370 2.451 10 20 CECD CCc1cccc(CNCc2snnc2C)c1O 691434209 LRODFJZLIAIYQO-UHFFFAOYSA-N 263.366 2.404 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1C[C@@H]1F 1262801101 JDRXCWAYPNFPFD-CQDKDKBSSA-N 278.371 2.466 10 20 CECD C=C=CCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 1346389659 IRZHOMFTBDIETR-GFCCVEGCSA-N 259.353 2.454 10 20 CECD O=C(O)c1coc(CNCc2cc(F)cc(F)c2O)c1 1608989400 JSWSBWILAURDQT-UHFFFAOYSA-N 283.230 2.251 10 20 CECD O=C(O)c1cncc(NCc2cc(Cl)ccc2O)n1 1602539597 AINMMCKVJQRUAZ-UHFFFAOYSA-N 279.683 2.146 10 20 CECD CN(CC1CCC(=O)CC1)c1ccc(OCC(=O)O)cc1 1606100062 UYWIFYPOXPIWHI-UHFFFAOYSA-N 291.347 2.346 10 20 CECD CCC(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C)c1 1755574716 PYUCWKXAKTYJTK-ZDUSSCGKSA-N 278.396 2.350 10 20 CECD CCN1CCc2cc(CNCC3(CC(=O)O)CC3)ccc21 1776877242 BYQHFYQEKWVZQC-UHFFFAOYSA-N 288.391 2.414 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccc(F)cc1F 158863616 URCYBPLCYULLKF-UHFFFAOYSA-N 279.242 2.306 10 20 CECD COc1cc(O)c(CN2C[C@H](C)O[C@H](C)C2)cc1OC 159456225 JEMMCAWBWWXTLS-PHIMTYICSA-N 281.352 2.019 10 20 CECD C[C@H]1CCCN(Cc2ccc(N(C)C)cc2)[C@H]1CN 252173564 OMHOTDWAVXAHRA-BBRMVZONSA-N 261.413 2.312 10 20 CECD CN1CCCc2cc(CNCc3ncc[nH]3)ccc21 67694608 DQAZPGBPTAYGKP-UHFFFAOYSA-N 256.353 2.082 10 20 CECD C[C@H](CNC(=O)c1cccc(O)c1O)c1nccs1 193162781 YICYNWNBIRFXRB-MRVPVSSYSA-N 278.333 2.088 10 20 CECD Oc1c(F)cc(F)cc1CNC1CCC2(CC1)OCCO2 708421456 SPRJDGZBXAKZIJ-UHFFFAOYSA-N 299.317 2.446 10 20 CECD CCOc1cccc(CN2[C@H]3CC[C@H]2COC3)c1O 695064990 RVSLINZZUGRLNN-STQMWFEESA-N 263.337 2.154 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C2CCNCC2)c1O 50158760 HOFMSMSEIIVRKU-UHFFFAOYSA-N 296.798 2.432 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccnc(Cl)c2)c1 114544151 AMSJYDBTFQTKQE-UHFFFAOYSA-N 292.722 2.379 10 20 CECD Oc1cc2c(cc1CNC[C@H]1CCCS1)OCO2 122016323 YLVBXSGXKZYACH-SNVBAGLBSA-N 267.350 2.106 10 20 CECD CCOCc1cc(CNC[C@@H]2CC[C@@H](O)C2)ccc1OC 188798081 BQZRTTGQBJWDOH-GDBMZVCRSA-N 293.407 2.482 10 20 CECD CC[C@H](COC)NCc1ccc(N(C)C)c(F)c1 120225235 PCOIYSVESNAODR-GFCCVEGCSA-N 254.349 2.406 10 20 CECD CCCCN1CC(=O)N[C@H]1c1ccc(N(C)C)c(F)c1 75943823 DTXIDKQVFIDHFE-OAHLLOKOSA-N 279.359 2.122 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)c1nccn1C 182684071 ALPCUGYUXDKPAO-NSHDSACASA-N 276.359 2.476 10 20 CECD COCCCOCCN(C)Cc1cc(C)ccc1O 181523876 DVTAMAUVZFMTSI-UHFFFAOYSA-N 267.369 2.186 10 20 CECD Cc1ccc(C(=O)Nc2cccc(N(C)C)n2)c(O)c1O 183976569 ZWCYRAPQUYWPTA-UHFFFAOYSA-N 287.319 2.120 10 20 CECD CCOC(=O)N1CC[C@H](NCc2cc(C)c(C)cc2O)C1 185771360 IFHGJSABFSIRSJ-AWEZNQCLSA-N 292.379 2.329 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccn(CC(F)F)n1 194323799 DPAAHCUMAMZNAC-UHFFFAOYSA-N 295.289 2.126 10 20 CECD Cc1nccc(N(C)Cc2ccc(N3CCOCC3)cc2)n1 266138570 GIZBLVAWDKJJGM-UHFFFAOYSA-N 298.390 2.258 10 20 CECD COCC1(O)CCN(Cc2cccc(Cl)c2O)CC1 271839818 QARCEZVPLNFOAP-UHFFFAOYSA-N 285.771 2.019 10 20 CECD CC(C)[C@H](NCc1ccc(N(C)C)cc1)c1nncn1C 285500336 XMTWLOVHPTYOGH-HNNXBMFYSA-N 287.411 2.368 10 20 CECD CC(=O)C(=O)CSc1nc2ccccc2nc1C 808019677 FZRXSJFTMUBLPC-UHFFFAOYSA-N 260.318 2.188 10 20 CECD CCN(CC)C(=O)CN(CC)c1ccc(OC)cc1 299387745 QIGFYBLZWQYMDA-UHFFFAOYSA-N 264.369 2.390 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2OC)C[C@@H](C)[S@@]1=O 809699233 LZUVTJYITZRZLD-HTGLOVNISA-N 297.420 2.132 10 20 CECD Oc1ccc(Br)cc1CN1CC2(CCOC2)C1 294039424 OTKSETPNVWVCCG-UHFFFAOYSA-N 298.180 2.377 10 20 CECD COC(=O)c1cnc(SCC(=O)C(C)C)s1 295345810 QGBNMYSZIGPNPI-UHFFFAOYSA-N 259.352 2.247 10 20 CECD COC(=O)[C@@H]1C[C@H](F)CN1Cc1ccc(N(C)C)c(C)c1 815106469 VNHREGRTIIPUBR-ZFWWWQNUSA-N 294.370 2.146 10 20 CECD Cc1cc(O)c(CNCCc2cn[nH]c2)cc1Cl 825944564 YGAGZTAGRXPRKJ-UHFFFAOYSA-N 265.744 2.409 10 20 CECD Cc1cc(O)c(CNCC2(CC(N)=O)CC2)cc1Cl 826131218 PXYWIKWVYSBEPF-UHFFFAOYSA-N 282.771 2.099 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CN1CCCC1 820877533 AJZUTSAZPHJUSE-UHFFFAOYSA-N 276.380 2.227 10 20 CECD Oc1c(Cl)cccc1CN1CCC[C@H](n2ccnn2)C1 822503824 LSVIDWZSZWBAKF-LBPRGKRZSA-N 292.770 2.474 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H]2CCCN(CCCO)C2)c1 834850617 OEILSIIZUMKOEF-CABCVRRESA-N 292.423 2.198 10 20 CECD Cc1nnc([C@H](C)OC(=O)c2cc(O)cs2)o1 732353725 SXUKGZOFMMAXJL-YFKPBYRVSA-N 254.267 2.063 10 20 CECD COc1cccc(CNC(=O)c2ncoc2C(C)C)c1O 732284331 PLIOHXZKKMUVOW-UHFFFAOYSA-N 290.319 2.442 10 20 CECD CO[C@@](C)(C1CC1)[C@H](C)NC(=O)c1cccc(O)c1O 839827726 AZNQBVNPZMVPTL-BJOHPYRUSA-N 279.336 2.031 10 20 CECD CS(=O)(=O)c1cccc(NC(=O)c2cc(O)cs2)c1 731867509 LTDOTMYMVQYRRU-UHFFFAOYSA-N 297.357 2.110 10 20 CECD Cc1cc(C)c(CNC(=O)c2ccc(C)c(O)c2O)cn1 837106165 WWMSLXQEEBDIMJ-UHFFFAOYSA-N 286.331 2.348 10 20 CECD COC/C=C/C(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840556054 USFMYJRAABGNHL-UZYOAWRESA-N 290.407 2.311 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@H](C)c1cccc(OC)c1O 846143866 INJOGQQFMYYTSK-LOWVWBTDSA-N 267.369 2.458 10 20 CECD CC[C@H](N[C@@H](C)c1cccc(OC)c1O)[C@H](C)O 846170061 VTIKAPZFVICYST-NHCYSSNCSA-N 253.342 2.211 10 20 CECD CCn1nnc(C)c1COc1ccc(N(C)C)cc1 842043272 IIAGBHIZEJGFSJ-UHFFFAOYSA-N 260.341 2.251 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H]([C@@H](C)N)C2)c1O 843353954 RUQGEWPQYLFFLR-PWSUYJOCSA-N 294.370 2.293 10 20 CECD Cc1cc(O)c(CN2CCN[C@@H](C)C2)c(Cl)c1 840908970 ZRGVKZNETNYLCC-JTQLQIEISA-N 254.761 2.148 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@@H]2C=CCC2)cc1 852511743 LRCMMEIQGBJGCC-CYBMUJFWSA-N 259.353 2.270 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@](C)(O)C2CC2)c1 756767594 VFNMRFMZDITSMP-MGPLVRAMSA-N 293.363 2.129 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2ccn(C)c2)c1 858266162 AIPWHMQXPLASBF-UHFFFAOYSA-N 273.336 2.039 10 20 CECD c1cc(N2CCCCC2)ccc1CNCCN1CCC1 697358439 NCAFFHCYQRCMLT-UHFFFAOYSA-N 273.424 2.472 10 20 CECD O=C(CCn1cnc2ccccc21)NCc1ccccc1O 769363517 SKUFTKKSVDEXKA-UHFFFAOYSA-N 295.342 2.448 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@](C)(CC)OC 935945922 PSVHNAUSZZCFTG-OAHLLOKOSA-N 286.368 2.309 10 20 CECD C[C@@H](NC(=O)NCCc1cscn1)c1ccccc1O 875396165 OZZWGERHRNSBEN-SNVBAGLBSA-N 291.376 2.452 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCC[C@H]2N)c1 1118269365 DLKNCTRPRPKJMR-VHRBIJSZSA-N 292.379 2.096 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CCO[C@]2(CCOC2)C1 770752357 NMLUBMIOKFMOPD-XHDPSFHLSA-N 297.782 2.473 10 20 CECD COC(=O)[C@@H]1CCC[C@H](C(=O)N(C)c2ccc(N)cc2)C1 877075220 AMOKSFJDBDPIOV-NWDGAFQWSA-N 290.363 2.211 10 20 CECD C[C@H](NC(=O)[C@H]1CCO[C@@H]1C)c1ccc(N(C)C)cc1 772997308 FZSAKSLAHMYGCJ-ZOWXZIJZSA-N 276.380 2.355 10 20 CECD COCCC(C)(C)CNC(=O)NCc1ccc(N)cc1 1120528346 AKTZPBBHLYLUQQ-UHFFFAOYSA-N 279.384 2.131 10 20 CECD CC[C@@H](CO)C(=O)N(CC)Cc1ccc(N(C)C)cc1 779615512 JYGBTGJYSUKTNL-AWEZNQCLSA-N 278.396 2.120 10 20 CECD C[C@@H](NCCc1cncn1C)c1c(O)cccc1F 886594711 SAZDCTFQZQFPCT-SNVBAGLBSA-N 263.316 2.158 10 20 CECD C[C@@H](N[C@@H](CCO)C1CCOCC1)c1c(O)cccc1F 886590046 MJGJDQPIZFMSOF-RISCZKNCSA-N 297.370 2.360 10 20 CECD CCOC(=O)N(C)C1CCN(Cc2ccccc2O)CC1 770509482 AOVVXZYHOAZXKF-UHFFFAOYSA-N 292.379 2.445 10 20 CECD CC[C@H]1COCCN1Cc1ccc(OC)c(OC)c1O 891716407 PRRBJWODRLYPRT-LBPRGKRZSA-N 281.352 2.020 10 20 CECD CCOc1cccc(CNCCC(=O)N[C@@H](C)CC)c1O 38013684 NCMWZISPAKNLFC-LBPRGKRZSA-N 294.395 2.185 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](C)CNC)cc1 1325321757 ZKNHXEHDZPHGCS-AWEZNQCLSA-N 263.429 2.478 10 20 CECD OCCCSCCNCc1cccc(Cl)c1O 224793185 PTZJBJHBLAYFBH-UHFFFAOYSA-N 275.801 2.251 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)NCc1ccc(N)cc1 1335464838 JAIKQVKHUGPWFS-LLVKDONJSA-N 279.384 2.272 10 20 CECD Oc1ccc(Br)cc1CNC[C@H]1C[C@H](O)C1 720924757 GLPWFQVZCPBZLE-JLIMDTESSA-N 286.169 2.015 10 20 CECD Cc1nnc(O)c(CNCc2cc(F)cc(F)c2O)c1C 1331925753 WUNIYSRXKIVOFB-UHFFFAOYSA-N 295.289 2.073 10 20 CECD C[C@@H](NC(=O)N[C@@H]1C[C@@H]2CC[C@H]1O2)c1ccccc1O 1343487010 BPXWEWATZSWOFK-IQOUGMIPSA-N 276.336 2.072 10 20 CECD O=C(NCc1cccc(O)c1O)C1(C(F)(F)F)CC1 1520508720 KGRSWHGDDZUVCN-UHFFFAOYSA-N 275.226 2.057 10 20 CECD Cc1ccc(CN2C[C@@H]3CCC[C@H]3[C@H]2C(=O)O)c(O)c1 1600413668 VTGFUSQWIFXYIW-LNSITVRQSA-N 275.348 2.386 10 20 CECD O=C(O)CCCCC(=O)NCc1cccc(Cl)c1O 1606142032 ODDNTHMUHFONDD-UHFFFAOYSA-N 285.727 2.307 10 20 CECD C[C@H](N[C@H]1C[C@@H](C)O[C@H]1C)c1cc(C(=O)O)ccc1O 1594261954 SKIGAPZFIBKBIF-QYTUQVAYSA-N 279.336 2.307 10 20 CECD CCC[C@@H](CC(=O)O)NCc1ccc(N(C)C)cc1 1776828201 QWHSBCYNZJDESO-ZDUSSCGKSA-N 264.369 2.486 10 20 CECD CCN1CCc2cc(CN[C@H](CC(=O)O)C3CC3)ccc21 1776877663 YIXAADVCZYBGDW-OAHLLOKOSA-N 288.391 2.412 10 20 CECD C[C@@H]1C[C@H]1[C@H](NCc1ccc2c(c1)CCCO2)C(=O)O 1776603062 OWWHPMFMEVCJCE-YVLXSGLVSA-N 275.348 2.210 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2(N(C)C)CCC2)c1 153888292 GGQUBBRPXNATEG-LLVKDONJSA-N 292.379 2.062 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(F)c(F)c(F)c1 159129523 KVYGPVSMVCHGGB-UHFFFAOYSA-N 297.232 2.445 10 20 CECD CC(C)C[C@@H]1COCCN1C(=O)Cc1ccc(N)cc1 157519791 JALKMPJYMDHZJX-OAHLLOKOSA-N 276.380 2.085 10 20 CECD Cc1ccc([C@@H](C)NCCc2cncn2C)c(O)c1 401717351 HVUQSVPRSZYBPV-GFCCVEGCSA-N 259.353 2.327 10 20 CECD CNC(=O)C[C@H](C)NCc1cc(Cl)cc(Cl)c1O 322831805 ZLZMUXSTFSQSLX-ZETCQYMHSA-N 291.178 2.313 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)c1cnn(C)c1 708494448 JZJVXYKDNCFOHV-QMMMGPOBSA-N 267.279 2.255 10 20 CECD CNC(=O)CCN(Cc1ccco1)Cc1ccccc1O 111232746 GXSKPDVKCWABSW-UHFFFAOYSA-N 288.347 2.124 10 20 CECD CCCN(CC(=O)OCC)Cc1cccc(C)c1O 179825985 LQZDIUYMGNHGTN-UHFFFAOYSA-N 265.353 2.476 10 20 CECD CCOc1cccc(CN2CCC[C@@](C)(O)C2)c1O 129474720 KFHUKTOATYUHGZ-OAHLLOKOSA-N 265.353 2.138 10 20 CECD C[C@H]1CN(C(=O)c2cccc(O)c2O)C[C@H](C)C1(F)F 862437737 IMLBPMCYALDUIL-IUCAKERBSA-N 285.290 2.461 10 20 CECD O=C(NCc1ccc(N2CCSCC2)cc1)NC1CC1 42933199 FMGRAMGBBHILTC-UHFFFAOYSA-N 291.420 2.201 10 20 CECD Cc1n[nH]c(C)c1NC(=O)CSc1nccs1 194355627 PYXQJRBZSRTCHK-UHFFFAOYSA-N 268.367 2.214 10 20 CECD Cc1noc(C)c1NC(=O)NCCc1ccc(O)c(O)c1 268584639 NSVZWQYMEYDAAE-UHFFFAOYSA-N 291.307 2.067 10 20 CECD Cc1ccc(O)c(CN(C)CCc2noc(C)n2)c1 271141848 ATKQPAIZZFUNHF-UHFFFAOYSA-N 261.325 2.067 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)cc(OC)c2O)C[C@@H]1O 273779466 SLDCAQHWZKBAOH-CABZTGNLSA-N 285.771 2.257 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)[C@@H]1CCCCO1 272639774 LLDYRDKHMDVZGH-SMBUJGDBSA-N 291.347 2.185 10 20 CECD COC1(CCNC(=O)NCc2ccccc2O)CCC1 297920866 ZEHLSHHCUPSSJI-UHFFFAOYSA-N 278.352 2.151 10 20 CECD COCC1(CNCc2cc(C)ccc2O)CCOCC1 291779576 UTKUPQZCVBGYCL-UHFFFAOYSA-N 279.380 2.233 10 20 CECD CN(C)c1ccc(CN2CC[C@H](n3cccn3)C2)cc1 291363669 YQDUNYWWJAPLCT-INIZCTEOSA-N 270.380 2.396 10 20 CECD Oc1ccccc1CNCCO[C@@H]1CCCCO1 813333027 IFPDTIINZSUGEF-CQSZACIVSA-N 251.326 2.025 10 20 CECD C[C@@H](N[C@@H]1CCCNCC1)c1cc(F)ccc1O 817968455 JNYDPBIILHZMTD-ZYHUDNBSSA-N 252.333 2.324 10 20 CECD Cc1noc([C@@H](C)NCc2ccc3c(c2)CCO3)n1 725843067 QTBHECKQBJJBHP-SECBINFHSA-N 259.309 2.164 10 20 CECD CO[C@H]1COCC[C@H]1CNCc1cc(Cl)c(C)cc1O 826049759 ZDNOVWBMEJUTRP-NHYWBVRUSA-N 299.798 2.495 10 20 CECD C[C@@H](NC(=O)[C@H]1CCn2ccnc2C1)c1ccccc1O 827941113 MNXMENAECRSRHQ-NEPJUHHUSA-N 285.347 2.029 10 20 CECD O=C(O)C1CCN(Cc2cc(Cl)cc(F)c2O)CC1 821511841 RTBHWKPFXKGXFO-UHFFFAOYSA-N 287.718 2.481 10 20 CECD COC(=O)c1cnc(SCCCC(C)=O)s1 829680878 HKHGJSNEKVUTMW-UHFFFAOYSA-N 259.352 2.391 10 20 CECD CC(=O)c1cc(F)cc(CN(CCC(=O)O)C(C)C)c1O 825946881 VFWCDXXQYQQBSA-UHFFFAOYSA-N 297.326 2.419 10 20 CECD C[C@@H](NCC[C@@H](O)C1CC1)c1cc([N+](=O)[O-])ccc1O 903409459 XCSOYEFCWORQQM-NOZJJQNGSA-N 280.324 2.112 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(F)c1O)C(=O)O 820419259 TUULXCGFYWHZPT-SECBINFHSA-N 261.680 2.138 10 20 CECD C[C@H](N[C@H]1COC[C@H]1C)c1cc(F)cc(F)c1O 903395068 JFYUCULZKFNJLM-LWINAJNOSA-N 257.280 2.356 10 20 CECD CC(C)[C@H]1CN(C(=O)c2cc(O)cs2)CCCO1 832939861 CUDUKXJJJJZHMN-LLVKDONJSA-N 269.366 2.341 10 20 CECD O=C(NCC[C@@H]1C[C@H]2CC[C@H]1O2)NCc1ccccc1O 838059539 BTEQBTUBLXRMFH-UXIGCNINSA-N 290.363 2.149 10 20 CECD COc1ccc(CNC(=O)CCCC(=O)C2CC2)c(O)c1 831032538 GMYHSPMQHVISDM-UHFFFAOYSA-N 291.347 2.166 10 20 CECD Cc1cn(C)nc1C(=O)NCc1c(O)ccc2c1CCCC2 839693423 UYGZNYRANHAKLK-UHFFFAOYSA-N 299.374 2.243 10 20 CECD COC(C)(C)CNCc1ccc(N2CCOCC2)c(F)c1 742380127 INVMVOZEOPZRTN-UHFFFAOYSA-N 296.386 2.177 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H]2[C@@H](C1)[C@H]1C=C[C@H]2O1 840951586 ZAMQEHMOVPFLGM-BRSBDYLESA-N 284.403 2.446 10 20 CECD Cc1cccc(CN2CCC([C@@H]3OCC[C@H]3N)CC2)c1O 843124397 AELDGCWDEJLYRL-WBVHZDCISA-N 290.407 2.029 10 20 CECD CN(C)c1ccc(CNC2(C)CCNCC2)cc1F 841064329 FCWUFYLVWPKHAN-UHFFFAOYSA-N 265.376 2.123 10 20 CECD CCC[C@H]1CNCCN1Cc1cc(F)cc(C(C)=O)c1O 843365847 YNRZIKFGCZKZPC-AWEZNQCLSA-N 294.370 2.308 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)CO[C@H]2CCOC2)c1O 846150907 SVIYNGDIBDEYIP-AVGNSLFASA-N 295.379 2.245 10 20 CECD Cc1ccc(C(=O)N2CCOC[C@H]2C2CCC2)c(O)c1O 844039931 XOHVJLRKPIHOMC-ZDUSSCGKSA-N 291.347 2.047 10 20 CECD C[C@H]1CN(Cc2cccc(Br)c2O)C[C@H](C)N1 843049189 IQXDHYHFLYFFDD-UWVGGRQHSA-N 299.212 2.337 10 20 CECD CCC[C@H]1CNCCN1Cc1ccc(N(C)C)c(F)c1 843057989 JXRWQLWKRINZOM-AWEZNQCLSA-N 279.403 2.466 10 20 CECD COc1ccc(CN[C@](C)(C(N)=O)c2ccccc2)cc1C 929926392 VPXRTRCQIJUBII-SFHVURJKSA-N 298.386 2.494 10 20 CECD Oc1ccc(Cl)cc1CNC[C@@H]1CCCCN1 841032622 IDEFCBNQKZZKAR-LBPRGKRZSA-N 254.761 2.277 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCCN(C)C 840933768 SOVFMHKYDVHMII-UHFFFAOYSA-N 263.429 2.492 10 20 CECD CN[C@@H]1CCCN(Cc2ccc(N(C)C)c(C)c2)C1 923284865 WDFSKVXVIJYJRJ-OAHLLOKOSA-N 261.413 2.245 10 20 CECD C[C@@H]1C[C@@H](NC/C=C\CO)c2c(O)ccc(F)c21 850507743 HPGJXTGHONBQET-NWRGJWMSSA-N 251.301 2.218 10 20 CECD CN(C)c1cc(F)c(CNCCn2cccn2)cc1F 858105134 JWDFOGNETFUDDW-UHFFFAOYSA-N 280.322 2.017 10 20 CECD C/C=C\C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 753742673 WHHGFZUUAYKYFH-ARJAWSKDSA-N 278.327 2.059 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)OCCF)cc1 859207261 VTFGSCJIKOQYQV-UHFFFAOYSA-N 284.331 2.169 10 20 CECD C[C@H](NC(=O)CCc1ccncn1)c1ccc(N(C)C)cc1 755387815 XFJSSBMLXUBAKL-ZDUSSCGKSA-N 298.390 2.353 10 20 CECD CC[C@@H]1CC[C@@H](C)N(C(=O)C(=O)Nc2ccc(N)cc2)C1 850852730 WYEMTJOSNYXYMU-VXGBXAGGSA-N 289.379 2.244 10 20 CECD CC(=O)c1cc(Cl)cc(CN2[C@H]3CC[C@H]2CNC3)c1O 852761643 PWHQDUJBQGPAAD-STQMWFEESA-N 294.782 2.184 10 20 CECD OCCOC1CCN(Cc2c(O)cccc2Cl)CC1 769537231 JFDJWANHZWYFPJ-UHFFFAOYSA-N 285.771 2.019 10 20 CECD CCOc1ccc(CN2CC[C@@](C)(C(=O)OC)C2)c(O)c1 769528743 ZBOFWHLVRKQREF-MRXNPFEDSA-N 293.363 2.176 10 20 CECD COc1cccc(O)c1CN1CCN(c2ccccn2)CC1 768143706 MPNZTDHDVIBAJX-UHFFFAOYSA-N 299.374 2.118 10 20 CECD COc1cc(CN2CC[C@@H](CN(C)C)C2)c(O)cc1C 768444723 BQJSRIWWOBJDFB-ZDUSSCGKSA-N 278.396 2.093 10 20 CECD Cc1ccc(O)c(CN2CCC(O[C@H]3CCOC3)CC2)c1 769526468 LTUUDGCQIUFADW-INIZCTEOSA-N 291.391 2.471 10 20 CECD O=C(N[C@H]1CCc2cc(O)ccc2C1)c1cc(O)cs1 774357165 ZDTGYEUSNJLGDB-NSHDSACASA-N 289.356 2.447 10 20 CECD COC(=O)C(C)(C)CCNCc1ccc(C)cc1O 877515722 NPNWFPUACIITJH-UHFFFAOYSA-N 265.353 2.380 10 20 CECD C[C@H](C[C@@H]1CCCC(=O)N1)NCc1ccc2c(c1)CCO2 876996616 XBIWTTIPYFBICO-DOMZBBRYSA-N 288.391 2.158 10 20 CECD Cc1[nH]nc(NC(=O)/C=C/c2ccc(O)c(O)c2)c1C 779514688 QAHFOOAATCHUGG-GQCTYLIASA-N 273.292 2.090 10 20 CECD COCCOC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 885115885 JDSBWZZYOZLVLE-NSHDSACASA-N 266.341 2.186 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCN3CCCC[C@H]23)c1O 894181065 PAACHJLQFBUVAO-HUUCEWRRSA-N 290.407 2.426 10 20 CECD CCOc1ccc(CN[C@H](COC)[C@H]2CCCO2)c(O)c1 788533858 DDLIKVBBGZAOIA-GDBMZVCRSA-N 295.379 2.075 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CC[C@@H](C)C2)c(O)c1 793066090 KNIMNXRUEYWWTO-ZYHUDNBSSA-N 278.352 2.389 10 20 CECD COCCOCCCNCc1c(O)cccc1Cl 83551601 UZXRBTBPVHTKTN-UHFFFAOYSA-N 273.760 2.188 10 20 CECD Cc1ccc(O)c(CN2CCO[C@@H]([C@@H]3CCCO3)C2)c1 91928187 DJLCDXSKEHYRHH-JKSUJKDBSA-N 277.364 2.080 10 20 CECD C[C@H](NC1COC(C)(C)OC1)c1ccccc1O 757697903 NJSDFTLFZQXYAJ-JTQLQIEISA-N 251.326 2.194 10 20 CECD CC(C)C[C@H](CN)CC(=O)N(C)Cc1ccccc1O 88277451 GDQMUUCJJLYBNC-ZDUSSCGKSA-N 278.396 2.362 10 20 CECD CC[C@H](F)C(=O)NCCCSc1nccs1 1337075396 CRQLVSXRJWUDPE-QMMMGPOBSA-N 262.375 2.490 10 20 CECD CO[C@H]1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 1337744233 RNGWBIHFFLQZGY-GJZGRUSLSA-N 276.380 2.184 10 20 CECD COc1ccc(CNC[C@H]2CCC[C@H](O)C2)c(O)c1OC 1342959491 HEMAAUJMLSPEIH-AAEUAGOBSA-N 295.379 2.050 10 20 CECD CN(C)[C@H]1CCCC[C@@H]1NCc1cc(F)ccc1O 1320161966 ULOFAQRLEYEJHJ-KBPBESRZSA-N 266.360 2.494 10 20 CECD CN(C)c1ccc(/C=C/c2ccncc2-c2nn[nH]n2)cc1 1604700722 QAMPHWMMTVNIAL-ZZXKWVIFSA-N 292.346 2.498 10 20 CECD Cc1cc(O)c(CN2CCO[C@H](CC(=O)O)C2)c(Cl)c1 1600285797 GWOXZCMNGUSJTE-SNVBAGLBSA-N 299.754 2.030 10 20 CECD C[C@H](N[C@@H](C)[C@@H]1CCCNC1)c1cc(C(=O)O)ccc1O 1593196367 HMFRZCSYTSPGQV-GMXVVIOVSA-N 292.379 2.129 10 20 CECD O=C(O)[C@]1(NCc2ccc3c(c2)CCCO3)CC[C@H]2C[C@@H]21 1777600187 RDNXTEJQAAGUMR-JDFRZJQESA-N 287.359 2.355 10 20 CECD Oc1cccc2c1[C@@H](NCCOC[C@@H]1CCCO1)CC2 834588330 AXOJEIMKPIMJRZ-KBPBESRZSA-N 277.364 2.165 10 20 CECD Cc1ccc(S(=O)(=O)NCc2ccccc2O)c(C)c1 158575091 HOKFHHYARCSZQN-UHFFFAOYSA-N 291.372 2.488 10 20 CECD COc1ccc(O)c(CNCC(C)(C)C(C)(C)O)c1 393586584 ALXNMGNZDULBFM-UHFFFAOYSA-N 267.369 2.288 10 20 CECD C[C@H](O)CN(Cc1ccccc1)C(=O)Cc1ccc(N)cc1 830290956 GUUMJAOZEIXENK-AWEZNQCLSA-N 298.386 2.221 10 20 CECD Cc1cccc(C(=O)N[C@@H]2CCCC(=S)C2=O)c1 2332239631 KXLCSYYCVZTQRR-LLVKDONJSA-N 261.346 2.216 10 20 CECD CC(C)NC(=O)CCNCc1c(O)cccc1Cl 134652458 AZAGHSGWNMTSPI-UHFFFAOYSA-N 270.760 2.050 10 20 CECD COc1ccc(O)c(CN[C@@H](CO)Cc2ccccc2)c1 63218420 YMCSHWQDFYPPSC-OAHLLOKOSA-N 287.359 2.094 10 20 CECD CC(C)Cn1cnc(S(=O)(=O)Nc2ccc(O)cc2)c1 182419716 AYIUOHIWXTXBMD-UHFFFAOYSA-N 295.364 2.046 10 20 CECD CCCN(Cc1ccccc1O)C(=O)C[C@@H]1CCNC1 128879611 WLMKLVFPFPLWHL-ZDUSSCGKSA-N 276.380 2.130 10 20 CECD COC(=O)[C@H]1CCN(Cc2cccc(OC)c2O)C[C@@H]1C 188121882 MZRWIYFWOFVVNW-AAEUAGOBSA-N 293.363 2.032 10 20 CECD CC(=O)N1CCN(Cc2cccc(C)c2O)C(C)(C)C1 182085240 FFQRAYZKVXCZET-UHFFFAOYSA-N 276.380 2.143 10 20 CECD CC[C@@H](O)CCN[C@H](C)c1ccc(F)c(F)c1O 187762214 BDOQAQKOLXGGRJ-RKDXNWHRSA-N 259.296 2.482 10 20 CECD CCCN1CCN(Cc2ccccc2O)C(C)(C)C1=O 190269220 MHYBTKFVRTVYEQ-UHFFFAOYSA-N 276.380 2.225 10 20 CECD CC[C@](C)(CCO)NCc1ccc(N2CCOCC2)cc1 134463683 PFHWOXNVUYABDB-QGZVFWFLSA-N 292.423 2.164 10 20 CECD CCOC[C@H](O)CN(C)c1ccc(OC)c(Cl)c1 131440262 IDTHDAKCUSNFLO-LLVKDONJSA-N 273.760 2.182 10 20 CECD Nc1ccc(NC(=O)c2cc3c([nH]c2=O)CCCC3)cc1 238020675 OELXBHGVSCADAL-UHFFFAOYSA-N 283.331 2.088 10 20 CECD CCOC[C@H]1CN(Cc2ccc(OCC)cc2O)CCO1 529667407 VCQWALQHYVSISL-OAHLLOKOSA-N 295.379 2.028 10 20 CECD C[C@H](N[C@H](C)[C@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O 273610367 VPQKOGHOQMRVKD-VWYCJHECSA-N 280.324 2.376 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@H](COC)OC)cc1 272642449 CXSHJFBFPAHGRT-BBRMVZONSA-N 280.412 2.455 10 20 CECD COc1cccc(CN2CCO[C@H](COC(C)C)C2)c1O 372116400 KLSRNKPULIGCCP-AWEZNQCLSA-N 295.379 2.027 10 20 CECD COCC(C)(C)CCCNC(=O)c1cccc(O)c1O 288248179 QRTAPKIEHVGZTC-UHFFFAOYSA-N 281.352 2.280 10 20 CECD CCS(=O)(=O)CCN[C@@H](C)c1c(C)cc(C)cc1O 284221936 UCJBGROARSAXLN-LBPRGKRZSA-N 285.409 2.094 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@]2(O)CCO[C@H]2C)c(O)c1 285447661 ZHXVNIJRWSBLMV-XEZPLFJOSA-N 279.380 2.200 10 20 CECD Cc1ncc(NCc2ccc(N3CCOCC3)cc2)cn1 395266645 MYHLXSMLNOOFGO-UHFFFAOYSA-N 284.363 2.234 10 20 CECD CO[C@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 298833485 YTYLGIILGVRLGD-GFCCVEGCSA-N 276.380 2.279 10 20 CECD C[C@H](N[C@@H]1CC[C@@H](CN)C1)c1ccc(F)cc1O 817981272 IIAJVUFNKRPNBL-HOSYDEDBSA-N 252.333 2.309 10 20 CECD COc1ccc2c(c1)C[C@H](C(C)C)CN2CC(=O)O 817874291 PHAJAGQTCHVBDX-LBPRGKRZSA-N 263.337 2.415 10 20 CECD CO[C@@H](C)[C@@H](C)NC(=O)NCc1ccc(N(C)C)cc1C 811960332 ULJNMKUXQDNQBR-OLZOCXBDSA-N 293.411 2.284 10 20 CECD CN(C)c1ccc(CN2CC[S@@](=O)C(C)(C)CC2)cc1 825024658 SMBYVYNTKIUYSX-HXUWFJFHSA-N 294.464 2.486 10 20 CECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)Cc1ccc(N)cc1 829805405 SVJBUEWWVITTGL-MRXNPFEDSA-N 296.374 2.104 10 20 CECD COC(=O)C[C@@H](C)CC(=O)N[C@H](C)c1ccccc1O 827946404 GXOZBBOLGNRXBE-WDEREUQCSA-N 279.336 2.159 10 20 CECD C[C@@H](NCC[C@@H](O)C1CC1)c1cc(F)cc(F)c1O 903408903 VIARKRFMUPCZSE-AMIZOPFISA-N 271.307 2.482 10 20 CECD Cc1ncc(/C=C/C(=O)N2C[C@@H](N)Cc3ccccc32)s1 493334434 KDCJLSCODHZXKZ-YBJDMEARSA-N 299.399 2.381 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2cc(Cl)cc(F)c2O)C1 833554508 VTVJNSHCOACXML-ZDUSSCGKSA-N 287.718 2.481 10 20 CECD C[C@H](NC(=O)N[C@H](C)CCCN)c1ccc(N(C)C)cc1 841882048 VRRSSHYNPWOKOZ-OLZOCXBDSA-N 292.427 2.240 10 20 CECD O=C(CSCC(F)(F)F)NCc1ccc(O)cc1O 910949986 RNHQHLQTEILLGC-UHFFFAOYSA-N 295.282 2.010 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCO[C@@H](CF)C1 840955708 YJVXTIRDAHNGFP-HNNXBMFYSA-N 266.360 2.231 10 20 CECD CCCN[C@@H](C)C(=O)N(CC)Cc1ccc(N(C)C)cc1 843487893 LMPDEOCJRVDUFZ-AWEZNQCLSA-N 291.439 2.489 10 20 CECD C[C@H]1C[C@H](NC(=O)NCc2ccccc2O)CS1 840276686 MVWDCKJAXUJFKS-ONGXEEELSA-N 266.366 2.085 10 20 CECD CCS(=O)(CC)=NC(=O)/C=C\c1ccc(O)c(O)c1 925881602 JSJLYTXLIMFSPC-VURMDHGXSA-N 283.349 2.145 10 20 CECD COC[C@H](C)CC(=O)N[C@H](C)c1ccccc1O 827937471 XTOFRBBCBQVHRU-GHMZBOCLSA-N 251.326 2.242 10 20 CECD CCOc1ccc(CN(CCO)[C@@H](C)CC)c(O)c1 862388034 UVXYNTQOKDNNAL-LBPRGKRZSA-N 267.369 2.384 10 20 CECD CCCOc1ccc(CN[C@H]2CCS(=O)(=O)C2)cc1C 873008762 CLXQPOMSWAHSIK-AWEZNQCLSA-N 297.420 2.061 10 20 CECD CCN(Cc1ccc(C)cc1O)[C@@H](C)CS(=O)(=O)CC 876734878 AZQJHSKGZVZMMD-ZDUSSCGKSA-N 299.436 2.346 10 20 CECD COc1ccc(N2CCN(C[C@H]3CCO[C@@H]3C)CC2)cc1 877912515 XOHOGNZRXYZMAC-HUUCEWRRSA-N 290.407 2.242 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ccc[nH]1 779539544 HCNAUUGFXMEJDM-STUBTGCMSA-N 272.304 2.317 10 20 CECD CCCNC(=O)C1CCN(Cc2c(C)cccc2O)CC1 876561637 QABIYFIHDLMGCN-UHFFFAOYSA-N 290.407 2.439 10 20 CECD COC(=O)C1=C(C)O[C@@H](CN[C@H](C)c2ccccc2O)C1 879649015 HLROBAHRULPZJD-ZYHUDNBSSA-N 291.347 2.279 10 20 CECD COc1cccc(CN2CCC(C(C)(C)O)CC2)c1O 877753577 HBBHVSXJXCBIAX-UHFFFAOYSA-N 279.380 2.384 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)N(C)C 874232271 SXFAUKBDVMULEI-CYBMUJFWSA-N 277.412 2.051 10 20 CECD CN(C)c1ccccc1N(C)C(=O)/C=C\c1cnn(C)c1 772135923 HHLQAFOUXSGXCW-KTKRTIGZSA-N 284.363 2.162 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@](C)(O)C(C)C 771371722 KOMFEBIWTBEJHU-INIZCTEOSA-N 278.396 2.084 10 20 CECD CCC1(CC)[C@H](NC(=O)c2cccc(O)c2O)C[C@H]1OC 776678312 SQGPWJOCDHNRRY-CHWSQXEVSA-N 293.363 2.421 10 20 CECD CCn1cc([C@H](C)NC(=O)NCc2ccc(N)cc2)cn1 1120625353 YAKSPWAQDBUKCY-NSHDSACASA-N 287.367 2.046 10 20 CECD C[C@H](NCCCN1CCCCC1=O)c1ccccc1O 783509801 SZRIUQLXRNZOQB-ZDUSSCGKSA-N 276.380 2.445 10 20 CECD COc1cc(N2C[C@H]3C[C@@H]3C2)c([N+](=O)[O-])cc1OC 884589528 CPIHHNBCWBSXQM-RKDXNWHRSA-N 264.281 2.068 10 20 CECD CCn1c(-c2sccc2O)nnc1N1C[C@H]2C=C[C@H]1C2 1121765227 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Cc1cc(CN2CC[C@H](CCN)C2)ccc1N(C)C 923478410 BRXSPIHQPRTXDX-AWEZNQCLSA-N 261.413 2.232 10 20 CECD CS/C=C\C(=O)NCc1ccc(N(C)C)cc1 751457031 BBKSGDSNACKWHU-HJWRWDBZSA-N 250.367 2.246 10 20 CECD C[C@@H](NC(=O)NCCc1nccs1)c1ccccc1O 868182094 ZZUSSKKBODLTHV-SNVBAGLBSA-N 291.376 2.452 10 20 CECD CC(=O)Nc1ccccc1CC(=O)NCc1ccccc1O 768070260 GKLVUQGGVSSSSX-UHFFFAOYSA-N 298.342 2.210 10 20 CECD CCOc1ccc(CN[C@@H]2CCO[C@@H](C)C2)c(O)c1 769709733 JKALBZAACSABLZ-WCQYABFASA-N 265.353 2.448 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1ccc(N(C)CC)cc1 773814819 JBPZNYQMXUAWOB-MRXNPFEDSA-N 289.423 2.243 10 20 CECD CCOc1ccc(CN2CCC[C@@]23CCOC3=O)c(O)c1 779198692 KIENMVZXUCKWPZ-INIZCTEOSA-N 291.347 2.072 10 20 CECD Cn1ccnc1[C@H]1CCCN(C(=O)c2cc(O)cs2)C1 774658411 NOGAYNCUMSWAFB-JTQLQIEISA-N 291.376 2.207 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CNC(C)(C)C 1116074886 YPUPZDQALBFEJY-UHFFFAOYSA-N 277.412 2.065 10 20 CECD Oc1ccc(F)cc1CN1CCC(O[C@@H]2CCOC2)CC1 779026844 ZLAFLZUOCKVFAM-OAHLLOKOSA-N 295.354 2.301 10 20 CECD CCC[C@](C)(N)C(=O)N[C@H](C)c1ccccc1O 870988061 FIWQKTOWWLLCEI-YGRLFVJLSA-N 250.342 2.087 10 20 CECD Cc1cccc(O)c1CNC[C@H]1CC[C@H](C(N)=O)CC1 877594989 PAMOQJISQVICBZ-JOCQHMNTSA-N 276.380 2.082 10 20 CECD CC[C@@H](NCC(=O)NC1CCCC1)c1ccccc1O 775416813 YANGBNQLNXDGOW-CQSZACIVSA-N 276.380 2.492 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@@H](C)c1c(O)cccc1F 886509845 GCILWBMPNWQDDD-QWRGUYRKSA-N 280.343 2.193 10 20 CECD CC(C)[C@H](NCc1cc(F)cc(F)c1O)c1nncn1C 883117404 YIGYDZGOVVHVIW-LBPRGKRZSA-N 296.321 2.286 10 20 CECD CCN(CC)c1ccc(CN2CC(=O)N(C)C[C@@H]2C)cc1 783727289 AMJUMKZJLNNDQE-AWEZNQCLSA-N 289.423 2.195 10 20 CECD CN[C@@H](CC(C)C)C(=O)N[C@@H](C)c1cc(OC)ccc1O 884309805 GPVMILVBWSTSQZ-FZMZJTMJSA-N 294.395 2.212 10 20 CECD CO[C@@H]1CCOC[C@H]1NCc1cc(Cl)c(C)cc1O 897889061 MROLZZBOUNIFGM-TZMCWYRMSA-N 285.771 2.248 10 20 CECD COc1ccc(CNC(=O)[C@H]2C[C@H]2C2CC2)c(O)c1 794387518 KDPRMSLVFBESLB-STQMWFEESA-N 261.321 2.063 10 20 CECD Cc1nccn1CCCNCc1cc(F)ccc1O 272395203 JJACYNUYMHXTMM-UHFFFAOYSA-N 263.316 2.216 10 20 CECD COc1ccc(O)c(CNCc2ncc(Cl)n2C)c1 393336431 YCZIHZCLJGBALZ-UHFFFAOYSA-N 281.743 2.078 10 20 CECD Nc1ccc(CCNC(=O)CC[C@H]2CCCCO2)cc1 69384415 HQSCKRQNMIKQHS-OAHLLOKOSA-N 276.380 2.277 10 20 CECD C[C@@H](CN(C)C)NCc1ccc(Br)cc1O 691456340 SWNAGDTUGQZSPP-VIFPVBQESA-N 287.201 2.194 10 20 CECD Cc1ncsc1CCNC(=O)NCc1ccc(N)cc1 1338610817 YSGZYHGITXGTCP-UHFFFAOYSA-N 290.392 2.076 10 20 CECD CN(C(=O)/C=C\c1cn(C)cn1)c1cccc2c1CCCN2 1358173768 ZBRLWVPFWMGGGQ-HJWRWDBZSA-N 296.374 2.454 10 20 CECD C[C@H](NC(=O)[C@H](C)CC(=O)O)c1ccc(N(C)C)cc1 1609731519 JLWVJNLRHCLSMK-MNOVXSKESA-N 278.352 2.041 10 20 CECD Cc1ccc(O)c(CN[C@](C)(CC(=O)O)C2CC2)c1 1600465234 UGHSZORFXMSRHK-OAHLLOKOSA-N 263.337 2.434 10 20 CECD CCOc1cccc(CN2CCC(C(=O)O)CC2)c1O 15416228 BOGYWVANCWPAKI-UHFFFAOYSA-N 279.336 2.088 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)CN2CCCC2=O)c(O)c1 37782956 JDAXDSIGEBLNMK-OLZOCXBDSA-N 276.380 2.362 10 20 CECD CC(C)(C)NC(=O)CCN[C@H]1CCc2cccc(O)c21 312651264 FNLNXBKJSVPHAC-LBPRGKRZSA-N 276.380 2.274 10 20 CECD O=C(NC[C@@H]1CCCC1(F)F)c1cccc(O)c1O 391057093 YHPRGEWIOAESBO-QMMMGPOBSA-N 271.263 2.263 10 20 CECD COc1ccc(O)c(CNCc2ccnc(C)c2)c1 391192718 ZNRPOVSOCXHJBL-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Cc1cc(C(=O)N[C@H]2CCNC2)c(C)n1-c1ccccc1 125918337 LUNQQYWRCHGSCZ-AWEZNQCLSA-N 283.375 2.186 10 20 CECD CC[C@H](NCCN)c1cc(Br)ccc1O 37712452 GVBOUTOGFRZOEJ-JTQLQIEISA-N 273.174 2.154 10 20 CECD COc1cccc(CN[C@@H](C)C(=O)OC(C)(C)C)c1O 158060629 GJNWJEUIMFNZLL-JTQLQIEISA-N 281.352 2.221 10 20 CECD CN(C)c1ccc(CN(CC(N)=O)C2CCCC2)cc1F 130082814 NZZSLIZPFBUBGL-UHFFFAOYSA-N 293.386 2.122 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@H](C)SC)c1 133761352 NDJWSHFTUFUBAE-VIFPVBQESA-N 269.366 2.159 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC(F)(F)C(F)F 192022938 ZKMRKTBSVWVLIP-DUXPYHPUSA-N 293.216 2.128 10 20 CECD COc1ccccc1S(=O)(=O)Nc1ccc(O)cc1F 181625350 MORXQAQXSWSYNL-UHFFFAOYSA-N 297.307 2.341 10 20 CECD Cc1c(CNC(=O)CCn2ccnc2)n(C)c2ccccc12 348666064 LJNOMLNDOTXQRD-UHFFFAOYSA-N 296.374 2.390 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@](C)(O)C2CC2)cc1F 270027332 GUWQMMJBHAJTOM-INIZCTEOSA-N 294.370 2.059 10 20 CECD Cc1ccc(O)c(CN2CCc3ccccc3[C@H]2C(N)=O)c1 378350987 QQHSAPAWEMLVHQ-KRWDZBQOSA-N 296.370 2.285 10 20 CECD C[C@@H](NCC1([S@@](C)=O)CC1)c1ccc(F)c(F)c1O 282175498 FIHPWSODRSFOCV-LILOVNGRSA-N 289.347 2.232 10 20 CECD CCOC(=O)N1CC[C@H](N[C@H]2CCc3cccc(O)c32)C1 296307949 DXIZCHZQJLHJFG-STQMWFEESA-N 290.363 2.200 10 20 CECD CN(C[C@@H](O)CNc1ccccc1OCC1CC1)C1CC1 819452411 RKPQCQYTKWDXGS-HNNXBMFYSA-N 290.407 2.342 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H](OCCO)C2)cc1Cl 824767787 AXVDPMRXZICTIW-CYBMUJFWSA-N 299.798 2.327 10 20 CECD CN(Cc1ccccc1O)c1cccc(F)c1-c1nn[nH]n1 825980913 LQTZFCHPVKUDHR-UHFFFAOYSA-N 299.309 2.348 10 20 CECD Cc1noc(C)c1N(C)C(=O)c1cc(O)cs1 829375359 BNXWNYWXEYSHMQ-UHFFFAOYSA-N 252.295 2.335 10 20 CECD Cc1nccn1CCCc1nc(Cc2ccc(N)cc2)no1 843158712 HVEXVMRATBTUOT-UHFFFAOYSA-N 297.362 2.380 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2[C@H]3[C@@H]4CC[C@@H](C4)[C@H]32)cc1 911783279 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OUTNBEMSWYXMON-UHFFFAOYSA-N 294.395 2.302 10 20 CECD CN1CCCc2cc(CNC(=O)CCc3cn[nH]c3)ccc21 863862311 PHNFVNQREKGLGU-UHFFFAOYSA-N 298.390 2.041 10 20 CECD O=C(NCc1ccccc1O)c1cc(O)nc2c1CCCC2 934935290 HQAXHKANIVRJSF-UHFFFAOYSA-N 298.342 2.302 10 20 CECD CSc1nsc(NC(=O)NCc2ccccc2O)n1 762953634 PMKYQEZMMAOHBF-UHFFFAOYSA-N 296.377 2.287 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H](C)n2cccn2)c1 862755501 UNIXXVFUMFPYJE-LBPRGKRZSA-N 273.336 2.165 10 20 CECD Cc1ccc(CN2CCCC[C@@H]2CS(C)(=O)=O)c(O)c1 877568640 TVQFBVOIMJBHBP-CQSZACIVSA-N 297.420 2.100 10 20 CECD C[C@@H](NC(=O)NC[C@H]1CCCCO1)c1ccccc1O 868360831 ZTRLSQHZRIBPLW-VXGBXAGGSA-N 278.352 2.322 10 20 CECD Cc1ccc2c(c1)OCCN2C(=O)/C=C/c1cn(C)cn1 933487149 MZFKZULWDXXBGT-GQCTYLIASA-N 283.331 2.167 10 20 CECD CC[C@H](NC[C@@H]1COCCO1)c1ccc(N(C)C)cc1 765250304 JCCMBIGQXUVDHI-CVEARBPZSA-N 278.396 2.209 10 20 CECD Cc1cccc(F)c1S(=O)(=O)NCc1ccccc1O 772704858 HXHFJAWVUHNJEF-UHFFFAOYSA-N 295.335 2.318 10 20 CECD Cc1ccc(CNCCCOC2CCOCC2)c(O)c1 877056158 ZWHVPDYWZNOFAK-UHFFFAOYSA-N 279.380 2.376 10 20 CECD C[C@H]1OCC[C@H]1C(=O)NCc1ccc(N2CCCC2)cc1 770642555 UHNIVYSTPMWOLI-CZUORRHYSA-N 288.391 2.328 10 20 CECD C[C@H](CCCO)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776159484 QNIALFVJMRNEEZ-CHWSQXEVSA-N 293.411 2.274 10 20 CECD Nc1ccc(CN2CCC([C@@H]3CCNC3)CC2)cc1 1120268795 JIOGDWYUMQGYQI-OAHLLOKOSA-N 259.397 2.090 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)C[C@H](C)OC 894577249 UNYSOJMBOSNZHH-NSHDSACASA-N 283.368 2.266 10 20 CECD COc1cc(C)cc(CN[C@@H](C)C(=O)OC(C)C)c1O 894916083 IIRVJNFIYBWYCB-NSHDSACASA-N 281.352 2.139 10 20 CECD CCOC[C@H]1CCN(Cc2ccc(OC)c(OC)c2O)C1 892180360 OSOHURVJWISUNW-LBPRGKRZSA-N 295.379 2.268 10 20 CECD CNC(=O)C(C)(C)CN[C@@H](C)c1ccc(C)cc1O 186223926 SNCDZJGLPFMPCF-NSHDSACASA-N 264.369 2.123 10 20 CECD COC(=O)[C@H]1CCC[C@@H]1NCc1ccc(N(C)C)c(C)c1 1324268477 WJCJHBUYWAEMTK-GJZGRUSLSA-N 290.407 2.492 10 20 CECD COC(=O)[C@H]1CCC[C@@H]1NCc1cc(C)c(C)cc1O 1320838196 XKKRPVMDLKFTFI-KBPBESRZSA-N 277.364 2.440 10 20 CECD Cc1ccc(N)cc1NC(=O)Cc1ccc(N)cc1 746403768 BZDCEMFOSCYBHR-UHFFFAOYSA-N 255.321 2.341 10 20 CECD CCN(CC)c1ccc(CN[C@H](CO)C2CC2)cc1 734161211 NCUDLECIWMNPAI-MRXNPFEDSA-N 262.397 2.393 10 20 CECD CCc1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)n(C)n1 1337412327 DYYGWNJJXWGWRK-ALCCZGGFSA-N 287.319 2.046 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCOC(C)(C)C2)c(O)c1 1337209888 JWGAUPCEQZQTMG-NSHDSACASA-N 293.363 2.222 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1[C@@H]2CCC(=O)[C@@H]12 1262488348 ZCPLSMJGYCVSBM-BDGWPESGSA-N 291.694 2.040 10 20 CECD C[C@H](NC[C@@H](C)N(C)C1CC1)c1cc(C(=O)O)ccc1O 1604331863 HENCATWWTLIBOW-MNOVXSKESA-N 292.379 2.224 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C(F)(F)F)c1 104900909 AFOCLOWQGWNKKO-LURJTMIESA-N 263.215 2.140 10 20 CECD CC(C)[C@H](CNCc1cc(F)c(F)cc1O)C(=O)O 1573498374 HGBORGOTHGUJDV-VIFPVBQESA-N 273.279 2.117 10 20 CECD COc1cc2c(c(OC)c1)N(C/C=C(/C)C(=O)O)CCC2 1599462619 CFLJDEYEKGLFND-WDZFZDKYSA-N 291.347 2.487 10 20 CECD COc1cc(C)cc(CN2CC[C@H](C)C[C@@H]2C(=O)O)c1O 1599392310 LAYGMWCNJKXQKH-GXFFZTMASA-N 293.363 2.394 10 20 CECD CCN1CCc2cc(CN[C@H](C(=O)O)C3CCC3)ccc21 1776884661 GPOHIUVTRFXSKD-INIZCTEOSA-N 288.391 2.412 10 20 CECD CC1(C)CC(C(=O)NCCc2ccc(O)c(O)c2)C1 802778903 KSUHHXGBJOXHFJ-UHFFFAOYSA-N 263.337 2.193 10 20 CECD C[C@@H](NCC[C@@H](O)C1CC1)c1cc(F)ccc1O 903406156 GZZFINDKWOMNGD-NOZJJQNGSA-N 253.317 2.343 10 20 CECD CCOc1cccc(CN2CC[C@H](COC)C2)c1O 211515690 PMOJKHRWFWKKGD-LBPRGKRZSA-N 265.353 2.259 10 20 CECD COc1cc(CNCc2cccc(C)c2O)ccn1 124798239 JCOZAKAHAJWUJG-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1ccc(CN[C@H]2CCN3CCC[C@H]3C2)c(O)c1 252667499 KPODXWJHSJXVKY-KBPBESRZSA-N 276.380 2.117 10 20 CECD CC(=O)c1cc(F)cc(CN2CCOCC2(C)C)c1O 48945888 JREOPCKRBBIDEQ-UHFFFAOYSA-N 281.327 2.345 10 20 CECD COc1ccc(O)c(CNC(C)(C)CN2CCCC2)c1 308641735 MWWSOIMIPYYPIG-UHFFFAOYSA-N 278.396 2.365 10 20 CECD COc1ccc(N(C)CCn2cccn2)c(OC)c1 179003948 UYZPFHKZISECSA-UHFFFAOYSA-N 261.325 2.037 10 20 CECD COc1cccc(CNC(=O)c2ccc(F)cc2)c1O 68488689 OCTZJYVROHYODG-UHFFFAOYSA-N 275.279 2.470 10 20 CECD Oc1ccc(F)cc1CNCCC1CCOCC1 310687615 PPZUXNUGLUEHMC-UHFFFAOYSA-N 253.317 2.438 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccnn2C)c1 125606461 JLDJARGKJLFPHH-SECBINFHSA-N 290.323 2.017 10 20 CECD O=C(C[C@H]1CCCO1)NCc1c(O)ccc2c1CCCC2 75160054 YLMBLJHXRCMOTF-CYBMUJFWSA-N 289.375 2.456 10 20 CECD C[C@H](N[C@H]1CCCn2ncnc21)c1ccc(F)c(F)c1O 187751576 RYRWCURNASOQKY-KWQFWETISA-N 294.305 2.448 10 20 CECD CO[C@H](C)CN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 188107042 MTIOLXGPGOMBSG-OLZOCXBDSA-N 296.386 2.348 10 20 CECD Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)co1 189048712 IDDXXENBGJVOHR-SECBINFHSA-N 275.304 2.360 10 20 CECD CCn1nc(C)c(NC(=O)c2ccc(C)c(O)c2O)c1C 182515791 WFCDOMJDRPEWLC-UHFFFAOYSA-N 289.335 2.492 10 20 CECD CCN(CC)S(=O)(=O)Nc1ccc(O)c(Cl)c1 85204660 NVDOYCCPLORNQT-UHFFFAOYSA-N 278.761 2.044 10 20 CECD C[C@@H](CNC(=O)Cc1ccc(N)cc1)N(C)c1ccccc1 237557437 ZBNSGSNGARZLTG-AWEZNQCLSA-N 297.402 2.452 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@H]1[C@@H](O)C(F)(F)F 272214342 AZXDYLMBUQEZTF-CMPLNLGQSA-N 293.260 2.419 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H]2CCCCO2)c1 273422117 SLVCIJVRSVKYPT-AAEUAGOBSA-N 293.363 2.399 10 20 CECD O=C(N[C@H]1CCc2ccccc2OC1)c1cccc(O)c1O 374877801 MNYOXWKSNHGOAB-LBPRGKRZSA-N 299.326 2.221 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cc2n(n1)CCCC2 286321993 XZZRHVFPDMWGBG-FNORWQNLSA-N 299.330 2.283 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCOCCO)c1O 808672129 DNXNADWOGXKZTK-JTQLQIEISA-N 273.760 2.014 10 20 CECD COCC1(CN[C@@H](C)c2cc(C)ccc2O)CCNCC1 817974443 LYOSKEXBUPEAPE-AWEZNQCLSA-N 292.423 2.367 10 20 CECD C[C@@H](NCC1(CC(N)=O)CC1)c1ccc(N(C)C)cc1 817585825 IUGQJTZWIOMHQG-GFCCVEGCSA-N 275.396 2.059 10 20 CECD Oc1cccc2c1[C@@H](N[C@H]1CC13CCNCC3)CC2 817977001 YXYNFEIIYAKSID-JSGCOSHPSA-N 258.365 2.111 10 20 CECD CCOC(=O)[C@H](C)NCc1cc(Cl)c(F)cc1O 816590406 ZMXHUOAMFBVQRA-ZETCQYMHSA-N 275.707 2.226 10 20 CECD CC(C)[C@H](N)CN[C@@H](C)c1cc(F)cc(F)c1O 817959894 WKGLEXBEOPAZRZ-QPUJVOFHSA-N 258.312 2.304 10 20 CECD C[C@@H](O)CN(Cc1cc(Cl)ccc1O)CC(F)F 825099048 SGJBVQNCHMOQEB-MRVPVSSYSA-N 279.714 2.494 10 20 CECD C[C@@H](NC(=O)c1c(F)ccc(O)c1O)C1CCC1 827354478 QCOPTDASWNORLP-SSDOTTSWSA-N 253.273 2.155 10 20 CECD CCOC(=O)[C@@H](C(=O)N(C)Cc1ccccc1O)C(C)C 820878598 KXUMKZVNIWRMLT-CQSZACIVSA-N 293.363 2.186 10 20 CECD CC[C@@H](NCc1ccc(N2CCCCC2)cc1)C(=O)NC 825315869 HCIGJVJAICSZJD-MRXNPFEDSA-N 289.423 2.291 10 20 CECD CC(C)C1(O)CN(Cc2c(O)ccc(Cl)c2F)C1 839133261 NKFRDXZKABGDNW-UHFFFAOYSA-N 273.735 2.387 10 20 CECD Nc1ccc(CC(=O)N2CCC([C@H]3CCCO3)CC2)cc1 831934140 YLVOPSNEFZTIPO-MRXNPFEDSA-N 288.391 2.229 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@H]2CCN2C)cc1 903321694 HYTIDNREJRJHIP-CZUORRHYSA-N 261.413 2.497 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)C2CCCC2)cc1 832292435 HABPAQVRPVBKFV-OAHLLOKOSA-N 275.396 2.059 10 20 CECD CC(C)[C@H](C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832272296 DUZCMNIMNRMUPT-SWLSCSKDSA-N 277.412 2.161 10 20 CECD Oc1ccc(Cl)cc1CN1CC(OC(F)F)C1 839145768 VJPRYFABCGJDQB-UHFFFAOYSA-N 263.671 2.469 10 20 CECD CCn1ccc(C(=O)NCCCSc2nccs2)n1 843796170 HXPVACCAVFDBPM-UHFFFAOYSA-N 296.421 2.272 10 20 CECD Cn1cc(CCC(=O)NCc2cc(Cl)ccc2O)cn1 846473718 VXVPLAUBNBQLFO-UHFFFAOYSA-N 293.754 2.028 10 20 CECD C[C@H](N[C@@H](CO)C1CCOCC1)c1ccc(Cl)cc1O 841752062 FOYSZFOEELTGMT-HZMBPMFUSA-N 299.798 2.484 10 20 CECD COc1cc(Cl)cc(CN(C)C2CCNCC2)c1O 843045077 HPLZNCTVOYSOEK-UHFFFAOYSA-N 284.787 2.238 10 20 CECD CCc1noc(CN2CCOc3cc(N(C)C)ccc32)n1 746493425 VVIWYCGHWIRQCL-UHFFFAOYSA-N 288.351 2.097 10 20 CECD CN(CCCCCCO)c1ccc(OCC(=O)O)cc1 846280490 XZDSIJQMAVQLHA-UHFFFAOYSA-N 281.352 2.139 10 20 CECD Cc1cc(C)c([C@@H](C)NCCO[C@@H]2CCOC2)c(O)c1 927081307 OKJBVEKZYQSUDJ-ZIAGYGMSSA-N 279.380 2.465 10 20 CECD COc1ccc(N(C)CCN(C)CCC(=O)C2CC2)cc1 844400652 FIZXHELMHWCHBO-UHFFFAOYSA-N 290.407 2.432 10 20 CECD Cc1nc(CCN[C@H]2C[C@H](C)c3c(F)ccc(O)c32)n[nH]1 757636466 HIKCFSCLVKVPCH-KWQFWETISA-N 290.342 2.338 10 20 CECD COc1ccc(N(C)C[C@H]2CCC(=O)O2)cc1Cl 851807131 AAJXTLCGPGIMMG-SNVBAGLBSA-N 269.728 2.490 10 20 CECD COC[C@](C)(O)CN[C@@H](C)c1ccc(C)c(C)c1O 756578587 WXZYXXLMUYNJBH-SWLSCSKDSA-N 267.369 2.057 10 20 CECD FC(F)CN1CC[C@H](NCc2ccc3c(c2)CCCO3)C1 922191385 FCCJRLWLSVWMID-AWEZNQCLSA-N 296.361 2.441 10 20 CECD C[C@H](NC(=O)c1cn(C2CC2)nn1)c1ccc(N(C)C)cc1 860950703 QVQZRTHLSFNYKJ-NSHDSACASA-N 299.378 2.170 10 20 CECD CC(=O)c1ccc(CNC(=O)c2cc(O)cs2)nc1C 765351992 ZKYVYQGBLHLXAN-UHFFFAOYSA-N 290.344 2.290 10 20 CECD CCNC(=O)CN(CC)Cc1cc(Cl)cc(F)c1O 775646364 JNMWFOXEDDCMSA-UHFFFAOYSA-N 288.750 2.143 10 20 CECD CC[C@H](NC[C@H](O)COCC1CC1)c1ccccc1O 775416254 XMMGVVCFTUFQFX-ZFWWWQNUSA-N 279.380 2.220 10 20 CECD Nc1ccnc(C(=O)NCc2c(O)ccc3c2CCCC3)c1 1123742973 UPUSMQUCWXCRJP-UHFFFAOYSA-N 297.358 2.178 10 20 CECD COc1ccc(CNCCNC(=O)[C@H](C)C2CC2)cc1C 1125343608 WTNPOEWRVVKLCC-CYBMUJFWSA-N 290.407 2.256 10 20 CECD COc1cc(C)cc(CN[C@@H](C)c2nc(C)no2)c1O 894543870 XMWVHUJKEWRJJS-VIFPVBQESA-N 277.324 2.251 10 20 CECD CCC[C@H](CNCc1ccc(OC)c(OC)c1O)OC 894664607 VDUGNCPAOKATBC-GFCCVEGCSA-N 283.368 2.314 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CCOC2(CCC2)C1 896015780 SXNGNDZYMCSXOI-LBPRGKRZSA-N 275.348 2.358 10 20 CECD Oc1c(F)cc(F)cc1CN1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 894904426 OSMWKPTTYKVSJH-CDGCEXEKSA-N 279.286 2.056 10 20 CECD COc1ccc(CNC(=O)[C@H]2CC[C@H](C)C2)c(O)c1 794390972 RZQKCHYGTIAGGX-QWRGUYRKSA-N 263.337 2.453 10 20 CECD C[C@@H](NCc1cc(F)cc(F)c1O)C(=O)OC(C)(C)C 708408301 FPTXXANAGSOXBX-MRVPVSSYSA-N 287.306 2.490 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CC[C@@H](CF)C1 1338089332 YBVUYGSFRIUICY-QMMMGPOBSA-N 282.344 2.045 10 20 CECD C[C@H](CCNCc1cc(Cl)ccc1O)N(C)C 697835603 FVBOLESPLHAELQ-SNVBAGLBSA-N 256.777 2.475 10 20 CECD COC1([C@@H](N[C@H](C)c2ccccc2O)C(=O)O)CCC1 1606712934 BTRXYDXSLBJIJI-MFKMUULPSA-N 279.336 2.065 10 20 CECD Cc1ccc(C(=O)NCc2cc(N)cc(F)c2)c(O)c1O 1579663687 GIXPXXQNUJIHJA-UHFFFAOYSA-N 290.294 2.058 10 20 CECD COc1cccc(CN2CC[C@H](C)C[C@H]2C(=O)O)c1O 1599672550 IFDOIONXNAVJGU-JQWIXIFHSA-N 279.336 2.086 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@@H]2C[C@H]2C(=O)O)c1 1599598003 DDYNSFHDXROPGT-UPBCOZELSA-N 279.336 2.161 10 20 CECD Nc1ccc(CN[C@H]2COc3ccccc3C2)cc1 1120370558 AIUYQINLXSNKOQ-OAHLLOKOSA-N 254.333 2.362 10 20 CECD CCOc1cccc(CNC[C@@H]2CCCOC2)c1O 38044034 NJLQHGVQVBGWPW-LBPRGKRZSA-N 265.353 2.307 10 20 CECD CSC[C@@H]1CCCN1C(=O)Cc1ccc(N)cc1 400432155 DUKDCBISBZJTCR-ZDUSSCGKSA-N 264.394 2.165 10 20 CECD COc1cccc(CNCCC[C@H]2CCOC2)c1O 402047655 NYJUSWAQTFSXCD-LBPRGKRZSA-N 265.353 2.307 10 20 CECD CO[C@@H](CNC(=O)c1cccc(O)c1O)C1CCCC1 692957243 GNGGTTPZXHHFFX-ZDUSSCGKSA-N 279.336 2.033 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](CC(=O)O)C1 820870836 BQQQVIKUJYRXAJ-LLVKDONJSA-N 279.336 2.088 10 20 CECD Nc1ccc(CC(=O)NCc2nc(C3CC3)cs2)cc1 178843129 ZQBJDATXYSLPDS-UHFFFAOYSA-N 287.388 2.462 10 20 CECD CC[C@@](C)(O)CNC(=O)NCc1ccc(N(C)C)cc1C 115856194 RTPBKESMRYSSKK-MRXNPFEDSA-N 293.411 2.021 10 20 CECD CCOC(=O)CN(C)Cc1cc(Cl)cc(C(C)=O)c1O 177057132 IBIKRVYENMGTOC-UHFFFAOYSA-N 299.754 2.243 10 20 CECD CN(CC(=O)OC(C)(C)C)c1ccc2c(c1)OCO2 121336794 SIBOYPGLCIGHDZ-UHFFFAOYSA-N 265.309 2.193 10 20 CECD Cc1cccc(CN2CCC(C3OCCO3)CC2)c1O 180011237 FCOAHMURRWDTOQ-UHFFFAOYSA-N 277.364 2.286 10 20 CECD OCC1CCN(Cc2c(O)cccc2Cl)CC1 127075612 LERAQKBPUFMWHG-UHFFFAOYSA-N 255.745 2.250 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(F)ccc2O)C[C@H]1C 188110273 PROSPMZMKCZJPE-MFKMUULPSA-N 281.327 2.162 10 20 CECD COC(=O)C(C)(C)C(=O)[C@@H](C)Sc1nccs1 286407064 CIUPCZJETFGPPW-SSDOTTSWSA-N 273.379 2.392 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cncc(F)c2)c1 133082047 TWOYXVGQZVHMGX-SECBINFHSA-N 290.294 2.426 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(O)CCCCC1 86587350 LCNGKCNJTCQHBD-UHFFFAOYSA-N 290.407 2.372 10 20 CECD Nc1ccc(NC(=O)c2cccc(N3CCOC3=O)c2)cc1 238031860 LLXGJPHAIGWFAF-UHFFFAOYSA-N 297.314 2.478 10 20 CECD Oc1ccccc1CN1CCC[C@H]1[C@H](O)C(F)(F)F 271261153 IPYIJNQLLIDNJM-JQWIXIFHSA-N 275.270 2.280 10 20 CECD COc1ccc(O)c(CNC[C@@H](O)c2ccc(C)o2)c1 271798461 IJUXMQDYVFKPQH-CQSZACIVSA-N 277.320 2.125 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCCN[C@@H]3C2)cc1F 271184451 MRBMKDSXJYPBBW-DZGCQCFKSA-N 277.387 2.076 10 20 CECD CCn1c(SCC(=O)C(C)=O)nc2ccccc21 289001682 WOCWFDBUGDABQH-UHFFFAOYSA-N 262.334 2.306 10 20 CECD CC[C@H](NC[C@H](O)CN1CCCC1)c1ccc(F)cc1O 286334446 YBETXTIWWOIRLE-ZFWWWQNUSA-N 296.386 2.029 10 20 CECD C[C@H](CO[C@H]1CCOC1)N[C@@H]1CCc2cccc(O)c21 297944510 YIKIVNRQKBWCEV-KWCYVHTRSA-N 277.364 2.163 10 20 CECD CCCC[C@@H](CN)N[C@@H](C)c1cc(C(=O)OC)ccc1O 817962066 HPPMSTZLJVTGLU-AAEUAGOBSA-N 294.395 2.347 10 20 CECD CC(C)(C)N1CC[C@@H](NCc2ccc3c(c2)CCO3)C1=O 818112185 VMMRWAHRLNGBLH-CQSZACIVSA-N 288.391 2.111 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)[C@@](C)(CO)C2)cc1C 827700049 OTFCIXXGQNNCSZ-XJKSGUPXSA-N 263.381 2.459 10 20 CECD Cc1cncc(/C=C/C(=O)N(C)c2ccc([N+](=O)[O-])nc2)c1 493760022 SZVLMAWICLZRND-ZZXKWVIFSA-N 298.302 2.369 10 20 CECD COc1ccc(O)c(CN2CC(C(=O)OC(C)(C)C)C2)c1 839133512 QUTPHADQKFHTOK-UHFFFAOYSA-N 293.363 2.174 10 20 CECD O=C(NCCCO[C@@H]1CCCCO1)c1cc(O)cs1 839749241 DPUSGCUWURUPHH-GFCCVEGCSA-N 285.365 2.117 10 20 CECD C[C@H]1CCCC[C@H]1OCC(=O)NCc1ccc(N)cc1 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CN(C)c1cc(F)c(CNCc2cocn2)cc1F 858131802 IZUKTZNVKQBUKZ-UHFFFAOYSA-N 267.279 2.309 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C)[C@H](CO)C2)cc1C 857061106 KANXBYMLXYHMRA-ABAIWWIYSA-N 263.381 2.459 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@H](O)CC2)cc1F 862380772 MTEULCXSMMZGMO-LBPRGKRZSA-N 284.350 2.378 10 20 CECD C[C@@H]1C[C@H](N[C@H]2C[C@@H](CO)C2)c2c(O)ccc(F)c21 866415921 IKSAVTGBIUBVEL-SVDPJWKOSA-N 265.328 2.440 10 20 CECD CC[C@H](C)OCC(=O)NCc1cc(C)ccc1O 862758045 MVMDAEBTGOVVMM-NSHDSACASA-N 251.326 2.132 10 20 CECD CC[C@@H](CO)N(C)Cc1c(O)cccc1Br 862381804 HYNLMZSCNSHZHF-VIFPVBQESA-N 288.185 2.357 10 20 CECD CCN(C)c1ccc([C@H](C)NCc2nnc(C)n2C)cc1 1116288947 JWTOXEDRWJSBFI-LBPRGKRZSA-N 287.411 2.430 10 20 CECD CC1(C2CCN(C(=O)c3cc(O)cs3)CC2)OCCO1 761575581 YLRHCLACOXVTSI-UHFFFAOYSA-N 297.376 2.069 10 20 CECD Cc1ccc(CN[C@H](C)Cc2cnn(C)c2)c(O)c1 877570396 HNQZGTNZHGKQQW-GFCCVEGCSA-N 259.353 2.155 10 20 CECD CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@H](C)[S@]1=O 877519686 ZLLGIPMCTITWMW-XEKQOVJPSA-N 281.421 2.432 10 20 CECD Cc1cncc(NC(=O)/C=C/c2ccc(O)c(O)c2)c1 779531818 YVOJSJIBKOTHNZ-HWKANZROSA-N 270.288 2.453 10 20 CECD O=C(Cc1ccc(Cl)cn1)NCc1ccccc1O 786394441 UNJCRRMAXZKMKJ-UHFFFAOYSA-N 276.723 2.300 10 20 CECD COc1ccc(CN2CCC(C)(OC)CC2)c(O)c1OC 893426196 DCFSQKOHSLLEOF-UHFFFAOYSA-N 295.379 2.410 10 20 CECD COc1ccc(CN[C@H]2C[C@H](C)O[C@H](C)C2)c(O)c1OC 893260177 LKXBGCHJLKRYRD-PTEHBNRSSA-N 295.379 2.455 10 20 CECD C[C@@H]1C[C@@H](C(=O)N(C)Cc2ccc(N(C)C)cc2)CO1 784312045 JOMLDRQSYASELD-TZMCWYRMSA-N 276.380 2.136 10 20 CECD CCn1cccc(CNCc2ccc3c(c2)CCO3)c1=O 788523473 DDVXJWTVLXMFIB-UHFFFAOYSA-N 284.359 2.093 10 20 CECD CCOC(=O)C1(CNCc2cc(F)cc(F)c2O)CCC1 894445483 OWULURLZJGZKQS-UHFFFAOYSA-N 299.317 2.493 10 20 CECD COc1ccc(CNC(=O)Nc2c(C)noc2C)c(O)c1 797621049 WEFYGIVGKACYHT-UHFFFAOYSA-N 291.307 2.327 10 20 CECD COC(=O)[C@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2 1320717905 VWVIVOSOARPWME-KBPBESRZSA-N 275.348 2.053 10 20 CECD CN(CCCF)c1nnc(-c2sccc2O)n1C 1519511650 VXQUQNANEFDMPD-UHFFFAOYSA-N 270.333 2.045 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CC[C@@H](C(=O)O)C2)c1O 1604720214 XEPSIHOCSJHIOU-KCJUWKMLSA-N 299.754 2.397 10 20 CECD CNC[C@@H]1CCCN(Cc2c(C)cc(OC)cc2O)C1 1578656081 DSDKEKYIWMNEBO-ZDUSSCGKSA-N 278.396 2.141 10 20 CECD CCC(C)(C)NC(=O)CSc1ncc(C(=O)O)s1 1594806198 YHLDRKAFCDXHAT-UHFFFAOYSA-N 288.394 2.238 10 20 CECD CCONC(=O)NCc1ccc(N(CC)CC)c(F)c1 163098953 XZRMIMNQHJBKCI-UHFFFAOYSA-N 283.347 2.423 10 20 CECD C[C@H](NCC1(C)COC1)c1ccc(N2CCOCC2)cc1 164351233 LRWIVDXNWKHCQI-AWEZNQCLSA-N 290.407 2.210 10 20 CECD NC(=O)NCc1ccc(NCc2ccccc2O)cc1 152884342 ABMCOTKUDHVCHV-UHFFFAOYSA-N 271.320 2.173 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)C[C@@H](C)O)c1 228068922 DJMQMGAHQSUZJY-AXFHLTTASA-N 253.342 2.211 10 20 CECD COc1cc(Cl)cc(CN2CCCN(C)CC2)c1O 228560967 STRQMIBIYKOJPF-UHFFFAOYSA-N 284.787 2.192 10 20 CECD COc1ncccc1CNCc1ccc2c(c1)CCO2 37650193 OLVZRFIARSPPBW-UHFFFAOYSA-N 270.332 2.315 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@@H](C)c1ccccc1O 38013797 WBNQLECLHJQAIT-NEPJUHHUSA-N 264.369 2.348 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@@H]1CN 163436876 YVVYBSYCBBGLND-ZFWWWQNUSA-N 261.413 2.169 10 20 CECD C[C@](O)(CNCc1c(O)cccc1Cl)C(F)(F)F 270472714 HZJMRFUSTPEWKV-JTQLQIEISA-N 283.677 2.449 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CCCN(C)C2)c1 44534965 RIDCNRAHBOMUQX-CHWSQXEVSA-N 278.396 2.393 10 20 CECD OCCCCCCNCc1cc(F)cc(F)c1O 708453219 GCDYBECLTRHAPB-UHFFFAOYSA-N 259.296 2.313 10 20 CECD Cn1cnc(CNCc2cc(Br)ccc2O)c1 898046087 YBLPPXROIJPGEF-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CCOc1cccc(CN2CCC(C)(O)CC2)c1O 179724052 JEFADQMLJCYKNB-UHFFFAOYSA-N 265.353 2.138 10 20 CECD COc1ccc(O)c(CNC(=O)Cc2csc(C)n2)c1 114542262 UQZATTLVOJDBFM-UHFFFAOYSA-N 292.360 2.025 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CCOC2)c1 37738142 FYEHUCFLVKLYDN-GHMZBOCLSA-N 251.326 2.088 10 20 CECD COc1cccc(CN[C@H]2CCO[C@@H](C)C2)c1O 219886671 SMISRQXKBQMJBK-JQWIXIFHSA-N 251.326 2.058 10 20 CECD C[C@@H](NCc1cccc(Cl)c1O)c1nncn1C 124800351 HFBXRDXDEXYOCW-MRVPVSSYSA-N 266.732 2.025 10 20 CECD COC(=O)COc1ccc(N(C)Cc2ccccn2)cc1 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CC(=O)N(C)CC(=O)Oc1ccc2c(c1)c(C)c(C)n2C 817761831 PSRFCXSJUNHLAS-UHFFFAOYSA-N 288.347 2.179 10 20 CECD CC[C@H]1C[C@H](C(=O)NCCc2ccc(N)cc2)CCO1 818545236 QXRUVCJPJQNYSC-HIFRSBDPSA-N 276.380 2.133 10 20 CECD O=C(/C=C\c1cncc(F)c1)N1CCc2ccncc21 492471125 HKZAJRCFKGKXLD-UPHRSURJSA-N 269.279 2.218 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1 824839351 XDOVWHHZVGHEEY-RRCSTGOVSA-N 257.333 2.086 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C)C[C@H]2C(N)=O)cc1Cl 825568204 UCTHENMRIFSCBL-RNCFNFMXSA-N 296.798 2.440 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NOCC1CC1 838609719 OSRPOWQYSBOBOY-UHFFFAOYSA-N 277.368 2.202 10 20 CECD C[C@@](O)(CNCCCSc1nccs1)C(F)F 905112872 XRBHEMIXDIJWSX-SNVBAGLBSA-N 282.381 2.231 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1[C@H]2CCC(=O)[C@H]21 906995239 XXSMMVPMLLPBHL-VBNZEHGJSA-N 287.359 2.356 10 20 CECD O=C(c1cc(O)cs1)N1CC(Oc2ccccc2)C1 732284898 HSXDVDBGGWDTDO-UHFFFAOYSA-N 275.329 2.357 10 20 CECD CN1CCCN(C(=O)/C=C/c2cnn(C)c2)c2ccccc21 737584211 ODQGMBCNTBFDII-CMDGGOBGSA-N 296.374 2.306 10 20 CECD CC[C@@H]1OCC[C@H]1NC(=O)NCc1ccc(N(C)C)cc1 837380589 RINBXESQAQDBOP-CABCVRRESA-N 291.395 2.119 10 20 CECD CC[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)[C@H](C)O 842234012 MXCGYBNUWHVFQA-WCQYABFASA-N 291.391 2.294 10 20 CECD COCC[C@H](C)N[C@@H](C)c1cccc(OC)c1O 846144285 IPPPLULGTUWTKN-QWRGUYRKSA-N 253.342 2.476 10 20 CECD CC[C@@H]1CN(C(=O)/C=C\c2ccc(O)c(O)c2)[C@@H](C)CO1 846434532 RKKAZEREPGOYHV-PDCNKGEESA-N 291.347 2.137 10 20 CECD CCc1csc(CC(=O)NCCc2ccc(N)cc2)n1 843342882 REGZJCSSFJRMGP-UHFFFAOYSA-N 289.404 2.189 10 20 CECD Cc1nccn1CCCCNC(=O)c1cc(O)cs1 743562359 ULUYNUZWWPSCMQ-UHFFFAOYSA-N 279.365 2.169 10 20 CECD CN(C)c1ccc(CN2CCC3(CCNCC3)C2)cc1F 843120196 SAYXJWJSVZGUTF-UHFFFAOYSA-N 291.414 2.467 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)c2ccco2)cc1 844851890 KIACOAYYVSZAGF-UHFFFAOYSA-N 288.347 2.497 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C(=O)O)C2)cc1 846227234 KKLOJHRXGQJYKP-CYBMUJFWSA-N 262.353 2.049 10 20 CECD CCOCC1(c2nc(Cc3ccc(N)cc3)no2)CC1 843160448 JLGGSGYECYEUHK-UHFFFAOYSA-N 273.336 2.311 10 20 CECD CN(C)c1ccc(OCc2ccc(C(N)=O)cc2)cc1 757718845 YORCJSTWLKVRIB-UHFFFAOYSA-N 270.332 2.431 10 20 CECD CCCNC(=O)CN[C@H](C)c1ccc(C)c(C)c1O 756354748 CGJQKNKEDGJOOE-GFCCVEGCSA-N 264.369 2.186 10 20 CECD CCOCCN(C)Cc1cc(F)c(N(C)C)cc1F 862303122 KJRIJRKMLLLBGT-UHFFFAOYSA-N 272.339 2.499 10 20 CECD O=C(NCc1ccccc1O)[C@H](O)CCc1ccccc1 765177584 OWQSSXUEBGHTMZ-MRXNPFEDSA-N 285.343 2.002 10 20 CECD CCCN(C(=O)/C=C\c1cn(C)cn1)c1cccnc1 934247863 QDFNGZIKRMIMKH-SREVYHEPSA-N 270.336 2.272 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@@H]2O)CC1CCCC1 768439438 HMKJOERLRYLHAO-HNNXBMFYSA-N 277.364 2.440 10 20 CECD CC1(C)CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768447699 AVYWEIHMSMLPJW-CQSZACIVSA-N 277.364 2.440 10 20 CECD Cc1cc(NC(=O)CCN[C@H](C)c2ccccc2O)no1 879648133 ZLWOSFWFUYXMRY-LLVKDONJSA-N 289.335 2.368 10 20 CECD C[C@@H](NC(=O)N[C@@]1(C)CCOC1)c1ccc(N(C)C)cc1 776237913 KCCZFGMMZLWGDF-WBMJQRKESA-N 291.395 2.292 10 20 CECD O=C(NCCCSc1nccs1)N1C[C@@H]2C[C@H]2C1 888565527 MSYLSQLYTUIVSG-UWVGGRQHSA-N 283.422 2.287 10 20 CECD C[C@@H](NC(=O)[C@@H]1OC[C@@H]2CCC[C@@H]21)c1ccccc1O 881440879 PPNNSNIUFAJMPY-REJLFOLJSA-N 275.348 2.385 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccc2c[nH]nc2c1 789990767 VXZPRHVEQGVXTP-UHFFFAOYSA-N 295.342 2.470 10 20 CECD CN(C)c1ccc([C@H](CNc2cnccn2)N(C)C)cc1 897523217 RXKZTMKIRHCINX-HNNXBMFYSA-N 285.395 2.257 10 20 CECD CC[C@H](NC[C@H](O)COCC1CC1)c1ccc(F)cc1O 796737531 VZTZYSARQMENBA-ZFWWWQNUSA-N 297.370 2.360 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCC(F)(F)C2)c1 795101278 PKHLTTZWUMPOKD-SECBINFHSA-N 285.290 2.452 10 20 CECD CCOc1cccc(CN(C)Cc2nccn2C)c1O 134111741 XWLUNLYEQCPYAS-UHFFFAOYSA-N 275.352 2.156 10 20 CECD COCCN1CC[C@H](N[C@@H](C)c2cc(C)ccc2O)C1 273610451 VRMBGPUWSRLMCM-KBPBESRZSA-N 278.396 2.072 10 20 CECD OC[C@@]12C[C@H]1CN(Cc1ccc(N3CCCC3)cc1)C2 1320882612 YNWYWXQVTVOZFW-RDJZCZTQSA-N 272.392 2.101 10 20 CECD COc1cc(C)cc(CN[C@@H]2CC[C@@H](OC)C2)c1O 1332708729 VIBOWLWYONBDFS-CHWSQXEVSA-N 265.353 2.366 10 20 CECD CC(C)CN1CCC[C@@H]1C(=O)NCc1ccccc1O 1262614921 VEHNZWGEXCIWNC-CQSZACIVSA-N 276.380 2.129 10 20 CECD CN(C)c1cc(F)c(CN[C@]23CCC[C@H]2CNC3)cc1F 1578422848 IWEQUINHQYHYHR-LRDDRELGSA-N 295.377 2.263 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@@H]3C[C@H](C(=O)O)C[C@@H]32)cc1 1777039931 DVJABGDKIFAMMA-DARAHFNDSA-N 288.391 2.342 10 20 CECD CC[C@H](NCCS(=O)(=O)C1CC1)c1ccccc1O 840882672 JPOCTGLWGLZKHG-ZDUSSCGKSA-N 283.393 2.010 10 20 CECD COc1ccc(O)c(CNCCNC(=O)OC(C)(C)C)c1 114505863 SHFMHAZTIUJMMV-UHFFFAOYSA-N 296.367 2.015 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(F)cc1N 59930540 QJBIJQPZHRCQKA-UHFFFAOYSA-N 274.295 2.386 10 20 CECD Cc1cc(CNCc2cc(F)cc(F)c2O)no1 708535677 PEKUCYMMASLFAB-UHFFFAOYSA-N 254.236 2.257 10 20 CECD CCOC(=O)CN(Cc1cccc(C)c1O)C(C)C 179800116 DAOSHSNECDSMPP-UHFFFAOYSA-N 265.353 2.474 10 20 CECD CC(C)[C@](C)(O)CNCc1ccc(N2CCOCC2)cc1 304002666 ADKLDAUKQAMTMH-QGZVFWFLSA-N 292.423 2.020 10 20 CECD CCCc1cc(C(=O)NCc2cccc(OC)c2O)[nH]n1 174954743 XBVCSCWGGIRISF-UHFFFAOYSA-N 289.335 2.006 10 20 CECD CCN(CC)C(=O)[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 37126596 FREOPVUQABEYJX-NWDGAFQWSA-N 294.395 2.308 10 20 CECD C[C@@H]1C[C@H]1C(=O)N1CCOc2cc(N(C)C)ccc21 173200823 JKJCRVLNFXDAEW-ZYHUDNBSSA-N 260.337 2.134 10 20 CECD COc1cc(NC(=O)c2cccc(O)c2O)cc(OC)c1 126206997 LXBLGLQTGZDSJX-UHFFFAOYSA-N 289.287 2.367 10 20 CECD COc1ccc(O)c(CNC[C@@]2(O)CCc3ccccc32)c1 182653510 QRLHYZKVTOCBBL-SFHVURJKSA-N 299.370 2.324 10 20 CECD CCOCCC1(C(=O)NCc2ccc(O)c(O)c2)CCC1 182537842 BWOYXOLIDFZRLY-UHFFFAOYSA-N 293.363 2.311 10 20 CECD C[C@@H]1CC[C@H](CCC(=O)NCc2ccc(O)c(O)c2)O1 182547972 AFCZRTJNWLPFJZ-ZYHUDNBSSA-N 279.336 2.062 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2CCCOC2)cc1 195053105 WMFOFVXAXIQQKF-CQSZACIVSA-N 276.380 2.186 10 20 CECD C[C@H](CCO)NCc1cccc(Br)c1O 96811393 URSMHZLDUYXHGP-MRVPVSSYSA-N 274.158 2.015 10 20 CECD CC[C@H](NC[C@@H](C)CO)c1ccc(N(C)C)cc1 268799314 AOQBFNOKJGZUTD-DOMZBBRYSA-N 250.386 2.422 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(O)c(O)c2)on1 269212560 OQQQYZGNBCRQCV-UHFFFAOYSA-N 290.319 2.182 10 20 CECD Cc1cc(O)c(CN(C)[C@H](C)CN2CCOCC2)cc1C 278616969 DTHFSPGDEZQGGJ-OAHLLOKOSA-N 292.423 2.162 10 20 CECD CCC1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CC1 274978641 WVZDUNRMUPASJP-JTQLQIEISA-N 263.337 2.335 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CC(=O)N(C3CC3)C2)c(O)c1C 273540969 YIPTZGTWRIKXCB-QWHCGFSZSA-N 288.391 2.423 10 20 CECD C[C@@H](NCC(C)(C)CCO)c1cc([N+](=O)[O-])ccc1O 273596425 QTPFRDXGYPIVEJ-SNVBAGLBSA-N 282.340 2.360 10 20 CECD CCOCC1(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 281547127 BTQIADSYNPMKQO-UHFFFAOYSA-N 294.370 2.325 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](N3CCCC3)[C@@H]2C)c1 289141840 AITCMVXTHRFBQN-XJKSGUPXSA-N 290.407 2.459 10 20 CECD CC(=O)C(=O)COC(=O)c1cccc(C(F)(F)F)c1 808488288 QYIMNRUCGHWUPN-UHFFFAOYSA-N 274.194 2.020 10 20 CECD COC(=O)C[C@@H]1CC[C@H](NCCc2ccc(N)cc2)[C@H]1C 817956787 CXTNHIRFQWPODR-NOLJZWGESA-N 290.407 2.379 10 20 CECD CNCCN[C@@H](C)c1cc(Br)cc(C)c1O 817952819 ULOBYKJNWNHBCI-VIFPVBQESA-N 287.201 2.333 10 20 CECD CCOc1ccc(CN2CCC[C@H](O)CC2)c(O)c1 816667147 DSVBQHFCFKVJDE-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1cc(C)ccc1O 828664603 CVDKFEGNMOMFAZ-AWEZNQCLSA-N 251.326 2.434 10 20 CECD CC(C)OC(=O)[C@@H](NCc1ccccc1O)C(C)C 824845842 NNCPUVIQUCODOT-AWEZNQCLSA-N 265.353 2.458 10 20 CECD CCN(CC(N)=O)Cc1cc(OC)cc(C(C)(C)C)c1O 825671746 OARDRSFTJRSBRQ-UHFFFAOYSA-N 294.395 2.006 10 20 CECD CCOc1ccc(CNCc2nc(C3CC3)n[nH]2)c(O)c1 824602948 ISJDFVXGBZSYKT-UHFFFAOYSA-N 288.351 2.076 10 20 CECD Nc1ccc(CC(=O)N2CCCC[C@H]2c2ncc[nH]2)cc1 827980969 VHASAQANANHAKU-AWEZNQCLSA-N 284.363 2.288 10 20 CECD C[C@H](NC[C@H]1CCCCCN1)c1cc([N+](=O)[O-])ccc1O 902481760 GQESKRQSRDNFKG-NWDGAFQWSA-N 293.367 2.483 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@]2(C)CCCCO2)cc1 837316699 LPNZJLOLOAKMHK-MRXNPFEDSA-N 276.380 2.328 10 20 CECD COC[C@H](Cc1ccccc1)NC(=O)Cc1ccc(N)cc1 830993762 CMGAKDRZTLVOBM-KRWDZBQOSA-N 298.386 2.185 10 20 CECD Cc1nn(C(C)C)cc1C(=O)NCc1ccc(O)c(O)c1 847591775 ZEPVMUOFDFDMLY-UHFFFAOYSA-N 289.335 2.114 10 20 CECD CC[C@@H](CN1CCCC1)NC(=O)Nc1ccc(N)cc1 841300099 NEPKJUQKDXRJSM-ZDUSSCGKSA-N 276.384 2.265 10 20 CECD CCc1cccc(CN2CC[C@H](N3CCCC3=O)C2)c1O 848906323 SYBIHPONGOAFPW-HNNXBMFYSA-N 288.391 2.151 10 20 CECD C[C@@H](NC1CCN([C@@H]2CCOC2)CC1)c1ccccc1O 848919390 KHFYGQDKJAMMIR-UKRRQHHQSA-N 290.407 2.296 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H](CNC)C2)c1 843044982 OPJPWRYAMLMMRF-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD CCc1cccc(CN2CCO[C@@]3(CCO[C@H]3C)C2)c1O 848908382 SHBWRCFMGLZWBO-GUYCJALGSA-N 291.391 2.334 10 20 CECD CO[C@H]1CCC[C@@H](CC(=O)NCc2ccc(O)cc2O)C1 910946911 VPEOGGNWRCPEPH-RISCZKNCSA-N 293.363 2.309 10 20 CECD Fc1cc(CNc2cncnc2)ccc1N1CCOCC1 846748147 HORGODOUMZAXMB-UHFFFAOYSA-N 288.326 2.064 10 20 CECD Cc1cc(N(C)C)ccc1CNCC[C@@]1(O)CCCOC1 846106565 CLLCNNMTHOFEMY-KRWDZBQOSA-N 292.423 2.082 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)c1cnnn1C 925078569 IIIMBDKDTYYKSU-GFCCVEGCSA-N 273.384 2.040 10 20 CECD C[C@H](Nc1nccn(C)c1=O)c1ccc(N(C)C)cc1 856742716 UXGIZZUCTLXDFC-NSHDSACASA-N 272.352 2.019 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1cnon1 851884484 RYPMCBPLRAVYED-UHFFFAOYSA-N 259.309 2.421 10 20 CECD C[C@H]1CN(Cc2cccc(F)c2O)CC[C@@H]1C(=O)O 863739595 MWSBISXSUALTGW-ONGXEEELSA-N 267.300 2.074 10 20 CECD CCOC(=O)C[C@@H](O)CSc1ncc(Cl)s1 863348017 NPZNJBAIQTZWFM-ZCFIWIBFSA-N 281.786 2.203 10 20 CECD Cn1ccc(CN2CCCc3cc(CN)ccc32)c1 863642156 SVOXBXIYALRDRW-UHFFFAOYSA-N 255.365 2.437 10 20 CECD CN1CCN(c2ccc(CNc3ccon3)cc2)CC1 766110129 STAFOLBTVJPJBT-UHFFFAOYSA-N 272.352 2.039 10 20 CECD Cc1ccc(CNCC(=O)NCCc2ccccc2)c(O)c1 877010339 UYGUKYREAZPWDK-UHFFFAOYSA-N 298.386 2.149 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1=CCOCC1 769675242 OEPFNIPUVBLNOE-UHFFFAOYSA-N 274.364 2.058 10 20 CECD C[C@H]1[C@@H](C)N(C)CCN1Cc1cc(F)ccc1O 775983644 CGMZNZVTZXQKLF-MNOVXSKESA-N 252.333 2.056 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCCCCN1 1118221454 CZOJXLRSVATGBR-MRXNPFEDSA-N 289.423 2.209 10 20 CECD Cc1ccc(CN2CCN(c3ccnc(C)n3)CC2)c(O)c1 877347114 QXYPCTFUBTYXCO-UHFFFAOYSA-N 298.390 2.121 10 20 CECD CCOC(=O)N1CCC(NCc2ccc(C)cc2O)CC1 876919563 WFYHCLSLZRTVFL-UHFFFAOYSA-N 292.379 2.411 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1CC(F)(F)C1 773750073 UAMDGFBALMNLKZ-QMMMGPOBSA-N 285.290 2.190 10 20 CECD CC(C)[C@@](C)(O)C(=O)NCc1c(O)ccc2c1CCCC2 771418914 TVTYJCZSKWANSD-QGZVFWFLSA-N 291.391 2.294 10 20 CECD COc1cc(C)cc(CN2CC(c3nc(C)no3)C2)c1O 894970714 LQVVESZIKWKPLV-UHFFFAOYSA-N 289.335 2.000 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1ccccc1O 783518688 NQWFHYGNYOOFQQ-NEPJUHHUSA-N 253.342 2.094 10 20 CECD COc1cc(C)cc(CN[C@@H]2c3ccccc3C[C@@H]2O)c1O 894203049 PKOAKGHWNCTJPP-DOTOQJQBSA-N 299.370 2.457 10 20 CECD COc1ccc(CNC(=O)Nc2nccs2)c(O)c1 794760724 WFQVKIDLKUIJOF-UHFFFAOYSA-N 279.321 2.179 10 20 CECD C[C@H](O)C[C@H](C)NCc1c(O)cccc1Br 706871596 LOTYYSWAMJNLBA-IUCAKERBSA-N 288.185 2.404 10 20 CECD C[C@H]1c2cccn2CCN1C(=O)c1cccc(O)c1O 192971026 KVGMPSCCPUSZND-JTQLQIEISA-N 272.304 2.116 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@]1(F)CCOC1 1259130955 KIXTZWZKEUGPKS-HNNXBMFYSA-N 281.327 2.259 10 20 CECD CCOc1cccc(CN2CCCC[C@H]2C(=O)O)c1O 86729945 LXZCZSKCXXCNQB-LBPRGKRZSA-N 279.336 2.230 10 20 CECD COC(=O)c1cc(/C=C2/C(=O)Nc3ccccc32)cn1C 112828 ZRTLCWIPASDAAQ-KPKJPENVSA-N 282.299 2.304 10 20 CECD CO[C@]1(C(=O)O)CCN(Cc2cc(Cl)c(C)cc2O)C1 1599078770 JSEFHTWPGDRBQM-CQSZACIVSA-N 299.754 2.030 10 20 CECD Oc1ccccc1CNCCCOC[C@H]1CCCO1 20146615 CASDELMNIAESFV-CQSZACIVSA-N 265.353 2.068 10 20 CECD CCN1CCc2cc(CN[C@@H](CC(=O)O)C3CC3)ccc21 1776877776 YIXAADVCZYBGDW-HNNXBMFYSA-N 288.391 2.412 10 20 CECD CCN(CC)CCC[C@H](C)NC(=O)Cc1ccc(N)cc1 19393003 AVYBRXDSOXQAJZ-AWEZNQCLSA-N 291.439 2.438 10 20 CECD CN(C)c1ccc(CNC(=O)C2(C)CC2)cc1F 151325334 XJKLLQWPDVSWEP-UHFFFAOYSA-N 250.317 2.308 10 20 CECD CC[C@H](NCc1cc2c(cc1O)OCO2)C(F)F 824508141 ANJCVFCAPZMOSP-QMMMGPOBSA-N 259.252 2.254 10 20 CECD C[C@@H](NCCN1CCSCC1)c1cc(F)ccc1O 230661676 LAVOPLCGNWKEDS-LLVKDONJSA-N 284.400 2.231 10 20 CECD CN(C)c1ccc(CNC[C@](C)(O)C(F)(F)F)cc1 270455239 DKVXJYKRLZUUID-LBPRGKRZSA-N 276.302 2.156 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@]2(O)CCSC2)c1 185638499 WDXJKCBEJXTYDL-BXUZGUMPSA-N 267.394 2.219 10 20 CECD CCC[C@@](C)(CO)NCc1cccc(OCC)c1O 304825407 FTIKXXPMMNNSEG-HNNXBMFYSA-N 267.369 2.432 10 20 CECD CC(C)Cc1noc(CN(C)c2ccc(N)cc2)n1 702086813 JJOXALGYOAOSLW-UHFFFAOYSA-N 260.341 2.487 10 20 CECD CC[C@]1(NCc2cc(F)cc(F)c2O)CCOC1 708497318 RIIMDXDAIUUFBX-ZDUSSCGKSA-N 257.280 2.329 10 20 CECD CC[C@]1(C)COCCN1Cc1cccc(OC)c1O 687973910 NRAQAFRJGLENIA-OAHLLOKOSA-N 265.353 2.402 10 20 CECD C[C@@H](NCCc1cnccn1)c1ccc(F)cc1O 390036211 IDHUMSGTKGKWIG-SNVBAGLBSA-N 261.300 2.215 10 20 CECD COc1cccc(CNC(=O)CSC(F)(F)F)c1O 105651548 FLAQTCZNWJMJEO-UHFFFAOYSA-N 295.282 2.270 10 20 CECD OCCN1CCCc2cc(OC(F)(F)F)ccc21 173193171 TVEAVEITKWVCQF-UHFFFAOYSA-N 261.243 2.330 10 20 CECD COc1ccc(O)c(CNC(=O)NC2CCCC2)c1 114512495 UNKDLTDCVXSCRP-UHFFFAOYSA-N 264.325 2.143 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1ccn[nH]1 172712396 AJUBEDNXGTVSRD-UHFFFAOYSA-N 286.379 2.067 10 20 CECD CC(C)OC(=O)[C@H](C)N(C)Cc1ccccc1O 179582665 AZSYBAHNTZHIHR-NSHDSACASA-N 251.326 2.164 10 20 CECD Cc1c(C(=O)NCc2ccc3c(c2)CCCN3C)cnn1C 123955633 AQLZTBUFJYJIHW-UHFFFAOYSA-N 298.390 2.041 10 20 CECD C[C@@H](CO)N[C@H](C)c1ccc(N2CCOCC2)cc1Cl 127544480 LOSSNBHOFXNTEN-NWDGAFQWSA-N 298.814 2.208 10 20 CECD CC[C@H](NC(=O)N(C)Cc1ccccc1O)[C@@H]1CCCO1 128716585 ZIHIEQOQVSJYPP-ZFWWWQNUSA-N 292.379 2.491 10 20 CECD COCc1noc([C@H](C)N(C)Cc2ccccc2O)n1 182161134 BCKAOUFSQTUBQP-JTQLQIEISA-N 277.324 2.115 10 20 CECD CN(C)c1ccc(CN2CCCN3CCC[C@H]3C2)cc1 378348975 HQNXDPLJEZLGPB-KRWDZBQOSA-N 273.424 2.423 10 20 CECD COCCC[C@H](C)C(=O)NCc1cccc(OC)c1O 182344884 PONAQAQGQWMBCX-NSHDSACASA-N 281.352 2.080 10 20 CECD CCN1CC(=O)N[C@H]1c1cc(Cl)cc(Cl)c1O 189891342 KJYACZZWXLZBQD-LLVKDONJSA-N 275.135 2.149 10 20 CECD CSC[C@H](CCO)N[C@@H](C)c1ccc(C)cc1O 185530651 SANWJUCVFRHXRJ-RYUDHWBXSA-N 269.410 2.465 10 20 CECD COc1ccc(CNC(=O)c2cccc(O)c2O)cc1F 188157043 ZFYURPOCDJJBFN-UHFFFAOYSA-N 291.278 2.176 10 20 CECD COCCOCCN[C@@H](C)c1cc(C)ccc1O 44694090 NZBVENKEQZHFFI-LBPRGKRZSA-N 253.342 2.014 10 20 CECD 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CCCCCCNC(=O)COC(=O)c1cc(O)cs1 732354076 OFZRUWUCCHGHFG-UHFFFAOYSA-N 285.365 2.307 10 20 CECD O=C(NCCCN[C@H]1CCc2cccc(O)c21)C1CCC1 834675651 KNQHITIKHIUZRB-AWEZNQCLSA-N 288.391 2.276 10 20 CECD CC[C@@]1(C)COCCN1C(=O)c1cc(O)cs1 831612158 LOAMWQWKOVNWJS-LBPRGKRZSA-N 255.339 2.095 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@H]3CCNC[C@H]2CC3)c1O 843365148 FFZBXTMQNBNTHQ-ZIAGYGMSSA-N 292.354 2.060 10 20 CECD CC(C)=CCC[C@H](C)NC(=O)C(=O)Nc1ccc(N)cc1 841137650 MZRUUCBPLHZYPS-LBPRGKRZSA-N 289.379 2.458 10 20 CECD CCO[C@H]1C[C@@H](N[C@H](C)c2cc(C(=O)OC)ccc2O)C1 840764793 ZLVFABADBJZFLT-RTXFEEFZSA-N 293.363 2.397 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](C)[C@H]2CN)c1O 843353400 HIPLHNNOIJZURT-MEBBXXQBSA-N 294.370 2.293 10 20 CECD COC(=O)[C@@H](C)CN(C)Cc1ccc(N(C)C)cc1C 840910042 DOMGKQDOLHJHOG-ZDUSSCGKSA-N 278.396 2.302 10 20 CECD CCc1nn(C)cc1CN1CCCc2cc(CN)ccc21 843058637 YCZFYZGBLCTPNI-UHFFFAOYSA-N 284.407 2.394 10 20 CECD CCC[C@@H](O)CC(=O)NCc1ccc(N(C)C)cc1C 750312234 ROCCKVAZWRWZCJ-OAHLLOKOSA-N 278.396 2.228 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@H](C)c1ccc(F)cc1O 756775752 SMZXVZOWZUCGDC-OASPWFOLSA-N 280.343 2.097 10 20 CECD CON(C)C(=O)[C@H](C)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 858580192 XNBBJGTUWVJCSB-ATZCPNFKSA-N 296.342 2.078 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cn(CC)nn1 934706103 DASWKNAOIGQVRN-UHFFFAOYSA-N 288.351 2.056 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)/C=C\c1cn(C)cn1 932943587 MXCLFKRMLJMSJH-VURMDHGXSA-N 298.390 2.124 10 20 CECD COc1cccc(O)c1CN1CCC(NC(C)C)CC1 769232297 KQGYSQNDBWFFPS-UHFFFAOYSA-N 278.396 2.363 10 20 CECD C[C@H](CC(=O)N(C)c1ccc(N)cc1)[C@H]1CCCNC1 877079230 VLXODPLIDVOSDL-OLZOCXBDSA-N 275.396 2.257 10 20 CECD C[C@H](NS(=O)(=O)CCCF)c1ccc(N(C)C)cc1 773089169 SICKKLIVLVTIMO-NSHDSACASA-N 288.388 2.093 10 20 CECD CCCC(=O)c1cn(Cc2ccc(N(C)C)cc2)nn1 881270564 GOTFAAMWTORGBH-UHFFFAOYSA-N 272.352 2.375 10 20 CECD COC(=O)[C@@H](C)CN(Cc1cc(F)cc(F)c1O)C1CC1 894422282 IZMOCDANWWKCDC-VIFPVBQESA-N 299.317 2.444 10 20 CECD COc1cc(C)cc(CN[C@@H](C)[C@@H](C)OC)c1O 894534391 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272520640 YFPDBPGHVAHJJS-MWLCHTKSSA-N 281.249 2.323 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)C(C)C)c1O 278186726 HJHIKSYVEQZVLH-UHFFFAOYSA-N 254.286 2.149 10 20 CECD CC(C)N1C[C@H](N[C@H](C)c2ccc(F)c(F)c2O)CC1=O 276898527 ISWRPQBSDVKHPX-NXEZZACHSA-N 298.333 2.330 10 20 CECD Cc1cc(C)c([C@H](C)NCCc2n[nH]c(C)n2)c(O)c1 285318670 SWYKZULYURUOFL-NSHDSACASA-N 274.368 2.329 10 20 CECD Cc1cc(CN(C)Cc2cnn(C)c2)ccc1N(C)C 293514880 ONPIQMRKKNYLGJ-UHFFFAOYSA-N 272.396 2.427 10 20 CECD COc1cccc(O)c1CN1CC[C@@H](c2nccn2C)C1 809757241 LNCVVPLDMGXFMK-GFCCVEGCSA-N 287.363 2.124 10 20 CECD Cc1cncc(CCC(=O)NCc2ccccc2O)c1 293611963 FKDPRTHEOHMRCZ-UHFFFAOYSA-N 270.332 2.345 10 20 CECD CC[C@@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCN1 817902041 HHJUVHZOMGAHTG-CABCVRRESA-N 260.381 2.242 10 20 CECD CCN(C)c1ccc(CN(CCOCCO)C(C)C)cc1 815112116 LDJQKYPRMQBGKC-UHFFFAOYSA-N 294.439 2.362 10 20 CECD CCn1nncc1/C=C1\C(=O)N2CCCc3cccc1c32 817347048 ZKGLYTSSHQCJLB-ZROIWOOFSA-N 280.331 2.131 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2cc(Cl)c(F)cc2O)C1 827812564 PXOGJVWAKHEKLP-XWEPSHTISA-N 287.718 2.226 10 20 CECD CC[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@H](C)O 824921540 MWDYVWIDAYRIJF-GXFFZTMASA-N 254.349 2.141 10 20 CECD CO[C@@H]1COCC[C@H]1CNCc1cc(Cl)ccc1O 824708395 GCLBFIPHHSRGFR-IINYFYTJSA-N 285.771 2.187 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2CCN2C)c2c(O)ccc(F)c21 903317401 KGGHHEVWHDIFNG-FOGDFJRCSA-N 264.344 2.373 10 20 CECD CN(C(=O)c1cc(O)cs1)[C@@H]1CCCc2c1cnn2C 830863459 RZXPDTJVBHZIHC-LLVKDONJSA-N 291.376 2.337 10 20 CECD Cc1ccc(NCCCNC(=O)c2cc(O)cs2)nc1 736682404 GZDZGUUUIMZTGQ-UHFFFAOYSA-N 291.376 2.389 10 20 CECD CCC(CC)(NCc1cc(F)cc(F)c1O)C(=O)O 904009731 HUJWKXGLDBEJFK-UHFFFAOYSA-N 273.279 2.403 10 20 CECD COc1cc2c(c(OC)c1)N(CCn1cccn1)CCC2 839656487 NIAGDFYELVXFKT-UHFFFAOYSA-N 287.363 2.353 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2cc(Cl)ccc2O)CCO1 846473238 KSIVDMOBSPNENI-UWVGGRQHSA-N 283.755 2.477 10 20 CECD C[C@@H](CNC(=O)NCc1ccccc1O)N1CCCCC1 748460325 NYNCATRWJNDKAM-ZDUSSCGKSA-N 291.395 2.066 10 20 CECD COc1cccc(CN[C@@H]2CCCC[C@H]2CN)c1O 841030125 KJXIMGXNJCDEJD-WCQYABFASA-N 264.369 2.008 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@@H](C)c1cccc(OC)c1O 846142686 GKWNAMWIRJJTKL-NEPJUHHUSA-N 294.395 2.356 10 20 CECD COc1c(N)ncnc1NCCCSc1nccs1 848665250 QVDOVVHFVGBBSJ-UHFFFAOYSA-N 297.409 2.118 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1c(O)ccc(Cl)c1F 846703698 PMKYGZSFHNYCSY-IUCAKERBSA-N 272.751 2.496 10 20 CECD C[C@H]1C[C@H](N[C@H]2CCNC2)c2c(O)ccc(F)c21 854223281 BSKMDTSUETVQDL-QXEWZRGKSA-N 250.317 2.031 10 20 CECD Nc1ccc(CCNC(=O)c2cnc3n2CCCCC3)cc1 856998009 HULGTFLSHQLJOA-UHFFFAOYSA-N 298.390 2.164 10 20 CECD CCOC[C@@H]1CN(Cc2ccc(N(C)C)c(C)c2)CCO1 859770497 BKNPVSZMJKZQAQ-INIZCTEOSA-N 292.423 2.298 10 20 CECD C[C@H](NC[C@](C)(O)C1CC1)c1cc(F)cc(F)c1O 756575679 JRFQSROYEMVXAP-RTHLEPHNSA-N 271.307 2.482 10 20 CECD CC(C)[C@@H](NC(=O)c1cc(O)cs1)C1(CO)CCC1 854601394 VQQXLUPZQBSADE-GFCCVEGCSA-N 283.393 2.371 10 20 CECD O=C(NC[C@@H]1CCCCS1)c1cc(O)cs1 753476397 LHGNTBCVSGSSKO-VIFPVBQESA-N 257.380 2.469 10 20 CECD CCOc1ccc(CN2CCC[C@H](OC)C2)c(O)c1 768754141 PXJDYGKARSEELL-AWEZNQCLSA-N 265.353 2.402 10 20 CECD C[C@H]1C[C@@H](CNC(=O)NCc2ccccc2O)CCO1 770818843 JDWDNSVJZFUPFZ-RYUDHWBXSA-N 278.352 2.007 10 20 CECD Cc1cccc(O)c1CN1CCO[C@H]([C@@H]2CCCO2)C1 876805657 DSHRYPBTZZAKPL-HOTGVXAUSA-N 277.364 2.080 10 20 CECD C[C@@H](NCC(=O)N(C)Cc1ccco1)c1ccccc1O 879648796 DXMVAFCWEGMLPF-GFCCVEGCSA-N 288.347 2.294 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2c(O)cccc2F)C1 886541700 ZYGLEYJXIWUCLH-QWRGUYRKSA-N 280.343 2.193 10 20 CECD N=C1Nc2nc3ccccc3n2[C@H](c2cccc(F)c2O)N1 778519872 LWMJEAKKOOTDRB-CYBMUJFWSA-N 297.293 2.378 10 20 CECD COc1ccc(O)c([C@H](C)NCCC2OCCCO2)c1 775372705 GPFMSMCVTPMCQS-NSHDSACASA-N 281.352 2.205 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccccc1CO 779648276 JTGORAVIBMTZPS-UHFFFAOYSA-N 285.343 2.086 10 20 CECD Cc1nc2n(n1)C[C@H](N[C@H](C)c1c(O)cccc1F)CC2 886521135 VBHURTPQGNEDDV-MWLCHTKSSA-N 290.342 2.097 10 20 CECD Cc1nc(C(C)C)ncc1C(=O)NCCc1ccc(N)cc1 884028571 KQMMKTYAORRIIQ-UHFFFAOYSA-N 298.390 2.463 10 20 CECD CCN(CC)c1ccc(CNC(=O)OCCOC)cc1 884964253 KRRZMGIWEQDECV-UHFFFAOYSA-N 280.368 2.405 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1cc(F)cc(F)c1O 894469569 HONCMXBSCDOCOY-GFCCVEGCSA-N 285.290 2.198 10 20 CECD O=C(NCc1ccc2c(c1)COC2)c1cccc(O)c1O 790893942 ABDLPVJNKSPPSS-UHFFFAOYSA-N 285.299 2.058 10 20 CECD COc1ccc(CN[C@@H](C)C2CCOCC2)c(O)c1OC 893120138 GRVULOALYUPSQR-NSHDSACASA-N 295.379 2.314 10 20 CECD CC(C)(C)[C@H]1CN(C(=O)c2cc(O)cs2)CCO1 791080300 AJKYIYXIBRSDBA-LLVKDONJSA-N 269.366 2.341 10 20 CECD C[C@@H](NS(=O)(=O)CC(C)(C)C)c1ccccc1O 867834579 QYIDMYOKOAAGHO-SNVBAGLBSA-N 271.382 2.419 10 20 CECD CC(C)[C@H](NCc1cc(Cl)ccc1O)C(=O)O 43429896 NOAPZMYVHSOBDG-NSHDSACASA-N 257.717 2.244 10 20 CECD Cc1cccc(OCC(=O)NCc2ccccc2O)c1 701177020 QNQHMIHQZMKPDC-UHFFFAOYSA-N 271.316 2.396 10 20 CECD c1ncn([C@@H]2CCN(Cc3ccc(N4CCCC4)cc3)C2)n1 1325849926 JPDYXMLMTCCOOH-QGZVFWFLSA-N 297.406 2.325 10 20 CECD COCCC1CCN(C(=O)NCc2ccc(N)cc2)CC1 1335737049 KRCRAJFSZMOQRR-UHFFFAOYSA-N 291.395 2.227 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@@H]1CC12CCCC2 762275597 WHGVEQGTFBIIOR-LBPRGKRZSA-N 275.348 2.337 10 20 CECD CO[C@@H]1CC[C@@H](NC(=O)N[C@H](C)c2ccccc2O)C1 1330022190 QRHVBXLVDMPDLG-IJLUTSLNSA-N 278.352 2.320 10 20 CECD CCn1ncnc1CN[C@H](C)c1ccc(N(C)C)cc1 785808128 IUOJTQOUTCEFRZ-GFCCVEGCSA-N 273.384 2.215 10 20 CECD C[C@H](Nc1ncc(O)cn1)c1ccc(N(C)C)cc1 1339665310 DZZHBLKKPJMRNW-JTQLQIEISA-N 258.325 2.421 10 20 CECD C[C@H](NCC1CC=CC1)c1cccc(-c2nn[nH]n2)c1O 1603659017 YREGUIMMIHGDQP-JTQLQIEISA-N 285.351 2.189 10 20 CECD Cc1cc(O)c(CN[C@H]2CCC[C@H]2C(=O)O)cc1C 1610475636 HDSAJACYDADZRF-OLZOCXBDSA-N 263.337 2.352 10 20 CECD C[C@@H](NC[C@H]1CCOC1)c1ccc(N2CCOCC2)cc1 153088529 HGVYOCIHPALRCV-HUUCEWRRSA-N 290.407 2.210 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCC[C@@H]3C1)OCO2 147936853 VAXNJMZMWCSZGM-GHMZBOCLSA-N 261.321 2.353 10 20 CECD COCC1(NCc2cc(F)cc(F)c2O)CCC1 708498003 WCSVMMJNEILDQE-UHFFFAOYSA-N 257.280 2.329 10 20 CECD OCC[C@@H](N[C@@H]1CCc2cccc(O)c21)C(F)(F)F 886802872 AKPQQEQVCVQNKK-MWLCHTKSSA-N 275.270 2.282 10 20 CECD CN(C)c1ccc(CNC(=O)NCC(F)(F)F)cc1F 58514977 PMIUZLOZYUZXHC-UHFFFAOYSA-N 293.264 2.253 10 20 CECD C[C@@H]1C[C@@H]1NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 108796261 QUMXMCYDLKEUDK-UCCUKHFHSA-N 286.375 2.061 10 20 CECD CC[C@H]1CC(=O)N(CN(C)Cc2ccc(N(C)C)cc2)C1 119154814 RWBUYWAMGDBXMN-AWEZNQCLSA-N 289.423 2.400 10 20 CECD O=C(CCn1cccn1)NCCCSc1nccs1 114375941 GWZUWNJDZAPTMA-UHFFFAOYSA-N 296.421 2.028 10 20 CECD CCOC(=O)[C@@H]1CCCCN1Cc1cc(F)ccc1O 179885334 WMKAAZUWIJEKTB-ZDUSSCGKSA-N 281.327 2.449 10 20 CECD CCOCc1cc(CN[C@@H]2C[C@@H](O)C2(C)C)ccc1OC 189328166 NCCGSAJJAKZNGH-HZPDHXFCSA-N 293.407 2.481 10 20 CECD COc1ccc(N2CCN([C@@H](C)c3cnccn3)CC2)cc1 184403837 NXNFSJGCIKWQFF-AWEZNQCLSA-N 298.390 2.368 10 20 CECD CC[C@@H]1CN(C(=O)c2ccc(C)c(O)c2O)C[C@H](C)O1 182423943 CHMJNRCGAMFDDZ-WDEREUQCSA-N 279.336 2.046 10 20 CECD CC(=O)OC1CCN(Cc2cccc(C)c2O)CC1 180278367 VVLLUTHYGMKSTC-UHFFFAOYSA-N 263.337 2.228 10 20 CECD C[C@@H]1[C@H](C(=O)N2CCOc3cc(N(C)C)ccc32)C1(F)F 336579645 SLFGMHGGGMPOAK-NOZJJQNGSA-N 296.317 2.379 10 20 CECD CC[C@H]1C(=O)NCCN1Cc1ccc(N(CC)CC)cc1 93050726 JLEXEDRQEDRGHX-INIZCTEOSA-N 289.423 2.243 10 20 CECD Oc1cc(F)c(Cl)cc1CNCC12CC(CO1)C2 529663859 UTUIKRHWLCJDFN-UHFFFAOYSA-N 271.719 2.453 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCc2nn(C)cc21 374225523 QCOLCVPUKGUFHU-CYBMUJFWSA-N 299.374 2.204 10 20 CECD CC[C@@H](N[C@H](CO)COC)c1cccc(Cl)c1O 286942130 GXZDHJFYZOHUCY-BXKDBHETSA-N 273.760 2.094 10 20 CECD COC[C@H](N[C@@H]1CCc2cccc(O)c21)[C@@H]1CCCO1 296591181 WVTQBFHEPPNXDO-IPYPFGDCSA-N 277.364 2.163 10 20 CECD CC[C@@H](N[C@@H](CCSC)C(=O)NC)c1ccccc1O 806664066 ZGMVMCZOIBUHFY-OLZOCXBDSA-N 296.436 2.301 10 20 CECD CC(C)(C)c1n[nH]c(COC(=O)c2cc(O)cs2)n1 814453416 LGFXOMBNCSYVRI-UHFFFAOYSA-N 281.337 2.226 10 20 CECD CC[C@@H](O)CNc1ccccc1OCCCOC 819422064 RWQIMVMNDPXPQQ-GFCCVEGCSA-N 253.342 2.285 10 20 CECD Cc1cc(CN2CC[C@H](C)C[C@@H]2C(N)=O)ccc1N(C)C 815095165 AMUJVLPQKGKLMP-BLLLJJGKSA-N 289.423 2.147 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)C(C)(C)F)C2)cc1 819586475 QPEONFJSPLOQCL-LBPRGKRZSA-N 294.370 2.386 10 20 CECD CN(CCC(=O)O)Cc1cc(Cl)cc(F)c1O 820586190 PPCNDKMCLHAYGU-UHFFFAOYSA-N 261.680 2.091 10 20 CECD COc1ccc(C(=O)NCc2ccc(N(C)C)cc2C)cn1 734402070 GAIQTGOZHIYUMF-UHFFFAOYSA-N 299.374 2.395 10 20 CECD CSCC1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 900701785 RRVKMEHGBCLNKQ-UHFFFAOYSA-N 299.367 2.452 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccon1 839919658 SMMKGNSTNTWARH-LBPRGKRZSA-N 287.363 2.410 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](CCCO)C2)c1O 832783673 SVAZVVHIJQKWIX-LBPRGKRZSA-N 295.354 2.328 10 20 CECD CC(C)CS(=O)(=O)NCCCSc1nccs1 735315435 NTFLGNYBHSGFEI-UHFFFAOYSA-N 294.467 2.201 10 20 CECD COc1ccc2c(c1)CCCN2Cc1cnn(C)c1 749899333 MJXVNHVYHZMXNI-UHFFFAOYSA-N 257.337 2.382 10 20 CECD C[C@H]1CN[C@H](C)CN1Cc1cccc(Cl)c1O 843119874 JGECMKXRZFMLDL-ZJUUUORDSA-N 254.761 2.228 10 20 CECD CN(C)C(=O)[C@@H]1CCN(Cc2ccc3ccccc3c2O)C1 840959067 XRVIVLJLQWISCG-OAHLLOKOSA-N 298.386 2.456 10 20 CECD CC[C@@H]1CCCC[C@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841011924 XATXSBBURXODFY-BXUZGUMPSA-N 289.379 2.292 10 20 CECD Oc1c(F)cc(Cl)cc1CN[C@H]1CCCNCC1 841058569 SVGPKNNBZLMWIG-NSHDSACASA-N 272.751 2.416 10 20 CECD NC[C@H]1CC[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 841084949 QTDLUFHCWMKKCP-KWQFWETISA-N 299.758 2.171 10 20 CECD Nc1ccc(NC(=O)NC[C@H](O)C2CCCCC2)cc1 841300280 OWMORAZEBZVAEE-AWEZNQCLSA-N 277.368 2.332 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCS[C@H]2C)c(O)c1O 844109089 VDAMNRLIHYFEGE-WCBMZHEXSA-N 267.350 2.030 10 20 CECD COc1ccc(N2CCC(N[C@@H]3CO[C@@H](C)C3)CC2)cc1 842673335 JNMBPRCQGADIHB-ZFWWWQNUSA-N 290.407 2.431 10 20 CECD Nc1ccc(-n2cc(CC3(O)CCCCC3)nn2)cc1 849134644 KTQWHXJFYQBYLQ-UHFFFAOYSA-N 272.352 2.087 10 20 CECD COCCC1(NC(=O)Nc2ccc(N)cc2)CCC1 841297456 PXDDSKBBJKPILE-UHFFFAOYSA-N 263.341 2.350 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H]([C@@H](C)N)C1 843057381 JSRZCHFPANMWJY-UKRRQHHQSA-N 261.413 2.230 10 20 CECD COCCCN(C)CCNCc1ccc(N(C)C)cc1C 840935121 FVPIMAMYSPKIIX-UHFFFAOYSA-N 293.455 2.119 10 20 CECD CCN1C(=O)/C(=C/c2c[nH]c(C(=O)OC)c2)SC1=S 753134899 ZFDRQLWOVLLDAB-UITAMQMPSA-N 296.373 2.022 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CSCCS2)c1 862758172 RJORRXXRQWEMDU-GFCCVEGCSA-N 283.418 2.165 10 20 CECD CCCN(C[C@@H](OC)[C@@H]1CCOC1)c1ccc(CN)cc1 877477385 CEGRBYHTPHHUMF-NVXWUHKLSA-N 292.423 2.413 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@H](O)C(F)(F)F 877693758 QCMZRABCHJXNDP-GWCFXTLKSA-N 290.329 2.462 10 20 CECD CC[C@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)N(C)C 775409312 DTXJWVIOCZPCNS-IUODEOHRSA-N 277.412 2.270 10 20 CECD O=C(CCNCC1CC1)NCCCSc1nccs1 870886884 UAPKEWOOUOJCMM-UHFFFAOYSA-N 299.465 2.131 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@H](C)C2CC2)c1O 774974913 LXKODWVLBONTJF-VIFPVBQESA-N 280.324 2.445 10 20 CECD CC[C@@]1(O)CCCN(Cc2c(O)cccc2OC)C1 877692719 PUIVNKDDLVREJH-OAHLLOKOSA-N 265.353 2.138 10 20 CECD CCOc1cccc(CN2CCOC[C@@H]2CC)c1O 132346772 RENUKPLDJDRUKI-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD COc1ccc(CN[C@@H]2CSC[C@@H]2C)c(O)c1OC 894411921 BTTSEUYOFIBFJL-GXSJLCMTSA-N 283.393 2.251 10 20 CECD COC(=O)CC1(NCc2cc(F)cc(F)c2O)CCC1 894374277 HHTAZYOXPSGHIZ-UHFFFAOYSA-N 285.290 2.246 10 20 CECD COc1cc(C)cc(CNC[C@H]2CC[C@@H](C)O2)c1O 894970182 SRWXVRNMKZFRGN-DGCLKSJQSA-N 265.353 2.366 10 20 CECD C/C=C(/C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891253351 RKASMKXZTJJYEQ-VXXVJXPCSA-N 289.423 2.438 10 20 CECD COC[C@H](CO)N[C@H](C)c1cccc(C(F)(F)F)c1O 788804524 IRIGGKJPLKMNEH-BDAKNGLRSA-N 293.285 2.069 10 20 CECD COc1ccc(CNC(=O)[C@H]2CC=CCC2)c(O)c1 794382239 SBEKEBROGLNZNL-NSHDSACASA-N 261.321 2.373 10 20 CECD Cc1ccc(CNCCO[C@@H]2CCCCO2)c(O)c1 894793858 KZVNNYCQYBOXMI-OAHLLOKOSA-N 265.353 2.333 10 20 CECD CCN(CCC(=O)NC)Cc1c(O)cccc1Cl 897709918 LHWZRNBYZZTWRJ-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CN1C(=O)c2ccccc2N[C@@H]1c1cc(O)ccc1O 1317901483 NLLYEGNMAMUGCD-AWEZNQCLSA-N 270.288 2.294 10 20 CECD CCCN(CC(=O)NC)Cc1ccc(N2CCCC2)cc1 1319932848 HMLRJONPJZFUHM-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COc1cccc(O)c1CN1CCO[C@@H](C(F)(F)F)C1 769467000 QEEUBBDJDKYDME-GFCCVEGCSA-N 291.269 2.164 10 20 CECD Cc1nnc(CN[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)n1C 1321022048 AXHXVTIKRVQFPP-KCJUWKMLSA-N 290.342 2.306 10 20 CECD CC(C)CNCc1ccc(N2CCN(C)CC2)cc1 62734226 UUDZIMQFUBCVRX-UHFFFAOYSA-N 261.413 2.184 10 20 CECD COc1cccc(O)c1CN1C[C@@H](C)OC(C)(C)C1 769101694 UJDYSRWCKMZKDV-LLVKDONJSA-N 265.353 2.400 10 20 CECD NC[C@H]1CN(Cc2ccc(N)cc2)CC[C@@H]1C(F)(F)F 1337838935 VZAQQGOVFUFFNX-AAEUAGOBSA-N 287.329 2.228 10 20 CECD Cc1nnc(O)c(CN[C@H](C)c2ccc(F)cc2O)c1C 1254730353 SHFFKGSRPQRGRK-SNVBAGLBSA-N 291.326 2.495 10 20 CECD CC[C@H](C)C[C@H](N)C(=O)N[C@H](C)c1cc(OC)ccc1O 1340340615 NPSZLXPDCXHDGL-WDMOLILDSA-N 294.395 2.342 10 20 CECD Cc1nc(CNC(=O)/C=C/c2ccc(O)c(O)c2)oc1C 1347738897 SHKMBIZGADZAEZ-GQCTYLIASA-N 288.303 2.032 10 20 CECD CCC(CC)(CNC(=O)c1ccc(C)c(O)c1O)C(=O)O 1573788351 QVDVQSJRSNGREZ-UHFFFAOYSA-N 295.335 2.027 10 20 CECD Oc1ccc(Br)cc1CN[C@H]1CCCOC1 163932970 NURIXGRAEFCVIW-NSHDSACASA-N 286.169 2.423 10 20 CECD Oc1cc2c(cc1CNCC[C@H]1CCCCO1)OCO2 227338511 BDEZBPRDCZTRLN-GFCCVEGCSA-N 279.336 2.170 10 20 CECD CN(CCNCc1ccccc1O)C(=O)OC(C)(C)C 227760527 DZBMIHBPNLSKSU-UHFFFAOYSA-N 280.368 2.349 10 20 CECD COc1ccc(O)c(CN2CCC3(CCOCC3)C2)c1 271795663 KAJCYJUTOKVKDB-UHFFFAOYSA-N 277.364 2.403 10 20 CECD CCOc1cccc(CNC[C@@H]2CCCN(C)C2)c1O 44535077 XYAMJRBZWKBCHG-ZDUSSCGKSA-N 278.396 2.222 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC2(O)CCC2)c1 284410880 QMMZTVWZUCVIHX-LLVKDONJSA-N 265.353 2.357 10 20 CECD CCOc1cccc(CNC2CCC(N)CC2)c1O 51693755 QOJXFFZJHKFBSR-UHFFFAOYSA-N 264.369 2.150 10 20 CECD Cc1nnc(CCNCc2ccc(N(C)C)cc2)s1 289717246 FITJQDCXOHLQOF-UHFFFAOYSA-N 276.409 2.245 10 20 CECD CC(C)[C@H](CO)CNCc1ccc(N(C)C)cc1 394102439 DOIRHXCDPOXOTG-AWEZNQCLSA-N 250.386 2.107 10 20 CECD CCCCS(=O)(=O)NCc1ccc(N(C)C)c(F)c1 58507271 MQWHWVZNZUJYHR-UHFFFAOYSA-N 288.388 2.111 10 20 CECD Cc1n[nH]c2ncc(C(=O)N(C)Cc3ccccc3O)cc12 67137787 AHRKUFSXKGOETC-UHFFFAOYSA-N 296.330 2.244 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CC2(O)CCCC2)c1 118785849 RZDINIRETJKCLE-NSHDSACASA-N 293.363 2.273 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cn(C)nc1C 115280102 QWXHLNSDVZJOFN-UHFFFAOYSA-N 286.379 2.033 10 20 CECD CC[C@H](N[C@@H](C)C[S@](C)=O)c1ccccc1O 119178365 AKEGKOYMPMGIPQ-QAGHZCBJSA-N 255.383 2.200 10 20 CECD O=C(c1cccc(O)c1O)N(Cc1cccnc1)C1CC1 186859815 MUAYABXHFIZHJP-UHFFFAOYSA-N 284.315 2.298 10 20 CECD CC(C)CN(CCN(C)C)Cc1cc2c(cc1O)OCO2 132553888 WEYILJRUPUJXPM-UHFFFAOYSA-N 294.395 2.141 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)NC1CC1 80612789 ATVQXWBANZGGHI-UHFFFAOYSA-N 260.337 2.233 10 20 CECD COCCOC[C@@H]1CCN(Cc2cc(F)ccc2O)C1 180215670 XSYTYCWGCYJQKC-GFCCVEGCSA-N 283.343 2.016 10 20 CECD CN(C)c1ccc(CN2CC[C@@H](N3CCCC3)C2)cc1 92756122 HKWRQUBAWSLPHN-QGZVFWFLSA-N 273.424 2.423 10 20 CECD CC[C@H](NCC(=O)NCC(F)(F)F)c1ccccc1O 183325963 ZVAYQLGGTJESNY-JTQLQIEISA-N 290.285 2.111 10 20 CECD C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H]1C 272685293 SRXIOSJKDGTZIU-UBTSRBCMSA-N 261.321 2.225 10 20 CECD CCCC[C@@H]1NC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 272094204 MMEJETOORRJUQM-AWEZNQCLSA-N 289.379 2.363 10 20 CECD CN(C)c1ccc(CN2CCC[C@](C)(O)CC2)cc1 280129903 QKOYIIJOPFMQLZ-INIZCTEOSA-N 262.397 2.490 10 20 CECD COCC[C@@H](CO)N[C@@H](C)c1ccc(C)c(C)c1O 281726205 UVMRRJBNWIPSIL-STQMWFEESA-N 267.369 2.057 10 20 CECD COc1cccc(CNC(C)(C)c2nc(C)no2)c1O 283894665 HQTYNYLKDCYGOO-UHFFFAOYSA-N 277.324 2.117 10 20 CECD CC[C@@H](N[C@@H]1CCCN(CCCO)C1)c1ccccc1O 295193030 XNUKLRZVPXFQSU-GDBMZVCRSA-N 292.423 2.280 10 20 CECD C[C@@H]1C[C@@H](NCC(C)(C)OCCO)c2c(O)ccc(F)c21 806664427 PZZWUMKNMZRMRQ-ZYHUDNBSSA-N 297.370 2.457 10 20 CECD OCC[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)CC1 817418888 KGYCUEDWJVMRND-GFCCVEGCSA-N 293.363 2.105 10 20 CECD CCc1nc(CNCc2c(O)ccc(Cl)c2F)n[nH]1 824445910 OSWRORVWWFMWSU-UHFFFAOYSA-N 284.722 2.155 10 20 CECD C/C(=C/C(=O)N1C[C@@H](C)Oc2ncccc21)c1cnccn1 829227111 GGIBHFLWLLFNLR-NXIHDVOMSA-N 296.330 2.089 10 20 CECD COC(=O)c1cnc(Sc2ncnc3c2CCC3)s1 828428071 HLSNQBQBKQBDEI-UHFFFAOYSA-N 293.373 2.360 10 20 CECD Cc1ccc(C(=O)NCC[C@@H]2C[C@H]3CC[C@H]2O3)c(O)c1O 837885709 GQWHBGSPOHLSMS-NQBHXWOUSA-N 291.347 2.094 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@@H](C)c1ccc(C)cc1O 834880469 DGOAWIJTCQFXQU-WOSRLPQWSA-N 279.380 2.403 10 20 CECD Cc1noc(C2CN(Cc3cc(Cl)cc(F)c3O)C2)n1 839131506 UROYHYAVABAMGG-UHFFFAOYSA-N 297.717 2.476 10 20 CECD CCc1onc(C)c1NC(=O)Cc1ccc(N)cc1 831470085 KHIBVOGEVJEDRE-UHFFFAOYSA-N 259.309 2.309 10 20 CECD C[C@@H]1CCCN(Cc2cccc(F)c2O)[C@H]1CN 843052577 VUTXLBFIHWQBMC-MFKMUULPSA-N 252.333 2.091 10 20 CECD COCC1(CNCc2c(O)cccc2Cl)CCNCC1 841068368 MMBREUVXPXAUDW-UHFFFAOYSA-N 298.814 2.151 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2(N)CCCCC2)c1 843489074 CSHWIMFJQPQQOD-LLVKDONJSA-N 292.379 2.240 10 20 CECD CCc1cccc(CN[C@@H](COC)[C@@H]2CCCO2)c1O 848907171 JTHKVJTYKUOKLX-GJZGRUSLSA-N 279.380 2.238 10 20 CECD CC[C@H](N[C@H](CO)CCF)c1ccc(C)cc1O 846209379 QSKNJFYUWJSZHP-AAEUAGOBSA-N 255.333 2.462 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@@H]1CN 841028521 AKLMIUAEZYZEEJ-CJNGLKHVSA-N 261.413 2.278 10 20 CECD CC(C)N1C[C@@H](N[C@H](C)c2cc(F)ccc2O)CC1=O 756739755 ZCFMOKQKCSATAM-PWSUYJOCSA-N 280.343 2.191 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCO[C@H](C)C2)c1 756782078 MJRNASVXYGUXLV-MDZLAQPJSA-N 293.363 2.397 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC[C@H]1CCCOC1 760766842 DVVRCZWOWMJERL-RNZFLTOJSA-N 278.304 2.081 10 20 CECD CC[C@H](C)NC(=O)CCNCc1c(C)cccc1O 876945194 VMCWNLDWFZGHGC-LBPRGKRZSA-N 264.369 2.095 10 20 CECD Cc1nnc(NCc2cc(F)c(N(C)C)cc2F)n1C 865290923 OWCWVKYYLYYNFO-UHFFFAOYSA-N 281.310 2.080 10 20 CECD CN(C(=O)/C=C/C1CCOCC1)c1ccc(N)cc1 877078463 QHPHCFQDIUKBRX-FARCUNLSSA-N 260.337 2.214 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@@H]([S@@](C)=O)C2)c(O)c1 877623014 GVLJGIJCHPXWLG-PJIJBLCYSA-N 281.421 2.480 10 20 CECD OC1CCN(c2ccc(CN[C@H]3C=CCC3)cc2)CC1 877624840 TYHKOLRBSYRDRI-HNNXBMFYSA-N 272.392 2.456 10 20 CECD Oc1c(Cl)cccc1CNCCCNc1ncccn1 775757996 NFVNIXXBQGDLPC-UHFFFAOYSA-N 292.770 2.427 10 20 CECD O=C(NCc1ccccc1O)Nc1ccc(F)cn1 775729797 SRCASBNQDZZAAT-UHFFFAOYSA-N 261.256 2.248 10 20 CECD O=C(NCc1ccc2c(c1)COC2)c1cc(O)cs1 771064296 JZRAKVZHFWVLQE-UHFFFAOYSA-N 275.329 2.414 10 20 CECD COCCCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773017297 SXDQGVJARPHEEF-GFCCVEGCSA-N 264.369 2.356 10 20 CECD Cc1cccc(O)c1CN(C)CCCN(C)CCN(C)C 877535411 MKZZEPBQHGPZMA-UHFFFAOYSA-N 293.455 2.016 10 20 CECD COC(=O)CC(C)(C)NCc1ccc(C)cc1O 877149921 VJHFYHVPZSHLSV-UHFFFAOYSA-N 251.326 2.132 10 20 CECD CC(C)N1C[C@H](N[C@H](C)c2c(O)cccc2F)CC1=O 886549065 BBASFAPGQLBFSH-GHMZBOCLSA-N 280.343 2.191 10 20 CECD C[C@@H](NCCOC[C@H]1CCOC1)c1c(O)cccc1F 886525904 ASIFQOXZKRBDPG-NEPJUHHUSA-N 283.343 2.235 10 20 CECD CC[C@@](C)(N)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881377170 HHPXJZQVZFRMIT-MRXNPFEDSA-N 287.411 2.285 10 20 CECD CC(C)COC[C@@H](O)CN[C@H](C)c1c(O)cccc1F 886511016 GMXYSTMOYSUIHT-NEPJUHHUSA-N 285.359 2.215 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(C)cc(OC)c2O)[C@@H]1C 787243383 WJXUJEUAIYUQSH-DGCLKSJQSA-N 293.363 2.093 10 20 CECD CCCC[C@@H](CN)NC(=O)N[C@H](C)c1ccccc1O 892039313 AHQWKVICXRSVOT-NEPJUHHUSA-N 279.384 2.270 10 20 CECD C[C@@H](COc1ccccc1)NC(=O)c1cccc(O)c1O 790554662 KCXFDSGGTUTHJG-NSHDSACASA-N 287.315 2.295 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H]3C[C@]3(CO)C2)c1O 782624084 IYPIZGZGDFTJOX-IAQYHMDHSA-N 295.766 2.062 10 20 CECD CC(C)[C@H](CNCc1cc(F)cc(F)c1O)C(=O)O 1353945561 LXNIUDKLLBKVIU-JTQLQIEISA-N 273.279 2.117 10 20 CECD C[C@@](CNCc1ccc(N)cc1)(C(=O)O)c1ccccc1 1592712226 IXLLRSMOKLEJRS-KRWDZBQOSA-N 284.359 2.401 10 20 CECD C[C@@H](N[C@@H]1COC2(CCC2)C1)c1cc(C(=O)O)ccc1O 1593230786 FZMCIBYGUPCTRR-PWSUYJOCSA-N 291.347 2.453 10 20 CECD C[C@@](NCc1ccc2c(c1)CCCO2)(C(=O)O)C1CC1 1776450448 ZEVGLFGHQDDMBJ-INIZCTEOSA-N 275.348 2.355 10 20 CECD CCN(CC)C(=O)CCCC(=O)Nc1ccc(N)cc1 160354588 GMQIOQMBDFQYGO-UHFFFAOYSA-N 277.368 2.246 10 20 CECD C[C@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(O)c(O)c1 159140656 NLJMGVVJAIRXDI-NHYWBVRUSA-N 293.363 2.309 10 20 CECD C[C@H](CNCc1ccc2c(c1)CCCO2)CN(C)C 922140915 UQHYZZDDHBDVEG-CYBMUJFWSA-N 262.397 2.299 10 20 CECD COc1cccc(O)c1CNCc1cccnc1C 858273979 TYRGGBLBTUWOMO-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CN(CC(=O)O)Cc1ccc(N2CCCCC2)cc1 108245371 VHGDDBNDCYTUQE-UHFFFAOYSA-N 262.353 2.193 10 20 CECD Nc1ccc(CC(=O)NCCOC2CCCCC2)cc1 111633637 FWEOJRKHHHCFQS-UHFFFAOYSA-N 276.380 2.277 10 20 CECD C[C@H]1CSCCN(C(=O)Nc2ccc(N)cc2)C1 379573976 XYNXMYCFHRXKDR-SNVBAGLBSA-N 265.382 2.486 10 20 CECD Oc1cccc(Cl)c1CNC[C@@H](O)C(F)(F)F 226646649 YJJLDLGQHFUNJQ-SECBINFHSA-N 269.650 2.058 10 20 CECD COc1ccc(N(CC(=O)N(C)C)[C@H](C)C2CC2)cc1 111236614 GVPZHMGHOCGIJP-GFCCVEGCSA-N 276.380 2.388 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)C[C@H](C)O)c1O 228677813 KFOFEGHTMZISMZ-BDAKNGLRSA-N 273.760 2.303 10 20 CECD CC[C@@H](NC[C@H](O)COCC(C)C)c1ccccc1O 121081619 MWXAUFZKUTZGTH-DZGCQCFKSA-N 281.396 2.466 10 20 CECD CC[C@@H](NCC1(CS(C)(=O)=O)CC1)c1ccccc1O 121107942 YESDNKZCLXRIET-CYBMUJFWSA-N 297.420 2.258 10 20 CECD Cc1cc(C(=O)N2CCC[C@H]2CO)c(C)n1-c1ccccn1 125020428 APMKDMCQECNQBH-AWEZNQCLSA-N 299.374 2.086 10 20 CECD CCOCCOCCN(C)Cc1cc(C)cc(C)c1O 189230620 YKNMABLDSHKVQQ-UHFFFAOYSA-N 281.396 2.494 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1 126447251 ZJTGLHMHZCSTSR-ZFWWWQNUSA-N 289.423 2.414 10 20 CECD COc1cccc(CN2CCCO[C@H](C)C2)c1O 134155574 RUFXKWSBZMKNBS-LLVKDONJSA-N 251.326 2.012 10 20 CECD Cc1ccn(C)c1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 190479969 VQAUUNNVNVLOFZ-NSHDSACASA-N 288.347 2.106 10 20 CECD Cc1c(CNC(=O)N2CCC2)n(C)c2ccccc12 334537849 AGANGAUNRYHMPK-UHFFFAOYSA-N 257.337 2.402 10 20 CECD O=C(O)[C@@H](Cc1ccccc1)NCc1ccc2c(c1)CCO2 262691287 GLZMEPGLHNMCEB-MRXNPFEDSA-N 297.354 2.407 10 20 CECD CC[C@@H](CCO)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273609130 VFCYUCXGCACWPT-RYUDHWBXSA-N 295.379 2.238 10 20 CECD C[C@H](N[C@H](C)Cn1ccnc1)c1cc([N+](=O)[O-])ccc1O 273363760 DNZCJGQNOGYLKJ-MNOVXSKESA-N 290.323 2.236 10 20 CECD C[C@@H](NC[C@H]1CCCOC1)c1cc([N+](=O)[O-])ccc1O 273414016 QLTGTAGSWGBOOP-GHMZBOCLSA-N 280.324 2.378 10 20 CECD COC[C@@H]1CCCCN(Cc2cc3c(cc2O)OCO3)C1 375096253 DNALPYBSYKZPEB-GFCCVEGCSA-N 293.363 2.369 10 20 CECD O=C(NCCc1ccc2c[nH]nc2c1)c1cc(O)cs1 807528196 HVMCORYYTQDJGI-UHFFFAOYSA-N 287.344 2.303 10 20 CECD Oc1c(Cl)cccc1CN1CCn2cncc2C1 291533699 KNCMKXLXIYXXKW-UHFFFAOYSA-N 263.728 2.258 10 20 CECD Cc1cc(CNCc2ccc3c(c2)CCCN3C)n(C)n1 390534301 ZOZOKOGVZXUZOH-UHFFFAOYSA-N 284.407 2.401 10 20 CECD Cc1cccc(CN(C)[C@H]2CC(C)(C)OC2=O)c1O 814180696 RCKQNLBTKMZEHA-LBPRGKRZSA-N 263.337 2.227 10 20 CECD C[C@H](OC[C@@H]1CCCO1)C(=O)N[C@H](C)c1ccccc1O 827930855 SKFMWWCKZGPASK-AGIUHOORSA-N 293.363 2.154 10 20 CECD C[C@@H](Cc1cnc[nH]1)C(=O)N[C@H](C)c1ccccc1O 827952600 YGNIEGWPDLIQTH-WDEREUQCSA-N 273.336 2.171 10 20 CECD Cc1cc(CNCC[N+](=O)[O-])c(C)n1-c1ccccc1 905395875 PNONNFMKHZUEOP-UHFFFAOYSA-N 273.336 2.460 10 20 CECD O=C(CCc1ccc(C(=O)O)cc1)NCc1ccccc1O 739256290 QMYBFCUCCUFGNU-UHFFFAOYSA-N 299.326 2.339 10 20 CECD Cc1cn(C)nc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 839727865 DUHJLQYDWSQCAX-GFCCVEGCSA-N 286.379 2.286 10 20 CECD CC(C)N(C)S(=O)(=O)Nc1cc(F)c(O)cc1Cl 901963900 ZKJTUAQNIGLBKH-UHFFFAOYSA-N 296.751 2.182 10 20 CECD CCN1CCC[C@H](N[C@H](C)c2cccc(OC)c2O)C1=O 903387220 DNGUNVXHJTYVAX-YPMHNXCESA-N 292.379 2.062 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@]2(C)CCC(=O)N2)c1 834910336 WMPZDSWORBROLB-IAQYHMDHSA-N 262.353 2.020 10 20 CECD CCN(C(=O)/C=C\c1cnn(C)c1)c1ccccc1C(=O)O 737053723 WLYGKNNQLPEOJL-HJWRWDBZSA-N 299.330 2.185 10 20 CECD CCc1cc(CNC(=O)N(C)Cc2ccccc2O)n[nH]1 739025763 PVJSDKYWQKPBFU-UHFFFAOYSA-N 288.351 2.019 10 20 CECD CCC(C)(C)OCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 837519687 CQYHNQHDFDHWMF-NSHDSACASA-N 295.379 2.350 10 20 CECD COc1cccc([C@@H](C)NC[C@H](C)CN(C)C)c1O 846170244 MVPDPCQLGCXWCC-NWDGAFQWSA-N 266.385 2.249 10 20 CECD CNC[C@@H]1CCCN(Cc2ccc(N(C)C)cc2C)C1 843044974 OGTCXMMATJMVLX-HNNXBMFYSA-N 275.440 2.492 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1cccc(Br)c1O 843066334 VCBLGAWUNVLWDJ-AOOOYVTPSA-N 299.212 2.337 10 20 CECD CCc1cccc(CN(C)C[C@@H](O)C(F)(F)F)c1O 848912861 XXESTCQIIGETFL-LLVKDONJSA-N 277.286 2.310 10 20 CECD CCOCc1cc(CN[C@@H]2CO[C@H](C)C2)ccc1OC 842774509 IHCLPKBWTKZUCU-DOMZBBRYSA-N 279.380 2.499 10 20 CECD CS[C@@H](C)C(=O)NCc1cc(Cl)ccc1O 846472705 LVKWWKLDCKHCJB-ZETCQYMHSA-N 259.758 2.413 10 20 CECD COc1ccc(N(C)CCN(C)c2cncc(C)n2)cc1 845672323 JOCQXUUNMHCBDN-UHFFFAOYSA-N 286.379 2.366 10 20 CECD OC1CCN(c2ccc(CNCC3CC3)cc2)CC1 850405712 AKSYNRNJBAZLQH-UHFFFAOYSA-N 260.381 2.147 10 20 CECD CC(C)N1C[C@@H](N[C@@H](C)c2cc(F)ccc2O)CC1=O 756739754 ZCFMOKQKCSATAM-JQWIXIFHSA-N 280.343 2.191 10 20 CECD C[C@@H](O)C1(NCc2cc(F)c(N(C)C)cc2F)CC1 862418798 LSJSPHLQQTWCJR-SECBINFHSA-N 270.323 2.034 10 20 CECD CN(Cc1ccccc1O)C(=O)C1(c2ccccn2)CC1 866596381 FVEPPKDQKCRUPZ-UHFFFAOYSA-N 282.343 2.477 10 20 CECD CCOc1nccc(C)c1C(=O)NCc1ccccc1O 765423253 JHJKPSHYCNDXKY-UHFFFAOYSA-N 286.331 2.424 10 20 CECD Cc1cccc(O)c1CN1CCN(CC(C)C)C(=O)C1 877433523 VTHJSDWAGKFUEM-UHFFFAOYSA-N 276.380 2.001 10 20 CECD CCCOc1ccc(CN[C@H]2C(=O)NCC[C@@H]2C)cc1C 873122545 SUCMNDSHNREMCT-BLLLJJGKSA-N 290.407 2.398 10 20 CECD C[C@H]1C[C@@H](C)CN1C(=O)/C=C/c1ccc(O)c(O)c1 779521829 UZWPBZHNUJUPHH-MRUFAENASA-N 261.321 2.368 10 20 CECD C[C@H]1[C@@H](C)N(Cc2cccc(Cl)c2O)CC[S@@]1=O 775712682 BEMMAHJYFQOSHR-JJQCHNSYSA-N 287.812 2.387 10 20 CECD CC[C@@H](CO)C(=O)NCc1ccc(N2CCCCC2)cc1 779752001 JWMNKAWLKPYGTA-HNNXBMFYSA-N 290.407 2.312 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CC23CCC3)c1 873267909 LYJFMJVBTRCVCK-ZDUSSCGKSA-N 260.337 2.442 10 20 CECD CCOC(=O)CN(CC)Cc1c(C)cccc1O 876632187 IIUJSQVXVOGYBP-UHFFFAOYSA-N 251.326 2.086 10 20 CECD C[C@@H]1[C@@H](C)N(Cc2cc(F)ccc2O)CCN1C 775983638 CGMZNZVTZXQKLF-GHMZBOCLSA-N 252.333 2.056 10 20 CECD C[C@H]1CCc2[nH]nc(C(=O)Nc3ccc(N)cc3)c2C1 884009439 WIKPLLJMNKOBRO-VIFPVBQESA-N 270.336 2.369 10 20 CECD COc1cc(C)cc(CNC[C@]2(C)CCOC2)c1O 894260494 MMDSKVNODQTQFU-HNNXBMFYSA-N 265.353 2.225 10 20 CECD CCN(Cc1cc(F)cc(F)c1O)C[C@@H](O)C(F)(F)F 894494040 LOMLRBGWCFTJSM-SNVBAGLBSA-N 299.239 2.416 10 20 CECD CCOc1ccc(CNCCO[C@H]2CCCCO2)c(O)c1 894798570 GFFSTRGNGPFUTD-INIZCTEOSA-N 295.379 2.424 10 20 CECD O=C1NC(=S)S/C1=C\c1c(F)ccc(O)c1F 794927288 QAQHCTXUOUKGNT-CLTKARDFSA-N 273.285 2.159 10 20 CECD Cc1cc(O)c(CN2[C@H](C)C(=O)N[C@@H](C)[C@H]2C)cc1C 895117747 WAYHFRCQWAUNNZ-YNEHKIRRSA-N 276.380 2.106 10 20 CECD CCC[C@@H](C)NC(=O)NCc1ccc(OC)cc1O 792777826 KOVJEGVMFGZPRD-SNVBAGLBSA-N 266.341 2.389 10 20 CECD COc1cccc(CNC(=O)c2cnoc2C2CC2)c1O 1319959188 GNZUKGXTRBPBCL-UHFFFAOYSA-N 288.303 2.196 10 20 CECD COc1ccc(N(C)CCCCCO)cc1OC 727025914 NCBOGNDKAPTWGX-UHFFFAOYSA-N 253.342 2.303 10 20 CECD CN(C)c1ccc(OCc2ccccn2)cc1C(=O)O 1606060953 RRXSMXQFPUECNK-UHFFFAOYSA-N 272.304 2.425 10 20 CECD CC[C@@](C)(NCc1ccc(N(C)C)cc1)C(=O)O 1609897111 JYVASAMCVUCZQE-CQSZACIVSA-N 250.342 2.096 10 20 CECD CC[C@H](NC1C[C@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1590466775 OIVLIRJGJLPGCH-RULNRJAQSA-N 299.378 2.412 10 20 CECD C[C@H](N[C@H]1CCC[C@@H](N)C1)c1cc(C(=O)O)ccc1O 1593221824 BIQBLOZMSYQVKU-WCQGTBRESA-N 278.352 2.011 10 20 CECD CCN(C)c1ccc(CN[C@H]2C[C@H](C(=O)O)C2)c(C)c1 1776856511 ZSZHOSNOORAJBK-HDJSIYSDSA-N 276.380 2.404 10 20 CECD Cc1cccc2nc(C(=O)NCCc3ccc(N)cc3)cn12 152577458 RDMNJTUJUXPYGH-UHFFFAOYSA-N 294.358 2.197 10 20 CECD COc1ccc(O)c(CN2CCCC[C@H]2[C@H](C)N)c1 63191909 PIVXBQGBGUSJLX-FZMZJTMJSA-N 264.369 2.103 10 20 CECD COc1ccc(CN[C@@H]2CSC[C@H]2C)c(O)c1 397913089 ZEJUJFLNBOYMCW-BXKDBHETSA-N 253.367 2.242 10 20 CECD C/C=C/C[C@H](CO)NCc1cccc(Cl)c1O 186531299 HYYQSGDZRPLOFS-KXMPLOMGSA-N 255.745 2.462 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1c(O)cccc1Cl 120610875 HBXGOIGTMBVYJI-SECBINFHSA-N 271.744 2.287 10 20 CECD CCOC(=O)[C@@H](NCc1ccccc1O)[C@H](C)CC 187863436 DEDJBZWAOAFMOE-RISCZKNCSA-N 265.353 2.460 10 20 CECD CC(C)C[C@H](NCc1ccc(N(C)C)cc1)C(=O)O 41689626 PUUPVAFHVNKIAZ-AWEZNQCLSA-N 264.369 2.342 10 20 CECD Cc1ncc2c(n1)CC[C@H](NCc1ccccc1O)C2 360256061 XQFCODLPKNOLLU-AWEZNQCLSA-N 269.348 2.138 10 20 CECD Cc1nc([C@@H]2CCCN(Cc3ccccc3O)C2)n[nH]1 271445906 SXPTZJMKEKCLJB-CYBMUJFWSA-N 272.352 2.198 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@H](C)SC)c1O 278548908 YTIANUQEQLAKSK-QMMMGPOBSA-N 286.353 2.150 10 20 CECD Cc1cccnc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 274942497 PUDNUWRYRBRYOI-LLVKDONJSA-N 286.331 2.162 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)c1 273520448 UAZZDMWTMZWWFD-QWHCGFSZSA-N 276.380 2.361 10 20 CECD C[C@@H](NC[C@H]1CCCN1C)c1cc([N+](=O)[O-])ccc1O 273400646 MXGRHPVSZJUZHW-ZYHUDNBSSA-N 279.340 2.045 10 20 CECD COC(=O)c1ccc(CN(C)Cc2ccccc2O)[nH]1 272766114 RHHCVYXCNWDWOZ-UHFFFAOYSA-N 274.320 2.139 10 20 CECD OC[C@@H]1CN(Cc2ccccc2O)CC[C@H]1C(F)(F)F 289685247 OCCXOPSSMVIIRD-NWDGAFQWSA-N 289.297 2.385 10 20 CECD COC(=O)c1cnc(SC[C@H]2CCCO2)s1 295160695 GUSIXJYCDLIDHY-SSDOTTSWSA-N 259.352 2.201 10 20 CECD CC(=O)C(=O)COC(=O)c1csc2c1CC[C@H](C)C2 808483249 IEDLBBVKYIHUEH-QMMMGPOBSA-N 280.345 2.188 10 20 CECD CNC(=O)CCCN[C@@H](C)c1c(C)cc(C)cc1O 293720361 MLIQPFNMQRRBGC-LBPRGKRZSA-N 264.369 2.186 10 20 CECD Oc1cccc2c1[C@H](NCCNc1ccccn1)CC2 297682907 LPJQWQCMVDWMCI-CYBMUJFWSA-N 269.348 2.476 10 20 CECD CC(C)[C@@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H](C)N 399783435 WILAMQREZCWWJJ-XJKSGUPXSA-N 291.439 2.330 10 20 CECD O=C1NN(c2ccccc2)C(=O)/C1=C\c1cccnc1Cl 728697286 MQLWGNZZIFRCAF-XFXZXTDPSA-N 299.717 2.196 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCCN2C(C)C)c1 827167252 OXOQGQOUPUXTGX-AWEZNQCLSA-N 276.380 2.190 10 20 CECD Cc1cc(O)c(CNC[C@@H]2CCOC2)cc1Cl 825107269 FVBRHESJECFGEU-JTQLQIEISA-N 255.745 2.480 10 20 CECD Oc1cc2c(cc1CN1CCSC[C@H]1C1CC1)OCO2 824914322 PGVHMJIXSWERQX-LBPRGKRZSA-N 293.388 2.448 10 20 CECD CCCCCNC(=O)[C@H](C)OC(=O)c1cc(O)cs1 732354813 RYIKDSMVJKQHTB-VIFPVBQESA-N 285.365 2.305 10 20 CECD CCCSCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832280535 PDNLHUBRWCODRO-CQSZACIVSA-N 295.452 2.012 10 20 CECD COC[C@@H]1CCCCN1C(=O)/C=C\c1ccc(O)c(O)c1 837145187 IKGIKEBMVRDXIV-WOLRVDTOSA-N 291.347 2.139 10 20 CECD COc1cc(O)c(CNC[C@@H]2CC[C@@H](C)O2)cc1OC 835086754 JGRBVBMHUACGNX-PWSUYJOCSA-N 281.352 2.067 10 20 CECD CC[C@H](C)[C@@](C)(O)CNC(=O)Nc1ccc(N)cc1 841300829 WQILZIQKZBLMLW-HZMBPMFUSA-N 265.357 2.187 10 20 CECD COCCCCc1nc(Cc2ccc(N)cc2)no1 843159443 PMMMEKJPVCMXMP-UHFFFAOYSA-N 261.325 2.212 10 20 CECD CCc1cccc(CN(C)CC(C)(C)CO)c1O 848913697 BQRBACYQYHETIS-UHFFFAOYSA-N 251.370 2.405 10 20 CECD CC[C@H](C)CC(=O)N(CC(=O)O)Cc1ccccc1O 911494718 XHTCMXPMPZHSRS-NSHDSACASA-N 279.336 2.242 10 20 CECD CC(C)(N)CN(Cc1ccccc1O)C[C@H]1CCCO1 843117150 VTLYBLOFIAXKSS-CQSZACIVSA-N 278.396 2.111 10 20 CECD NC[C@@H](NCc1cc2c(cc1O)OCO2)C1CCCCC1 841039607 WIKIEOLHWCSBTG-CYBMUJFWSA-N 292.379 2.118 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@@H](CO)C1 840908039 NGFLCHZFTZVXLR-CQSZACIVSA-N 262.397 2.265 10 20 CECD CCc1cccc(CNC[C@@H](C)CN2CCOCC2)c1O 848897081 MSYAWOPWGCQATN-CQSZACIVSA-N 292.423 2.013 10 20 CECD COc1ccc(O)c(CNC(=O)C2CC(F)(F)C2)c1 754015504 UJCIPSGGIQGHDO-UHFFFAOYSA-N 271.263 2.062 10 20 CECD CCn1cnnc1NCc1c(O)cccc1Cl 922660982 XGKRBFDCUHYRQR-UHFFFAOYSA-N 252.705 2.269 10 20 CECD CCC[C@H](C)S(=O)(=O)NCc1ccc(N(C)C)cc1 757745268 SWCAIURIDBHQIL-LBPRGKRZSA-N 284.425 2.361 10 20 CECD C[C@H](O)CN(Cc1cc(F)c(N(C)C)cc1F)C1CC1 862407233 VWYLBERGVXHGKN-JTQLQIEISA-N 284.350 2.376 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2O[C@@H](C)C[C@H]2C)c1 862755450 HIQAGUADERYARY-UHIISALHSA-N 263.337 2.130 10 20 CECD CN1CCCc2cc(CNC(=O)[C@@H]3CCSC3)ccc21 762168516 RNBFLUNFPARPRK-CQSZACIVSA-N 290.432 2.438 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2C[C@H]3C[C@@H]3C2)c1O 862441346 QQUAXWLBNZBORO-HTQZYQBOSA-N 268.700 2.406 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@H]2O)CC(C)(C)C 768447425 OWKBXGLPQFFXHI-CYBMUJFWSA-N 265.353 2.296 10 20 CECD CCOc1ccc(CN2CCO[C@@H](CC)C2)c(O)c1 768239472 WLVVQIUYECNGLJ-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD CC[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768464197 ODTCSGVSHMRFQT-QMTHXVAHSA-N 263.337 2.050 10 20 CECD CC[C@@H](NCc1nncn1C)c1cc(Cl)ccc1O 775491155 AXSQGFYCAWTWKE-LLVKDONJSA-N 280.759 2.415 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H]1O 770380098 LJKHXJOSKWXAJB-ZANVPECISA-N 255.745 2.248 10 20 CECD COc1ccc(O)c([C@H](C)NCCOC[C@@H]2CCCO2)c1 775369988 JQEPAPUWHBEDMP-JSGCOSHPSA-N 295.379 2.247 10 20 CECD CN1C(=O)C2(CCCC2)N[C@H]1c1cc(F)cc(F)c1O 887328481 ZQYGSGDCRBRCQY-GFCCVEGCSA-N 282.290 2.043 10 20 CECD Cc1ccncc1/C=C/C(=O)N1CCc2ncccc21 784089434 YRXMKHXADOZJQF-SNAWJCMRSA-N 265.316 2.388 10 20 CECD O=C(Nc1cc([C@@H]2CCCOC2)[nH]n1)c1cc(O)cs1 792675662 YLMYVEBNSSYVSN-MRVPVSSYSA-N 293.348 2.323 10 20 CECD CC[C@](C)(OC)C(=O)N[C@@H](C)c1cc(OC)ccc1O 795080916 NGMIPCZWNOBQFR-BONVTDFDSA-N 281.352 2.393 10 20 CECD CO[C@@H](C(=O)N[C@H](C)c1ccc(N(C)C)cc1)C1CC1 791720367 NDSBGTPUJONCPS-IAQYHMDHSA-N 276.380 2.355 10 20 CECD C[C@H](CNCc1cc(F)cc(F)c1O)CN1CCCC1 708557817 BOVDMHMLCFEITG-LLVKDONJSA-N 284.350 2.492 10 20 CECD CN(C)c1ccc(CN[C@H]2CCCC[C@H]2CN)cc1 89140415 FYWWFQBIXFDRBJ-HOCLYGCPSA-N 261.413 2.360 10 20 CECD C[C@@H](NCc1cc(Cl)ccc1O)c1ncnn1C 788971614 PYYYVLZFYCHQDO-MRVPVSSYSA-N 266.732 2.025 10 20 CECD CN(C)c1ccc(CNc2cc(Cl)nc(N)n2)cc1 24056625 PIZSIUZPWSASQS-UHFFFAOYSA-N 277.759 2.390 10 20 CECD Nc1ccc(CC(=O)N[C@H](c2ccccn2)C2CC2)cc1 1341749705 OOKSEVFWLPSJFU-KRWDZBQOSA-N 281.359 2.474 10 20 CECD CC[C@@H](C)[C@](C)(O)CNCc1ccc(OC)c(OC)c1O 1342948319 VYLRNIUPTHVUOV-BDJLRTHQSA-N 297.395 2.296 10 20 CECD Cc1ccc(O)c(CNCCC(=O)NC(C)(C)C)c1 134653592 GPNNTNFMBVXYTE-UHFFFAOYSA-N 264.369 2.095 10 20 CECD CN(C)c1ccncc1CNCc1ccc(N)cc1 1578428679 DFJNTSYWQDDSOZ-UHFFFAOYSA-N 256.353 2.020 10 20 CECD Cc1nc(N[C@@H](C)c2ccccc2O)ccc1-c1nn[nH]n1 1581526484 GPSKNEQQILQLDY-VIFPVBQESA-N 296.334 2.449 10 20 CECD C[C@H](N[C@@H](C)c1ccccc1O)c1nc(C(=O)O)co1 1593353389 VHRJSTKOFJUAHP-IUCAKERBSA-N 276.292 2.490 10 20 CECD CCN(C)c1ccc(CN[C@@H](C)C(=O)O)c(C)c1 1776856530 MTYYLQYUYVCSDQ-NSHDSACASA-N 250.342 2.014 10 20 CECD CCN(C)c1ccc([C@H](C)NCCOCCOC)cc1 153997659 IFMOBMDMRDOYFX-AWEZNQCLSA-N 280.412 2.456 10 20 CECD C[C@H](CC(=O)NCc1ccccc1O)[C@@H]1CCCNC1 228423522 ZQGSEDRNSQLXEA-CHWSQXEVSA-N 276.380 2.034 10 20 CECD Oc1cc2c(cc1CNC[C@@H](O)c1ccsc1)OCO2 152546075 HAZMHWCNIUNTQQ-GFCCVEGCSA-N 293.344 2.006 10 20 CECD C[C@H]1C[C@@H](CNCc2cc3c(cc2O)OCO3)CCO1 271363228 ISJIDIQYSHVHII-QWRGUYRKSA-N 279.336 2.026 10 20 CECD C[C@](O)(CNCc1cc(F)cc(F)c1O)C(F)(F)F 708535578 MVXUGGFRUAWMFM-JTQLQIEISA-N 285.212 2.073 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccncc1 115280437 ROTXDDLCRARCKP-UHFFFAOYSA-N 269.348 2.386 10 20 CECD CC1(C)[C@H]2CN(Cc3cc4c(cc3O)OCO4)C[C@H]21 172942030 CDGWHYDTQSACLG-PHIMTYICSA-N 261.321 2.209 10 20 CECD Cc1ocnc1C(=O)NCCCSc1nccs1 114374734 NXNKYNLZQAYGPJ-UHFFFAOYSA-N 283.378 2.352 10 20 CECD Cc1ccc(OCCNC(=O)c2cccc(O)c2O)cc1 186872046 APBXNSGMMUWKOX-UHFFFAOYSA-N 287.315 2.215 10 20 CECD Cc1cc(C(=O)CN2CC[C@H](O)C2)c(C)n1-c1ccccc1 305267616 VZZLEHMWAUKXNH-INIZCTEOSA-N 298.386 2.343 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccncc2C)c1 121531264 DDRAKTDCBSCEDC-UHFFFAOYSA-N 287.319 2.426 10 20 CECD CO[C@@H](C)c1noc(CN(C)c2ccc3c(c2)OCO3)n1 121347352 IGROGQRAIWGRAL-VIFPVBQESA-N 291.307 2.142 10 20 CECD CCOC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2O)C1 186443139 IIUHGQFNEBRJST-RYUDHWBXSA-N 278.352 2.274 10 20 CECD Cc1cc(C(=O)NCCCN)c(C)n1-c1ccc(F)cc1 237588837 GLLJPZYGTNTCCX-UHFFFAOYSA-N 289.354 2.312 10 20 CECD Oc1ccc(Cl)cc1CN[C@@H]1C[C@H]2CC[C@H]1NC2 530245814 FISRCSWGMZMDLB-OASPWFOLSA-N 266.772 2.276 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H]1C1CC1)OCO2 363384440 KNEHCSXNIFBABA-LBPRGKRZSA-N 261.321 2.495 10 20 CECD CC(C)Cn1cc(C(=O)NCc2ccccc2O)cn1 272775841 HXSWNIXBANPAFZ-UHFFFAOYSA-N 273.336 2.175 10 20 CECD C[C@H](NC[C@H]1CCCOC1)c1cc([N+](=O)[O-])ccc1O 273414021 QLTGTAGSWGBOOP-WDEREUQCSA-N 280.324 2.378 10 20 CECD Cc1ccc([C@@H](C)NC[C@H]2CCS(=O)(=O)C2)c(O)c1C 273444045 ZJXMTRKCGDBIJT-CHWSQXEVSA-N 297.420 2.094 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)CC[S@]1=O 277839928 ZVIAGAIBOJEDCI-BFUOFWGJSA-N 280.437 2.096 10 20 CECD Cc1ccc(O)c(CN(C)CCCn2ccnc2)c1 290323399 DDBHZQKRKFCGGI-UHFFFAOYSA-N 259.353 2.419 10 20 CECD CCOc1ccc(CN=c2nc[nH]n2C(C)(C)C)c(O)c1 800815771 NBEUNTBOEVNXQT-UHFFFAOYSA-N 290.367 2.171 10 20 CECD COC[C@](C)(O)CN[C@@H](C)c1cc(Cl)cc(C)c1O 808695272 KHFCEKWXMUNOJD-IINYFYTJSA-N 287.787 2.402 10 20 CECD C[C@H](NCC[C@@H]1CCNC1)c1cc(F)ccc1O 817955521 XXENGAUMTSPKMV-QWRGUYRKSA-N 252.333 2.182 10 20 CECD CN(C)C(=O)CCNCc1ccc2ccccc2c1O 816543909 RITOLMJLQHGHPU-UHFFFAOYSA-N 272.348 2.113 10 20 CECD COC(=O)[C@@](C)(NCc1ccc(N(C)C)c(C)c1)C1CC1 815080386 ATQWQTHJCPNUCV-KRWDZBQOSA-N 290.407 2.492 10 20 CECD CC[C@@H](NC[C@@H]1CCCN1CCCO)c1ccccc1O 824564302 IKGCEUZATPBFRM-GOEBONIOSA-N 292.423 2.280 10 20 CECD Cc1cc(O)c(CN[C@@H]2CC[C@H](C(N)=O)C2)cc1Cl 826100803 UCYJHSKSFKVZBP-GXSJLCMTSA-N 282.771 2.098 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)CNC2CC2)cc1 826020935 YUNVPNBTGKZCHI-UHFFFAOYSA-N 289.423 2.243 10 20 CECD COc1ccc(N2CCC(NC3([C@H](C)O)CC3)CC2)cc1 827586103 UBOXOVQGPOAIBG-ZDUSSCGKSA-N 290.407 2.167 10 20 CECD Cc1cc(O)c(CN2CC[C@H](n3cncn3)C2)cc1Cl 825556657 UDHZZZJGAQPDCR-LBPRGKRZSA-N 292.770 2.393 10 20 CECD COc1ccc(CC(=O)N[C@H](C)c2ccccc2O)nc1 827946587 NEBXUIRSCDCJAD-LLVKDONJSA-N 286.331 2.216 10 20 CECD CCCCN(Cc1ccccc1O)C[C@@H]1COCCO1 829516014 MPTBWFTYDCTXCA-OAHLLOKOSA-N 279.380 2.410 10 20 CECD CCn1cnc2c(NCc3cc(OC)ccc3O)ncnc21 733995084 ZYDONUFEDXSWSR-UHFFFAOYSA-N 299.334 2.173 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@H]2CCC[C@@H](C2)C1 831835364 RHQYYTHYVMGLQG-UWVGGRQHSA-N 279.311 2.499 10 20 CECD CO[C@@](C)(C1CC1)[C@H](C)NC(=O)c1cc(O)cs1 839837815 TYDHAIOAOLROQQ-ISVAXAHUSA-N 269.366 2.387 10 20 CECD Cc1cc(O)c(CN2CC[C@@]3(CCCN3)C2)cc1C 841105674 XUFXHXAXFHYEDW-INIZCTEOSA-N 260.381 2.337 10 20 CECD CN(C)c1ccc(CN[C@H]2CCN(CC(F)F)C2)cc1 841894795 VIMZQLLDXAMAEV-ZDUSSCGKSA-N 283.366 2.182 10 20 CECD C[C@@H]1CCC[C@H](N(C)C(=O)C(=O)Nc2ccc(N)cc2)C1 841015747 LITBAEKUGQHGFE-RISCZKNCSA-N 289.379 2.244 10 20 CECD CC(C)OCCN(C)c1ccc(OCC(=O)O)cc1 846279407 CJWGVTNGJNUBAF-UHFFFAOYSA-N 267.325 2.011 10 20 CECD Cc1nc(NC(=O)NCCc2ccc(N)cc2)oc1C 841060542 ZONRAWNYQSHOTM-UHFFFAOYSA-N 274.324 2.238 10 20 CECD CCc1noc([C@H](C)OC(=O)c2ccc(C)c(O)c2O)n1 744909596 JOZCZNFBLREIKV-QMMMGPOBSA-N 292.291 2.270 10 20 CECD C[C@H](NC[C@@H](CO)[C@H]1CCOC1)c1ccc(Cl)cc1O 841754073 YSWRIPQNIYDVLS-SRVKXCTJSA-N 299.798 2.341 10 20 CECD Cc1cc(CN2CCC[C@H]3CNC[C@H]32)ccc1N(C)C 923360049 FYXCNRKEZRLELH-DOTOQJQBSA-N 273.424 2.245 10 20 CECD COc1cccc(O)c1CN(C)CCc1ccncc1 757888308 QXTLRCMEFASBPE-UHFFFAOYSA-N 272.348 2.470 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H]3CCC[C@]3(N)C2)c1O 857085803 HTKUGHLCKXYJLU-LRDDRELGSA-N 292.354 2.047 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](CO)C2CCOCC2)c(O)c1 757660049 ZFYCLKMMDBKIJW-DOMZBBRYSA-N 279.380 2.139 10 20 CECD CC(C)(C)OC(=O)CCCOC(=O)c1cccc(O)c1O 758562569 SNCODBDCWHSLTM-UHFFFAOYSA-N 296.319 2.377 10 20 CECD CC[C@@H](CNC(=O)N[C@H](C)c1ccccc1O)OC 868630110 QNFAWZSPENNMBV-MNOVXSKESA-N 266.341 2.177 10 20 CECD Cc1nocc1CNC(=O)N[C@H](C)c1ccccc1O 875951181 GXXQHPMLSSBNDH-SNVBAGLBSA-N 275.308 2.249 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCCOCC1)c1ccccc1O 875463699 XHVUYPWLAALZGO-VXGBXAGGSA-N 278.352 2.322 10 20 CECD C[C@@H](NCCc1nnn(C(C)(C)C)n1)c1ccccc1O 879650098 IPOOQPJPKQPNDL-LLVKDONJSA-N 289.383 2.027 10 20 CECD COC(=O)[C@@H]1CCN(Cc2c(C)cccc2O)C[C@@H]1C 877636403 WHEOCPWKBWZREW-QWHCGFSZSA-N 277.364 2.332 10 20 CECD Cc1ccc(CN[C@@H]2CCN(c3ccccn3)C2)c(O)c1 877121224 LTETXLBSQDXVKB-OAHLLOKOSA-N 283.375 2.464 10 20 CECD Cc1noc(C)c1COC(=O)/C=C\c1ccc(O)c(O)c1 772774279 HZLFNUWTDLKHPZ-XQRVVYSFSA-N 289.287 2.459 10 20 CECD CCCOc1ccc(CNC[C@@H]2CCCNC2=O)cc1C 873131528 URTXYNBIWJVOLQ-HNNXBMFYSA-N 290.407 2.400 10 20 CECD C[C@@H]1N(C(=O)/C=C\c2ccc(O)c(O)c2)CCOC1(C)C 779535933 YTGJPGPYXZZKMN-XOIDGJRKSA-N 291.347 2.137 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H](C)c1c(O)cccc1F 886530738 PMYFJVFZNYDXRQ-VDDIYKPWSA-N 273.373 2.294 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=N)NCC1CC1 887355266 JQSLFZDDAREIKN-UHFFFAOYSA-N 260.385 2.085 10 20 CECD CN(C)c1ccc(Cn2cc([C@H](N)C(C)(C)C)nn2)cc1 881272175 PGHIHZJNUNZZDH-HNNXBMFYSA-N 287.411 2.438 10 20 CECD COC(=O)[C@@H](CC(F)F)NCc1cc(C)c(C)cc1O 789579155 FCOZGWWLDBJJKE-LLVKDONJSA-N 287.306 2.295 10 20 CECD CCOc1ccc(CN[C@@H](C)C[C@@H](C)O)c(O)c1 782977136 BYRIHBZSDVLKOB-WDEREUQCSA-N 253.342 2.040 10 20 CECD COc1ccc(CN2CCCOC[C@H]2C)c(O)c1OC 892077828 ZPIIAUJDWOYNBJ-LLVKDONJSA-N 281.352 2.020 10 20 CECD COc1cc(O)c(CNCCOC(F)(F)F)cc1OC 789582656 XHXHZXKRLRNYTN-UHFFFAOYSA-N 295.257 2.035 10 20 CECD COc1ccc(CN[C@H]2CCC[C@@H]2CCO)c(O)c1OC 893721548 SVWPEPUMAUCUKR-YPMHNXCESA-N 295.379 2.050 10 20 CECD CC[C@@H](NCc1ccc(OC)c(OC)c1O)C(C)(C)O 894631663 NMFNTIXCTJMRPJ-GFCCVEGCSA-N 283.368 2.049 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)C[C@H]1CCCO1 891784440 XWORGDJNKIHGHM-CYBMUJFWSA-N 295.379 2.410 10 20 CECD CCC(O)(CC)CN(C)Cc1ccc(OC)c(OC)c1O 895663155 OPGHETXYNTVAFC-UHFFFAOYSA-N 297.395 2.392 10 20 CECD CCOc1cc(O)ccc1NS(=O)(=O)c1ccco1 790411880 SOFJJCCSMNVXKI-UHFFFAOYSA-N 283.305 2.185 10 20 CECD CCc1occc1C(=O)NCc1ccc(O)c(O)c1 797744397 PRSGCSYXBNNACS-UHFFFAOYSA-N 261.277 2.183 10 20 CECD Oc1c(Cl)cc(Cl)cc1CNC[C@H]1COCCO1 38060443 CYFHUOLOKUALBO-JTQLQIEISA-N 292.162 2.204 10 20 CECD O=C(O)[C@@H](NCc1ccc2c(c1)CCCO2)C1CCC1 1355404815 CPXMFOGEMJJHDD-HNNXBMFYSA-N 275.348 2.355 10 20 CECD N[C@H]1Cc2ccccc2N(C(=O)c2cccc3c2CCN3)C1 1341975812 ZGCIADRRIRSECA-ZDUSSCGKSA-N 293.370 2.185 10 20 CECD COC[C@H](N[C@@H](C)c1cc(C(=O)O)ccc1O)C1CC1 1606814279 CGFBMQDZUHGRJS-ZANVPECISA-N 279.336 2.166 10 20 CECD C[C@H](NCC1=CCN(C)CC1)c1cc(C(=O)O)ccc1O 1609781518 XYZCZIDZWSTXCH-NSHDSACASA-N 290.363 2.003 10 20 CECD Nc1ccc(NC(=O)N[C@@H](CC(=O)O)C2CCCC2)cc1 1601216900 VEUARAMWBDWTJF-ZDUSSCGKSA-N 291.351 2.424 10 20 CECD CCN(CC(=O)O)Cc1cccc(Br)c1O 1605415790 SUNWCBJXOJFXHG-UHFFFAOYSA-N 288.141 2.061 10 20 CECD Cc1c(CNCC2[C@@H]3CNC[C@@H]23)n(C)c2ccccc12 1579534293 DEKLDIIWNBRSDZ-ZIAGYGMSSA-N 269.392 2.042 10 20 CECD COc1ccc(O)c(CNCc2cnn(C)c2Cl)c1 815127198 YRFRWWNEOXQEPU-UHFFFAOYSA-N 281.743 2.078 10 20 CECD C[C@@H]1CCN(CCN[C@H]2CCc3cccc(O)c32)C1 834611532 MJHJMRIJJLRFKQ-OCCSQVGLSA-N 260.381 2.311 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NCCCOCCO 230672063 KULKNFAKPAXBTP-OLZOCXBDSA-N 279.380 2.238 10 20 CECD COc1ccc(O)c(CNCc2cnccc2OC)c1 294024755 VCVAQVPFTBSFBS-UHFFFAOYSA-N 274.320 2.094 10 20 CECD C[C@H](N[C@H](C)c1cc(F)ccc1O)C(=O)NC(C)(C)C 181234776 RATOBHMDTIGVPI-ZJUUUORDSA-N 282.359 2.485 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CCC[C@@H]2O)c1O 323672002 MRAPXKHQNVPINI-QWRGUYRKSA-N 271.744 2.057 10 20 CECD O=C(O)[C@H]1C[C@H]2CC[C@H]1N(Cc1cc(F)ccc1O)C2 394672221 SXVKRICTYAQEMA-JIMOISOXSA-N 279.311 2.216 10 20 CECD C[C@H](N[C@H](CO)C[C@@H]1CCCO1)c1cc(F)ccc1O 886670142 JXYCBWNVPKLFNO-DRZSPHRISA-N 283.343 2.112 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCC[C@@H]2C)c1 114596469 ALFPHOOLWTZXSO-GXFFZTMASA-N 278.352 2.389 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@]1(O)CCO[C@@H]1C 300423509 GCXKZVFSGFFWTJ-KOFHJDLBSA-N 291.391 2.378 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)C1=CCOCC1 193597438 PFRRVTOIIFQWEF-UHFFFAOYSA-N 287.359 2.234 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@]1(C)C[C@H]1F 335602416 ZNJJKIYVQXKCDG-HIFRSBDPSA-N 278.327 2.226 10 20 CECD CCC[C@@](C)(O)CNCc1cc(OCC)ccc1O 264863391 PMZQVTJUUPLQBC-OAHLLOKOSA-N 267.369 2.432 10 20 CECD CC[C@H](N[C@H]1CCCCNC1=O)c1ccc(C)cc1O 279990242 FGUZHFRIMZETNF-KBPBESRZSA-N 276.380 2.410 10 20 CECD CN(C)c1ccc(OCC(=O)N2CCCCC2)cc1 277759018 KBNGHKJIZWUNFV-UHFFFAOYSA-N 262.353 2.144 10 20 CECD Cc1cc(CN2CCC[C@H](OCCO)C2)ccc1N(C)C 293046402 KEHHWDVTKWEWLO-INIZCTEOSA-N 292.423 2.034 10 20 CECD COc1ccc(O)c(CN(C)C2CCC(CO)CC2)c1 809766138 VKNJAXNZZBBXQB-UHFFFAOYSA-N 279.380 2.384 10 20 CECD Cc1ccc(C(=O)N[C@@H]2C[C@H]2C2CCC2)c(O)c1O 819630835 MWJMDXZELCSBGE-NWDGAFQWSA-N 261.321 2.325 10 20 CECD C[C@@H](C[S@](C)=O)NCc1ccc2ccccc2c1O 816568055 VDBVPBNUKLQHIZ-WLRWDXFRSA-N 277.389 2.402 10 20 CECD Cn1cc(/C=C2\C(=O)N3CCCc4cccc2c43)cn1 817345254 FOJUPZNLLZFXGZ-ZSOIEALJSA-N 265.316 2.254 10 20 CECD Cc1ccc(C(=O)NC2CCC(N(C)C)CC2)c(O)c1O 817659183 RCWIQUYGLSMOEE-UHFFFAOYSA-N 292.379 2.009 10 20 CECD C[C@H]1SCC[C@@H]1NC(=O)NCc1ccc(N(C)C)cc1 825602882 OHJWREXXECQWIX-RISCZKNCSA-N 293.436 2.446 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@](C)(C(=O)O)C2CC2)c1O 825946936 XXQYWYOFXNFYSS-OAHLLOKOSA-N 295.310 2.077 10 20 CECD CN(C)c1ccc(CN2CC[C@@H]3OCC[C@@H]3C2)cc1 829586838 CDKZOHKYJAPSGX-ZBFHGGJFSA-N 260.381 2.363 10 20 CECD CCOc1ccc(O)c(CNC[C@@](C)(O)C2CC2)c1 732669672 RASFFVZTKOORHF-OAHLLOKOSA-N 265.353 2.042 10 20 CECD CC[C@]1(C)COCCN1C(=O)c1cc(O)cs1 831612157 LOAMWQWKOVNWJS-GFCCVEGCSA-N 255.339 2.095 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1Cc2cc(F)ccc2O1 743328854 WGIHLAIEWQGNLB-HNNXBMFYSA-N 287.290 2.151 10 20 CECD Cc1cc(Cn2ccnc2[N+](=O)[O-])ccc1N(C)C 918386828 MBAJEUBDVQWXSY-UHFFFAOYSA-N 260.297 2.214 10 20 CECD Nc1ccc(Cc2noc([C@@H]3C[C@H]4CC[C@H]3O4)n2)cc1 843158952 JFGGVQKPKFYHSS-JHJVBQTASA-N 271.320 2.278 10 20 CECD CCn1ccc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1 843580808 LDDOEWUJSMXABG-LBPRGKRZSA-N 286.379 2.460 10 20 CECD COC(=O)C(C)(C)CNCc1ccc(N(C)C)cc1C 840928516 XACZBYDMCPHCMY-UHFFFAOYSA-N 278.396 2.350 10 20 CECD COc1ccc(CNC(=N)N2CCC[C@H](C)C2)c(O)c1 849025152 QBXRPYUKGBDTTC-NSHDSACASA-N 277.368 2.157 10 20 CECD C[C@@H]1C[C@H](N[C@@H](CO)CCF)c2c(O)ccc(F)c21 846208770 KYMFSHUSDDSEOP-KKZNHRDASA-N 271.307 2.390 10 20 CECD C[C@H]1CCN(Cc2cccc(F)c2O)C[C@@H]1C(=O)O 843039083 AHMVCPMIVRPQJL-ONGXEEELSA-N 267.300 2.074 10 20 CECD COCCCC(=O)N(C)CCN(C)c1ccc(OC)cc1 844854051 MTODJRCSZNDOKL-UHFFFAOYSA-N 294.395 2.016 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)c2nccc(N)n2)c1 846844822 PXTYUHVOILHRTJ-ZJUUUORDSA-N 288.351 2.185 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1cncs1 857547603 LTRCCADQCYEHLC-UHFFFAOYSA-N 268.725 2.432 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)O[C@H]1CCCCC1=O 759588748 OEZSKLSDNUSXED-QPBFKRLHSA-N 276.288 2.166 10 20 CECD C[C@@H](N[C@@H]1CCN(C)C1)c1cc(F)cc(F)c1O 756534700 NAEKDOUHCWCKMU-PSASIEDQSA-N 256.296 2.025 10 20 CECD C[C@H](NCc1ccc(C(N)=O)nc1)c1ccc(N(C)C)cc1 766531594 PGKGHBBOEYHULA-LBPRGKRZSA-N 298.390 2.097 10 20 CECD C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)[C@@H]1CO 879365710 ISVLKRSXUQLDSG-CZUORRHYSA-N 262.397 2.345 10 20 CECD C[C@@H](O)CCCNCc1cc(F)c(N(C)C)cc1F 1118804515 MJBFTGNCMNFQSC-SNVBAGLBSA-N 272.339 2.281 10 20 CECD CCN(C)c1ccc([C@H](C)NCCCn2cncn2)cc1 776975262 OZNKDSWSSMWTQM-AWEZNQCLSA-N 287.411 2.475 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cc(C)c(C)cc2O)[C@H]1OC 775979232 SUZRPPOKZBISCK-FVQBIDKESA-N 279.380 2.291 10 20 CECD NC(=O)N1CCc2ccc(NCc3ccccc3O)cc21 785571566 HKNJEEXTOPGATJ-UHFFFAOYSA-N 283.331 2.446 10 20 CECD CC(C)(C)N1CC[C@H](NCc2cc(F)cc(F)c2O)C1=O 883152304 QVXBCDSZISLYQX-LBPRGKRZSA-N 298.333 2.159 10 20 CECD CSCC[C@H](C)NC(=O)c1ccc(C)c(O)c1O 780947902 OUXYROSYLBPFCZ-VIFPVBQESA-N 269.366 2.278 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CSCC(C)=O 787428617 ZRQQNBHSOYUXFH-UHFFFAOYSA-N 295.404 2.453 10 20 CECD O=C(Cc1ccc2c[nH]nc2c1)NCc1ccccc1O 793681876 PWNSESCSCPZBIM-UHFFFAOYSA-N 281.315 2.127 10 20 CECD c1cc(N2CCCC2)ccc1CN1CCC2(C1)OCCO2 1204325978 COOXFOSIPSQHMN-UHFFFAOYSA-N 288.391 2.236 10 20 CECD CC[C@H](C)[C@H](OC)C(=O)N(C)Cc1ccccc1O 793656813 MRBGORLDAWYZNJ-FZMZJTMJSA-N 265.353 2.412 10 20 CECD CN(CCCc1cnn(C)c1)Cc1ccccc1O 111236362 SXSGVZFQCWDOLY-UHFFFAOYSA-N 259.353 2.190 10 20 CECD CN(C)[C@@H]1CCCC[C@H]1NCc1cc2c(cc1O)OCO2 1254184551 PECUEBRQYOAGRV-CHWSQXEVSA-N 292.379 2.083 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](CO)CC2CC2)c1 756768671 FXXLYPGOPZJIIW-ZYHUDNBSSA-N 265.353 2.212 10 20 CECD CN[C@@H](CC(C)C)C(=O)N[C@H](C)c1ccccc1O 1336977379 WNQSHKOTGBHTRZ-YPMHNXCESA-N 264.369 2.204 10 20 CECD COc1cccc(O)c1CNCC[C@@H]1CCCC[C@@H]1O 897539254 VPHHGAURJNRCMN-JSGCOSHPSA-N 279.380 2.432 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H](N)C(C)(C)C)cc1F 1341587023 SPRQNQLVESIYDL-AWEZNQCLSA-N 295.402 2.271 10 20 CECD C[C@H]1CCN(c2nnc(-c3sccc3O)n2C)[C@@H]1C 1350468594 FIHPRSQTCBQOSO-DTWKUNHWSA-N 278.381 2.484 10 20 CECD C[C@H](N[C@@H]1COC[C@@H]1C1CC1)c1cc(C(=O)O)ccc1O 1604331121 ZOAJIIKXOZCYPW-CUOATXAZSA-N 291.347 2.166 10 20 CECD Cc1cc(C=O)c(O)c(C(=O)Oc2ccc(N)cc2)c1 1579590320 XUYLLFXBDBCMBK-UHFFFAOYSA-N 271.272 2.315 10 20 CECD CN(C)c1ccc(/C=C/CN[C@@H]2CNCC23CC3)cc1 1578425602 HYOPIZWSUUVGDO-QDLOVBKTSA-N 271.408 2.107 10 20 CECD Nc1ccc(NC(=O)CCN2CSCCSC2)cc1 1580447600 HHKVAQRAMZXHJS-UHFFFAOYSA-N 297.449 2.294 10 20 CECD COCCNCc1cc(Cl)cc(Cl)c1O 19881622 RUZJIPYYLNJFGP-UHFFFAOYSA-N 250.125 2.435 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@H]2C(=O)O)c1O 158490175 QDLPJGWJCFYRIR-ZDUSSCGKSA-N 295.310 2.173 10 20 CECD CC(C)(O)[C@H]1CCCN1Cc1cc(F)ccc1O 154475618 OPORVXGKDYDJFK-CYBMUJFWSA-N 253.317 2.267 10 20 CECD COCCO[C@@H]1CCCN(Cc2ccccc2O)C1 802652408 FVIBXSLXXAOIEA-CQSZACIVSA-N 265.353 2.020 10 20 CECD Cc1ccc(O)c(CN2CCCC[C@H]2CS(C)(=O)=O)c1 824914670 XASJBHLURRDEQB-AWEZNQCLSA-N 297.420 2.100 10 20 CECD C[C@@H](C[S@](C)=O)N(C)Cc1cc(Cl)ccc1O 130866262 YWYFCIPVQSZHQT-HUTHGQBESA-N 275.801 2.244 10 20 CECD CN1CCCc2cc(CNC3CCC(O)CC3)ccc21 50285864 GGQZWSCLMZNEKR-UHFFFAOYSA-N 274.408 2.462 10 20 CECD CCOc1cccc(CNCc2nnc(CC)s2)c1O 289851107 PSGYLZNRTJCPPY-UHFFFAOYSA-N 293.392 2.495 10 20 CECD CC(C)[C@H]1CN(C(=O)c2cccc(O)c2O)CCS1 187150629 SGFCDWZPZSTRDA-GFCCVEGCSA-N 281.377 2.311 10 20 CECD FC(F)OCCCNCc1ccc2c(c1)CCO2 193661519 OKWBZUOFXFCHIU-UHFFFAOYSA-N 257.280 2.340 10 20 CECD CCC[C@@](C)(O)CNCc1cc(F)cc(F)c1O 708453817 KKZOVSCOHJDVJL-CYBMUJFWSA-N 259.296 2.311 10 20 CECD CC1(C)CN(Cc2cc(Br)ccc2O)CCN1 396049889 DFAAGKCGEPNIDU-UHFFFAOYSA-N 299.212 2.339 10 20 CECD C[C@H]1C[C@@H](C)[C@@H](CN)CN1Cc1cc(F)ccc1O 397304686 GHDXMDMMJZUQEV-MDZLAQPJSA-N 266.360 2.337 10 20 CECD C[C@H](O)C1(NCc2ccc(Br)cc2O)CC1 827585633 NCYUMFFWBNFDQZ-QMMMGPOBSA-N 286.169 2.158 10 20 CECD COc1ccc(O)c(CNCc2nccn2C(C)C)c1 850137791 WSYGDPCQSVAFSJ-UHFFFAOYSA-N 275.352 2.468 10 20 CECD Cc1sc(NCc2ccccc2O)nc1C(=O)O 1610593324 CQEJTJIGKCHRST-UHFFFAOYSA-N 264.306 2.467 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2ccn(C)n2)c1 107054047 GANNERPRXWUCFR-SECBINFHSA-N 290.323 2.017 10 20 CECD N#Cc1c(F)cccc1C(=O)NCc1ccc(O)c(O)c1 186899120 MMCBSAYXRNDNOZ-UHFFFAOYSA-N 286.262 2.039 10 20 CECD COc1ccc(CN[C@H](C)CC[S@@](C)=O)cc1C 125440989 KJKXJVQYPUQIOI-XIKOKIGWSA-N 269.410 2.250 10 20 CECD CN1CCCc2cc(CNC(=O)CCc3c[nH]cn3)ccc21 189285531 VQPBYRKZXLXZFQ-UHFFFAOYSA-N 298.390 2.041 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)N[C@@H](C)C(N)=O)c1 183206793 FYYTWQGKAWGMKG-ZDUSSCGKSA-N 299.374 2.006 10 20 CECD CC[C@@]1(C(=O)O)CCCN(Cc2cccc(OC)c2O)C1 86784375 DSSKWFHPVGPVFF-MRXNPFEDSA-N 293.363 2.478 10 20 CECD C[C@H](O)CN[C@@H](C)c1cc(Br)cc(F)c1O 134899372 YUYZSWHBMHJHRX-BQBZGAKWSA-N 292.148 2.325 10 20 CECD CC1CCC(O)(CNCc2cc3c(cc2O)OCO3)CC1 87044294 DDSYZKJSOKWFOM-UHFFFAOYSA-N 293.363 2.152 10 20 CECD C[C@H](NC[C@@H](C)CN(C)C)c1ccc(F)cc1O 293387639 ISPHMYNNJISUTK-MNOVXSKESA-N 254.349 2.380 10 20 CECD Nc1ccc(CC(=O)N[C@H]2CCN(c3ccccc3)C2)cc1 237916243 YSUMNUGEWKUACF-INIZCTEOSA-N 295.386 2.206 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1cccc(OC)c1O 274850750 BFXARDMUJPGGKI-YPMHNXCESA-N 293.363 2.174 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@@]3(CCCOC3)C2)c1 366449958 FZAVJLWYZCDTCS-YOEHRIQHSA-N 291.391 2.471 10 20 CECD CO[C@H]1COC[C@@H]1NCc1cc(Cl)cc(Cl)c1O 289832935 OKWQKUHWGMQICB-QWRGUYRKSA-N 292.162 2.202 10 20 CECD COc1cccc(CN2C[C@H](CO)c3ccccc32)c1O 294064893 YCXAHBHADLHASU-CYBMUJFWSA-N 285.343 2.497 10 20 CECD CCC[C@]1(CO)CCN(Cc2c(O)cccc2OC)C1 809790148 AONCKRGXWHUQSM-INIZCTEOSA-N 279.380 2.385 10 20 CECD COCCn1cc(CNCc2cc(Cl)ccc2O)cn1 800287521 LFDPQMPCMLGKMI-UHFFFAOYSA-N 295.770 2.178 10 20 CECD O=C(NC[C@@H]1COc2ccccc21)c1cc(O)cs1 811562438 DVLGUPJLAJBWRQ-SECBINFHSA-N 275.329 2.360 10 20 CECD CCNCCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 817952022 MVESDTPSQWGSNJ-MWLCHTKSSA-N 252.333 2.279 10 20 CECD CC[C@@H]1C[C@H](C(=O)NCCc2ccc(N)cc2)CCO1 818545237 QXRUVCJPJQNYSC-UKRRQHHQSA-N 276.380 2.133 10 20 CECD C[C@@H]1C[C@@H](NC[C@H](N)c2ccc(N(C)C)cc2)c2nccn21 817942288 NPSXLTACOIAXJY-UHOFOFEASA-N 299.422 2.245 10 20 CECD Cc1nnsc1CN(C)c1ccc2c(c1)OCO2 821396643 SCRGAPFJNAPBAS-UHFFFAOYSA-N 263.322 2.212 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](N)CC(F)F)cc1 827340732 JLHYIYDULSERFN-CYBMUJFWSA-N 299.365 2.132 10 20 CECD O=C1CC[C@@H]2CN(Cc3cccc(Cl)c3O)CC[C@@H]2N1 827133053 QVWZBCKVDCVYCV-MFKMUULPSA-N 294.782 2.146 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)c1cn(C)nn1 902805534 AZLYVHYYFIHXNK-GFCCVEGCSA-N 273.384 2.040 10 20 CECD CC(C)O[C@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1 839148352 ZSYXCQCMZALMRV-BJHJDKERSA-N 280.324 2.346 10 20 CECD CC(C)CCOCCNC(=O)NCCc1ccc(N)cc1 841753027 XEIQYXMWMWHEPY-UHFFFAOYSA-N 293.411 2.173 10 20 CECD CN(C)CCN(C)CCCNCc1c(O)cccc1Cl 857783754 AJXZHWPAYWGTJB-UHFFFAOYSA-N 299.846 2.019 10 20 CECD CCOc1cccc(CN[C@@H]2CCCNCC2)c1O 841058656 UXHUFAKONRKDOE-CYBMUJFWSA-N 264.369 2.023 10 20 CECD C[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)C[C@@H]1C 841958963 IXLLTHDTAQQWNT-STQMWFEESA-N 275.396 2.499 10 20 CECD O=C(/C=C\[C@@H]1CCOC1)NCc1cc(Cl)ccc1O 846476167 JTMQMCHOCOHCHO-GAGJOLBNSA-N 281.739 2.255 10 20 CECD C[C@H](C[C@H]1CCC(=O)N1)NCCCSc1nccs1 925104275 WZPYHGMSTNYDIE-GHMZBOCLSA-N 299.465 2.272 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCCCCCN)c1 843343356 ZRUSKTCOEFZNSU-GFCCVEGCSA-N 294.395 2.349 10 20 CECD CC[C@H](OC(=O)c1cccc(O)c1O)C(=O)OC(C)(C)C 758571542 GQWZOTRQOHOCFK-NSHDSACASA-N 296.319 2.375 10 20 CECD Cc1ccc(O)c([C@H](C)NCC(=O)NC2CCCC2)c1 756703961 CXPFPMWPLYHTKI-LBPRGKRZSA-N 276.380 2.410 10 20 CECD COc1ncc(CNCc2cccc(OC)c2O)s1 877525581 IIULVODSBMRWSP-UHFFFAOYSA-N 280.349 2.156 10 20 CECD CC(C)[C@@H]1NC(=O)N([C@H](C)c2ccc(N(C)C)cc2)C1=O 761582049 ZCYYAUULYMBQNK-RISCZKNCSA-N 289.379 2.390 10 20 CECD CN1CCN(C(=O)/C=C/[C@H]2CCCNC2)c2ccccc21 876731216 GJHBCOZWOXHRJG-MYSGNRETSA-N 285.391 2.025 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1ccc(C)cc1O 877496206 OLROGPGJPWGBSM-LBPRGKRZSA-N 265.353 2.474 10 20 CECD CCN(CC)c1ccc(CNC(=N)N(C)CCOC)cc1 871603798 HWTDADULGBKRDV-UHFFFAOYSA-N 292.427 2.135 10 20 CECD CC(=O)c1cc(F)cc(CN2CCN(C)[C@H](C)[C@@H]2C)c1O 771467641 UPKGXCBAHSKFIT-MNOVXSKESA-N 294.370 2.258 10 20 CECD C[C@H]1CCc2[nH]nc(C(=O)NCCc3ccc(N)cc3)c2C1 884028278 BYJNNBMJRXAPKV-NSHDSACASA-N 298.390 2.089 10 20 CECD CCOc1ccc(CN[C@@H](C)[C@H]2CCOC2)c(O)c1 776220359 WJXPZFGRSFFJHO-AAEUAGOBSA-N 265.353 2.306 10 20 CECD CC[C@@H]1C(=O)NCCCN1Cc1cc(Cl)ccc1O 898541798 PIBUCFILIBMYDU-GFCCVEGCSA-N 282.771 2.146 10 20 CECD COc1cc(C)cc(CN[C@@H]2CN(C3CC3)C[C@H]2C)c1O 894344339 QJDGXGFBYXPVBP-IUODEOHRSA-N 290.407 2.282 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCC=C(Cl)C1 898196971 HICNNABBZCVZNG-UHFFFAOYSA-N 271.675 2.206 10 20 CECD CN(Cc1ccccc1O)C(=O)c1c(F)ccc(O)c1O 789990675 UGXAAUDFRUUTMH-UHFFFAOYSA-N 291.278 2.215 10 20 CECD COc1ccc(CNc2cnn(CCF)c2)c(O)c1OC 895590265 UFUISIKQIUNLKC-UHFFFAOYSA-N 295.314 2.188 10 20 CECD O=C(NCc1cccs1)c1c(F)ccc(O)c1O 789939359 LKVYANRZBYXNQM-UHFFFAOYSA-N 267.281 2.228 10 20 CECD COc1cc(C)cc(CN2CC[C@H](C)[C@@H](CO)C2)c1O 895375470 BRHUKEBJDQDNLB-GXTWGEPZSA-N 279.380 2.160 10 20 CECD CC[C@H](NC[C@@]1(OC)CCOC1)c1ccc(F)cc1O 796939477 CLOHVDJGKHUQDY-ZFWWWQNUSA-N 283.343 2.378 10 20 CECD Cc1ccc(C(=O)N2CCC(F)(F)CC2)c(O)c1O 794291738 YBSDGUGRELLONC-UHFFFAOYSA-N 271.263 2.278 10 20 CECD COc1ccc(CNC(=O)NC[C@H]2CC2(C)C)c(O)c1 792939302 YCYMASDPWQXLNS-LLVKDONJSA-N 278.352 2.246 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(C)cc1O 188468427 QZSUNYCROYJZSP-NWDGAFQWSA-N 264.369 2.218 10 20 CECD Oc1cccc(Br)c1CNCC1(O)CCC1 706871516 BWCXFFGFCMDVEZ-UHFFFAOYSA-N 286.169 2.159 10 20 CECD CCOc1ccc(N2CCN([C@H](C)COC)CC2)cc1 1255583541 OEZQJTHDZRXQQZ-CQSZACIVSA-N 278.396 2.242 10 20 CECD C[C@H](O)C1(NCc2ccc(N3CCCC3)cc2)CC1 1261691453 PHBAWVSGUGABGR-ZDUSSCGKSA-N 260.381 2.290 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H](C(=O)O)C1 1517400350 YVCYCDAZRHVZAU-BETUJISGSA-N 291.347 2.242 10 20 CECD O=C(c1cc(O)cs1)N1C[C@H]2CCCC[C@@]2(C(=O)O)C1 1602622705 JMMJKZPRJABGHL-YMTOWFKASA-N 295.360 2.171 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)CC(=O)O)c1O 1611033507 NWHPIHALLKQICT-SSDOTTSWSA-N 273.716 2.007 10 20 CECD CC1(C)OC[C@@H](CCN2CCCc3cc(CN)ccc32)O1 1576494864 GUNCBBSQOKQHAP-OAHLLOKOSA-N 290.407 2.440 10 20 CECD CC[C@@H](NCC1(C(=O)O)CCOCC1)c1ccccc1O 1589571421 ZGRGIAYEWHCSRR-CYBMUJFWSA-N 293.363 2.314 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCn2ccnc2)c1 20506221 RBELSKAVXFANMF-GFCCVEGCSA-N 275.352 2.338 10 20 CECD CC[C@@H](CCO)N[C@H](C)c1cc(OC)ccc1O 168794334 OWHDWTFQVZGVMS-MNOVXSKESA-N 253.342 2.212 10 20 CECD C[C@H](C(=O)Nc1ccc(N)cc1)N1CCCCCC1 22154970 BRXKFGOMAPZCNV-GFCCVEGCSA-N 261.369 2.472 10 20 CECD Cc1cc(CNCc2cc(Cl)ccc2O)nn1C 846054686 DOKSXRKCVMBXNC-UHFFFAOYSA-N 265.744 2.377 10 20 CECD CC(C)(C)OC(=O)N1CC[C@H](NCc2ccccc2O)C1 113343727 ZFRQKAUAGIWYJI-ZDUSSCGKSA-N 292.379 2.491 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)c2nncn2C)c1O 228673271 NJRSQKXXMQNAHR-MRVPVSSYSA-N 296.758 2.034 10 20 CECD CC(C)n1cc(NC(=O)c2cccc(O)c2O)cn1 126392623 ZUEBCLNHEKDTQR-UHFFFAOYSA-N 261.281 2.128 10 20 CECD C[C@@H](NCCC1(O)CCC1)c1cc(F)ccc1O 284382071 OMQFDTWSVYMMOM-SNVBAGLBSA-N 253.317 2.487 10 20 CECD COCCCN(CCOC)Cc1cc(F)ccc1O 179951973 TZSMLCXOFMMHND-UHFFFAOYSA-N 271.332 2.016 10 20 CECD COCC[C@H](CO)N[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 312155063 BSKMMVDEKBDZSC-JHJVBQTASA-N 279.380 2.236 10 20 CECD CC(C)N1CCN(Cc2cc(F)cc(F)c2O)CC1 708401435 SEGDDQPUHCEWJI-UHFFFAOYSA-N 270.323 2.196 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@H](CF)C2)cc1 711413516 GFPFAZWWBMZQFU-GFCCVEGCSA-N 250.317 2.019 10 20 CECD COc1ccc(O)c(CNC[C@@H](OC)C(C)C)c1 381921626 PBTJUGPZUXKRGF-CQSZACIVSA-N 253.342 2.161 10 20 CECD C[C@@H](NC(=O)[C@H](N)C1CCCCC1)c1ccccc1O 1119241597 HRVLHTYVUZUTFK-IAQYHMDHSA-N 276.380 2.477 10 20 CECD CN(CCn1cccn1)Cc1cc(Cl)ccc1O 125276584 YKZVHBOUDSHNJB-UHFFFAOYSA-N 265.744 2.374 10 20 CECD C[C@@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H](C)S1 70381538 QXDVVJIDNWOPHF-GHMZBOCLSA-N 264.394 2.164 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)CCO1 132013578 BHLFPSZYPBMUPX-GFCCVEGCSA-N 251.326 2.012 10 20 CECD CC[C@@H](NCc1ncn(C)n1)c1ccc(N(C)C)cc1 90969745 UQSCOTPBLRGUFD-CQSZACIVSA-N 273.384 2.122 10 20 CECD CN(CCCCCCO)c1ccc2c(c1)OCO2 270332815 LZYJFHWOAGAKGS-UHFFFAOYSA-N 251.326 2.404 10 20 CECD CC[S@@](=O)c1ccccc1C(=O)N1CCSCC1 298566848 HHZCHNNHBGOMIF-GOSISDBHSA-N 283.418 2.003 10 20 CECD C[C@@H](NCC1CCNCC1)c1ccc(N(C)C)cc1 817939330 CTHXWOBYAPSCLW-CYBMUJFWSA-N 261.413 2.403 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CCc3cccnc32)c1O 819873458 JFVXAUPUIXBJRR-CYBMUJFWSA-N 298.342 2.142 10 20 CECD C[C@@H](N)CN[C@H](C)c1cccc(C(F)(F)F)c1O 817973280 SJJDJLWSRVZRRS-HTQZYQBOSA-N 262.275 2.409 10 20 CECD CC1=NO[C@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 821841841 GLNCKNDTDZDSQH-HNNXBMFYSA-N 287.363 2.068 10 20 CECD Cc1ccn(CC(=O)NCc2c(O)ccc3c2CCCC3)n1 826137660 VQJJDTXCTDVGOU-UHFFFAOYSA-N 299.374 2.092 10 20 CECD Cc1cc(O)c(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1C 824839190 WBORPRPCVKZHBJ-YALNPMBYSA-N 271.360 2.394 10 20 CECD O=C(O)C1CCC(NCc2cc([N+](=O)[O-])ccc2O)CC1 821504416 WDVCCPWFVXCPEY-UHFFFAOYSA-N 294.307 2.033 10 20 CECD CCNC(=O)C(C)(C)NCc1cc(C)c(C)cc1O 835076693 UMMDDHZBFWXIKK-UHFFFAOYSA-N 264.369 2.013 10 20 CECD CC[C@@H]1C[C@H]1CNC(=O)NCc1cc(OC)ccc1O 838474832 SMMDPALACQSRHS-MNOVXSKESA-N 278.352 2.246 10 20 CECD Cc1cc(C)c2c(N)c(C(=O)O[C@H]3CCOC3)sc2n1 837383601 DKFSRWRPSNZKEA-VIFPVBQESA-N 292.360 2.441 10 20 CECD C[C@H](N[C@H]1C[C@H]2CCCCN2C1=O)c1ccccc1O 834914460 MYJZJDUSCFAFFX-SCRDCRAPSA-N 274.364 2.196 10 20 CECD C[C@@H]1C[C@@H](NC[C@@]2(C)CCC(=O)N2)c2c(O)ccc(F)c21 834909433 RLWKKRBDSSANQA-ZYSBLVPFSA-N 292.354 2.338 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C[C@@H](O)C(F)(F)F 840948231 FWRUPWGCMCSOCM-CYBMUJFWSA-N 290.329 2.416 10 20 CECD Cc1cccc(CN(C2CCNCC2)C2CC2)c1O 843044106 SXNZXZBSVDTNGA-UHFFFAOYSA-N 260.381 2.417 10 20 CECD CCCC1(CNC(=O)C(=O)Nc2ccc(N)cc2)CCC1 841069736 ZMQDODIFBSDPRB-UHFFFAOYSA-N 289.379 2.294 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@H](C)C[S@](C)=O 840940084 VEMLYRNYDOYCSN-YJYMSZOUSA-N 282.453 2.260 10 20 CECD Cc1cc(CN2CC(=O)N[C@H](C)C2)c(O)c(C(C)(C)C)c1 840132824 LDSNVLRVWIVFLF-GFCCVEGCSA-N 290.407 2.318 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@@H]2CCNC2)c1O 843351540 NYOHDZBFIJJKCU-GFCCVEGCSA-N 282.771 2.042 10 20 CECD CN(C)c1ccc(CN[C@H]2CCC[C@H](N)C2)cc1F 841056963 GHHHPHFILQXGPU-STQMWFEESA-N 265.376 2.251 10 20 CECD CC(C)Oc1ccc(N(C)C[C@@H]2CCC(=O)N2)cc1 844320309 JJUYBNNMGUZVCX-LBPRGKRZSA-N 262.353 2.189 10 20 CECD CCCCN(Cc1ccccc1O)c1nccn(C)c1=O 856750751 UAFYJDXNSXTYSV-UHFFFAOYSA-N 287.363 2.293 10 20 CECD CC(=O)N1CC[C@@H](N[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)C1 857084280 LNHZRPQLJXKUBG-IRUJWGPZSA-N 292.354 2.290 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)N(C)C 750609969 ZACFKQCOWVVIJU-AWEZNQCLSA-N 291.439 2.440 10 20 CECD Cc1cc(O)c(CN2CCC(S(C)(=O)=O)CC2)cc1C 760394892 DTPKAITWXMQDNU-UHFFFAOYSA-N 297.420 2.018 10 20 CECD Cc1ccc(CN[C@@H]2CCN3CCCC[C@H]23)c(O)c1 876933830 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COc1cc(C)cc(CNC[C@@](C)(O)c2ccco2)c1O 894315081 HJBNWFUYZFOAFA-MRXNPFEDSA-N 291.347 2.300 10 20 CECD COCC1(C)CN(Cc2cc(C)cc(OC)c2O)C1 894980450 PSJMTGXJNSIEOQ-UHFFFAOYSA-N 265.353 2.178 10 20 CECD COc1cccc(CNCc2ccc(CCO)cc2)c1O 898172477 KPCGRGNIGCQKTF-UHFFFAOYSA-N 287.359 2.225 10 20 CECD C[C@@H]1C[C@H](CO)CN(Cc2cc(F)cc(F)c2O)C1 895032770 ALAHIVSCZSCDDA-ZJUUUORDSA-N 271.307 2.121 10 20 CECD CCN(CC)[C@@H]1CCN(Cc2cccc(OC)c2O)C1 134063029 SAHLXEIDNRAYKB-CQSZACIVSA-N 278.396 2.317 10 20 CECD CC1(O)CCC(NCc2cc(F)cc(F)c2O)CC1 708389309 KCWUPDWZBOWCSE-UHFFFAOYSA-N 271.307 2.454 10 20 CECD CCN(C)c1ccc(CN(C)[C@H]2CCCCNC2=O)cc1 1256015758 JKUZLFZNVORWEA-INIZCTEOSA-N 289.423 2.243 10 20 CECD Nc1ccc(CN2CCC[C@@H](C(=O)NCC3CC3)C2)cc1 1334775100 RFSLTHMRSGYHGL-OAHLLOKOSA-N 287.407 2.007 10 20 CECD O=C(NCCCSc1nccs1)N1CC(F)(F)C1 1347406017 RFFKSYUVDITWCS-UHFFFAOYSA-N 293.364 2.286 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H]2CC[C@@H]1N2 1579617359 OCDIACDUDYEUJO-KBMXLJTQSA-N 259.397 2.044 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCN3CCC[C@@H]3C2)cc1 106868659 SMFTVGVRZVSDKK-NVXWUHKLSA-N 273.424 2.469 10 20 CECD C[C@@H](Sc1ncc(C(=O)O)s1)C(=O)C1CC1 1593679982 SCDIRDIDDFZFQW-RXMQYKEDSA-N 257.336 2.301 10 20 CECD CCc1cccc(CNC[C@H](O)[C@H](C)CC)c1O 848894407 FAPGMTFAARWJQB-RISCZKNCSA-N 251.370 2.451 10 20 CECD Cc1ccc(O)c([C@H](C)NCCO[C@@H]2CCOC2)c1 927079948 IJDXWGZXZLXUCJ-QWHCGFSZSA-N 265.353 2.157 10 20 CECD CCC[C@H](CCO)CNCc1cc(F)ccc1O 226612321 UKCCKZYSQLQKRX-LLVKDONJSA-N 255.333 2.420 10 20 CECD Cc1nc(CNCc2cc3c(cc2O)OCO3)cs1 42880401 SLKBHBUBWFVCBK-UHFFFAOYSA-N 278.333 2.176 10 20 CECD C[C@@H](Cn1cccn1)NCc1ccc(N(C)C)cc1 35259085 KKVRTXUUDVVEJH-ZDUSSCGKSA-N 258.369 2.127 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)N(C)CC)c1ccccc1O 188487540 JPRWAYBNVUQSBQ-WCQYABFASA-N 264.369 2.300 10 20 CECD NCc1ccc2c(c1)CCCN2CCCCCCO 700831559 RZRBIVGIBANXFT-UHFFFAOYSA-N 262.397 2.451 10 20 CECD CCO[C@H](C)C(=O)NCc1ccc(N(C)C)cc1C 115280996 IGHIYVMBABWPMA-GFCCVEGCSA-N 264.369 2.102 10 20 CECD CSCCN(C)Cc1ccc(N2CCOCC2)cc1 178063753 LJSSNRFPTHDROH-UHFFFAOYSA-N 280.437 2.318 10 20 CECD CCN(CC)C1CCN(C(=O)Cc2ccc(N)cc2)CC1 37827342 XFJMZKWBKTZKTQ-UHFFFAOYSA-N 289.423 2.144 10 20 CECD CC[C@@H](NC(=O)N(C)Cc1ccccc1O)[C@@H]1CCCO1 128716788 ZIHIEQOQVSJYPP-HIFRSBDPSA-N 292.379 2.491 10 20 CECD CCC[C@@H](C)C(=O)NCCc1ccc(O)c(O)c1 156651780 ZHRXHMCIWKBJJV-SNVBAGLBSA-N 251.326 2.193 10 20 CECD Cc1cnn(C)c1CNCc1ccc(N(C)C)cc1 285556059 VBENKIGVUWUOKN-UHFFFAOYSA-N 258.369 2.084 10 20 CECD COc1ccc(O)c([C@@H]2NC(=O)c3ccccc3N2)c1 49537147 OHKOEBHJJHGFJD-AWEZNQCLSA-N 270.288 2.255 10 20 CECD Oc1c(F)cccc1CN1CCO[C@@H]2CCC[C@H]21 228003585 PTEMWAWBWAPTRI-CHWSQXEVSA-N 251.301 2.285 10 20 CECD C[C@@H](NCC1(O)CCCC1)c1cc(F)ccc1O 94618381 BTBSCEKYGGFRIS-SNVBAGLBSA-N 253.317 2.487 10 20 CECD Nc1ccc(NC(=O)c2cccc3c2OCO3)cc1 140113082 SCLZNNAXVPRKIZ-UHFFFAOYSA-N 256.261 2.250 10 20 CECD CCS(=O)(=O)C[C@@H](C)N(C)Cc1cc(C)c(C)cc1O 93416972 WLGMLIQBMDQHHW-CYBMUJFWSA-N 299.436 2.264 10 20 CECD Cc1cc(Br)cc(CN2CCOCC2)c1O 162804155 XIBJCFVDYIAHQS-UHFFFAOYSA-N 286.169 2.295 10 20 CECD C[C@@H](CO)CCCNCc1ccc(N2CCOCC2)cc1 230160440 YNPUQUMMDCVLCU-OAHLLOKOSA-N 292.423 2.021 10 20 CECD Cc1ccc(C(=O)N2CCCC[C@H]2C[C@H](C)O)c(O)c1O 279860423 SHXMHXYEAIPWJF-RYUDHWBXSA-N 293.363 2.172 10 20 CECD CCOC[C@H](O)CN1CCCCc2cc(OC)ccc21 270877564 MTMSCILTJOSULD-CQSZACIVSA-N 279.380 2.235 10 20 CECD CCCOc1ccc(CN[C@@H](C)c2ncnn2C)c(O)c1 276770645 VUQFSFFLAQFWCE-NSHDSACASA-N 290.367 2.160 10 20 CECD COC[C@H](C)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273412852 QEOACELHXIYXJF-GHMZBOCLSA-N 281.352 2.112 10 20 CECD C[C@H](NCc1ccn(C)c1)c1cc([N+](=O)[O-])ccc1O 273557679 HFAPTJLNYDBUFA-JTQLQIEISA-N 275.308 2.490 10 20 CECD CN(C)c1ccc(CN2CCC[C@@](F)(CO)C2)cc1F 289799156 MQDJSLCZNQNXAX-HNNXBMFYSA-N 284.350 2.188 10 20 CECD C[C@@H]1C[C@@H](C)[C@H](C(=O)NCc2ccc(N(C)C)c(F)c2)O1 282194748 PJTYXSODFFCZFR-UEKVPHQBSA-N 294.370 2.321 10 20 CECD CC[C@H](NC[C@@]1(O)CCO[C@H]1C)c1ccc(F)cc1O 287713657 XTSRNIGMXUCITI-XEGUGMAKSA-N 283.343 2.112 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ncc(C)o2)c1 813811360 ZMYJNFKSNHGEQZ-VIFPVBQESA-N 276.292 2.188 10 20 CECD CCC(CC)(CNCc1cccc(OC)c1O)C(=O)O 818629970 KWTWQKKKVRQPLW-UHFFFAOYSA-N 281.352 2.381 10 20 CECD Cc1nccnc1CCNCc1cc(Cl)ccc1O 815155056 VRZJFEMMLHBOCN-UHFFFAOYSA-N 277.755 2.476 10 20 CECD CC[C@](C)(CNCc1cc(OC)c(OC)cc1O)OC 824743389 ARKOXEXKXIDWBO-OAHLLOKOSA-N 283.368 2.314 10 20 CECD O=C(CC1(O)CCC1)NCc1c(O)ccc2c1CCCC2 826137840 ZMYBIWSCOFQSGH-UHFFFAOYSA-N 289.375 2.192 10 20 CECD CN(C)c1ccc(CN[C@@](C)(CC(=O)O)C2CC2)cc1 901951603 ZDCOYKGEXJHMBS-INIZCTEOSA-N 276.380 2.486 10 20 CECD CON(C)C(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840482531 XZYIUEFBKJOTMJ-GFCCVEGCSA-N 279.384 2.195 10 20 CECD C[C@@H](Cc1nc(Cc2ccc(N)cc2)no1)n1ccnc1 844905757 FZCZHPDGYBQXAJ-NSHDSACASA-N 283.335 2.243 10 20 CECD Nc1ccc(CCNC(=O)N[C@H]2CCC[C@@H]3C[C@H]23)cc1 841916246 QSUWKWHVQHFMSK-SNPRPXQTSA-N 273.380 2.299 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cn1ccsc1=O 746605242 QPVXKSHQZTYQDB-UHFFFAOYSA-N 277.393 2.065 10 20 CECD CCc1cccc(CN2C[C@@H](CO)C[C@@H](C)C2)c1O 848917981 MALIZMBLTRYAHU-OLZOCXBDSA-N 263.381 2.405 10 20 CECD C[C@@H](CNCc1ccc(N2CCCCC2)cc1)C(=O)O 848638402 RQKOVQHAUIYCAL-ZDUSSCGKSA-N 276.380 2.487 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H]([C@H](C)O)C1 840936158 FPXAOTRLTVIQAR-ZFWWWQNUSA-N 262.397 2.264 10 20 CECD CN1C(=O)/C(=C/c2ccc([N+](=O)[O-])c(O)c2)SC1=S 748358313 UDHMCRDESHLXCO-UITAMQMPSA-N 296.329 2.131 10 20 CECD COc1cccc(O)c1CN1CCC([C@H]2CCNC2)CC1 843125930 CRRVYEZPXMOCQD-AWEZNQCLSA-N 290.407 2.222 10 20 CECD CC(C)[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CCN1 843104441 HWQXAEBCIOHJME-OAHLLOKOSA-N 279.403 2.322 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](O)C[C@@H]2COC)cc1 846053803 XPCJTLRHDMBOAL-IAGOWNOFSA-N 292.423 2.114 10 20 CECD COC[C@H]1CN(Cc2ccc(N(C)C)cc2C)C[C@@H](C)O1 840940093 UKABSFHGLYCHGL-RHSMWYFYSA-N 292.423 2.297 10 20 CECD CC1(C)CN(C(=O)Cc2ccc(N)cc2)[C@H]1[C@H]1CCCO1 852873510 XCEZCMIMFOAGNY-ZBFHGGJFSA-N 288.391 2.227 10 20 CECD C[C@@H](NCCOC[C@@H]1CCOC1)c1cc(F)ccc1O 756565204 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ZTTDIQYXIINYFM-UHFFFAOYSA-N 267.325 2.135 10 20 CECD Cc1cccc(O)c1CNCCOc1ncccc1F 877117427 ZGFFRLRYZQKPSU-UHFFFAOYSA-N 276.311 2.403 10 20 CECD Cc1ncsc1/C=C/C(=O)NCc1ccccc1O 777275258 OVADOYZKVZNATH-VOTSOKGWSA-N 274.345 2.487 10 20 CECD Nc1ccc(CNC(=O)NCCCc2ccco2)cc1 1120640081 RPZSVSMLYXGLGD-UHFFFAOYSA-N 273.336 2.294 10 20 CECD COc1ccc(CN[C@@H](C)C2(OC)CCC2)c(O)c1OC 894924085 YROALUVFQCJPPL-NSHDSACASA-N 295.379 2.457 10 20 CECD COCC(C)(C)CNCc1cc(C)cc(OC)c1O 894842117 PWMZTRFRELLFEV-UHFFFAOYSA-N 267.369 2.471 10 20 CECD COc1ccc(CNC(=O)CSC(C)C)c(O)c1 794389991 VSISUBUXKKKIQN-UHFFFAOYSA-N 269.366 2.159 10 20 CECD CCCC(=O)NCCC1=CCN(c2nccnc2F)CC1 1089806243 RAPCWZSXCAXRHH-UHFFFAOYSA-N 292.358 2.059 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc(N)ccn1 1346942237 DLANHMZCGXPVBL-UHFFFAOYSA-N 285.347 2.422 10 20 CECD C[C@@H]1CNC[C@H]1CC(=O)NCc1c(O)ccc2ccccc12 1579450932 OLJATLHDIMQWLG-TZMCWYRMSA-N 298.386 2.407 10 20 CECD C[C@@]1(N)CCCC[C@@H]1C(=O)N1Cc2cccc(O)c2C1 1576531514 SVBUVCWZMRWRDZ-CZUORRHYSA-N 274.364 2.142 10 20 CECD CCOC(=O)[C@@H]1C[C@H]1CSc1ncc(C(=O)O)s1 1596685467 PCVGDNDVEFOSAA-NKWVEPMBSA-N 287.362 2.133 10 20 CECD C[C@@H](NC(=O)c1cc(C(=O)O)co1)c1ccccc1O 1599840572 PJRFWEOCYUVEKC-MRVPVSSYSA-N 275.260 2.174 10 20 CECD CC[C@H](NCc1ccc2c(c1)CCCN2CC)C(=O)O 1776722122 ODDLFBWHVRCBNV-AWEZNQCLSA-N 276.380 2.412 10 20 CECD CC(C)C[C@H](NCc1cccc(F)c1O)C(=O)O 158743245 KJUAQBFUFAZDSW-NSHDSACASA-N 255.289 2.120 10 20 CECD COc1cccc(CNC(=O)[C@H]2CC2(Cl)Cl)c1O 155576464 KDDSEANSBTYFIA-MRVPVSSYSA-N 290.146 2.211 10 20 CECD C[C@@H]1CCN(CCNCc2ccc3c(c2)CCCO3)C1 921805689 HQNSRACDWAQVHX-CQSZACIVSA-N 274.408 2.443 10 20 CECD CCOc1cccc(CNC[C@H](O)CC(C)C)c1O 227442380 BSBRYADPIYTDQI-CYBMUJFWSA-N 267.369 2.288 10 20 CECD COc1cccc(CN[C@H]2C[C@H](OC)C2(C)C)c1O 227827930 HRSSEDQWSHKVHF-STQMWFEESA-N 265.353 2.304 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2cc(C)ccc2O)CC1 37138519 RXJZIGFOENZNCX-GFCCVEGCSA-N 276.380 2.362 10 20 CECD CCc1nc(CN[C@@H](C)c2ccc(N(C)C)cc2)n[nH]1 275026442 VIRILXUFRVCXGT-NSHDSACASA-N 273.384 2.284 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](C)[C@H](CO)C2)c1O 190870939 HEMLFJGNRXSYKD-SKDRFNHKSA-N 297.782 2.308 10 20 CECD CCc1cccc(CN[C@@H](C)CC[S@](C)=O)c1O 691499884 JQYOKBSQRSUODL-VOJFVSQTSA-N 269.410 2.201 10 20 CECD CN1CCN(c2ccc(CNCc3cccnc3)cc2)CC1 107797377 GEWDOYRNOYGXJH-UHFFFAOYSA-N 296.418 2.123 10 20 CECD C[C@@H](CC(=O)O)CC(=O)N(C)Cc1ccc(N(C)C)cc1 61836193 WEYYQMFSRCWNQX-GFCCVEGCSA-N 292.379 2.212 10 20 CECD CN(C)c1ccc(CNCC2(C)COC2)cc1F 113342863 ZLOFSHHTLWVLHJ-UHFFFAOYSA-N 252.333 2.018 10 20 CECD Cn1cc(Cl)cc1C(=O)NCCc1ccc(O)c(O)c1 122018989 UYPKZQOYRUUYSH-UHFFFAOYSA-N 294.738 2.062 10 20 CECD COCCN(C)CCCN[C@@H](C)c1cc(F)ccc1O 185009006 WWUSOPNHQVWSOJ-LBPRGKRZSA-N 284.375 2.150 10 20 CECD COCCCN(C)CCN[C@H](C)c1cc(C)ccc1O 185553709 NDSSJVKDYUQFFB-CQSZACIVSA-N 280.412 2.320 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)C(=O)C(C)(C)O 188092001 LIOCEASXLRXTKZ-UHFFFAOYSA-N 290.407 2.406 10 20 CECD Cc1ccc(C(=O)NCCCCOC(C)C)c(O)c1O 180936133 PXBYHOXRWLVIAF-UHFFFAOYSA-N 281.352 2.341 10 20 CECD COc1ccc(N2CCCN(Cc3ccon3)CC2)cc1 77268241 JWVZKUMIAZLAKS-UHFFFAOYSA-N 287.363 2.396 10 20 CECD Cc1cc(C(=O)N[C@@H]2CCC[C@H]2O)c(C)n1-c1ccccn1 132636139 QLKGQFHLVRNWEP-HUUCEWRRSA-N 299.374 2.132 10 20 CECD Nc1ccc(NC(=O)[C@@H]2C[C@H]3CCCC[C@@H]3N2)cc1 237998153 MCDUTFQNRRBCEI-SWHYSGLUSA-N 259.353 2.128 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2[C@H](C)O[C@@H](C)[C@@H]2C)c1 529835910 NALPEKWOJZGRHL-ASHKBJFXSA-N 277.364 2.376 10 20 CECD COc1ccc2c(c1)CCCCN2CCCS(C)(=O)=O 270887919 OMDIFVMSRAPLOD-UHFFFAOYSA-N 297.420 2.273 10 20 CECD C[C@H](CO)NCc1ccc(N(C)C)cc1C(F)(F)F 279935112 NIVZUYFSYIQLNB-SECBINFHSA-N 276.302 2.242 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)C(=O)NCCF)c(O)c1C 282773570 PAUWIEZEIWBBKN-NWDGAFQWSA-N 282.359 2.134 10 20 CECD COC[C@H](O)CN[C@@H](C)c1ccc(Cl)c(Cl)c1O 283348238 MGNVKELTJZUHIL-JGVFFNPUSA-N 294.178 2.357 10 20 CECD CSCC(C)(C)C(=O)NCc1ccccc1O 282624742 YEXFAOMIQPHCRJ-UHFFFAOYSA-N 253.367 2.398 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(Cl)c2O)CC(=O)N1 295076140 RNBCDAAUXMVAPN-ZETCQYMHSA-N 289.162 2.019 10 20 CECD CN(Cc1cc(Cl)c(F)cc1O)C[C@@H](O)C1CC1 816611457 QKXNVJVHQISOMG-CYBMUJFWSA-N 273.735 2.387 10 20 CECD C[C@@H](NCc1ccc(CC(N)=O)cc1)c1ccccc1O 810242920 VJIYZUGXXMXQRG-GFCCVEGCSA-N 284.359 2.271 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@@H]3CNC[C@@H]3C2)c1 817987592 UNMIOBBGBFSKIH-RFQIPJPRSA-N 290.407 2.440 10 20 CECD COc1cc(C)cc(CN2CCC(OC)CC2)c1O 813091976 WWZWOLVVQXRNRN-UHFFFAOYSA-N 265.353 2.320 10 20 CECD CO[C@](C)(C(=O)N[C@H](C)c1ccccc1O)C1CC1 827946533 LBMDRSLPSGCYHH-BMIGLBTASA-N 263.337 2.385 10 20 CECD C[C@H](NC(=O)[C@@H]1[C@H]2CCC(=O)[C@H]21)c1ccc(N(C)C)cc1 907492349 IXDWSWUOWZKZKV-NHJBHEPMSA-N 286.375 2.155 10 20 CECD C[C@H]1C[C@H](NCC2(N)CC2)c2c(O)ccc(F)c21 902406127 LTSKDBWQBAQYGC-WPRPVWTQSA-N 250.317 2.161 10 20 CECD COCC1CCC(NC(=O)c2cc(O)cs2)CC1 839854142 QHAHFUGHKOMRFD-UHFFFAOYSA-N 269.366 2.389 10 20 CECD O=C(/C=C\C1CCCC1)NCc1ccc(O)cc1O 910943454 CSTPVBFTJYOXDR-YVMONPNESA-N 261.321 2.460 10 20 CECD Cc1ccc(O)c(CN2CC(C(=O)OC(C)(C)C)C2)c1 839132890 GWWJXOISLRDPCP-UHFFFAOYSA-N 277.364 2.474 10 20 CECD Cc1noc(C)c1N(C)C(=O)Cc1ccc(N)cc1 843441028 SBQJBIDEZCCXBD-UHFFFAOYSA-N 259.309 2.079 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H]1CCCCN1 841034270 WTPAMLGMABDECI-OAHLLOKOSA-N 261.413 2.293 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1[C@H]2CCCC[C@H]21 910951830 VZKXZDLUKHCWMB-IMRBUKKESA-N 261.321 2.150 10 20 CECD C[C@@H]1OCC[C@@H]1C(=O)NCc1cc(Cl)ccc1O 846473537 MSTSQWKRZKPZLJ-KWQFWETISA-N 269.728 2.087 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C[C@H](C)O 840936509 KKXZDKFMQNWTMY-STQMWFEESA-N 250.386 2.310 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 840827023 ZHLNGEOQCZQKJO-GMTLJSCSSA-N 281.327 2.083 10 20 CECD CCS(=O)(=O)CCCN[C@H](C)c1ccc(F)cc1O 840889631 SSZPNDPLSPZVGX-SNVBAGLBSA-N 289.372 2.007 10 20 CECD CC1(C)CCCC[C@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841069060 MECUOZWFOADGHZ-CYBMUJFWSA-N 289.379 2.292 10 20 CECD C[C@H]1C[C@@H](Nc2cnn(CCO)c2)c2c(O)ccc(F)c21 756855874 ODZJTBUMTCXXSO-JOYOIKCWSA-N 291.326 2.381 10 20 CECD Cc1nc(COC(=O)c2cccc(O)c2O)cs1 758562278 SJVXASXERGPPQS-UHFFFAOYSA-N 265.290 2.220 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)C2CCOCC2)c1 858299786 AJINKZKPIIJZCP-LBPRGKRZSA-N 292.379 2.315 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(C)c(C)c1O 858587927 SIOSNKRTAGTQDF-NWDGAFQWSA-N 280.368 2.068 10 20 CECD Cc1ccc(CN[C@@H]2CCN3CCCC[C@@H]23)c(O)c1 876933828 AEFUQLUUDCYPBR-CABCVRRESA-N 260.381 2.417 10 20 CECD CSC1CCN(C(=O)c2ccc(C)c(O)c2O)CC1 869646268 OYBARSSRHQATIM-UHFFFAOYSA-N 281.377 2.374 10 20 CECD COc1cccc(O)c1CN1CCO[C@@H](COC(C)C)C1 770687295 DWQVZNRBJATYHD-CYBMUJFWSA-N 295.379 2.027 10 20 CECD CC(C)[C@@H](C(=O)N[C@H](C)c1ccccc1O)[C@@H](C)N 870987668 ABYMNZPBDCNQBV-JTNHKYCSSA-N 264.369 2.189 10 20 CECD Cc1cncc(NCc2ccc(N3CCN(C)CC3)cc2)n1 882880245 JEPBFQCBCVQSNZ-UHFFFAOYSA-N 297.406 2.149 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCC[C@H]2OC)c1 776256931 SVRJSFMMSRENEG-XHDPSFHLSA-N 265.353 2.306 10 20 CECD CCNC(=O)C1(CNCc2cc(F)cc(F)c2O)CCC1 883103526 WPURUBOMOCRTLH-UHFFFAOYSA-N 298.333 2.066 10 20 CECD C[C@H](N[C@H](C)c1ncn(C)n1)c1cc(F)cc(F)c1O 783300781 XNMXFZGGWDMTSG-JGVFFNPUSA-N 282.294 2.211 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCC23OCCO3)cc1F 883178738 CYRIWKHJAJQRCK-OAHLLOKOSA-N 294.370 2.277 10 20 CECD CN(Cc1cnc2cnccn12)c1ccc2c(c1)OCO2 780778452 KETOXHYOUFGZNX-UHFFFAOYSA-N 282.303 2.094 10 20 CECD Cc1ccc2nc(/C=C3\SC(=S)NC3=O)cn2c1 789127235 MALDKFBHQGDQDA-WTKPLQERSA-N 275.358 2.132 10 20 CECD CC(=O)OC1CCN(Cc2cc(F)cc(F)c2O)CC1 894031320 VIHLYRNMAQVBOW-UHFFFAOYSA-N 285.290 2.198 10 20 CECD Cc1cccc(CN(C)CCc2cnccn2)c1O 780894431 DYEFMDMNWXVZMB-UHFFFAOYSA-N 257.337 2.165 10 20 CECD Cn1nc(CNCc2cc(F)ccc2O)cc1C1CC1 897231356 DCMFUDFVWVKQBM-UHFFFAOYSA-N 275.327 2.432 10 20 CECD CCOc1cccc(CNCC[C@H](O)C2CC2)c1O 898206066 LGHUAWFQEJFYKX-ZDUSSCGKSA-N 265.353 2.042 10 20 CECD COc1cccc(CNCc2cncs2)c1O 168972796 YUJNATCPBVXVHD-UHFFFAOYSA-N 250.323 2.147 10 20 CECD CCN(CC)c1ccc(CNC[C@H](C)CO)cc1 88195051 QXQNUCZEYNLTPK-ZDUSSCGKSA-N 250.386 2.251 10 20 CECD CCOC(=O)C[C@@H]1CCCN1C(=O)Nc1ccc(N)cc1 1325333383 ZYQRPHYVXAWDEZ-ZDUSSCGKSA-N 291.351 2.218 10 20 CECD Cc1cnc(C(=O)NCc2ccccc2O)c(C)c1 780450562 IKCFETOOYKOGNU-UHFFFAOYSA-N 256.305 2.334 10 20 CECD C[C@H](O)C[C@@H]1CCCCN1C(=O)NCc1ccc(N)cc1 1262603512 KZPZQGXEOFPUSY-WFASDCNBSA-N 291.395 2.104 10 20 CECD COc1ccc2c(c1)CCCN2Cc1cc(C(=O)O)no1 1607296056 WXFRVKDOYCHYCT-UHFFFAOYSA-N 288.303 2.334 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(C(=O)O)CCC2)c1 1594106490 WTKQUBKIVQHXPN-JTQLQIEISA-N 279.336 2.306 10 20 CECD CCOc1ccc(N(C)CC(=O)Nc2cc(C)no2)cc1 150730124 IPTPVVASPRUPJM-UHFFFAOYSA-N 289.335 2.457 10 20 CECD O=S1CCC(NCc2cc(Cl)ccc2O)CC1 158010701 ASCZBSMHEBCKME-UHFFFAOYSA-N 273.785 2.046 10 20 CECD CN(C)c1ccc(CNc2ncccc2C(=O)O)cc1 13212472 RMTLNGOJRUHZNM-UHFFFAOYSA-N 271.320 2.458 10 20 CECD CCOC(=O)[C@H](C)N(Cc1ccc(N)cc1)C1CC1 49955154 LLXRMXCDZJGNSG-NSHDSACASA-N 262.353 2.185 10 20 CECD CC(C)N1CC[C@H](N[C@@H](C)c2ccc(F)cc2O)C1=O 186047851 XHZZLJZVJIJIFI-GWCFXTLKSA-N 280.343 2.191 10 20 CECD COc1ccc(N2CCN(Cc3cscn3)CC2)cc1 66863803 XHGHKCWNNWIKMT-UHFFFAOYSA-N 289.404 2.474 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)[C@@H](C)CO1 403831375 QAYXRFAVTWUHGE-WCQYABFASA-N 265.353 2.400 10 20 CECD COc1ccc(O)c(CNCc2cc(C)ns2)c1 404270768 IIADGKDGUDVWOX-UHFFFAOYSA-N 264.350 2.456 10 20 CECD CCOc1cccc(CNC[C@@](C)(O)C2CC2)c1O 311593702 AZKICXUHXRFVFU-OAHLLOKOSA-N 265.353 2.042 10 20 CECD CCC[C@@](C)(CO)NC(=O)NCc1ccc(N(C)C)cc1 304628187 NNJCPXUDJRXZLZ-INIZCTEOSA-N 293.411 2.103 10 20 CECD CCc1c[nH]c(SCC(=O)c2ccc(O)c(O)c2)n1 129090263 YOMCFPDEYMSCLL-UHFFFAOYSA-N 278.333 2.358 10 20 CECD COc1ccc(O)c([C@H](C)NCC(=O)NC2CCCC2)c1 182459962 IAYVVRQAIYLRRP-NSHDSACASA-N 292.379 2.110 10 20 CECD CCS[C@H](C(=O)NCc1ccc(O)c(O)c1)C(C)C 182523782 VWTZDYIFYZJHRC-ZDUSSCGKSA-N 283.393 2.492 10 20 CECD OCCCCN(Cc1cc(F)ccc1O)C1CC1 180149195 DVZXCCZZWUXWMW-UHFFFAOYSA-N 253.317 2.268 10 20 CECD C[C@H](NCCC(=O)N(C)C)c1cc(Cl)ccc1O 185264368 LIWITECPQGMSLC-VIFPVBQESA-N 270.760 2.175 10 20 CECD COc1cc(O)c(CN2CCOCC23CCC3)cc1OC 180321052 XJYBEIIQEYRXKL-UHFFFAOYSA-N 293.363 2.164 10 20 CECD C[C@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 72048162 WFBBQJLDWOSEJF-JTQLQIEISA-N 279.359 2.489 10 20 CECD CCCc1cc(N(C)Cc2ccccc2O)n2ncnc2n1 131405460 IDJXGXGYSJOJJI-UHFFFAOYSA-N 297.362 2.419 10 20 CECD CN(C)c1ccc(CNC(=O)/C=C\C2CCOCC2)cc1 98052737 HLBQMDMYICAZJO-YVMONPNESA-N 288.391 2.352 10 20 CECD CCOc1cccc(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)c1O 252853764 JIJQCWKKEAFYER-AEGPPILISA-N 290.407 2.350 10 20 CECD C[C@H](N[C@H]1C[C@@H](O)C1(C)C)c1cc([N+](=O)[O-])ccc1O 275335888 NVPXGEDFJHARPQ-AQUOVQTQSA-N 280.324 2.110 10 20 CECD COc1cc(O)c(CN(CCO)C2CCCC2)cc1OC 271772721 FPHOYYSLYZVXOS-UHFFFAOYSA-N 295.379 2.146 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@@]3(CCOC3)C2)c1O 280137706 CTLVFXDTCDKNQV-BBRMVZONSA-N 277.364 2.080 10 20 CECD O=C1CCC(COC(=O)c2cc(O)cs2)CC1 803346414 SZLRZSDNDYECSM-UHFFFAOYSA-N 254.307 2.370 10 20 CECD CC(C)c1nnc(N(C)Cc2ccccc2O)n1C 809875762 QISCNYUJBMFONC-UHFFFAOYSA-N 260.341 2.281 10 20 CECD C[C@H](N)CN[C@H](C)c1ccc(Br)cc1O 817974163 ZUIYUXLDBOVXGS-JGVFFNPUSA-N 273.174 2.153 10 20 CECD C[C@H]1C[C@@H](NCCc2ccc(N)cc2)CN1C1CC1 817955935 LTIUMFAXFLNWCA-SWLSCSKDSA-N 259.397 2.026 10 20 CECD CC(=O)c1ccc(NCCc2ccc(O)c(O)c2)nc1 811811647 ZKSPFXNCSGPMIP-UHFFFAOYSA-N 272.304 2.350 10 20 CECD Cc1cc(C)c([C@H](C)NCc2nnnn2C2CC2)c(O)c1 815595513 TVVHXOCZGKFOHL-NSHDSACASA-N 287.367 2.181 10 20 CECD COc1cccc(O)c1CNCc1ccc(C(=O)O)cc1 818622463 ISHOZRZBOCLWFP-UHFFFAOYSA-N 287.315 2.389 10 20 CECD CC(C)[C@@H](N)CN[C@H](C)c1cc(F)cc(F)c1O 817959892 WKGLEXBEOPAZRZ-PELKAZGASA-N 258.312 2.304 10 20 CECD C[C@H]1C[C@@H](C)[C@H](CN)CN1Cc1cccc(F)c1O 817866288 WWHDCIZOHXOKFR-NTZNESFSSA-N 266.360 2.337 10 20 CECD COC[C@H](O)CCNCc1ccc2ccccc2c1O 816559617 PJJNYUFMMLCOIL-CQSZACIVSA-N 275.348 2.032 10 20 CECD COc1ncc(/C=C\C(=O)N2CCc3ccccc32)cn1 492651902 SOQVPSGZWJQMRO-SREVYHEPSA-N 281.315 2.088 10 20 CECD C[C@@H](NC(=O)CC[C@]1(C)CCC(=O)N1)c1ccccc1O 827940349 BLMATAYYSQYRAG-BDJLRTHQSA-N 290.363 2.018 10 20 CECD O=C(O)C1(NCc2cc(F)cc(F)c2O)CCCC1 904007908 WAIRUDPUFAPULZ-UHFFFAOYSA-N 271.263 2.157 10 20 CECD CC[C@@H]1OCC[C@H]1NCc1cccc(OC)c1O 839192236 NMPAMNXCNCFKNO-NEPJUHHUSA-N 251.326 2.058 10 20 CECD C[C@H](N)C[C@@H](C)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 831150169 HDADPTWZZRHCNC-XQQFMLRXSA-N 292.427 2.239 10 20 CECD Cc1cc(NC(=O)N(C)Cc2ccccc2O)nn1C 748660463 KLCNFPVMDBPQRL-UHFFFAOYSA-N 274.324 2.098 10 20 CECD C[C@@H](N)C[C@@H](C)NCc1cc(Cl)cc([N+](=O)[O-])c1O 843130008 WODOWBATUACDEZ-HTQZYQBOSA-N 287.747 2.169 10 20 CECD CC(C)(C(=O)O)C(=O)NCc1ccc(N2CCCC2)cc1 844252083 LSYNOYRILPCYAG-UHFFFAOYSA-N 290.363 2.014 10 20 CECD Cc1cc(/C=C2\SC(N3CCCCC3)=NC2=O)nn1C 840713325 MUJOXHQRVAUPMS-XFXZXTDPSA-N 290.392 2.185 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1cccc(C)c1O 840957010 GVGWAAYTHKSYNY-CYBMUJFWSA-N 263.337 2.132 10 20 CECD CNC[C@H]1CCN(Cc2c(O)ccc(Cl)c2F)C1 843052184 JXWBMIAVSQZJNQ-SECBINFHSA-N 272.751 2.226 10 20 CECD C[C@@H]1NCCN(Cc2ccc(N(C)C)c(F)c2)[C@H]1C 843056963 DHSDGMYJKUTSHS-RYUDHWBXSA-N 265.376 2.074 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CO1 842773552 APGMVHADYVVJAF-GMSGAONNSA-N 286.715 2.221 10 20 CECD COc1cccc([C@@H](C)NC2CCN(C)CC2)c1O 846138602 WQVWFYWPNOIDFP-LLVKDONJSA-N 264.369 2.146 10 20 CECD C[C@@H](OC(=O)c1cccc(O)c1O)c1ccncc1 758555981 AWCVLQDZHWRKNQ-SECBINFHSA-N 259.261 2.411 10 20 CECD CCO[C@H](C(=O)N[C@H](C)c1cc(OC)ccc1O)C1CC1 860241562 KTMIPWBWUVXIER-BMIGLBTASA-N 293.363 2.393 10 20 CECD C[C@H]1C[C@@H](C)CN1Cc1cc2c(cc1O)OC[C@@H]2O 768449525 ZYNGKLINLGQFKY-BFVZDQMLSA-N 263.337 2.048 10 20 CECD C[C@@H]1C[C@H](NCc2cc(F)cc(F)c2O)CN1C1CC1 883034214 ODQGWYBMIXXTFQ-SKDRFNHKSA-N 282.334 2.385 10 20 CECD CC[C@@H](NCCN1CCNC1=O)c1cccc(Cl)c1O 886745158 PFPFESCROPYUCV-GFCCVEGCSA-N 297.786 2.112 10 20 CECD C[C@H](NC(=O)N(C)CCN(C)C)c1ccc(N(C)C)cc1 776245955 IPNRRSBUYFAFQQ-ZDUSSCGKSA-N 292.427 2.017 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@H](C(=O)Nc2ccc(N)cc2)C1 884009452 WTDVCQFRWYQMII-TVQRCGJNSA-N 270.336 2.297 10 20 CECD CO[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1C 1120605283 RKRYEKFFZTZZEW-JKSUJKDBSA-N 290.407 2.492 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)N1CCCCCC1 883089989 ZHNXANBRCCBVRQ-UHFFFAOYSA-N 278.352 2.226 10 20 CECD COCC1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 895970682 HZWGYMVCEJZSEQ-UHFFFAOYSA-N 286.715 2.032 10 20 CECD OCC[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894004260 LJUIZKPGLUNWRB-SNVBAGLBSA-N 271.307 2.265 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(C)cc(C)c2O)[C@@H]1C 787247288 SOBTUBHZQVQKGT-OCCSQVGLSA-N 277.364 2.392 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cccc(C)c2O)C1 896961260 WHZRYITUCYIPRJ-CYBMUJFWSA-N 263.337 2.086 10 20 CECD COCc1nc(C)cc(NCc2ccc(OC)cc2O)n1 795292058 KEVIEODCLUDYDX-UHFFFAOYSA-N 289.335 2.258 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1ccc(N2CCCC2)cc1 1209856477 FLZBZFVOHLLLHI-GASCZTMLSA-N 273.424 2.469 10 20 CECD O=C1CCCN1[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 792186044 NTZVHJVEOOOOSR-CYBMUJFWSA-N 294.782 2.242 10 20 CECD C[C@@H](NCCC1CC(O)C1)c1ccc(F)cc1O 702450172 KRNRIBHWKOOZQP-GRZMOONWSA-N 253.317 2.343 10 20 CECD CCc1cc(NCc2cc(C)ccc2O)n2ncnc2n1 1329192070 CHMFQQQNMVDLRZ-UHFFFAOYSA-N 283.335 2.313 10 20 CECD C[C@H](NC(=O)NCc1cnccn1)c1ccc(N(C)C)cc1 1343420164 HQBXKKAAGFVXKE-LBPRGKRZSA-N 299.378 2.103 10 20 CECD C[C@@H](NC[C@]1(C)CCOC1)c1cc(C(=O)O)ccc1O 1609776533 HFWHEMJOBGFCHM-BMIGLBTASA-N 279.336 2.168 10 20 CECD C[C@@H]1NC[C@@H](C)N(Cc2ccc(F)c(F)c2O)[C@@H]1C 1576881857 NQONKBYINPGMSS-KXUCPTDWSA-N 270.323 2.241 10 20 CECD CCCN(Cc1cc(C(=O)O)no1)c1ccc(CN)cc1 1595885773 FREKFXHYHVXCJL-UHFFFAOYSA-N 289.335 2.248 10 20 CECD C[C@H](N[C@H]1CC[C@H](CN)CC1)c1cc(C(=O)O)ccc1O 1593360067 OEMUESVSRYGJNS-GVXVVHGQSA-N 292.379 2.259 10 20 CECD C[C@@H](NCCc1ccncc1)c1cc(C(=O)O)ccc1O 1593274519 MZAZOTSDMVZIRU-LLVKDONJSA-N 286.331 2.379 10 20 CECD CN(C)c1ccc(CN2C[C@H]3C[C@@H](C(=O)O)C[C@H]3C2)cc1 1777039695 OYOPZPXXUKQJHA-QKDCVEJESA-N 288.391 2.295 10 20 CECD C[C@@H](NC(=O)CC[C@H]1CCOC1)c1ccccc1O 827937393 VFBYWEXBZXICTM-NEPJUHHUSA-N 263.337 2.386 10 20 CECD COCC1(CNCc2cc(OC)ccc2O)CCC1 282622888 YBVOXDJNEAPMSH-UHFFFAOYSA-N 265.353 2.307 10 20 CECD C[C@@H]1CSC[C@H]1NCc1ccc(N2CCOCC2)cc1 285470134 KMOWRLJADIOCAK-CZUORRHYSA-N 292.448 2.364 10 20 CECD Cc1ccc(O)cc1C(=O)NCc1ccccc1O 311946916 KPIGRDPUDVILQF-UHFFFAOYSA-N 257.289 2.336 10 20 CECD COCC[C@H](CO)N[C@H]1C[C@H](C)c2c(C)ccc(O)c21 312155066 BSKMMVDEKBDZSC-XQQFMLRXSA-N 279.380 2.236 10 20 CECD COC[C@@]1(C(=O)O)CCCN1Cc1cc(Cl)ccc1O 692407120 FHYOKKRZHWWTAM-CQSZACIVSA-N 299.754 2.111 10 20 CECD CC[C@@H](CO)NC(=O)NCc1ccc(N(CC)CC)cc1 57424660 JIAGWJJIXUOXFA-AWEZNQCLSA-N 293.411 2.103 10 20 CECD C[C@@H](N[C@H](C)c1nnnn1C1CC1)c1ccccc1O 189132097 OGOPAELGNBJECA-NXEZZACHSA-N 273.340 2.125 10 20 CECD CN(C)C(=O)c1cc(NCc2ccc(N(C)C)cc2)ccn1 73171930 IMNPSQVBZOFGTL-UHFFFAOYSA-N 298.390 2.462 10 20 CECD O=C(C[C@@H]1CCCO1)NCc1c(O)ccc2c1CCCC2 75160053 YLMBLJHXRCMOTF-ZDUSSCGKSA-N 289.375 2.456 10 20 CECD COC[C@H]1CN(Cc2cccc(Cl)c2O)C[C@@H](C)O1 188360531 OMNPVGSSDCLINV-ZYHUDNBSSA-N 285.771 2.281 10 20 CECD CCN(Cc1cc(C)ccc1O)[C@H](C)CS(=O)(=O)CC 93414191 CLBYCIGOGVABEM-CYBMUJFWSA-N 299.436 2.346 10 20 CECD CC(C)[C@@H]1C(=O)NCCN1Cc1cc(Cl)ccc1O 93054932 BZBAJBQIPMGKGL-CYBMUJFWSA-N 282.771 2.002 10 20 CECD COc1cccc(CN2CCC[C@H]2C[C@H](C)O)c1O 93482921 NTZMHZATWDNPCR-AAEUAGOBSA-N 265.353 2.136 10 20 CECD COC[C@H](N[C@@H](C)c1ccccc1O)[C@H]1CCCO1 278659752 FHZYLGQBHUXCRL-CORIIIEPSA-N 265.353 2.237 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](CC(N)=O)C2)cc1 367707989 PWYOTBLLCGYBAK-OAHLLOKOSA-N 289.423 2.230 10 20 CECD COC(C)(C)CC(=O)N1CCOc2cc(N(C)C)ccc21 279017159 OELVNKQSGLHQFZ-UHFFFAOYSA-N 292.379 2.293 10 20 CECD CCC(O)(CC)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273594072 PZJXCVQCRKRHJG-NSHDSACASA-N 295.379 2.381 10 20 CECD CCN(CC(F)F)C(=O)c1ccc(C)c(O)c1O 273304095 CINQZEOFJFGNNS-UHFFFAOYSA-N 259.252 2.133 10 20 CECD Cc1cccc(CN2CC[S@](=O)[C@H](C)[C@H]2C)c1O 271867440 RLWTXIMDOHMRCH-FMTVUPSXSA-N 267.394 2.042 10 20 CECD CC[C@@H](NCC1(C(N)=O)CCCC1)c1ccccc1O 274953373 VNHPMWKTBYBQPC-CYBMUJFWSA-N 276.380 2.479 10 20 CECD CC1=CCN(C(=O)c2c(F)ccc(O)c2O)CC1 296208910 CQLWBVHTYCAQKS-UHFFFAOYSA-N 251.257 2.029 10 20 CECD O=C(c1cccc(O)c1O)N1CCC=C(c2ccncc2)C1 804747235 KETGRIKOQDOZIW-UHFFFAOYSA-N 296.326 2.422 10 20 CECD COCC1(CN[C@H](C)c2cc(C)ccc2O)CCNCC1 817974444 LYOSKEXBUPEAPE-CQSZACIVSA-N 292.423 2.367 10 20 CECD C[C@H](N)CCN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 817953920 WIYPSMJBWYWPSZ-QWHCGFSZSA-N 295.402 2.050 10 20 CECD CC1=NO[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 821841845 GLNCKNDTDZDSQH-OAHLLOKOSA-N 287.363 2.068 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCCc2ccoc2)c1O 827230579 ULDWDYQLBBHNSI-UHFFFAOYSA-N 292.291 2.234 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(N(C)C)cc1 824703189 XUXCIMFTQQNLNM-CABCVRRESA-N 276.380 2.184 10 20 CECD COc1ccc(CNc2ccc(-c3nn[nH]n3)cc2)c(O)c1 826204068 VVMZMSYLDLITCP-UHFFFAOYSA-N 297.318 2.193 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2cc(Cl)ccc2O)C1 827812636 SNVCFMRSVIBVFS-JLIMDTESSA-N 269.728 2.087 10 20 CECD C[C@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)N(C)C 822949397 JLHNGCJCYZIKQE-SSDOTTSWSA-N 291.178 2.265 10 20 CECD CC[C@H](NCc1c(O)ccc(Cl)c1F)[C@H](C)O 824921450 LYIQJHCCTGADPP-XVKPBYJWSA-N 261.724 2.434 10 20 CECD O=C(OCc1nnc(C2CC2)o1)c1cc(O)cs1 732353406 HCTOSXXRGZYMOV-UHFFFAOYSA-N 266.278 2.071 10 20 CECD CC[C@@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(F)cc1O 834910777 ZISBENQQKWHHET-IUODEOHRSA-N 280.343 2.241 10 20 CECD CC[C@@H](NC[C@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 834909604 SOCJZVYJMCQTJT-WBVHZDCISA-N 289.423 2.462 10 20 CECD CC(C)[C@H]1CCCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841095326 DRZYZIHXAULIHS-LBPRGKRZSA-N 289.379 2.102 10 20 CECD Nc1ccc(CCNC(=O)NC[C@H]2CCCCS2)cc1 841876644 WAKVPDYGXGRXMI-CQSZACIVSA-N 293.436 2.396 10 20 CECD Cc1ncc(CNC(=O)NCCc2ccc(N)cc2)s1 841736881 ZEPXVPAZUMYCDA-UHFFFAOYSA-N 290.392 2.076 10 20 CECD C[C@H](N[C@H](C)C[S@](C)=O)c1ccc(Cl)cc1O 841753912 OJGAGXNEKLHNTM-NMIRZEMHSA-N 275.801 2.463 10 20 CECD CN(C)c1ccc(CNCCCNC2CC2)cc1F 841093068 QFPNMHWAIMVKRG-UHFFFAOYSA-N 265.376 2.123 10 20 CECD CC[C@@H](C)CONC(=O)NCCc1ccc(N)cc1 841906288 FADPQHSHUUAGCV-LLVKDONJSA-N 265.357 2.088 10 20 CECD Cc1ccc([C@H](C)NCC[C@@]2(O)CCCOC2)c(O)c1 846212876 NIASVGDXEBVLKQ-BBRMVZONSA-N 279.380 2.283 10 20 CECD CN(Cc1ccnc(N(C)C)c1)Cc1ccccc1O 754066048 KPFAUMIDAWTRGV-UHFFFAOYSA-N 271.364 2.485 10 20 CECD CN(C)c1ccc(CN2CCc3nc[nH]c3C2)cc1 859305185 CHBRVFDFBCFNOG-UHFFFAOYSA-N 256.353 2.034 10 20 CECD Cc1cc(CCC(=O)N(C)Cc2ccccc2O)no1 934704669 DTJUFERDOMUFGU-UHFFFAOYSA-N 274.320 2.280 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCSC1 935948836 QZZYIRXZBVADOY-SNVBAGLBSA-N 286.393 2.247 10 20 CECD Cc1ccc(O)c(CNC(=O)c2nn(C)c(C)c2Cl)c1 862755380 RSELICLONXQQLZ-UHFFFAOYSA-N 293.754 2.326 10 20 CECD O=C(NCC1(CCO)CCCC1)c1cc(O)cs1 761595139 JOQREZKCVDJCRG-UHFFFAOYSA-N 269.366 2.126 10 20 CECD CCCN(Cc1cc2c(cc1O)OC[C@H]2O)C1CC1 768451036 LLRITDQHUCUULT-CQSZACIVSA-N 263.337 2.192 10 20 CECD C[C@H]1C[C@@H](O)CN1Cc1c(O)cccc1Br 862339379 RMUWHPROXCMYSU-DTWKUNHWSA-N 286.169 2.110 10 20 CECD Cc1cccc(O)c1CNCCCOC[C@@H]1CCCO1 876900244 WPXBRDJFUPMVJR-AWEZNQCLSA-N 279.380 2.376 10 20 CECD Cc1nccc(NC(=O)NCc2ccc(N(C)C)cc2C)n1 776493969 PPCWQSCHNHBVIN-UHFFFAOYSA-N 299.378 2.481 10 20 CECD COc1ccc(N2CCCN(CCC[C@@H](C)O)CC2)cc1 789310287 PZOYMKXWRLLWEN-OAHLLOKOSA-N 292.423 2.368 10 20 CECD COc1cc(C)cc(CN(C)[C@@H]2CCN(C)C[C@H]2C)c1O 894783025 PGQHMPMGMBHOGV-UKRRQHHQSA-N 292.423 2.481 10 20 CECD C[C@@H]1SCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 783612312 YRKPGXFXURLODD-KWQFWETISA-N 268.338 2.284 10 20 CECD COC(=O)N1CCCN(Cc2c(O)cccc2Cl)CC1 1140338132 WENHMPFJAABLQO-UHFFFAOYSA-N 298.770 2.320 10 20 CECD COc1ccc(CNC(=O)NOC2CCCC2)c(O)c1 793039060 WLUGYLHGKVODJF-UHFFFAOYSA-N 280.324 2.074 10 20 CECD CC[C@@H](C)NC(=S)NCc1ccc(OC)cc1O 795031539 KEKBIVRWJXVYNC-SECBINFHSA-N 268.382 2.163 10 20 CECD Nc1ccc(CC(=O)Nc2cccc(C(=O)O)c2)cc1 40470027 CFLYTPYEEZWFSB-UHFFFAOYSA-N 270.288 2.148 10 20 CECD COc1cccc(CNC(=O)c2nc(C)cs2)c1O 1331107484 VDJOSFDGSFNLEX-UHFFFAOYSA-N 278.333 2.096 10 20 CECD Cc1csc(CCC(=O)NCc2ccc(N)cc2)n1 1342699971 PDFSWIIWVQOZDZ-UHFFFAOYSA-N 275.377 2.283 10 20 CECD CCCCN(Cc1ccccc1O)[C@@H](C)C(=O)O 1609970223 FPBMANLCLTUQIX-NSHDSACASA-N 251.326 2.467 10 20 CECD O=C(O)[C@@H](NCc1cc(F)ccc1O)c1cccc(O)c1 1610720790 SZFMZDPEQGVGPR-AWEZNQCLSA-N 291.278 2.152 10 20 CECD CCc1cc(C)c(C(=O)NCc2cccc(O)c2O)o1 1548791633 RURBKZHUEWUQPX-UHFFFAOYSA-N 275.304 2.492 10 20 CECD O=C(O)c1cnc(SC[C@H]2CCCOC2)s1 1602536667 DGJRQTWJFZDJJM-ZETCQYMHSA-N 259.352 2.360 10 20 CECD C[C@H](NC[C@@H]1CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589978770 PVDNPNMSYNJELE-UWVGGRQHSA-N 287.367 2.269 10 20 CECD Cc1n[nH]cc1CN(C)Cc1ccc(N(C)C)cc1 155199357 RCLPSAHMKKNFRB-UHFFFAOYSA-N 258.369 2.416 10 20 CECD COc1cccc(O)c1CN[C@H](C)CN1CCCCC1 850028703 QSLUDCXOCYYEMJ-CYBMUJFWSA-N 278.396 2.365 10 20 CECD Oc1cccc2c1[C@H](NCCOC[C@@H]1CCCO1)CC2 834588334 AXOJEIMKPIMJRZ-UONOGXRCSA-N 277.364 2.165 10 20 CECD c1cc(N2CCCC2)ccc1CNC[C@H]1CCOC1 37738785 YSBSEQJAGUFYMC-OAHLLOKOSA-N 260.381 2.413 10 20 CECD CN(C)C(=O)CCCNCc1c(O)cccc1Cl 264934588 CILMPFWBFSIMGZ-UHFFFAOYSA-N 270.760 2.004 10 20 CECD CCn1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)cn1 74536323 NXZJKIRQMOYANE-UHFFFAOYSA-N 290.342 2.038 10 20 CECD Oc1cc2c(cc1CNCc1cccs1)OCO2 42879497 ICYJOALRZLPTNT-UHFFFAOYSA-N 263.318 2.472 10 20 CECD COCCN1CC[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)C1 268966081 YMWHPEMLZUMHCZ-GDBMZVCRSA-N 291.439 2.124 10 20 CECD COc1cc(O)c(CN2CCO[C@@H]3CCC[C@@H]32)cc1OC 362378577 AEHQPRMYWHVPKE-GXTWGEPZSA-N 293.363 2.163 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCc2nccs2)c1O 278953998 ZWMBLYVCBSRZDH-UHFFFAOYSA-N 295.320 2.055 10 20 CECD COc1ccc(O)c(CNC[C@@](C)(O)c2ccccc2)c1 271814192 LKOKLIMJHOSOHQ-QGZVFWFLSA-N 287.359 2.398 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1cc(Cl)cc(OC)c1O 280451164 DLXOJMJEKVSYML-MRVPVSSYSA-N 287.743 2.048 10 20 CECD CSC(C)(C)CNC(=O)c1c(F)ccc(O)c1O 295427460 WJYQRWUKOVBBNE-UHFFFAOYSA-N 273.329 2.108 10 20 CECD NC(=O)[C@H]1CC[C@H](CN[C@@H]2CCc3cccc(O)c32)CC1 817587601 ZJPLBJSABZNGNR-MRVWCRGKSA-N 288.391 2.261 10 20 CECD Cc1nn(C)c(C)c1NC(=O)c1cc(O)cs1 819979616 ZKYYLRIGQDIGSO-UHFFFAOYSA-N 251.311 2.056 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)CC[C@@H]1O 816574986 YQQODRUZYAVXDW-PELKAZGASA-N 273.735 2.387 10 20 CECD C[C@H](NCC(C)(C)N)c1ccc(N2CCOCC2)c(F)c1 817961030 WJZDJZFJOLZDNE-LBPRGKRZSA-N 295.402 2.050 10 20 CECD COCCC[C@@H](C)NC[C@H](N)c1ccc(N(C)C)cc1 817943502 URNJIFYSOSYXLT-CJNGLKHVSA-N 279.428 2.157 10 20 CECD Cc1ncc(CN(C)c2ccc3c(c2)OCO3)n1C 825468520 MTOINLYOQLIFTL-UHFFFAOYSA-N 259.309 2.094 10 20 CECD Cc1ccc(C(=O)OCc2noc(C3CC3)n2)c(O)c1O 727004924 ZNKIOLFWFALGAD-UHFFFAOYSA-N 290.275 2.024 10 20 CECD CC(C)(C)OC(=O)N1CC[C@@H]1CNCc1ccccc1O 724920034 CRJYMUZZLIVBFE-CYBMUJFWSA-N 292.379 2.491 10 20 CECD CCOc1ccc(N(C)CCn2ccccc2=O)cc1 739922564 MKLBOBKYEPFUCX-UHFFFAOYSA-N 272.348 2.383 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@]2(C)CCCCO2)cc1F 837377132 IAFOLGZSJPHLKD-MRXNPFEDSA-N 294.370 2.467 10 20 CECD Cn1cncc1/C=C1\C(=O)N2CCCc3cccc1c32 901521922 JZAJFYWGZMWTCI-ZSOIEALJSA-N 265.316 2.254 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1[C@H]1CCC[C@H]1O 833767140 BOPPMYLNQYFIDF-IJLUTSLNSA-N 281.377 2.219 10 20 CECD CCN(C)c1ccc(CN[C@@H](CO)[C@@H]2CCCOC2)cc1 839651779 RDNNLYYSBAYTLI-WBVHZDCISA-N 292.423 2.020 10 20 CECD CCOc1cccc(NC(=S)NNc2ncccn2)c1 742982264 UIAZNLPWHLDANA-UHFFFAOYSA-N 289.364 2.189 10 20 CECD CC[C@@H](NC(=O)NCCc1ccc(N)cc1)[C@H]1CCCO1 841865398 RJGCSWZIJQNDSY-HUUCEWRRSA-N 291.395 2.068 10 20 CECD CC(=O)[C@H](C)CCOC(=O)/C=C/c1ccc(O)c(O)c1 849745287 OIAWSKFYXZIEOQ-DFVUYQKZSA-N 278.304 2.269 10 20 CECD C/C=C/C[C@H](CO)NCc1ccc(N(C)C)cc1C 840938392 OLWJNTYEKJLTDT-LLYBFZRZSA-N 262.397 2.478 10 20 CECD Cc1ccc([C@H](C)NCc2nnn(C(C)(C)C)n2)c(O)c1 848560669 JDLHFVGSJYZEDV-NSHDSACASA-N 289.383 2.293 10 20 CECD CNCCCNCc1ccc(N2CCCCC2)cc1 841043613 XXFZZCPMKMQKQF-UHFFFAOYSA-N 261.413 2.376 10 20 CECD C[C@@H](NC(=O)C(F)(F)C(F)F)c1ccccc1O 827937017 IJCZRCUICWSIPT-ZCFIWIBFSA-N 265.206 2.470 10 20 CECD CCc1cccc(CNCCCO[C@@H]2CCOC2)c1O 848897152 FLUUGKQBHAHQKA-OAHLLOKOSA-N 279.380 2.240 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@H]3C[C@H]3C2)cc1 853245254 WLAIMEVRBPNYCC-KBPBESRZSA-N 273.380 2.304 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H]3NC(=O)CC[C@@H]3C2)c1 853554672 BZTJFXHPTFKPNY-HIFRSBDPSA-N 288.391 2.110 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC[C@H]1CCCCO1 759595955 SIRHXMHOXYZAPR-SMYYYNMVSA-N 278.304 2.223 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)C(C)(C)O)cc1 756798450 XLQFBZMBSWRXDZ-UHFFFAOYSA-N 278.396 2.262 10 20 CECD CCOc1ccc(CN2CC[C@@H](C)[C@@H](CO)C2)c(O)c1 857060668 DIFABNXPOYCYPV-TZMCWYRMSA-N 279.380 2.241 10 20 CECD COc1cc(C)cc(CN2CCCOC[C@H]2C)c1O 754742081 WYXBFUSLFLMFMO-GFCCVEGCSA-N 265.353 2.320 10 20 CECD CCOc1ccc(CN2CCOC[C@H]2CC)c(O)c1 768878790 SCVCATLTUNZJLR-CYBMUJFWSA-N 265.353 2.402 10 20 CECD C[C@H](NCC(=O)NCc1ccccc1)c1ccccc1O 37908602 SNXKNLQCCLBPKQ-ZDUSSCGKSA-N 284.359 2.359 10 20 CECD CN[C@@H](C)CCNCc1ccc(N2CCCC2)cc1 1117953710 MZSVKYDQMZTMRC-AWEZNQCLSA-N 261.413 2.374 10 20 CECD Cc1cccc(O)c1CN(C)[C@H](C)C(=O)OC(C)C 876779399 DASYHXOWYFKWEY-GFCCVEGCSA-N 265.353 2.473 10 20 CECD Cc1cncnc1N(C)Cc1ccc(N2CCOCC2)cc1 881776657 SKHANCJPVQXJJK-UHFFFAOYSA-N 298.390 2.258 10 20 CECD CC(C)COC(=O)[C@H](C)NCc1ccc(N(C)C)cc1 789577757 RTJWMBIBSRCQTH-ZDUSSCGKSA-N 278.396 2.430 10 20 CECD COc1ccc(CN2CCC[C@@H](CCO)C2)c(O)c1OC 891948691 VYPIDFBFBIRAER-LBPRGKRZSA-N 295.379 2.004 10 20 CECD COC[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@@H](C)O1 784668569 QLZGUCKJTKYALC-TZMCWYRMSA-N 296.386 2.127 10 20 CECD CCN1CCN(Cc2cc(F)cc(C(C)=O)c2O)[C@H](C)C1 796314507 GEJWCZHNSPFXSE-LLVKDONJSA-N 294.370 2.260 10 20 CECD CCCCOCCNC(=O)NCc1ccc(OC)cc1O 792870329 PAZSNNDHTNUZJS-UHFFFAOYSA-N 296.367 2.017 10 20 CECD Cc1cc(O)c(CN[C@H]2COC[C@H]2C)cc1Cl 896732571 IMRUGQXHSQUVCA-SKDRFNHKSA-N 255.745 2.479 10 20 CECD CC1=CCCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 797999841 YABBKJHXSACBSO-UHFFFAOYSA-N 287.407 2.021 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cn2c(n1)CCCC2 799688973 AGJKLQCGNGSDQL-UHFFFAOYSA-N 285.347 2.197 10 20 CECD C[C@H](N[C@H](C)c1ncnn1C)c1cc(F)ccc1O 276605535 KTBUECQUUILUHK-DTWKUNHWSA-N 264.304 2.072 10 20 CECD CCOC(=O)[C@H](NCc1cccc(Cl)c1O)C1CC1 1320677337 SOUAXXIJXUWJGY-GFCCVEGCSA-N 283.755 2.477 10 20 CECD CCN1CCC[C@@H](N[C@H](C)c2cc(C)ccc2O)C1=O 722360808 BNXCRQFYVJAEPA-TZMCWYRMSA-N 276.380 2.362 10 20 CECD CCOC(=O)C1(C(=O)NCc2ccc(N)cc2)CCCC1 1346209208 FUVHJONQVJJFJG-UHFFFAOYSA-N 290.363 2.009 10 20 CECD CN1CCN(c2ccc(CN3C[C@H]4C[C@@H]4C3)cc2F)CC1 1348389796 WREPWADFZSECDP-HUUCEWRRSA-N 289.398 2.029 10 20 CECD CCOC(=O)[C@@H]1CCCCN1Cc1ccc(N)cc1 1356082718 DNKBLMMKZHWNBD-AWEZNQCLSA-N 262.353 2.186 10 20 CECD C[C@@H](NC1CCC(N)CC1)c1cc(C(=O)O)ccc1O 1593222128 HVAXKHHMBDAMPK-OIKLOGQESA-N 278.352 2.011 10 20 CECD COCCCCCNCc1cc2c(cc1O)OCO2 227442532 OIPOHVSXFRNPBF-UHFFFAOYSA-N 267.325 2.027 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H]2CCO[C@@H]2C)c1 234974641 DSJQRQIBLJABMN-TUAOUCFPSA-N 265.353 2.476 10 20 CECD OC[C@H](NCc1ccc2c(c1)CCO2)C1CCCC1 289598831 NOQWAYROHCHYTJ-HNNXBMFYSA-N 261.365 2.262 10 20 CECD CO[C@](C)(CNCc1cc2c(cc1O)OCO2)C1CC1 291049015 MSFKIPOCTLLRGW-OAHLLOKOSA-N 279.336 2.026 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CC[C@H](O)C2)c1 189341970 SXURMZXJZGQVJH-SRVKXCTJSA-N 265.353 2.212 10 20 CECD Oc1c(F)cc(F)cc1CNCCOCC(F)F 708455687 YDBFQAFUHGZWOK-UHFFFAOYSA-N 267.222 2.042 10 20 CECD OC[C@@H](NCc1c(O)cccc1Br)C1CC1 858137933 ISUXHXAYAAQYTQ-LLVKDONJSA-N 286.169 2.015 10 20 CECD C[C@H]1CN(Cc2ccccc2O)CCN1CC(F)(F)F 179587705 SJBJNBBVTWKXBX-NSHDSACASA-N 288.313 2.461 10 20 CECD C[C@@H](Oc1cccnc1)C(=O)NCc1ccc(N(C)C)cc1 117581555 BHLIPPJCZTWAMQ-CYBMUJFWSA-N 299.374 2.231 10 20 CECD COc1cccc(C(=O)NCc2cc(OC)ccc2O)c1 114541754 OEJOZJHVTHRECL-UHFFFAOYSA-N 287.315 2.339 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(N)CCCC1 37807437 FWJBZDFNQFHQFV-UHFFFAOYSA-N 289.423 2.373 10 20 CECD C[C@H](N[C@H](C)CN1CCOCC1)c1ccc(N(C)C)cc1 37273386 RQFSOJJWCMUCQC-CABCVRRESA-N 291.439 2.124 10 20 CECD O=C(NCCc1cc(F)cc(F)c1)c1cccc(O)c1O 126385871 LDOASJGNTOTPCX-UHFFFAOYSA-N 293.269 2.349 10 20 CECD O=C(Cc1cccc(F)c1F)NCc1ccc(O)c(O)c1 182519555 HUBKSFQAQXRVRK-UHFFFAOYSA-N 293.269 2.235 10 20 CECD CC[C@@]1(CO)CCCN1Cc1cc(F)cc(C(C)=O)c1O 189611539 UJFDTUZSEWXJQI-INIZCTEOSA-N 295.354 2.471 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)N2CCCC2)c1 228089692 LQJBFODDOCXRIV-RYUDHWBXSA-N 292.379 2.062 10 20 CECD Cc1ccncc1C(=O)N1CCOc2cc(N(C)C)ccc21 437018439 MGEISTPBVGOPRW-UHFFFAOYSA-N 297.358 2.495 10 20 CECD Cc1cc(NC(=O)c2ccc(C3=S=CC=C3)o2)n(C)n1 340907454 DOSJEEADCOIBHH-UHFFFAOYSA-N 287.344 2.200 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@H]1C[C@H]2CC[C@H]1NC2 530246075 APVXWJVYWHCIBF-FXAINCCUSA-N 284.762 2.415 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)[C@@H]2CCSC2)c1O 278205048 JNELHQREBHKARU-SNVBAGLBSA-N 298.364 2.246 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1ccncc1 700898754 LELJKMYHPAELAR-UHFFFAOYSA-N 253.349 2.493 10 20 CECD C[C@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)C[C@@H]1C 272685292 SRXIOSJKDGTZIU-LJRGRFNSSA-N 261.321 2.225 10 20 CECD CC[C@@H](N[C@H](C(N)=O)c1ccccn1)c1ccc(C)cc1O 296639292 BYABNYRLPRWFOO-CJNGLKHVSA-N 299.374 2.363 10 20 CECD CC(C)(CNCc1cc(Cl)cc(F)c1O)OCCO 809784037 CPRJXTOSAVTDBF-UHFFFAOYSA-N 291.750 2.062 10 20 CECD CC(C)[C@@H]1C[C@H](NC(=O)c2c(F)ccc(O)c2O)CCO1 297548222 QMTXFNVNBOUGTN-SKDRFNHKSA-N 297.326 2.170 10 20 CECD Cc1cccc(CN2CC(C(=O)OC(C)(C)C)C2)c1O 297419246 MGJGKBUFUHKLRI-UHFFFAOYSA-N 277.364 2.474 10 20 CECD Cn1cnc(/C=C2/C(=O)N3CCCc4cccc2c43)c1 817346275 QRLLQDTZWXDUAG-RIYZIHGNSA-N 265.316 2.254 10 20 CECD C[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)C1CCOCC1 817941460 JVCWJZCDDNWFIC-SUMWQHHRSA-N 291.439 2.157 10 20 CECD CCOc1ccc(CNC[C@]2(O)CCC[C@@H]2C)c(O)c1 815160114 PYONITMESVRFMB-BLLLJJGKSA-N 279.380 2.432 10 20 CECD C[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)c1ccccn1 817942694 QEOAHJROVKVJBC-XJKSGUPXSA-N 284.407 2.498 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](C)OC 821722033 FHLXTLSDGHFMDV-CYBMUJFWSA-N 293.411 2.319 10 20 CECD C[C@H]1SCC[C@@H]1NC(=O)NCCc1ccc(N)cc1 831177735 AZMMQWJIKFGWSX-MFKMUULPSA-N 279.409 2.005 10 20 CECD CCN(CC)c1ccc(CNC[C@H](F)C(=O)O)cc1F 904043531 SHMRJLOOAQFDSR-LBPRGKRZSA-N 286.322 2.184 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CC(=O)OC 908044778 FYKZRBWBGOSGOE-UHFFFAOYSA-N 279.336 2.084 10 20 CECD CCN(CC)c1ccc(CNCC[N+](=O)[O-])cc1F 905104778 GWJOJWCCGWWAIM-UHFFFAOYSA-N 269.320 2.038 10 20 CECD COCC(COC)N[C@H](C)c1ccc(C)c(C)c1O 834889934 HLIDYELWUKARPS-GFCCVEGCSA-N 267.369 2.321 10 20 CECD CCCNC(=O)CCCN[C@@H](C)c1cc(OC)ccc1O 839539101 JEKNAWVHOVHMIT-LBPRGKRZSA-N 294.395 2.358 10 20 CECD CNC(=O)c1cccc(NC(=O)c2cc(O)cs2)c1 731865968 CPQJIDWTBYAKOA-UHFFFAOYSA-N 276.317 2.066 10 20 CECD C[C@H](NC[C@@H](O)C1CCC1)c1cc(F)cc(F)c1O 834904795 CTVMWZLIRMWRGC-ISVAXAHUSA-N 271.307 2.482 10 20 CECD CCOC[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 733807009 QKAHTQBQJHFPIN-SNVBAGLBSA-N 269.366 2.342 10 20 CECD O=C(NCCc1cccs1)NCc1ccccc1O 748452151 ZDCRTOILEIAHCH-UHFFFAOYSA-N 276.361 2.496 10 20 CECD CCCCNCc1ccc(N2CCC[C@@H](C(N)=O)C2)cc1 917394226 AMGYBXDCQWGNHN-OAHLLOKOSA-N 289.423 2.278 10 20 CECD CN(C)c1ccc(/C=C/CN[C@H]2CCCNC2)cc1 841043032 MWHMHIRLUXVNDS-UJAVWCLSSA-N 259.397 2.107 10 20 CECD CCc1cccc(CN2C[C@@H](C)O[C@]3(CCOC3)C2)c1O 848908080 MRKSVAVDTTWLQI-CXAGYDPISA-N 291.391 2.334 10 20 CECD CCn1ccc(C(=O)NCc2cc(Cl)ccc2O)n1 857548380 LABLZEKHYQIWEX-UHFFFAOYSA-N 279.727 2.192 10 20 CECD Cc1ccc([C@@H](C)NCc2ccc(C(N)=O)nc2)c(O)c1 756641933 ZNEPYUXKWYJQLR-LLVKDONJSA-N 285.347 2.045 10 20 CECD Cc1ncc(C(=O)NCc2cc(Cl)ccc2O)[nH]1 857547770 SQKXDKPKQJEOQN-UHFFFAOYSA-N 265.700 2.007 10 20 CECD C[C@@H](NC(=O)/C=C\c1cn(C)cn1)c1ccc(N(C)C)cc1 935465359 QJRRJRGOVPKAEJ-PGJNLMOESA-N 298.390 2.377 10 20 CECD C[C@H](CNCc1cc(F)c(N(C)C)cc1F)CN(C)C 858167293 PQRDTCNKHTYTGE-LLVKDONJSA-N 285.382 2.318 10 20 CECD CCOCCOCCN1CCOc2cc(N(C)C)ccc21 930128964 YMJYYRBYIBUFEJ-UHFFFAOYSA-N 294.395 2.005 10 20 CECD COCC1(C(=O)NCc2cc(C)ccc2O)CCC1 862755805 LCQCQJVBSWHVGO-UHFFFAOYSA-N 263.337 2.134 10 20 CECD NC(=O)[C@H]1CCN(Cc2cc(-c3ccccc3)ccc2O)C1 768139245 YGQBYJSRNNOMDD-HNNXBMFYSA-N 296.370 2.366 10 20 CECD CCOc1ccc(CN2CC[C@@H](C(=O)O)[C@H](C)C2)c(O)c1 863740559 XREQEGMGYBCZHH-BXUZGUMPSA-N 293.363 2.334 10 20 CECD OC[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1116444508 WVEGAIXKDCUVSU-HNNXBMFYSA-N 260.381 2.101 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@H](c1ccc(O)c(O)c1)N2 877862489 WYHMIJVMHOMKAO-CQSZACIVSA-N 270.288 2.260 10 20 CECD C[C@@H](N[C@@H]1CCc2n[nH]cc2C1)c1c(O)cccc1F 886551053 ANEYMLQKXCWKKY-MWLCHTKSSA-N 275.327 2.463 10 20 CECD C[C@@H]1C[C@H]1C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891247409 HBCSCXWJNPQPPY-DAXOMENPSA-N 289.423 2.128 10 20 CECD CCOc1ccc(CN[C@H](C)C[C@H](C)O)c(O)c1 782977134 BYRIHBZSDVLKOB-MNOVXSKESA-N 253.342 2.040 10 20 CECD COc1cc(C)cc(CN(C)[C@H]2CCN(C)C[C@@H]2C)c1O 894783026 PGQHMPMGMBHOGV-ZFWWWQNUSA-N 292.423 2.481 10 20 CECD Cc1cccc(CCNC(=O)c2cc(O)cs2)n1 792670515 SMMQOLNKFAXGHI-UHFFFAOYSA-N 262.334 2.130 10 20 CECD Oc1cc2c(cc1CN1CCO[C@H]3C[C@@H]31)CCCC2 793608713 WXBZBYSXHSVQFK-HOCLYGCPSA-N 259.349 2.244 10 20 CECD Cc1ccc(CN2C[C@@H](C(=O)O)CC[C@@H]2C)c(O)c1 1605273131 JBRPNHLRZIBQOJ-AAEUAGOBSA-N 263.337 2.386 10 20 CECD C[C@@H](CCS(C)(=O)=O)N[C@@H](C)c1ccc(F)cc1O 185790623 DBHUPHHFCCJRHJ-UWVGGRQHSA-N 289.372 2.005 10 20 CECD C[C@H](c1cccnc1)N(C)C(=O)c1cccc(O)c1O 187031423 JZNCQHSHWOZMOY-SNVBAGLBSA-N 272.304 2.326 10 20 CECD Oc1c(F)cc(F)cc1CN1CCCN2CCC[C@@H]2C1 708423328 SBXHAPVWOGCJHQ-CYBMUJFWSA-N 282.334 2.341 10 20 CECD CC(C)CN1CCC[C@H]1C(=O)NCCc1ccc(N)cc1 1339851863 BQRKLUKHBBHLLX-INIZCTEOSA-N 289.423 2.048 10 20 CECD CCOc1ccc(N2CCN(CCOC3CC3)CC2)cc1 1332682590 ATWSCIDATLCOMA-UHFFFAOYSA-N 290.407 2.386 10 20 CECD C[C@@H](CCO)NCc1cccc(Br)c1O 96811392 URSMHZLDUYXHGP-QMMMGPOBSA-N 274.158 2.015 10 20 CECD C[C@@H](Nc1ccnc(N)n1)c1ccc(N(C)C)cc1 1354163424 OERCVISESDHEOK-SNVBAGLBSA-N 257.341 2.298 10 20 CECD C[C@@H](CCN(C)C)N[C@@H](C)c1cc(C(=O)O)ccc1O 1604142257 LGMIFERGWPHXRA-QWRGUYRKSA-N 280.368 2.081 10 20 CECD Cc1cc(COc2ccc(N(C)C)c(C(=O)O)c2)ncn1 1600215051 SDFIFBPCHJCWFI-UHFFFAOYSA-N 287.319 2.128 10 20 CECD CCN1CCC(N[C@@H](C)c2cc(C(=O)O)ccc2O)CC1 1610008291 CYYZGTZIGSWKLF-NSHDSACASA-N 292.379 2.225 10 20 CECD C[C@H](NCCc1ccncc1)c1cc(C(=O)O)ccc1O 1593274520 MZAZOTSDMVZIRU-NSHDSACASA-N 286.331 2.379 10 20 CECD C[C@@H](N[C@@H](CO)C1CCCC1)c1cc(C(=O)O)ccc1O 1593207135 BARSPEJBTVBLIG-YGRLFVJLSA-N 293.363 2.292 10 20 CECD CC1(C)[C@@H](NCc2ccc3c(c2)CCCO3)C[C@H]1O 922017133 LOLIRIHJLIELMU-LSDHHAIUSA-N 261.365 2.261 10 20 CECD CCOc1cccc(CNCC[C@@H](C)CCO)c1O 295145634 QLGGEMPLJCOODD-GFCCVEGCSA-N 267.369 2.289 10 20 CECD COc1ccc(O)c([C@H](C)NCC(=O)OC(C)C)c1 308753782 HHCLYXPAFXRGEE-JTQLQIEISA-N 267.325 2.003 10 20 CECD CC(C)[C@H](CC(=O)O)NCc1ccc(N(C)C)cc1 4636437 CIRVETXWOUOFLB-AWEZNQCLSA-N 264.369 2.342 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CCC[C@H]2C)c1 114596467 ALFPHOOLWTZXSO-ZWNOBZJWSA-N 278.352 2.389 10 20 CECD Cn1ccc(NC(=O)NCc2ccc(N3CCCC3)cc2)n1 171667606 ZPODRIMUWRPGDA-UHFFFAOYSA-N 299.378 2.342 10 20 CECD COc1ccc2c(c1)CCCN2CC(=O)NCC(C)C 27579235 XQPSXYUAOKNQQI-UHFFFAOYSA-N 276.380 2.220 10 20 CECD CCN1CCN(Cc2cc(F)cc(C(C)=O)c2O)C[C@@H]1C 110728055 MJWFMJYFGAXSON-NSHDSACASA-N 294.370 2.260 10 20 CECD N[C@@H]1CC[C@@H](C(=O)NCc2ccc(N3CCCC3)cc2)C1 178710462 DDKPTMYUAYKWHA-HUUCEWRRSA-N 287.407 2.030 10 20 CECD Cc1cccc(CN2CCC(CC(=O)N(C)C)CC2)c1O 180328438 XXWKWIIWZVSZMV-UHFFFAOYSA-N 290.407 2.391 10 20 CECD COc1ccc(O)c([C@@H](C)NCC(=O)OCC(C)C)c1 181507207 WFXNIDXQVBTREX-LLVKDONJSA-N 281.352 2.251 10 20 CECD CCC(C)(C)C(=O)NCCc1ccc(O)c(O)c1 156639303 DSHIEOOVSVWMAL-UHFFFAOYSA-N 251.326 2.193 10 20 CECD CSC1(C(=O)NCc2ccc(N(C)C)cc2)CC1 189902415 YSMKKZNYALIZBW-UHFFFAOYSA-N 264.394 2.264 10 20 CECD CCN(C)c1ccc([C@H](C)NCC(C)(C)C(N)=O)cc1 183201972 MTFNVDVBQNXAJM-LBPRGKRZSA-N 277.412 2.305 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NCCCC(N)=O)cc1 42927616 IPKJHQZWQFQBCG-UHFFFAOYSA-N 299.374 2.089 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@@H](C)C(=O)NC)cc1 93899672 XYFYVMNLLYZCTM-CQSZACIVSA-N 291.439 2.347 10 20 CECD C[C@@]1(C(=O)O)CCCN(Cc2cc(F)ccc2O)C1 235423936 JDKOKRHBPAMLDN-CQSZACIVSA-N 267.300 2.218 10 20 CECD CN(C)c1ccc(CN2CC[C@]3(CCOC3)C2)cc1 93819883 GMRWFENRWWELMH-INIZCTEOSA-N 260.381 2.365 10 20 CECD COc1cccc(CNC(=O)c2ccn(C(C)C)n2)c1O 265040681 IDNGMHQXIIEUHQ-UHFFFAOYSA-N 289.335 2.108 10 20 CECD O=C1[C@@H]2CCCN2C(=O)N1Cc1ccc(N2CCCC2)cc1 272341854 WMMYYRNVEVMUBA-HNNXBMFYSA-N 299.374 2.213 10 20 CECD COc1cccc(CN2CCO[C@@H](COC(C)C)C2)c1O 372116401 KLSRNKPULIGCCP-CQSZACIVSA-N 295.379 2.027 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](C)[S@@](=O)CC2)c1 277395166 GPEBYGUWFZVGNC-XIKOKIGWSA-N 267.394 2.044 10 20 CECD CCN(C[C@H]1CCCS(=O)(=O)C1)c1ccc(OC)cc1 284264217 XDGBUZJPLCMFOT-CYBMUJFWSA-N 297.420 2.346 10 20 CECD Cc1ccc(C(=O)OCCOC2CCC2)c(O)c1O 805433987 ZZGYURLDQSXCMD-UHFFFAOYSA-N 266.293 2.132 10 20 CECD COc1ccc(CN(C)c2ccc(OC)c(OC)c2)nn1 801511361 ARWNCWGZIWDYBJ-UHFFFAOYSA-N 289.335 2.139 10 20 CECD CC(C)c1cc(C(=O)NCc2ccccc2O)n[nH]1 299600145 VIDXUNNOXQUKIM-UHFFFAOYSA-N 259.309 2.169 10 20 CECD CCOc1cccc(CN2CCC[C@@H](O)CC2)c1O 293999734 MENXVLHOIRDAGH-CYBMUJFWSA-N 265.353 2.138 10 20 CECD O=C(c1cc(O)cs1)N1CCOc2cc(O)ccc2C1 807695328 QECOQKBRZZUAOP-UHFFFAOYSA-N 291.328 2.194 10 20 CECD CCc1ccc([C@H](O)CNC(=O)c2cc(O)cs2)cc1 807665589 BBFCDICCLPFIND-CYBMUJFWSA-N 291.372 2.480 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C[C@H]1C[C@H]1C 822511542 HWTSRFFOBRCTFT-TZMCWYRMSA-N 277.364 2.413 10 20 CECD Cc1cc(O)c(CN[C@H](C)c2ncn(C)n2)cc1Cl 825621139 JOVKVGKOSNRUIY-SECBINFHSA-N 280.759 2.333 10 20 CECD C[C@@H](NC[C@H]1CCCCCN1)c1cc([N+](=O)[O-])ccc1O 902481763 GQESKRQSRDNFKG-VXGBXAGGSA-N 293.367 2.483 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)C(C)(C)C)c1 735858301 LDNRGPSTLIXTGS-VIFPVBQESA-N 279.336 2.193 10 20 CECD CCC(C)(C)OCC(=O)NCc1ccccc1O 837481418 ODNXZTKOYZHTDQ-UHFFFAOYSA-N 251.326 2.214 10 20 CECD Cc1noc(C)c1[C@H](C)C(=O)NCc1ccc(O)cc1O 910953492 BYENXGUKXQRPPR-QMMMGPOBSA-N 290.319 2.123 10 20 CECD CCCCOCCN(C)c1ccc(OCC(=O)O)cc1 846279426 DMNFCEZVFZGTHB-UHFFFAOYSA-N 281.352 2.403 10 20 CECD C[C@@H]1C[C@@H](NCc2cccc(Cl)c2O)CCN1 841061177 FWGQDNUZVGBHAB-KOLCDFICSA-N 254.761 2.276 10 20 CECD CCc1ncc(CNCc2ccc(OC)cc2O)cn1 840941488 XRXFWIICFTYLPU-UHFFFAOYSA-N 273.336 2.043 10 20 CECD Cn1nc(C2CC2)nc1CN1CCCc2cc(CN)ccc21 843350771 UWUXUQPFRJBLEC-UHFFFAOYSA-N 297.406 2.104 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@]3(CCCN3)C2)c1O 842477032 CAYGJQLRJNAPDH-MRXNPFEDSA-N 292.354 2.062 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CCN1CCCC1=O 840917266 JOERELUBRUDULI-UHFFFAOYSA-N 289.423 2.115 10 20 CECD CNC[C@H]1CCCN(Cc2ccc(N(C)C)cc2C)C1 843044975 OGTCXMMATJMVLX-OAHLLOKOSA-N 275.440 2.492 10 20 CECD COc1cc(CN(C)CC2=CCCOC2)c(O)cc1C 853562806 WULYDGPWPYESHI-UHFFFAOYSA-N 277.364 2.488 10 20 CECD C[C@H]1C[C@@H](N[C@H](C)C[S@](C)=O)c2c(O)ccc(F)c21 757659322 YGBHBSZZFXGGMU-CGMWZMNDSA-N 285.384 2.436 10 20 CECD Cc1cc(Br)c(O)c(CNC/C=C\CO)c1 850357510 LZTROKYIKOVFQS-IHWYPQMZSA-N 286.169 2.101 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCC1SCCS1 856161849 CDCHYSJDNBJLHH-RQOWECAXSA-N 297.401 2.033 10 20 CECD Cc1cc(CN2CC[C@]3(CCCN3)C2)ccc1N(C)C 923380527 OQMZWKHWHIRGHB-QGZVFWFLSA-N 273.424 2.389 10 20 CECD CN(C)c1ccc(CNC(=O)C2(Br)CC2)cc1 873829752 WWQJNGKGXNJIEF-UHFFFAOYSA-N 297.196 2.296 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1nnc2ccccn12 769204004 QRBWFHPDYAWAOC-UHFFFAOYSA-N 295.390 2.427 10 20 CECD CN(Cc1ccc2c(c1)nnn2C)Cc1ccccc1O 768540651 ACJLSIHUBBGAIX-UHFFFAOYSA-N 282.347 2.306 10 20 CECD O=C(c1cc(O)cs1)N1CCOCC2(CCC2)C1 760451104 UWYYTIDDDGDUBQ-UHFFFAOYSA-N 267.350 2.096 10 20 CECD CC[C@H]1CN(Cc2ccc(N(C)CC)cc2)C[C@@H]1O 773827164 VYKAUAKKVHZSNY-HOCLYGCPSA-N 262.397 2.345 10 20 CECD C[C@@H](NCc1nnn(C(C)(C)C)n1)c1c(O)cccc1F 886633527 XXUVEUKRKCWOEX-SECBINFHSA-N 293.346 2.124 10 20 CECD CCN(CCOC)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776245866 OYBCIVQOVJBHJH-ZDUSSCGKSA-N 293.411 2.492 10 20 CECD CN(C)CCOC1CCN(Cc2cc(F)ccc2O)CC1 779013277 HCUVQUQVWJHMKZ-UHFFFAOYSA-N 296.386 2.074 10 20 CECD NC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccccc2O)C1 895004480 QUHSPUTXCABPGV-SFHVURJKSA-N 296.370 2.021 10 20 CECD CC[C@]1(C)COCCN1Cc1ccc(OC)c(OC)c1O 893666835 XZPZAOLFSMKYSR-MRXNPFEDSA-N 295.379 2.410 10 20 CECD COc1cc(C)cc(CN[C@@H](CCO)C(F)(F)F)c1O 894852519 TYLPYBIDWDLLMR-NSHDSACASA-N 293.285 2.112 10 20 CECD COc1cc(C)cc(CNCCOC2CCC2)c1O 894316544 WFDHLMPMNJBIQU-UHFFFAOYSA-N 265.353 2.368 10 20 CECD CC[C@H](N[C@H](CO)COC)c1cc(Cl)ccc1O 794839133 YVDCSWMHJJYMBG-PWSUYJOCSA-N 273.760 2.094 10 20 CECD CCCSCC(=O)NCc1ccc(OC)cc1O 794380699 AQYZRVJOUMPJQM-UHFFFAOYSA-N 269.366 2.160 10 20 CECD CCc1cccc(CN[C@H](CO)C(C)(C)C)c1O 691436550 RVEJMKIWXHOZMJ-CYBMUJFWSA-N 251.370 2.451 10 20 CECD Cc1nnc(O)c(CN[C@H](C)c2c(O)cccc2F)c1C 1333466171 JYKPROCGEPYBPL-SNVBAGLBSA-N 291.326 2.495 10 20 CECD Cc1cc(N[C@H](C)c2ccccc2O)ncc1-c1nn[nH]n1 1605739870 HTSAPVGWJCLEKT-SNVBAGLBSA-N 296.334 2.449 10 20 CECD Cc1c(NCc2c(O)cccc2Cl)cnn1CC(=O)O 1610425803 AJDWFJYADRYNIL-UHFFFAOYSA-N 295.726 2.247 10 20 CECD CCCN(CCOC(=O)N(C)C)Cc1ccccc1O 158749997 DTMPJWYJEJTODK-UHFFFAOYSA-N 280.368 2.302 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H](C(=O)O)C2)c1O 164508990 CTPHBFKUFANPOH-SNVBAGLBSA-N 295.310 2.031 10 20 CECD Oc1ccc(F)cc1CN1CCC2(CCNC2)CC1 843126817 NFDPJEVILQBSOC-UHFFFAOYSA-N 264.344 2.107 10 20 CECD COCC1(CC(=O)N[C@H](C)c2ccccc2O)CC1 827952363 PKXBJTXLEZVVED-LLVKDONJSA-N 263.337 2.386 10 20 CECD Cc1ccc(O)c(CNCC2([S@](C)=O)CCC2)c1 280642431 NFXQAQAWICJYJW-SFHVURJKSA-N 267.394 2.091 10 20 CECD C[C@H](N[C@H]1CCN(C2CC2)C1)c1cc(F)ccc1O 94617979 NDHDVKSIXIUGRN-JQWIXIFHSA-N 264.344 2.419 10 20 CECD CN1CCC[C@@H](CN(C)C(=O)Nc2ccc(N)cc2)C1 705161861 HZNCOLUADMMPOF-GFCCVEGCSA-N 276.384 2.074 10 20 CECD CNC(=O)c1ccc(CN(C)Cc2ccccc2O)cc1 109772789 OFNZSZMIQQUKAC-UHFFFAOYSA-N 284.359 2.384 10 20 CECD CN1CCCc2cc(CNC(=O)c3cscn3)ccc21 103003983 UZPPSAPBFXYSPP-UHFFFAOYSA-N 287.388 2.456 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H](C)CSC)c1 114543910 GUQGCRVWUPIHQU-SECBINFHSA-N 269.366 2.016 10 20 CECD COc1ccc(O)c([C@H](C)Nc2nccc(OC)n2)c1 301195369 NGHVYVLETAUDEM-VIFPVBQESA-N 275.308 2.373 10 20 CECD CC(=O)c1csc(C(=O)NCc2ccc(O)c(O)c2)c1 182517786 QHTZAAUOBAQJMK-UHFFFAOYSA-N 291.328 2.292 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccncc2Cl)c1 73144894 DZCPQRSPXNKCEC-UHFFFAOYSA-N 292.722 2.379 10 20 CECD CNC[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 128326172 YGYRBHKHCCQPKH-JTQLQIEISA-N 254.761 2.087 10 20 CECD CC(C)COC(=O)[C@H](C)NCc1ccc2c(c1)CCO2 187897159 QIBPDGUMBKSXGK-LBPRGKRZSA-N 277.364 2.299 10 20 CECD Cc1ccc(C(=O)Nc2cnc3[nH]nc(C)c3c2)c(O)c1O 182228101 MJABBXJEDLGOKK-UHFFFAOYSA-N 298.302 2.238 10 20 CECD C[C@H](O)C[C@H](C)NCc1cc(Br)ccc1O 228562086 TYRGURJMKIJYCI-IUCAKERBSA-N 288.185 2.404 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1cc(Br)ccc1O 220332673 JYSQSSXJRKDBQP-CABZTGNLSA-N 299.212 2.466 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccccc2N)cc1 40805237 BSTVIZIZWBLMHU-UHFFFAOYSA-N 269.348 2.265 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C(=O)c2ccccc2)c1 194477558 CFCOOSDKAPWART-NSHDSACASA-N 299.326 2.461 10 20 CECD CCCOc1ccc(CN(C)CC(C)(C)O)c(O)c1 93414659 XCXILYAHWNQOIP-UHFFFAOYSA-N 267.369 2.384 10 20 CECD O=C1CN(Cc2cc(Cl)ccc2O)[C@@H]2CCCC[C@H]2N1 245561185 NLLGOJXZPDVVPD-CHWSQXEVSA-N 294.782 2.289 10 20 CECD COc1ccc(O)c([C@H](C)NCCN(C)C(C)C)c1 54110845 YEQXFBIRTUIEAW-LBPRGKRZSA-N 266.385 2.392 10 20 CECD CCN(C[C@@H](O)COC(C)C)c1ccc(OC)c(OC)c1 269102871 SRZLUOORNMHLKP-CQSZACIVSA-N 297.395 2.316 10 20 CECD COc1cc(N(C)Cc2ccno2)cc(OC)c1OC 266007125 QJZIRYZRHQCMTN-UHFFFAOYSA-N 278.308 2.337 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H]2CC(=O)N(C)C2)cc1 268899178 ZPUMCZSUWPLJEP-GXTWGEPZSA-N 275.396 2.024 10 20 CECD CCNC(=O)[C@@H](C)N[C@H](C)c1cc2c(cc1O)CCCC2 273392034 LBFPGJGANNTBTL-VXGBXAGGSA-N 290.407 2.446 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)[C@H]2CCOC2)c1 271842457 RDZBTHDBFOTLBM-NEPJUHHUSA-N 265.353 2.306 10 20 CECD C[C@@H](NC[C@]1(N(C)C)CCSC1)c1ccccc1O 272931964 ZQRYRUNWPUVEKW-IUODEOHRSA-N 280.437 2.480 10 20 CECD CC[C@H](NCc1ccccc1O)[C@@H](O)C(F)(F)F 270973764 KHRBLDQIFGBKJI-GXSJLCMTSA-N 263.259 2.184 10 20 CECD Cc1cccc(CN2CC[C@@H]3CCN(C)C[C@@H]32)c1O 272625518 MKGITCYIMNWNSH-ZFWWWQNUSA-N 260.381 2.227 10 20 CECD OC[C@]1(NCc2cc(F)ccc2O)CCc2ccccc21 378489874 CRHDMQJXFBNBFX-QGZVFWFLSA-N 287.334 2.455 10 20 CECD Cc1cccc(CN2CCOC[C@@H]2[C@H]2CCCO2)c1O 377706854 ZHRJAIVLNYIQDY-HUUCEWRRSA-N 277.364 2.080 10 20 CECD CO[C@@]1(C)CCCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 280199835 WHPHCLZYXQWBGJ-YERXGYGTSA-N 291.347 2.139 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](N)CC1CC1 385800862 SBJZMQFDWKNBON-MRXNPFEDSA-N 289.423 2.229 10 20 CECD Oc1cccc2c1[C@@H](NCc1nc(C3CC3)n[nH]1)CC2 296583786 UNVYEMDRTSMJFX-NSHDSACASA-N 270.336 2.165 10 20 CECD COC1CCN(c2ccc(CN(C)C[C@@H](C)O)cc2)CC1 295205877 OGYPYTXBLDCFAS-CQSZACIVSA-N 292.423 2.114 10 20 CECD COc1cc(O)c(CN2CC[C@H](SC)C2)cc1OC 295132818 YJKFLPNHJYYJHY-NSHDSACASA-N 283.393 2.347 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H]1C(=O)O 299948967 CJJPRQYSPZVHOL-BXUZGUMPSA-N 262.353 2.048 10 20 CECD Oc1cc(Br)ccc1CN1CCCOCC1 700863478 SDNNREHKZUIUDI-UHFFFAOYSA-N 286.169 2.377 10 20 CECD Oc1cc2c(cc1CN1CC[C@H](O)C13CCCC3)OCO2 293983898 RNUBQNIZACHVMZ-HNNXBMFYSA-N 291.347 2.000 10 20 CECD Cc1ccc2c(c1)/C(=C\c1cn(C)cn1)C(=O)N2C 811701547 ZODKGHFUOZETAX-NTUHNPAUSA-N 253.305 2.246 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(N(C)C)CC2)cc1 822608897 YYIUXQKRXUABSJ-UHFFFAOYSA-N 289.423 2.243 10 20 CECD C[C@@H](NC(=O)C[C@@H]1CCCOC1)c1ccccc1O 827947027 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CO[C@@]1(C)C[C@H]1NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 852262119 ZASVPEHVVLSXKD-PEYYIBSZSA-N 291.395 2.290 10 20 CECD COc1cc(CN(C)c2ccc(OC)c(F)c2)on1 851809832 YZHXJNODLLQVKA-UHFFFAOYSA-N 266.272 2.467 10 20 CECD C[C@@H]1C[C@H](N[C@H]2CCCN(C)C2=O)c2c(O)ccc(F)c21 756637193 HCXGVRWFIPUXGB-USWWRNFRSA-N 292.354 2.290 10 20 CECD CCCN(Cc1ccccc1O)C[C@H](O)CCOCC 769728423 LLWSKVFTLGGIQS-OAHLLOKOSA-N 281.396 2.392 10 20 CECD CCC[C@H](O)C(=O)NCc1cc(Cl)cc(Cl)c1O 935994631 ZRDJNCOPYBSZRE-JTQLQIEISA-N 292.162 2.476 10 20 CECD CC(C)CN(C(=O)CN(C)c1ccc(N)cc1)C1CC1 863557403 OAWZSDJYNADZIJ-UHFFFAOYSA-N 275.396 2.352 10 20 CECD Cc1cccc(O)c1CNC1CCN(C2CC2)CC1 876907476 CKQITJCOVZMZDT-UHFFFAOYSA-N 260.381 2.417 10 20 CECD CCOC(=O)[C@H](C)NCc1cc(F)c(N(C)C)cc1F 862339289 OJOBVDLDIKTNIU-VIFPVBQESA-N 286.322 2.072 10 20 CECD CC(C)CC[C@@H](CO)NCc1cc(F)ccc1O 862480254 ARVWWZIOMPLQKY-ZDUSSCGKSA-N 255.333 2.418 10 20 CECD Cc1cccc(O)c1CN1CCCC[C@H]1CS(C)(=O)=O 877568392 MUCWBEVKKCXOAR-ZDUSSCGKSA-N 297.420 2.100 10 20 CECD CC[C@H](NCc1ccc(C)cc1O)[C@H](O)C(F)(F)F 877126081 FFGWCWVDCUYFCR-JQWIXIFHSA-N 277.286 2.492 10 20 CECD C[C@@H](NC(=O)C1(O)CCCC1)c1ccc(N(C)C)cc1 775412238 VNWMCNLIEZJLET-GFCCVEGCSA-N 276.380 2.235 10 20 CECD C[C@H](N[C@H](C)c1c(O)cccc1F)C(=O)NC(C)(C)C 886516540 MSYSIUAMONUZNN-ZJUUUORDSA-N 282.359 2.485 10 20 CECD Cc1ccc(CN(C)Cc2cc3c(cc2O)OCO3)nc1 789589302 KTPUCTDJMVHNJJ-UHFFFAOYSA-N 286.331 2.456 10 20 CECD CC[C@@H](SC)C(=O)NCc1ccc(OC)cc1O 794389718 CMROEBDVVIPLKQ-GFCCVEGCSA-N 269.366 2.159 10 20 CECD CC[C@H](CSC)NC(=O)NCc1ccc(OC)cc1O 793038324 QJUPWMRCIINAPI-LLVKDONJSA-N 298.408 2.342 10 20 CECD C[C@@]1(CN)CCN(Cc2ccc(N3CCCC3)cc2)C1 1326201944 MMKMWOXUCMPYQF-KRWDZBQOSA-N 273.424 2.458 10 20 CECD C[C@H](N[C@@H](C)c1ncnn1C)c1cc(F)ccc1O 276605538 KTBUECQUUILUHK-IUCAKERBSA-N 264.304 2.072 10 20 CECD COc1ccc(CN[C@@H]2CCCC[C@@H]2C(N)=O)cc1C 757911664 YTZZXKQTYSNGSH-UONOGXRCSA-N 276.380 2.137 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1ccc(N(C)C)cc1 686595598 GKJNLRWMOJATMI-CVEARBPZSA-N 278.396 2.036 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CC[C@@H]2C[C@H]2C1 1352668908 FUFJVZMFZOSGTK-FOGDFJRCSA-N 261.321 2.150 10 20 CECD COc1cc(C)c(CN2CCC[C@H](C(=O)O)C2)c(O)c1 1604695280 ICXPSDQHIJJLEY-NSHDSACASA-N 279.336 2.006 10 20 CECD Cc1ccc(O)c(CN[C@H]2CC[C@@H](CC(=O)O)C2)c1 1600467462 UESONUMLKMSBBO-YPMHNXCESA-N 263.337 2.434 10 20 CECD C[C@H](N[C@@H]1C[C@H](O)C12CCC2)c1cc(C(=O)O)ccc1O 1593217845 DAIYBPDQQNXAHF-FZZIBODNSA-N 291.347 2.045 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CCOC(C)(C)C1 161707251 OFYLLYMIMOLMPL-ZDUSSCGKSA-N 292.379 2.491 10 20 CECD O=C1NC(=S)S/C1=C/c1ccc(O)c(F)c1 158625398 OOIFJQFYEVSOCA-XBXARRHUSA-N 255.295 2.020 10 20 CECD C[C@@H]1CCN(Cc2c(O)cccc2Cl)C[C@@H]1CN 163492840 GQFSAHIEOFEREF-MNOVXSKESA-N 268.788 2.462 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)CN1C1CC1 122328795 DVCJRSVYSXVPTC-UKRRQHHQSA-N 273.424 2.467 10 20 CECD CC1(O)CCC(NCc2cc(F)ccc2O)CC1 703513564 BDLYFDLXUAGSLB-UHFFFAOYSA-N 253.317 2.315 10 20 CECD C[C@H](CNC(=O)c1cccc(O)c1O)CC(F)(F)F 397047227 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CECD Cc1c(CNC(=O)NC2CC2)n(C)c2ccccc12 336414246 GLUXGJUBRRJPQO-UHFFFAOYSA-N 257.337 2.448 10 20 CECD COCCOC[C@H]1CCN(Cc2cccc(C)c2O)C1 180525650 DMMZVWQUJSGLSF-AWEZNQCLSA-N 279.380 2.186 10 20 CECD CN(C)c1ccc(CNCCN2CC=CCC2)cc1F 279866775 SYCGOFZBJMHWKU-UHFFFAOYSA-N 277.387 2.243 10 20 CECD COc1cccc(CN[C@@]2(C)CCO[C@@H]2C2CC2)c1O 273090079 KUWKAAOCLHJROT-CVEARBPZSA-N 277.364 2.448 10 20 CECD CCC(O)(CC)CCNCc1cc([N+](=O)[O-])ccc1O 276297552 ZUAVESCTJWHYDL-UHFFFAOYSA-N 282.340 2.331 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(C)C1)c1cccc(Cl)c1O 287635080 KOIMUGFCAFXKSE-JOYOIKCWSA-N 282.771 2.317 10 20 CECD CCC[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)OC 296293587 ZMDUKPJULGNSRJ-WMADIVHISA-N 279.336 2.042 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1c[nH]ccc1=N 817896524 JESNOMIGMDFOMI-GFCCVEGCSA-N 270.380 2.411 10 20 CECD COc1cccc(CN[C@H](C2CC2)[C@H](CO)C2CC2)c1O 824846237 QIQIZGJKTNUVOE-GDBMZVCRSA-N 291.391 2.288 10 20 CECD CNC(=O)[C@@H](C)CN(C)Cc1cc(Cl)c(C)cc1O 824913173 KHHAWZZIJLPPHR-JTQLQIEISA-N 284.787 2.168 10 20 CECD C[C@@H]1[C@H](O)CCN1Cc1cc(Br)ccc1O 825103067 BSWICMGNCQIQCA-LDYMZIIASA-N 286.169 2.110 10 20 CECD O=C(c1cc(O)cs1)N1CCN(Cc2ccco2)CC1 732258490 CRQKVZHBWJZNRW-UHFFFAOYSA-N 292.360 2.005 10 20 CECD C[C@@H](NCC1(N)CC1)c1cc(Br)ccc1O 902414719 ZUZQXMOBMVVQMZ-MRVPVSSYSA-N 285.185 2.297 10 20 CECD CN(C)c1ccc(CN[C@H](C(=O)O)C(C)(C)C)cc1F 901574897 KMSZOUCVLNFEHP-CYBMUJFWSA-N 282.359 2.481 10 20 CECD O=C(O)NCc1ccc(NC(=O)c2cc(O)cs2)cc1 739992918 XWYOAGXKBOGNEG-UHFFFAOYSA-N 292.316 2.474 10 20 CECD C[C@@H](CCO)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 846109538 FDGZNQAKSSILIT-QMMMGPOBSA-N 288.731 2.157 10 20 CECD N[C@@H]1CCN(Cc2ccc(N3CCCCC3)cc2)C1 843045195 OYHYVSFPLYFNPX-OAHLLOKOSA-N 259.397 2.210 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@@H]1CCCCN1 843490374 SWZHBFLUWRNSPA-HNNXBMFYSA-N 288.391 2.029 10 20 CECD CNC(=O)C1(NCc2ccc(N(C)C)cc2C)CCCC1 840938386 OJTXSEZJCZPZNS-UHFFFAOYSA-N 289.423 2.209 10 20 CECD C[C@@H](NC(=O)Cc1cncc(O)c1)c1ccc(N(C)C)cc1 848373840 MMHTXPYUKVLFLW-GFCCVEGCSA-N 299.374 2.273 10 20 CECD CN[C@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 843048788 YRISGGNERLAUTM-VIFPVBQESA-N 272.751 2.369 10 20 CECD CO[C@H]1C[C@H](NCc2ccc(N(C)C)c(F)c2)C1 858322177 PKBXDUWYDKDZTL-HAQNSBGRSA-N 252.333 2.159 10 20 CECD COc1ccc(CNC(=O)NCCC(C)(C)F)c(O)c1 852552234 NTCZCQBMGUBNBM-UHFFFAOYSA-N 284.331 2.338 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)C2(CO)CC2)c1 696063722 PDHNDDBKTYQRIL-MNOVXSKESA-N 265.353 2.212 10 20 CECD C[C@H](NC(=O)NCc1ccc(N(C)C)cc1)C1CC1 31729576 HDOQRIVMZYBXOD-NSHDSACASA-N 261.369 2.350 10 20 CECD C[C@H](NCc1ccnc(N(C)C)n1)c1cc(F)ccc1O 756790726 OSBGZFWRMRILSB-JTQLQIEISA-N 290.342 2.238 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCCF)c1 756765980 UPDAZSNDMKIYQP-VIFPVBQESA-N 255.289 2.189 10 20 CECD CN(Cc1ccccc1)Cc1cc2c(cc1O)OC[C@H]2O 768437723 FIUPTOVXXKJUKE-MRXNPFEDSA-N 285.343 2.450 10 20 CECD CN(C)c1ccc(CNC[C@@H](CO)Cc2ccco2)cc1 768841662 MRDXQNVVDIODRF-HNNXBMFYSA-N 288.391 2.286 10 20 CECD C[C@@H](NC[C@H](O)COCc1ccco1)c1ccccc1O 879648733 BFIJXCSMBFESOU-OLZOCXBDSA-N 291.347 2.214 10 20 CECD COCc1cc(CN[C@H](C)c2ccccc2O)no1 877755519 DAGWLSQCYUMMCB-SNVBAGLBSA-N 262.309 2.377 10 20 CECD COc1ccc(N(C)C[C@@]2(OC)CCOC2)cc1F 877181160 IRWFXTQXGQHKNZ-AWEZNQCLSA-N 269.316 2.076 10 20 CECD CC1(C)CN(Cc2ccc(N3CCC(O)CC3)cc2)C1 877717796 QOVUBQMHOKSKLX-UHFFFAOYSA-N 274.408 2.490 10 20 CECD Cc1ccc(CN2CCCC[C@@H](S(C)(=O)=O)C2)c(O)c1 877480793 HZKONQUKEOLPHA-CQSZACIVSA-N 297.420 2.100 10 20 CECD CCc1nn(C)cc1NCc1cc(OC)c(OC)cc1O 776257442 XDHZLYMCTZVRGJ-UHFFFAOYSA-N 291.351 2.317 10 20 CECD COc1cccc(F)c1C(=O)NCc1ccc(O)c(O)c1 778919386 CCCHJXHNHXXGNO-UHFFFAOYSA-N 291.278 2.176 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCC[C@@H](CF)C1 881599556 BVZVSNNQYWNMRY-QMMMGPOBSA-N 271.263 2.059 10 20 CECD COc1cc(C)cc(CNC[C@@H](CO)C(C)C)c1O 894761875 RACZPHUJPQKAJA-ZDUSSCGKSA-N 267.369 2.063 10 20 CECD CO[C@@H]1Cc2ccc(NC(=O)c3cccc(O)c3O)cc2C1 790927113 DCHVMKUUVIQWSO-CYBMUJFWSA-N 299.326 2.464 10 20 CECD Cc1cc(O)c(CNC(C)(C)C(=O)N2CCCC2)cc1C 793394044 ILSNMCNSUBBIGR-UHFFFAOYSA-N 290.407 2.500 10 20 CECD Cc1cccc(CNc2ccc(C(N)=O)cc2)c1O 83415471 GYRIEEHHNWNHNG-UHFFFAOYSA-N 256.305 2.412 10 20 CECD CC[C@H](NCc1ccc(Br)cc1O)[C@H](C)O 691486630 AYITYVZVHNWVKC-KWQFWETISA-N 288.185 2.404 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2C[C@H](OC)C2)c1 706491277 HUOJZMHSDSFFMO-CKYFFXLPSA-N 251.326 2.229 10 20 CECD CCN(CC)[C@@H]1CCN(Cc2c(O)cccc2OC)C1 768243123 GGWXCTWFULTDGU-CYBMUJFWSA-N 278.396 2.317 10 20 CECD C[C@H](NCC1(C)OCCO1)c1cc(F)cc(F)c1O 1342410047 YBMMXBVIADBTGH-QMMMGPOBSA-N 273.279 2.084 10 20 CECD CN(C)c1cc(F)c(CNC[C@@H]2CC[C@@H](O)C2)cc1F 1261813904 JUWSIGBBIIQNJY-ZYHUDNBSSA-N 284.350 2.281 10 20 CECD O=C(O)[C@@H](NCc1cc(Cl)cc(F)c1O)C1CC1 1601674500 OFBNGCNURHCYGT-JTQLQIEISA-N 273.691 2.138 10 20 CECD O=C(O)c1ccc(C(=O)NCc2c(O)cccc2F)cc1 1606478788 NRCYEWOKJFRMRU-UHFFFAOYSA-N 289.262 2.160 10 20 CECD COC(=O)c1cc(OCCCCC(=O)O)ccc1N(C)C 1598949386 FFCMIECEMVVBMW-UHFFFAOYSA-N 295.335 2.173 10 20 CECD CCCOCCN(C)c1ccc(OCC(=O)O)cc1 1776813985 INBPDBFUWAXWHH-UHFFFAOYSA-N 267.325 2.013 10 20 CECD COc1ccc(N(C)CC[C@@H]2CCNC2)cc1F 259128446 WISSIYRNAGCQAM-NSHDSACASA-N 252.333 2.270 10 20 CECD C[C@H]1C[C@H](CNCc2cc(F)ccc2O)CCO1 272653089 QDKXUGQSFOVANK-WDEREUQCSA-N 253.317 2.436 10 20 CECD CC(=O)c1cc(F)cc(CN2CCN(C)C(C)(C)C2)c1O 110729428 YVYHERGOVYACMW-UHFFFAOYSA-N 294.370 2.260 10 20 CECD C[C@H](CC[S@@](C)=O)NCc1cc(Cl)ccc1O 125469817 KVECOXRJMLBEIF-XLFHBGCDSA-N 275.801 2.292 10 20 CECD Cc1nc2ncnn2c(Sc2nccs2)c1C 301511714 AXSWELJGYVVOHN-UHFFFAOYSA-N 263.351 2.349 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(OC)CCOCC2)c1 186146892 DGUSPZHTYAFBMO-LBPRGKRZSA-N 295.379 2.247 10 20 CECD O=C(Cc1cccs1)NCCc1ccc(O)c(O)c1 156666383 JEXRCFQNDZOCCF-UHFFFAOYSA-N 277.345 2.061 10 20 CECD CSC[C@@](C)(O)CNCc1ccc(N(C)C)c(F)c1 120671403 UYVQKPFRJRYYCI-AWEZNQCLSA-N 286.416 2.095 10 20 CECD Oc1ccc(Cl)cc1CNC[C@H]1CC[C@@H](O)C1 188831490 KYQGWEAAYZBLKK-JOYOIKCWSA-N 255.745 2.296 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)[C@H]2CCOC2)c1O 135148818 NEQJPNXONGSXJC-LBPRGKRZSA-N 283.755 2.469 10 20 CECD COc1ccc(O)c(CN2CC[C@@H]3OCCC[C@H]3C2)c1 245854376 NDCJJSOAEMAPBU-LRDDRELGSA-N 277.364 2.402 10 20 CECD Nc1ccc(CC(=O)NC2(CC(=O)O)CCCCC2)cc1 84161596 NQRSZIRMWCARHF-UHFFFAOYSA-N 290.363 2.105 10 20 CECD COC(=O)[C@@H](C)N(Cc1cccc(OC)c1O)C1CCC1 191649359 MMGMPTKVVDTVAN-LLVKDONJSA-N 293.363 2.317 10 20 CECD COC(=O)[C@H]1CC[C@@H](NCc2cc(C)c(C)cc2O)C1 193502837 WRCUKTNZPLBDMG-GXTWGEPZSA-N 277.364 2.440 10 20 CECD CC[C@]1(CO)CCCN(Cc2cccc(OC)c2O)C1 190211558 FTNHNUWSDLWPJO-INIZCTEOSA-N 279.380 2.385 10 20 CECD OC[C@@H]1CCCN1Cc1cccc(Br)c1O 92455857 LWIMATAGOTXNBD-JTQLQIEISA-N 286.169 2.111 10 20 CECD CCN(C)c1ccc([C@H](C)NCc2ncn(C)n2)cc1 90970133 ZPHVFBDWVCNTCX-LBPRGKRZSA-N 273.384 2.122 10 20 CECD Cc1c(CNC(=O)N=c2cco[nH]2)n(C)c2ccccc12 346895895 MEAITHGZRTXHRW-UHFFFAOYSA-N 284.319 2.218 10 20 CECD Cc1nc(CNCc2ccc3c(c2)CCO3)ccc1C(=O)O 277507177 XWKQUNAAUFFRGX-UHFFFAOYSA-N 298.342 2.313 10 20 CECD CCCN1CCCN(Cc2c(O)cccc2Cl)CC1=O 276703112 UPHMSCWBKAXXPP-UHFFFAOYSA-N 296.798 2.490 10 20 CECD C[C@H](NC[C@@H](O)C1CCOCC1)c1cc(Cl)ccc1O 273480130 LWPRGSSUKXYJCD-ZUZCIYMTSA-N 299.798 2.484 10 20 CECD CO[C@H]1CCCC[C@H]1NC(=O)c1ccc(C)c(O)c1O 272737990 LLCRLGFEOLMKEZ-NEPJUHHUSA-N 279.336 2.094 10 20 CECD CCOc1ccc(O)c(CN(C)[C@@H]2CCC[C@H]2O)c1 289783523 RUQXRNWNZPZFJD-UKRRQHHQSA-N 265.353 2.136 10 20 CECD CN(Cc1cc(Cl)ccc1O)C[C@H](O)C1CC1 809752420 RSFQVOLPLZQKCL-ZDUSSCGKSA-N 255.745 2.248 10 20 CECD CCn1nc(C)c(CC(=O)NCc2ccccc2O)c1C 293685341 LGDCBOXVYHPILH-UHFFFAOYSA-N 287.363 2.084 10 20 CECD CCO/C=C\C(=O)NCc1ccc(N2CCCC2)cc1 816866088 GVLUEZTXOLIJRD-XFXZXTDPSA-N 274.364 2.453 10 20 CECD C[C@@H](NC(=O)CCCCN(C)C)c1ccccc1O 827937185 NRNPFDKKSVYNFR-GFCCVEGCSA-N 264.369 2.301 10 20 CECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)CC(C)C 734503606 SNJWQEFQFJJLRK-UHFFFAOYSA-N 284.425 2.136 10 20 CECD C[C@H](NCCN1C[C@@H]2CC[C@H](C1)O2)c1ccc(F)cc1O 834887909 ABEZVPHWJFTALM-FPMFFAJLSA-N 294.370 2.045 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)NC(CF)CF 836530442 WCWQMLYVIXFMTL-UHFFFAOYSA-N 298.333 2.378 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](O)C(C)(C)C 735841709 VUJOLNOQJFQUMH-AWEZNQCLSA-N 278.396 2.118 10 20 CECD CC(C)(C)N1CC[C@H](N[C@H]2CCc3cccc(O)c32)C1=O 842882266 PPJFXOYLJKDBQV-STQMWFEESA-N 288.391 2.369 10 20 CECD COc1ccc(O)c(CN2CCOC[C@H]2C2CCC2)c1 843427957 DSYJJFPNRFWJCG-HNNXBMFYSA-N 277.364 2.402 10 20 CECD CCc1cccc(CN2CC([C@H]3CCOC3)C2)c1O 848908444 UPBIWBKMYTWUFZ-AWEZNQCLSA-N 261.365 2.423 10 20 CECD C[C@@H](NC(=O)COC(C)(C)C)c1ccccc1O 827941641 UPMDTIMZWRUCTA-SNVBAGLBSA-N 251.326 2.385 10 20 CECD CCN1CC[C@@H](NCCc2ccc(N)cc2)[C@@H](C)C1 841035391 NJKNHNHOAULTKW-XJKSGUPXSA-N 261.413 2.131 10 20 CECD C[C@H]1COCCN(Cc2c(O)ccc3ccncc23)C1 753988101 ZWEDAIXQWDQVFC-GFCCVEGCSA-N 272.348 2.409 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OC[C@H]1CCCOC1 760766838 DVVRCZWOWMJERL-FUEXJSSKSA-N 278.304 2.081 10 20 CECD Oc1cc2c(cc1CN1CCCC3(CC3)C1)[C@H](O)CO2 769798604 NMAYDBIXCAPVHS-CQSZACIVSA-N 275.348 2.194 10 20 CECD CCCN(Cc1ccc(C)cc1O)[C@@H]1CCS(=O)(=O)C1 876537849 FSVVBHXYSLULLF-CQSZACIVSA-N 297.420 2.100 10 20 CECD COc1ccc(O)c([C@H](C)Nc2nnc(C)c(C)n2)c1 775467333 GATUVUGIMWLEMQ-JTQLQIEISA-N 274.324 2.376 10 20 CECD C[C@H](NCc1cc(F)cc(F)c1O)c1nnc2n1CCC2 882886532 YTSWFEYOKCHQNW-QMMMGPOBSA-N 294.305 2.059 10 20 CECD C[C@H]1COC[C@H]1NCc1cc(Cl)cc(F)c1O 896735046 AOVMWJGDFCHQFL-WRWORJQWSA-N 259.708 2.309 10 20 CECD C[C@H](O)[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894423426 RUECWYGABOLLFU-UWVGGRQHSA-N 271.307 2.263 10 20 CECD CC(=O)OC[C@@H](C)NCCCSc1nccs1 893045790 XSUWYEWZRMCSKS-SECBINFHSA-N 274.411 2.167 10 20 CECD COC(=O)N1CCC[C@H](N[C@H](C)c2ccccc2O)C1 783505589 IEWZPAVOYQOPGF-NEPJUHHUSA-N 278.352 2.274 10 20 CECD CCOc1cccc(CNC[C@@H]2CC(C)=NO2)c1O 895309527 CADHZWNGZABWIL-LBPRGKRZSA-N 264.325 2.045 10 20 CECD COc1ccc(CNC(=O)c2ncc(F)cc2F)c(O)c1 794380634 GBVHBQZKXBLJGB-UHFFFAOYSA-N 294.257 2.004 10 20 CECD C[C@@H](C(=O)NCCCSc1nccs1)n1ccnc1 1318659224 CXKOQPNKCRLAKE-JTQLQIEISA-N 296.421 2.199 10 20 CECD C[C@H](C[S@@](C)=O)NCc1ccc(N2CCCC2)cc1 168149892 DJMOGJSPFKJJJI-YJYMSZOUSA-N 280.437 2.143 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1c[nH]c2ncccc12 194019155 PVEKGHYMSADZHT-UHFFFAOYSA-N 289.316 2.069 10 20 CECD O=C(O)CCCC(=O)Nc1c(Cl)ccc2nonc12 1601979565 DDNQCQVHGGFHQM-UHFFFAOYSA-N 283.671 2.070 10 20 CECD C[C@@H](C(=O)O)C(=O)NCc1ccc(N2CCCCC2)cc1 1588573993 RJQHRDWGNNIYCH-GFCCVEGCSA-N 290.363 2.014 10 20 CECD C[C@H](CO)CCCN[C@@H](C)c1cc(C(=O)O)ccc1O 1592758589 SXAQBCYWESPZAG-QWRGUYRKSA-N 281.352 2.150 10 20 CECD C[C@H](N=c1cc[nH]c(C(=O)O)c1)c1ccc(N(C)C)cc1 1776456645 HONUTURRANVMQX-NSHDSACASA-N 285.347 2.441 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1CCCCO1 158246075 JKQMOLPOYLQWFT-JTQLQIEISA-N 286.422 2.311 10 20 CECD Cc1nn(C(C)C)cc1C(=O)NCc1ccc(N)cc1 848940417 NFEGGMOABCNNQQ-UHFFFAOYSA-N 272.352 2.285 10 20 CECD CCC(=O)N1C[C@@H](NCc2ccc(OC)c(C)c2)[C@H](C)C1 1054307164 ICUCZZQKQGCKAY-UKRRQHHQSA-N 290.407 2.350 10 20 CECD Cc1noc(C)c1C(=O)N[C@H](C)c1ccccc1O 827922888 CDWKTYCWDRGNBO-MRVPVSSYSA-N 260.293 2.488 10 20 CECD O=C(CCNCc1cc(F)ccc1O)N1CCCCC1 226585270 ZDEGKONGIRDFSZ-UHFFFAOYSA-N 280.343 2.024 10 20 CECD CC[C@H](C)[C@H](NCc1ccc(N(C)C)cc1)C(=O)OC 37102577 XQCYRWFMAUXOIL-WFASDCNBSA-N 278.396 2.430 10 20 CECD COc1ccc(O)c([C@H](C)NCC2([S@@](C)=O)CCC2)c1 281071300 OGOCLBCPEJUQGK-PRWKNARSSA-N 297.420 2.353 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](C(C)C)N(C)C)c1 106917591 UBQCQLYNWOCAHQ-NHYWBVRUSA-N 294.395 2.164 10 20 CECD C[C@H](NCc1nnc2n1CCCC2)c1ccccc1O 179897699 MDIOSSXPSZRYDN-NSHDSACASA-N 272.352 2.171 10 20 CECD CN(C)c1ccc(CNC(C)(C)CCS(C)(=O)=O)cc1 174639040 QEJHDDGPWGGZNC-UHFFFAOYSA-N 298.452 2.056 10 20 CECD CCOC(=O)[C@H](NCc1ccc2c(c1)CCCO2)C1CC1 1355284473 SQFRNHRZNNVSBH-MRXNPFEDSA-N 289.375 2.443 10 20 CECD COc1ccc(N2CCN(C(=O)C3=CCCC3)CC2)cc1 177691869 ZVALJTPSNPEYQC-UHFFFAOYSA-N 286.375 2.454 10 20 CECD CCOC(=O)[C@@H](NCc1cccc(OC)c1O)[C@H](C)CC 187870737 JXCIEGJQKHQGIH-RISCZKNCSA-N 295.379 2.468 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 182343862 AUGLUFIVAZOBOG-GRYCIOLGSA-N 294.395 2.355 10 20 CECD C[C@H](N[C@H](C)CCCO)c1ccc(F)c(F)c1O 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CSCC[C@H](NCc1cccc(C)c1O)C(=O)N(C)C 809785435 WMBAWIATHRCBQA-ZDUSSCGKSA-N 296.436 2.000 10 20 CECD CC[C@@H]1CN(C)CCN1Cc1ccc(N(C)C)cc1 816660917 UXQALDPEEASLPE-OAHLLOKOSA-N 261.413 2.279 10 20 CECD CCOc1ccc(CNCC[C@@H](C)OC)c(O)c1 726607565 QGGAXMAQTQGTSS-LLVKDONJSA-N 253.342 2.306 10 20 CECD Cc1cc(O)c(CNCC[C@@]2(O)CCCOC2)cc1Cl 826142440 CFJRTJUUWUZKTE-HNNXBMFYSA-N 299.798 2.375 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)c1ccn(C)n1 839190931 LKUOCMGPFDYEJG-LLVKDONJSA-N 276.359 2.476 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1ccncn1 839922254 SOUVSTRRDBQSLK-CYBMUJFWSA-N 298.390 2.212 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2cnc(C)cn2)c1 834908368 JEYTXBPDYROBQM-GFCCVEGCSA-N 287.363 2.393 10 20 CECD CC(C)[C@@H](N)CNCc1c(O)ccc(Cl)c1F 841028734 CZIICVGIYVFCSD-JTQLQIEISA-N 260.740 2.258 10 20 CECD Cc1cc(O)c(CN[C@@H](C)C(=O)NC(C)C)cc1C 840974867 PGQDRZDWBUGFPU-LBPRGKRZSA-N 264.369 2.012 10 20 CECD O=C(O[C@@H](C(=O)O)c1ccccc1)c1cc(O)cs1 740297473 HVYDECUJHBBMRE-LLVKDONJSA-N 278.285 2.436 10 20 CECD NC[C@H]1CCCC[C@@H]1NCc1cccc(F)c1O 841028988 DCDGIVANLNZUNY-MFKMUULPSA-N 252.333 2.138 10 20 CECD COc1cccc([C@@H](C)NCC(C)(C)CCO)c1O 846144713 INMSFTOBWFPXCW-LLVKDONJSA-N 267.369 2.460 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CO)CC1CC1 840937776 XRWBPHUZFNSIHZ-HNNXBMFYSA-N 262.397 2.312 10 20 CECD COc1ccc(O)c(CN[C@H]2CCCC[C@H]2CN)c1 841028658 BXEDWBOFQGUJGG-FZMZJTMJSA-N 264.369 2.008 10 20 CECD CCOC(=O)c1cnc(S[C@H](C)[C@H](C)O)s1 390476025 JDDJOKCVKSRRSX-NKWVEPMBSA-N 261.368 2.181 10 20 CECD C[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccc(Cl)cc1O 841755103 NLZMGRSKSJWNDZ-BXKDBHETSA-N 282.771 2.317 10 20 CECD CCOc1cncc(CNCc2cccc(OC)c2O)c1 857046783 RSZTUOROKLBCBS-UHFFFAOYSA-N 288.347 2.484 10 20 CECD C[C@H](NCC(=O)NC1CCCC1)c1cc(F)ccc1O 756705492 KJFOYWRPGSOOPR-JTQLQIEISA-N 280.343 2.241 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc(C2CC2)nn1C 934705871 ZVNMGKRCZAESAU-UHFFFAOYSA-N 285.347 2.275 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@@H]2C(=O)O)cc1 864526929 SONKRHOSLINDBE-UONOGXRCSA-N 262.353 2.096 10 20 CECD CC(C)C1(C(=O)NCc2ccc(N(C)C)c(F)c2)COC1 931146980 NPQGDVGCYHITNG-UHFFFAOYSA-N 294.370 2.181 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](N)C[C@@H]2C)c1O 866684008 UIXCNYRFRFXZPS-UFBFGSQYSA-N 282.771 2.170 10 20 CECD CCC[C@@]1(CO)CCCN1C(=O)c1ccc(C)c(O)c1O 768936246 SMPZQDYJNYHXJN-INIZCTEOSA-N 293.363 2.173 10 20 CECD C[C@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@@]1(C)CO 862418029 KCLMVKZOZUOQNN-ZBEGNZNMSA-N 298.377 2.481 10 20 CECD Cc1ccc(O)c(CNC(=O)c2conc2C2CC2)c1 862756405 XIADUCIGPMSWKU-UHFFFAOYSA-N 272.304 2.496 10 20 CECD CCOc1ccc(CN2CCOC[C@@H]2C2CC2)c(O)c1 769485386 PWELTUXIAWRNPB-OAHLLOKOSA-N 277.364 2.402 10 20 CECD CO[C@H](CNCc1ccc(N(C)C)cc1)C1CCOCC1 876905518 IDBLBCHNZZJHMY-QGZVFWFLSA-N 292.423 2.284 10 20 CECD CN(C)c1cc(F)c(CN[C@@H](CO)CC(F)F)cc1F 1118859491 JQRCGDJIOHOJQU-SECBINFHSA-N 294.292 2.137 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)CC(C)(C)OC)c1O 774910461 AVDOWMNJGRAFTG-UHFFFAOYSA-N 298.339 2.166 10 20 CECD CO[C@H](C)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 785894378 QBYMUAZNDUXZOX-VXGBXAGGSA-N 279.384 2.148 10 20 CECD Cc1ccc(C(=O)N2CCOC(C)(C)[C@@H]2C)c(O)c1O 780984999 SVKQDGHYYFVHMN-JTQLQIEISA-N 279.336 2.046 10 20 CECD C[C@@H]1CN(Cc2ccc3ccccc3c2O)C[C@H]1O 897681186 YRUSVPLOFDNCNC-IAQYHMDHSA-N 257.333 2.358 10 20 CECD COc1cccc(CNCc2cnn3ccccc23)c1O 796479306 CYJVDWMFZMDREN-UHFFFAOYSA-N 283.331 2.338 10 20 CECD CCn1cc(CNCc2ccc(OC)cc2O)c(C)n1 894185437 NWCCDPBXCCKIDK-UHFFFAOYSA-N 275.352 2.215 10 20 CECD COCCC1(NCc2cc3c(cc2O)OCO3)CCC1 793329221 LIQZWDALFVIAMH-UHFFFAOYSA-N 279.336 2.170 10 20 CECD CC[C@H](NCc1nnc(C)n1C)c1ccc(N(C)C)cc1 1319198988 KQPCDIGILWYOCB-HNNXBMFYSA-N 287.411 2.430 10 20 CECD CN[C@H](C)CCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1327485854 IWMLINZLKBVSSL-OLZOCXBDSA-N 292.427 2.111 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)[C@H]1CCNC1 1326201233 VCJJBIHFYBYFMU-INIZCTEOSA-N 259.397 2.081 10 20 CECD CCC1(CNC(=O)NCc2ccc(N)cc2)CCOCC1 1335516661 AYRDGULIJWTPHV-UHFFFAOYSA-N 291.395 2.275 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)[C@@H]1CCCNC1 699664735 JUGKGWGWIPXFFV-DZGCQCFKSA-N 261.413 2.230 10 20 CECD Cc1ccc(O)c(CN[C@@H]2CCn3ccnc3C2)c1 778188722 IDEYEZPSSXEIFK-CYBMUJFWSA-N 257.337 2.002 10 20 CECD O=C(O)c1cnc(NCc2c(O)cccc2O)c(Cl)c1 1602533802 OIMBDUJGBGNMMC-UHFFFAOYSA-N 294.694 2.457 10 20 CECD C[C@@H]1CN(Cc2ccc(F)c(F)c2O)C[C@H]1CC(=O)O 1607438447 CGBKJYBDLMKGNB-PSASIEDQSA-N 285.290 2.213 10 20 CECD C[C@@H]1C[C@@H](NCCC(=O)O)c2c(O)ccc(F)c21 1589291817 UVZMALAIRCLGFC-VXNVDRBHSA-N 253.273 2.144 10 20 CECD C[C@](CCF)(NCc1c(O)ccc(Cl)c1F)C(=O)O 1592505420 BKNQNNBFURDNEV-GFCCVEGCSA-N 293.697 2.477 10 20 CECD Cc1ccc(CC(=O)NCc2ccc(O)c(O)c2)cc1 158873261 PAJKPPDOEBXJDL-UHFFFAOYSA-N 271.316 2.265 10 20 CECD CC[C@@H](NCCO[C@@H]1CCOC1)c1ccccc1O 927080448 KVJZACDLWWFPJK-TZMCWYRMSA-N 265.353 2.238 10 20 CECD CNCCC1CCN(Cc2cc(F)ccc2O)CC1 220342304 PYVYYSNKGSBZTK-UHFFFAOYSA-N 266.360 2.353 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCC[C@H](O)C2)c1 224866409 AVSDOPVGTILFLW-AAEUAGOBSA-N 265.353 2.042 10 20 CECD CNCc1ccc(NC(=O)c2cccc(O)c2O)cc1 234385685 XWUZZVWZGUDUPT-UHFFFAOYSA-N 272.304 2.070 10 20 CECD C[C@H]1CC[C@@H](C)N1[C@H](C)C(=O)NCc1ccccc1O 263696151 NLOMJAQNUFAERQ-FRRDWIJNSA-N 276.380 2.270 10 20 CECD CC[C@]1(NCc2cc(OC)ccc2O)CCOC1 386016479 WDDOTJUPDXWDAI-AWEZNQCLSA-N 251.326 2.060 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccc(=O)[nH]c1 66096728 NAOIYTMAQMRGIM-UHFFFAOYSA-N 286.331 2.133 10 20 CECD CCN(CC)c1ccc(CNC(=O)N(C)C[C@@H](C)O)cc1 179591134 PGVCGHIJTPMAJB-CYBMUJFWSA-N 293.411 2.055 10 20 CECD Cc1ccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)cn1 183484579 KRLULWNIJWDDMZ-LLVKDONJSA-N 286.331 2.162 10 20 CECD Cn1cc(/C=C/C(=O)N2CCCc3ccccc32)cn1 32537761 RDQKMZZYXBKBNY-CMDGGOBGSA-N 267.332 2.413 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CC(C)(C)OC2(C)C)c(O)c1O 183002844 XJLZSUIYQFJVFT-LLVKDONJSA-N 293.363 2.482 10 20 CECD COCCN1CCC(N[C@H](C)c2ccc(F)cc2O)CC1 185144831 VCOLTTRKOGMFHG-GFCCVEGCSA-N 296.386 2.293 10 20 CECD CC[C@H]1CN(C(=O)Cc2ccc(N)cc2)CCS1 157088444 PXQJYCYWVIFIHF-ZDUSSCGKSA-N 264.394 2.165 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)COC(C)(C)C)c1 182345227 AYHRWUDUVDUGEL-JTQLQIEISA-N 281.352 2.393 10 20 CECD O=C(CCc1ccsc1)NCCc1ccc(O)c(O)c1 96968120 VMBXMKFBUJBVLE-UHFFFAOYSA-N 291.372 2.451 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)[S@](=O)CC2)cc1C 277808543 YBHUHZBFPKGCLP-ORAYPTAESA-N 281.421 2.352 10 20 CECD CCC(O)(CC)CCNC(=O)c1ccc(C)c(O)c1O 276451137 MNEBGUMPVAMIND-UHFFFAOYSA-N 281.352 2.077 10 20 CECD OC[C@@]1(F)CCN(Cc2c(O)ccc(Cl)c2F)C1 802661662 VAZBVCOOUWYQOU-GFCCVEGCSA-N 277.698 2.091 10 20 CECD CC(C)n1ccc(C(=O)NCCc2ccc(N)cc2)n1 269146951 HBANZZPIKCUOQE-UHFFFAOYSA-N 272.352 2.019 10 20 CECD C[C@H](NC(=O)[C@@](C)(O)C1CCC1)c1ccc(N(C)C)cc1 813525324 QDHYTBSWKVAOSY-SJCJKPOMSA-N 290.407 2.481 10 20 CECD COc1ccc(O)c([C@H](C)NCCCNC(C)C)c1 817952597 GDPDUNVCVLNTMZ-LBPRGKRZSA-N 266.385 2.440 10 20 CECD C/C(=C\C(=O)N1CCCc2ncccc21)c1cnccn1 824230960 FKUFUOIDLOXJES-ZRDIBKRKSA-N 280.331 2.254 10 20 CECD Cc1cc(O)c(CN(C)CCN2CCOCC2)cc1Cl 824693247 DRFYCBCLMXNSEG-UHFFFAOYSA-N 298.814 2.118 10 20 CECD COCc1nc(C)c(C(=O)NCc2ccc(N)cc2)s1 837302807 HSHQMNRDOKNSBR-UHFFFAOYSA-N 291.376 2.110 10 20 CECD CC[C@@](C)(CNC(=O)NCc1ccccc1O)OC 836579829 QNWMITJFZIIEPW-AWEZNQCLSA-N 266.341 2.007 10 20 CECD COc1ccc(N(CC[S@](C)=O)CC2CC2)cc1 831587461 AMBXQEYHTOKIPU-SFHVURJKSA-N 267.394 2.290 10 20 CECD CCOC(=O)CCSc1ncc(C(=O)OCC)s1 866030915 OGFDIOKFNRKNNZ-UHFFFAOYSA-N 289.378 2.365 10 20 CECD Cc1nc(CCC(=O)NCc2ccc(O)cc2O)cs1 910950537 HCNSZSNIWKBPKZ-UHFFFAOYSA-N 292.360 2.112 10 20 CECD N[C@@H]1CCC[C@H]2CN(Cc3cccc(F)c3O)C[C@@H]12 843059284 JBZZVXGKYFFZAD-ZKYQVNSYSA-N 264.344 2.091 10 20 CECD COc1ccc(CNCCc2ccc(N)cc2)cc1O 841034556 CJOIKYRFPMUJSQ-UHFFFAOYSA-N 272.348 2.315 10 20 CECD Cc1cc(N(C)C)ccc1CNCCC1(CO)CC1 840951023 QZJZWTJMMROYRI-UHFFFAOYSA-N 262.397 2.313 10 20 CECD C[C@H](CN)CNCc1cc(Cl)cc(Cl)c1O 841048109 GYGZZCUKLWZMHI-SSDOTTSWSA-N 263.168 2.383 10 20 CECD COc1cccc([C@@H](C)NC[C@H](O)COCC(C)C)c1O 846142124 CADSAINHINDQOW-OLZOCXBDSA-N 297.395 2.085 10 20 CECD Cc1nc2ncnn2c(NCc2ccccc2O)c1C 750170585 XHZROQNZAWXMAM-UHFFFAOYSA-N 269.308 2.059 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@@H]3NC(=O)CC[C@H]3C2)c1 853554677 BZTJFXHPTFKPNY-ZFWWWQNUSA-N 288.391 2.110 10 20 CECD Cc1[nH]c(C(=O)N(C)Cc2ccccc2O)c(C)c1C=O 860048265 RXACDKIERKNDKA-UHFFFAOYSA-N 286.331 2.422 10 20 CECD CN(C)Cc1ccsc1C(=O)NCc1ccccc1O 769363573 VIHCYYJOUHSDKM-UHFFFAOYSA-N 290.388 2.445 10 20 CECD CCCN(CCO)Cc1c(O)cccc1Br 862213813 VQWQTFDNGFASLD-UHFFFAOYSA-N 288.185 2.359 10 20 CECD Cc1cccc(O)c1CNCc1ccc(CO)cc1 877604015 GVDUJZVZFSAAJJ-UHFFFAOYSA-N 257.333 2.483 10 20 CECD C[C@@H]1SCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@H]1C 768447249 NSLHLZGKBNIORS-BHDSKKPTSA-N 295.404 2.144 10 20 CECD COc1cccc(CNC(=O)c2ccc(C(C)=O)o2)c1O 772411728 YSMGHHJMAKKJFN-UHFFFAOYSA-N 289.287 2.126 10 20 CECD CS/C=C\C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773749630 RUVXFJFKIKXRIY-SSJHQANKSA-N 267.350 2.022 10 20 CECD CC[C@@H](O)c1cn(Cc2ccc(N(C)CC)cc2)nn1 881314988 KEODWCLBSLUMRF-OAHLLOKOSA-N 274.368 2.226 10 20 CECD C[C@H]1OCC[C@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 770618449 OXTRHWZZZQBTJP-IUODEOHRSA-N 276.380 2.136 10 20 CECD CC(C)OCCCC(=O)OCC(=O)c1ccc(O)c(O)c1 784669503 UZWKRZADFAJZNM-UHFFFAOYSA-N 296.319 2.029 10 20 CECD O=C(OCc1ccc(F)cn1)c1cc(O)cs1 787702304 CRJKOITYEPIVJG-UHFFFAOYSA-N 253.254 2.345 10 20 CECD CC(C)CO[C@H]1CCN(C(=O)NCc2ccc(N)cc2)C1 1120592508 ZLCRGYIOUDYTJQ-HNNXBMFYSA-N 291.395 2.225 10 20 CECD COc1ccc(O)c(CNC(=O)NC[C@H]2C=CCC2)c1 883412203 SXWBWOBTVXMGKH-NSHDSACASA-N 276.336 2.166 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@]2(C)CO)c1 789558599 ZTYBSLUEPUHDGU-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CC(C)=CC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 891256905 BLWFMWBZBMXFAZ-MRXNPFEDSA-N 289.423 2.438 10 20 CECD COc1ccc(CNC[C@@H]2C[C@@H](C)O[C@@H]2C)c(O)c1OC 894909442 COLFSYFEVYAPOW-WZRBSPASSA-N 295.379 2.313 10 20 CECD OC[C@@H]1Cc2ccccc2N1Cc1ccccc1O 895244723 MQJVOTWTBTZHLD-AWEZNQCLSA-N 255.317 2.316 10 20 CECD CN(Cc1ccon1)Cc1cc(F)cc(F)c1O 894040634 XARVEAAQFKFELQ-UHFFFAOYSA-N 254.236 2.290 10 20 CECD CC1=NO[C@@H](CNCc2cccc(Cl)c2O)C1 895306201 AVGIYVIQRPPAHY-SNVBAGLBSA-N 254.717 2.300 10 20 CECD Cc1ccc(C[C@H](CO)NC(=O)c2cc(O)cs2)cc1 788005980 POGOHMBJRMDODS-GFCCVEGCSA-N 291.372 2.096 10 20 CECD CCc1cccc(CNc2cc(CO)ccn2)c1O 895038560 UMSMSUYDWODUQS-UHFFFAOYSA-N 258.321 2.454 10 20 CECD COc1ncc(Cl)c(N(C)Cc2ccccc2O)n1 302605154 CZAWXCHKLSBJOD-UHFFFAOYSA-N 279.727 2.481 10 20 CECD COc1ccc(O)c(CN[C@H]2CCC[C@@H]2CCO)c1 190304482 MDAQKAMPHHCNAZ-RISCZKNCSA-N 265.353 2.042 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Br)CCO1 707134668 JMWZIVIRXKIQSD-SECBINFHSA-N 286.169 2.375 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(Br)cc2O)CO1 691429782 WZHFSORFJMUUOS-LDYMZIIASA-N 286.169 2.422 10 20 CECD CC[C@H]1CN(C(C)=O)[C@H](CC)CN1Cc1ccc(N)cc1 1336116962 JJOANUVVXQRVEU-DLBZAZTESA-N 289.423 2.490 10 20 CECD COC(=O)[C@H]1CC12CCN(Cc1ccc(N)cc1)CC2 1337838990 YKQOLVQCIJIUSU-CQSZACIVSA-N 274.364 2.044 10 20 CECD CCCn1c(C)nnc1CSc1ncc(C(=O)O)s1 1596108593 FGRGANYYNBZAMP-UHFFFAOYSA-N 298.393 2.444 10 20 CECD Cc1ccc(CN2CC[C@H](C)[C@H](C(=O)O)C2)c(O)c1 1594360371 WXEOCMFMHZYRRR-WCQYABFASA-N 263.337 2.243 10 20 CECD C[C@H](NC(=O)N[C@H]1CC[C@@H](C(=O)O)C1)c1ccccc1O 1594235587 PWKJFAIXBHRZJE-AXFHLTTASA-N 292.335 2.006 10 20 CECD CCN1CCc2cc(CNC3([C@H](C)C(=O)O)CC3)ccc21 1776877583 WAYZJXFWFBMGMC-GFCCVEGCSA-N 288.391 2.412 10 20 CECD CCOC(=O)C1CCN(Cc2cc(C)ccc2O)CC1 158104381 KVHKORNUSOSXNS-UHFFFAOYSA-N 277.364 2.476 10 20 CECD COc1cc(Cl)cc(CN(C)Cc2nccn2C)c1O 228677714 GPEDJIHGGKQYEE-UHFFFAOYSA-N 295.770 2.420 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccccc21 126225653 GTBVEJICUVLAEU-UHFFFAOYSA-N 255.273 2.301 10 20 CECD C[C@@H](NC[C@](C)(O)C(F)(F)F)c1cc(F)ccc1O 273478919 LLYQEOFBYVYROF-HQJQHLMTSA-N 281.249 2.495 10 20 CECD OCC(F)(F)CNCc1ccc(N2CCCCC2)cc1 183866611 CJTACWFIOYEXQV-UHFFFAOYSA-N 284.350 2.394 10 20 CECD COc1cc(Cl)cc(CNC[C@H]2CC[C@H](O)C2)c1O 187985373 KNGNNEMKBUALRY-CABZTGNLSA-N 285.771 2.305 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cnc(C)n2C)c1 689239888 PBCWMBIJNVTWSO-JTQLQIEISA-N 275.352 2.294 10 20 CECD CO[C@@H]1COC[C@H]1NCc1cc(Cl)cc(Cl)c1O 842752537 OKWQKUHWGMQICB-GHMZBOCLSA-N 292.162 2.202 10 20 CECD CCNC(=O)NCc1ccc(N(CC)CC)c(F)c1 66975550 IVTGNZKISPRTGW-UHFFFAOYSA-N 267.348 2.491 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)Cn2cncn2)cc1 67504948 INBFFIYSRIPGEE-CQSZACIVSA-N 287.411 2.303 10 20 CECD Cc1occc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183424576 MAUVMTGQXAKDBQ-VIFPVBQESA-N 275.304 2.360 10 20 CECD CN(C)c1ccc(CNC(=O)Cc2ccoc2)cc1F 121676841 RBTLQXAAWZXOHC-UHFFFAOYSA-N 276.311 2.344 10 20 CECD CC[C@H]1COCCN1Cc1cc(OC)ccc1O 132339249 OPWVHBODHUKJOO-LBPRGKRZSA-N 251.326 2.012 10 20 CECD COc1ccc(C(=O)NCc2ccccc2O)c(OC)c1 133787239 HQLDFWWZSKMTGM-UHFFFAOYSA-N 287.315 2.339 10 20 CECD COc1cc(C)ccc1CNC(=O)c1cccc(O)c1O 193132590 GULNWMVKDYWRBZ-UHFFFAOYSA-N 287.315 2.345 10 20 CECD Oc1ccc(F)cc1CN[C@@H]1CCO[C@H]1C1CC1 226618168 VCKXSESNABGUED-OCCSQVGLSA-N 251.301 2.188 10 20 CECD Cc1cc(O)c(CN(CC(N)=O)Cc2ccccc2)cc1C 93358483 PGUJKIZXPWCOEQ-UHFFFAOYSA-N 298.386 2.497 10 20 CECD COc1cccc(CNC[C@]2(O)CCc3ccccc32)c1O 269798555 IUUMETBCWLIXNO-GOSISDBHSA-N 299.370 2.324 10 20 CECD CCOC1CC(O)(CNCc2ccc(OC)c(C)c2)C1 277453751 AIZASTQSIZFSAQ-UHFFFAOYSA-N 279.380 2.023 10 20 CECD COCC[C@@H]1COCCN1Cc1cc(C)c(C)cc1O 365804672 RAARIEUUUWUTDJ-OAHLLOKOSA-N 279.380 2.246 10 20 CECD COc1ccc(O)c(CN(C)Cc2ccccn2)c1 273377776 HDSIKIAHHQZDGB-UHFFFAOYSA-N 258.321 2.428 10 20 CECD CCC(CC)CNC(=O)c1c(F)ccc(O)c1O 276664304 YLDPHEHIFYHBTM-UHFFFAOYSA-N 255.289 2.403 10 20 CECD CCCCN(CCCS(C)(=O)=O)Cc1ccccc1O 282564130 YSJMSCKXUSEYLH-UHFFFAOYSA-N 299.436 2.429 10 20 CECD CCOc1ccc(CN(C)CCCN(C)C)c(O)c1 809729977 VNMFBSNKWZHHAJ-UHFFFAOYSA-N 266.385 2.174 10 20 CECD CC(=O)C(=O)COC(=O)c1cc2c(F)cccc2s1 808486648 GUTYHCABFWUQQL-UHFFFAOYSA-N 280.276 2.355 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N(C)CCO)cc1 298418917 FWEBHIYNRGIQJO-UHFFFAOYSA-N 272.348 2.158 10 20 CECD CC[C@@H](NC[C@H]1CNCCO1)c1cccc(Cl)c1O 817984189 VTYKENPGRZUFKR-ZWNOBZJWSA-N 284.787 2.075 10 20 CECD Cc1cc(CN2C[C@@H](CO)OC(C)(C)C2)ccc1N(C)C 817278429 AYTHWEQBOKSCIN-HNNXBMFYSA-N 292.423 2.033 10 20 CECD CC(C)[C@H](O)C(=O)NCc1cc(Cl)cc(Cl)c1O 813684834 OTWBQZAAMADJKT-JTQLQIEISA-N 292.162 2.332 10 20 CECD CNCCN[C@@H](C)c1ccc(N2CCOCC2)cc1Cl 817954389 YSZDRVYUPNUNBC-LBPRGKRZSA-N 297.830 2.047 10 20 CECD Cc1cc(O)c(CN2CCC3(C2)OCCO3)cc1Cl 824701710 FJJCQWYTVBHLEP-UHFFFAOYSA-N 283.755 2.303 10 20 CECD O=C1[C@H](N[C@@H]2CCc3cccc(O)c32)C[C@H]2CCCCN12 834911870 BGJONJJSLUWRLF-MGPQQGTHSA-N 286.375 2.123 10 20 CECD CCNC(=O)CN(Cc1ccccc1O)C1CCCC1 733613235 GGJYHUCTABGDMB-UHFFFAOYSA-N 276.380 2.273 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@@H]1CCc2cccc(O)c21 834765511 NBSPOJUAWHELPH-UMVBOHGHSA-N 277.364 2.163 10 20 CECD Cn1c(Cl)cnc1COC(=O)c1cc(O)cs1 732354973 YIEKUFRYRHQODM-UHFFFAOYSA-N 272.713 2.198 10 20 CECD CC(=O)N1CCC(CN[C@H]2CCc3cccc(O)c32)CC1 834570405 GRISXXIFLJNKOF-HNNXBMFYSA-N 288.391 2.228 10 20 CECD Cc1nn(C)c(C)c1[C@H](C)C(=O)NCc1ccccc1O 748347258 XPCXSCMCTHMXKP-JTQLQIEISA-N 287.363 2.162 10 20 CECD Cc1cc(Br)c(O)c(CNC[C@@H](C)CN)c1 841049520 SYKUUOLVXUEVRJ-VIFPVBQESA-N 287.201 2.148 10 20 CECD C[C@H](NCC1(O)CCN(C)CC1)c1ccc(Cl)cc1O 841748939 CDNXSQDWIGNXNJ-NSHDSACASA-N 298.814 2.153 10 20 CECD Oc1c(F)cccc1CN1CCC([C@H]2CCNC2)CC1 843127443 RCWBYOBMVSFLIN-ZDUSSCGKSA-N 278.371 2.353 10 20 CECD COc1ccc(N2CCC(N[C@H]3CO[C@H](C)C3)CC2)cc1 842673334 JNMBPRCQGADIHB-UKRRQHHQSA-N 290.407 2.431 10 20 CECD CCc1ncc(CN(C)Cc2ccccc2O)cn1 840909849 AAYGOUXHVXLMJP-UHFFFAOYSA-N 257.337 2.377 10 20 CECD C[C@@H](COCC1CC1)NC(=O)/C=C\c1ccc(O)c(O)c1 846528601 NTWQIZLRDDEGAN-XOIDGJRKSA-N 291.347 2.042 10 20 CECD CC(C)n1nccc1CNCCc1ccc(N)cc1 841037556 AOLFULBDELZPNM-UHFFFAOYSA-N 258.369 2.379 10 20 CECD CNCC1CCN(Cc2cc(C)c(C)cc2O)CC1 843049428 LNWZVTUNBZEVKC-UHFFFAOYSA-N 262.397 2.440 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1NCC1(C)C 843412137 AYWUKFWQTCIJAZ-AWEZNQCLSA-N 276.380 2.129 10 20 CECD COc1cccc([C@H](C)NCCc2cn[nH]c2)c1O 846170163 JBNPPNFAUXCYET-JTQLQIEISA-N 261.325 2.017 10 20 CECD COc1ccc(N(C)Cc2cnn(C)c2)cc1OC 749905485 JJYLFVGXYDJGKJ-UHFFFAOYSA-N 261.325 2.074 10 20 CECD Cc1cccc(CNCc2ccc(CN)cc2)c1O 843127694 GMVVUMQDQNIRKO-UHFFFAOYSA-N 256.349 2.449 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)OCCF 858987781 DKHYOLSVFLBNLY-UHFFFAOYSA-N 254.305 2.257 10 20 CECD CN(C)c1ccc(CNC(=O)Cn2cc(C3CC3)cn2)cc1 854271414 GALLDZQJTKKJTN-UHFFFAOYSA-N 298.390 2.143 10 20 CECD COCC[C@](C)(O)CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756583610 CIMWWDOKVZLHDL-PKWAYOAASA-N 297.370 2.457 10 20 CECD COc1ccc(N(Cc2ncnn2C)CC(C)C)cc1 750045386 SWYIRIOHYGKZMD-UHFFFAOYSA-N 274.368 2.486 10 20 CECD Cc1ccc([C@@H](C)N[C@H](CO)C2CCOCC2)c(O)c1C 757656447 AAOVNZDMLQIUAL-CZUORRHYSA-N 293.407 2.447 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)c3cccn32)c1 862755456 HMBYIUVVQIWLEQ-AWEZNQCLSA-N 298.342 2.336 10 20 CECD CO[C@@H](CNCc1ccc(N(C)C)cc1)C1CCOCC1 876905517 IDBLBCHNZZJHMY-KRWDZBQOSA-N 292.423 2.284 10 20 CECD COC(=O)COc1ccc(N(C)C[C@H]2CCO[C@H]2C)cc1 878406799 DABGKPLZASLKIV-QWHCGFSZSA-N 293.363 2.100 10 20 CECD CCn1cccc(CN[C@H](C)c2ccccc2O)c1=O 788605824 QJVWSOFIQVJIAI-GFCCVEGCSA-N 272.348 2.425 10 20 CECD Nc1ccc(CNC(=O)c2conc2C2CC2)cc1 1122445089 LVZSZFBTDRSGGA-UHFFFAOYSA-N 257.293 2.064 10 20 CECD CC1(C)CCN(CCNCc2cc([N+](=O)[O-])ccc2O)C1 898035061 IVDCUTLQDZWYQY-UHFFFAOYSA-N 293.367 2.122 10 20 CECD CCc1nc([C@@H](C)NCc2cc(C)cc(OC)c2O)n[nH]1 894370708 OEZXHOBJXTXDBS-SNVBAGLBSA-N 290.367 2.241 10 20 CECD COc1cc(O)c(CN2CCCCC[C@@H]2CO)cc1OC 895150305 JSHHSJCLCQMMNL-CYBMUJFWSA-N 295.379 2.146 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(F)cc(F)c2O)[C@@H]1C 894538048 NTZQDSPPHDKDTA-KCJUWKMLSA-N 285.290 2.054 10 20 CECD COc1ccc(CNC(=O)c2cccc(O)c2O)c(F)c1 790878212 QPBDRMPUUAUOTM-UHFFFAOYSA-N 291.278 2.176 10 20 CECD C[C@H](N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21)C(=O)N(C)C 790743702 YHBUYEVPZBZECC-WCABBAIRSA-N 280.343 2.146 10 20 CECD CCOc1cccc(CN2C[C@H](C)OC[C@H]2C)c1O 245930787 PIXTUTQAJVVZTB-NEPJUHHUSA-N 265.353 2.400 10 20 CECD CCC[C@@](C)(N)C(=O)N[C@H](C)c1ccccc1O 870988060 FIWQKTOWWLLCEI-QMTHXVAHSA-N 250.342 2.087 10 20 CECD CCOc1cccc(CN2CCC[C@@H](CCN)C2)c1O 70169571 ADZOBZDLSFJCRC-ZDUSSCGKSA-N 278.396 2.352 10 20 CECD CCN(CC)c1ccc(CNC[C@@H](O)C2CC2)cc1 71300476 QEEFMXSHGLFURR-MRXNPFEDSA-N 262.397 2.393 10 20 CECD O=C(NCCCC(F)F)NCc1ccccc1O 1263143014 ROZJBNKTAAAHQK-UHFFFAOYSA-N 258.268 2.237 10 20 CECD Nc1ccc(CN2CCC[C@@H]([C@@H]3CCNC3)C2)cc1 1352791072 TYLNBWOHFOCITE-HUUCEWRRSA-N 259.397 2.090 10 20 CECD OC[C@H]1C=C[C@@H](NCc2c(O)cccc2Br)C1 1351508918 XOJRMLDRIKKFBB-VHSXEESVSA-N 298.180 2.181 10 20 CECD O=C(O)c1cnc(SCc2nnc(C3CC3)o2)s1 1608979137 LGRJKRWRCIZWIS-UHFFFAOYSA-N 283.334 2.394 10 20 CECD Cc1cc(O)c(CN2C[C@@H](C(=O)O)O[C@H](C)C2)cc1Cl 1600286280 NVLRIXOZRJFEFG-RNCFNFMXSA-N 299.754 2.028 10 20 CECD Cc1cc(CSc2ncc(C(=O)O)s2)nn1C 1610461807 PEMZRHBTLPEWPV-UHFFFAOYSA-N 269.351 2.176 10 20 CECD CC(C)(C(=O)O)n1cc(NCc2cc(F)ccc2O)cn1 1588619918 IBQZMMXKFVEBHP-UHFFFAOYSA-N 293.298 2.160 10 20 CECD CCN(C)c1ccc([C@@H](C)NCC(=O)NC(C)C)cc1 160925714 VYCFPYCSIHCVQG-CYBMUJFWSA-N 277.412 2.318 10 20 CECD CCc1cccc(CN2C[C@H](C)N(C)C[C@H]2C)c1O 848904456 UKNUPKZUYFBHRO-QWHCGFSZSA-N 262.397 2.479 10 20 CECD CCc1nc(CNCc2c(O)cccc2OC)co1 825049893 FHSFAAGXRXRKCN-UHFFFAOYSA-N 262.309 2.241 10 20 CECD COc1cccc(CNC[C@@H](O)CC(C)(C)C)c1O 227372888 XWCGXFOJAOPPEM-LBPRGKRZSA-N 267.369 2.288 10 20 CECD c1cc2c(cc1CNCCCN1CCCC1)CCO2 37362807 WEUPFWDAVBDOCD-UHFFFAOYSA-N 260.381 2.197 10 20 CECD CC1(C)CN(C(=O)c2cccc(O)c2O)CC(C)(C)O1 275944165 CRLJQSNRQDYEFV-UHFFFAOYSA-N 279.336 2.127 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CCN(C(C)C)C2=O)c(O)c1 186048473 OURVUZKTSGGDDQ-TZMCWYRMSA-N 276.380 2.361 10 20 CECD CC[C@@H](NCCc1cncn1C)c1ccccc1O 401720326 IVWGJJCVQOFUGO-CQSZACIVSA-N 259.353 2.409 10 20 CECD CC(C)O[C@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 404747944 KVCGTCJKMIZGRT-HNNXBMFYSA-N 276.380 2.227 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@@H](C(=O)O)C2)c1O 229118071 FDRSPHAVGHFRCV-SECBINFHSA-N 299.754 2.351 10 20 CECD C[C@H](N)[C@H]1CCCCN1Cc1cc(F)ccc1O 219584745 RLKMCHHWBWCVIU-GXFFZTMASA-N 252.333 2.233 10 20 CECD Cc1ccc(O)c(CNc2cccc(OCC(N)=O)c2)c1 71407644 DMUPHFMKVONINA-UHFFFAOYSA-N 286.331 2.177 10 20 CECD COc1cccc(CNCCCn2nc(C)cc2C)c1O 134225443 YXJVECPLUDQYAH-UHFFFAOYSA-N 289.379 2.394 10 20 CECD OC[C@@H](NCc1cccc(Br)c1O)C1CC1 381624557 HZYKWAMUSWONPK-LLVKDONJSA-N 286.169 2.015 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1Cc2ccccc2CN1 237168078 KVLFQISLWDVHBA-INIZCTEOSA-N 296.370 2.065 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N2CCNCC2)c1C 237729497 WPCMFALQQDHUGP-UHFFFAOYSA-N 297.402 2.448 10 20 CECD CN(C)c1ccc(CN(CCCO)CC(F)(F)F)cc1 93042861 RZAGOHMOUIATGC-UHFFFAOYSA-N 290.329 2.499 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H]1C1CC1)OCO2 363384439 KNEHCSXNIFBABA-GFCCVEGCSA-N 261.321 2.495 10 20 CECD COc1ccc(O)c(CN[C@@H](c2nncn2C)C(C)C)c1 289644268 XRAYXTAEBCXZHB-CQSZACIVSA-N 290.367 2.016 10 20 CECD COC(=O)[C@]1(C)CN(Cc2cc(F)ccc2O)C[C@H]1C 282778479 QEHSBIXPSPITAZ-MEBBXXQBSA-N 281.327 2.162 10 20 CECD c1ncn(CCCNCc2ccc(N3CCCC3)cc2)n1 381654874 CEQKOHAKUOTOLC-UHFFFAOYSA-N 285.395 2.058 10 20 CECD COC(=O)[C@H](C)CN(C)Cc1ccc(N(C)C)c(C)c1 293395986 HEEXBYDRXNTHTM-CYBMUJFWSA-N 278.396 2.302 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)CC(C)(C)CO 294775668 KPBFYXFLKSSKEL-UHFFFAOYSA-N 268.376 2.342 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1ncccn1 807837309 LBJDEIDHWVATRM-UHFFFAOYSA-N 298.129 2.419 10 20 CECD C[C@H]1CSC[C@H]1NC(=O)N(C)Cc1ccccc1O 807476292 CQUJUCGIDWQIIA-CMPLNLGQSA-N 280.393 2.285 10 20 CECD C[C@@H](NC(=O)c1cccc(O)c1O)c1c(F)cncc1F 804825849 IBULKAZWHYSEGJ-SSDOTTSWSA-N 294.257 2.262 10 20 CECD OC[C@@]1(F)CCN(Cc2cc(Cl)c(F)cc2O)C1 816601130 SJDLNWKUWVBZSB-GFCCVEGCSA-N 277.698 2.091 10 20 CECD Cc1nccnc1CCNCc1c(O)cccc1Cl 815153998 IQNDOXOXIIADGA-UHFFFAOYSA-N 277.755 2.476 10 20 CECD CN(Cc1ccccc1O)C(=O)CCc1cncs1 815796777 LQTZTZDDOYUUEU-UHFFFAOYSA-N 276.361 2.440 10 20 CECD CCNC(=S)NCc1ccc(N(C)C)cc1C 734387103 WPGRTEGELBTCJN-UHFFFAOYSA-N 251.399 2.045 10 20 CECD CCO[C@@H]1C[C@H](NCc2cc(OC)ccc2O)[C@H]1SC 838948543 UDVCEJSMYQOADF-NWANDNLSSA-N 297.420 2.399 10 20 CECD CCCCN(C)S(=O)(=O)Nc1ccc(O)c(F)c1F 830184415 DVVBMXZOTPFSLS-UHFFFAOYSA-N 294.323 2.059 10 20 CECD F[C@H]1CCCN(Cc2ccc(N3CCOCC3)cc2)C1 846122188 KFWVQJKQYMOQBV-HNNXBMFYSA-N 278.371 2.457 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)c1ccccn1 748463496 SYJFBZGIXNLKDW-LLVKDONJSA-N 271.320 2.348 10 20 CECD C[C@@H]1CCC(=O)CN1C(=O)NCc1ccc(N(C)C)cc1 913926473 DMOYLMQBKHCRKH-GFCCVEGCSA-N 289.379 2.016 10 20 CECD NC[C@H](NCc1cc(F)ccc1O)C1CCCC1 841087496 QJZNRKOSDLMXGY-ZDUSSCGKSA-N 252.333 2.138 10 20 CECD Cc1cccc(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)c1O 843059205 GEADEVANBDSKQG-CFVMTHIKSA-N 260.381 2.260 10 20 CECD COc1cccc(O)c1CN1C[C@H](N)Cc2ccccc21 841106753 PCWOKDYAZGRWBY-CYBMUJFWSA-N 284.359 2.291 10 20 CECD CCc1nocc1COC(=O)c1ccc(C)c(O)c1O 848712053 BKLHWKSRIUDRKG-UHFFFAOYSA-N 277.276 2.314 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@H](C)CCN1 844186650 MGOXMMIYTQOJIP-WBMJQRKESA-N 289.423 2.065 10 20 CECD CN(Cc1ccc(OCc2ccccc2)cc1O)C1CNC1 843124946 QSNUTNIFEHUCCK-UHFFFAOYSA-N 298.386 2.375 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCc2ccncc21 755995776 SDPCTBQNWBIYLB-RQOWECAXSA-N 282.299 2.095 10 20 CECD N[C@@]12CCC[C@H]1CN(Cc1c(O)cccc1Cl)C2 857226779 ZDCRWAFHPONXSD-IINYFYTJSA-N 266.772 2.359 10 20 CECD CN(C)c1cc(F)c(CNC(CF)CF)cc1F 858171660 ZWNKDNSKUSKFQC-UHFFFAOYSA-N 264.266 2.428 10 20 CECD COC1(CNC(=O)NCc2cc(C)ccc2O)CCC1 858354951 RGUBKODOPWFZGK-UHFFFAOYSA-N 278.352 2.069 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2nccs2)c1 858166255 FBZUXPQDJTUCMG-UHFFFAOYSA-N 291.376 2.199 10 20 CECD Cc1ccc(O)c(CNCC(C)(C)[C@@]2(O)CCCOC2)c1 850400440 HZBIFNFJRICKIZ-QGZVFWFLSA-N 293.407 2.358 10 20 CECD COC1CC(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 860949808 DQNJLCARIHDWPL-ZOODHJKOSA-N 276.380 2.355 10 20 CECD CON1CCC(N(C)Cc2ccc(C)cc2O)CC1 877579162 NEGABCNVLQRHQS-UHFFFAOYSA-N 264.369 2.158 10 20 CECD Cc1cccc(O)c1CNCc1nnc2n1CCCCC2 876885833 REOJTBBHHUBICX-UHFFFAOYSA-N 286.379 2.308 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@]1(F)CCOC1 1117705790 VVXOIUQCIYVTQP-INIZCTEOSA-N 292.354 2.032 10 20 CECD CC(C)CO[C@@H](C)C(=O)N(C)c1ccc(N)cc1 877080447 IYWVXMJBOMBSQI-NSHDSACASA-N 250.342 2.293 10 20 CECD Cc1ncc([N+](=O)[O-])n1CCN[C@H](C)c1ccccc1O 879650344 VQURSUONRMJGGE-SNVBAGLBSA-N 290.323 2.156 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)N(C)C)cc1 874085331 XJBZKXGAIMXTQR-CYBMUJFWSA-N 277.412 2.099 10 20 CECD Cc1noc(C)c1COC(=O)/C=C/c1ccc(O)c(O)c1 772774275 HZLFNUWTDLKHPZ-GQCTYLIASA-N 289.287 2.459 10 20 CECD C[C@@H](NCC1=CCN(C)CC1)c1c(O)cccc1F 886561995 OEEREZQIWGTQIY-LLVKDONJSA-N 264.344 2.444 10 20 CECD C[C@@H](N[C@H]1CCc2c[nH]nc2C1)c1c(O)cccc1F 886538545 JROVPVQZRMNZSH-KOLCDFICSA-N 275.327 2.463 10 20 CECD COCC[C@@H](C)OC(=O)/C=C\c1ccc(O)c(O)c1 784287132 RAGKQEBWLNGNJB-AYYIZTPMSA-N 266.293 2.079 10 20 CECD COc1cc(C)cc(CNC[C@H](OC)C2CC2)c1O 894861225 BZKSFIFLYHMHSU-AWEZNQCLSA-N 265.353 2.224 10 20 CECD CCC1(C(=O)OCC(=O)c2ccc(O)c(O)c2)CC1 784012684 GCYDEVRBFSGXPG-UHFFFAOYSA-N 264.277 2.014 10 20 CECD Cn1ccnc1[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1 894779750 NTVGNFHHWLEWSI-JTQLQIEISA-N 293.317 2.393 10 20 CECD Cc1cc(O)c(CN2CC(OC(F)F)C2)cc1C 797821111 DBDWNAOCKPSYPN-UHFFFAOYSA-N 257.280 2.432 10 20 CECD COc1ccc(CNC(=O)Cc2cccs2)c(O)c1 794389547 QFQNFIJHBBDEII-UHFFFAOYSA-N 277.345 2.321 10 20 CECD Cc1ccc(O)c(CN2CCN(CC(C)C)CC2)c1 133836664 BYYCSVQJFWNNAK-UHFFFAOYSA-N 262.397 2.474 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1CC[C@H]2C[C@H]2C1 1352668914 FUFJVZMFZOSGTK-UMNHJUIQSA-N 261.321 2.150 10 20 CECD COc1cc(C)c(CNCC2(N)CCCC2)c(O)c1 1579144373 CHCUWWSKBFIOIZ-UHFFFAOYSA-N 264.369 2.070 10 20 CECD CC(C)[C@@H](CNCc1cc(F)c(F)cc1O)C(=O)O 1573498373 HGBORGOTHGUJDV-SECBINFHSA-N 273.279 2.117 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@H](C(=O)O)C2)cc1F 1593711295 VIIIUWOKCBILQK-JTQLQIEISA-N 298.333 2.327 10 20 CECD COC(=O)[C@@H](NCc1ccc(N(C)C)cc1)C(C)C 35346584 FMUWEHPSOPOXRA-AWEZNQCLSA-N 264.369 2.040 10 20 CECD COc1cc(Cl)cc(CNC[C@H]2CCCN2C)c1O 230934239 WKDWJSJFGWZHDU-GFCCVEGCSA-N 284.787 2.238 10 20 CECD C[C@@]1(CNCc2cc3c(cc2O)OCO3)CCCS1 126479431 MLDOGUGCBDNUCU-AWEZNQCLSA-N 281.377 2.496 10 20 CECD C[C@H](NCc1cnns1)c1ccc(N(C)C)cc1 400248603 JGPYPQJLGAMFJP-JTQLQIEISA-N 262.382 2.455 10 20 CECD O=C(c1cccc(O)c1O)N1CCc2ccc(F)cc21 312200448 JLKJVAZXCMXYQM-UHFFFAOYSA-N 273.263 2.440 10 20 CECD CCC[C@@H](CNC(=O)Nc1ccc(N)cc1)OC 378687441 FZJFNUOHXBODGE-LBPRGKRZSA-N 251.330 2.205 10 20 CECD CC[C@@H](NCc1nnc(C)n1C)c1ccccc1O 393217450 RCLSXZLWTMJBBG-GFCCVEGCSA-N 260.341 2.070 10 20 CECD COc1ccc(CNCc2cc(OC)ns2)c(O)c1 399150747 XSPDHRILZZWWLH-UHFFFAOYSA-N 280.349 2.156 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)c1ccco1 783528112 MLPNSDWZJVQAGW-UHFFFAOYSA-N 253.279 2.094 10 20 CECD Cc1cc(CC(=O)N(C)Cc2ccc(N(C)C)cc2)no1 172045040 HHRUCDXQRVHIJO-UHFFFAOYSA-N 287.363 2.250 10 20 CECD O=[N+]([O-])c1cnc(NCCCSc2nccs2)nc1 302160289 OVAJQDMEWWYLED-UHFFFAOYSA-N 297.365 2.436 10 20 CECD O=C(NC1CC1)[C@@H]1CCCN1Cc1cc(Cl)ccc1O 179488252 JFCXRGTWHOJLSZ-ZDUSSCGKSA-N 294.782 2.289 10 20 CECD CCOCc1cc(CNC2(CO)CCC2)ccc1OC 178637277 CISJDVRYTOMQSF-UHFFFAOYSA-N 279.380 2.236 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2CCSC2)cc1 75463843 GIEOWCIQSMNEEB-LBPRGKRZSA-N 279.409 2.057 10 20 CECD CCNC(=O)C(C)(C)CN[C@H](C)c1ccccc1O 183666466 NQAIDTAUVPOKOJ-LLVKDONJSA-N 264.369 2.205 10 20 CECD COC(=O)[C@H]1CC[C@@H](N[C@@H](C)c2ccccc2O)C1 193886340 HNBOMDFUJUJMDN-SDDRHHMPSA-N 263.337 2.385 10 20 CECD Oc1c(Cl)cccc1CN1CCOC[C@@]12CCOC2 195018145 HLKWOBBPABZNKS-AWEZNQCLSA-N 283.755 2.037 10 20 CECD CC[C@]1(C(=O)O)CCCN(Cc2cccc(OC)c2O)C1 86784373 DSSKWFHPVGPVFF-INIZCTEOSA-N 293.363 2.478 10 20 CECD COC[C@H](CN[C@H](C)c1cc(C)ccc1O)OC 230672156 JXJSSYPIJARHBM-NEPJUHHUSA-N 253.342 2.013 10 20 CECD C[C@H](NCC1([S@@](C)=O)CC1)c1ccc(F)c(F)c1O 282175500 FIHPWSODRSFOCV-WPCRTTGESA-N 289.347 2.232 10 20 CECD C[C@H](N[C@H]1CCc2cccc(O)c21)[C@H](C)N1CCOCC1 297766289 OZZGNGZRFFHAOB-YDHLFZDLSA-N 290.407 2.078 10 20 CECD COCCn1cc(CN[C@H]2CCc3cccc(O)c32)cn1 296367997 IMWBYDVMGVEDPR-AWEZNQCLSA-N 287.363 2.012 10 20 CECD Cc1ccc(C(=O)NC[C@@]2(O)CCCC2(C)C)c(O)c1O 294457911 QHNIBODIIUYRCP-INIZCTEOSA-N 293.363 2.077 10 20 CECD CCOc1ccc(O)c(CN(C)[C@@H]2CCCOC2)c1 809692968 KUTFICZWSGQMCP-CYBMUJFWSA-N 265.353 2.402 10 20 CECD C[C@@H](CCCCN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 817976656 QMZIPGNAQRSQFA-WDEREUQCSA-N 281.356 2.469 10 20 CECD Cc1ccoc1CNC(=O)/C=C/c1ccc(O)c(O)c1 816983473 ZLBKCNCBAOLTKK-HWKANZROSA-N 273.288 2.329 10 20 CECD CC(C)n1cc([C@@H](C)NC(=O)Cc2ccc(N)cc2)cn1 829500896 SQENERZGEDAWSU-GFCCVEGCSA-N 286.379 2.466 10 20 CECD CN1CC[C@@H]2CN(Cc3c(O)ccc(Cl)c3F)C[C@@H]21 824892827 CLPXUEXZXBETLO-SKDRFNHKSA-N 284.762 2.321 10 20 CECD CN(Cc1nccs1)C(=O)/C=C\c1ccc(O)c(O)c1 588406824 RTVBXDRTPRTSQY-HYXAFXHYSA-N 290.344 2.226 10 20 CECD COc1ccc(N(C)C/C=C(/C)C(=O)O)cc1F 832378958 YEMCHJQLDMOFOG-TWGQIWQCSA-N 253.273 2.301 10 20 CECD Cc1ccc([C@@H](C)NC[C@@]2(C)CCC(=O)N2)c(O)c1 834910390 WTMYTROICJGWRQ-IAQYHMDHSA-N 262.353 2.020 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCCF)c1 830540857 OREOPYDKGGPIKK-VIFPVBQESA-N 255.289 2.328 10 20 CECD C[C@@H](NC(=O)c1c2c(nn1C)CCC2)c1ccccc1O 913763490 IDXKAWLOSSTUPC-SNVBAGLBSA-N 285.347 2.105 10 20 CECD Cc1ccc(C(=O)N[C@@H]2C[C@@H](C)n3ccnc32)c(O)c1O 836955818 SLBFQNOXBFBXIS-MWLCHTKSSA-N 287.319 2.039 10 20 CECD C[C@@H](NCCC1(CO)CC1)c1cc(F)cc(F)c1O 834896866 OPNBYZBYPAHLEE-SECBINFHSA-N 271.307 2.484 10 20 CECD CCC[C@H]1C[C@H](C(=O)NCc2ccc(O)cc2O)CCO1 910948803 ANMNSXDOOIUMDB-RISCZKNCSA-N 293.363 2.309 10 20 CECD O=C(CCNC1CC1)NCc1ccc(N2CCCC2)cc1 848410590 HRZDOCBKZMIKJM-UHFFFAOYSA-N 287.407 2.045 10 20 CECD NCC[C@@H](NCc1cc(Cl)ccc1O)C(F)F 841074375 PFZHWZFIDYGWRW-SECBINFHSA-N 264.703 2.118 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN[C@@H](C)C2)c1O 842473449 KBSCNGSJPGJLCZ-VIFPVBQESA-N 282.771 2.042 10 20 CECD CC(C)[C@H](NC(=O)c1cccc(O)c1O)C1(CO)CCC1 848122393 SFHNFJORMNRYRP-AWEZNQCLSA-N 293.363 2.015 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC2(C1)OCCO2 840913516 GQZNFRDBECDMBB-UHFFFAOYSA-N 276.380 2.010 10 20 CECD O=C(c1cc(O)cs1)N1CCOC(C2CC2)(C2CC2)C1 856078894 KCOVTLNIBFQFNN-UHFFFAOYSA-N 293.388 2.485 10 20 CECD CCN(CC[C@@H]1CCOC1=O)c1ccc(OC)c(OC)c1 753843044 AXULKOUHFDTVCL-GFCCVEGCSA-N 293.363 2.483 10 20 CECD C[C@@]1(CNC(=O)c2cc(O)cs2)CCCS1 759095378 QZEWGDKVKOLHDD-NSHDSACASA-N 257.380 2.469 10 20 CECD COCCCN(C)Cc1cc(F)c(N(C)C)cc1F 862234635 VMWGIEJHOFOFLW-UHFFFAOYSA-N 272.339 2.499 10 20 CECD C[C@@H](NC(=O)NC1CCC(C)(O)CC1)c1ccccc1O 868377149 MPPXFOPYKUSXOK-OPGSHWCFSA-N 292.379 2.446 10 20 CECD CCCN(CC(=O)NC)Cc1cc(Cl)cc(F)c1O 775664106 SDZKOOTYBJTJKH-UHFFFAOYSA-N 288.750 2.143 10 20 CECD CCOc1cccc(CN2CCN(C)[C@H](C)[C@@H]2C)c1O 775986463 QUNIRCOOQNRXNB-OLZOCXBDSA-N 278.396 2.315 10 20 CECD C[C@H](NC(=O)C[C@H]1CCCO1)c1ccc(N(C)C)cc1 773011286 FNIDXVSMICXDFR-SWLSCSKDSA-N 276.380 2.499 10 20 CECD CCCN1CCCC[C@@H]1C(=O)NCc1ccc(N)cc1 1122536360 ZPKJSZCWGCFJFE-OAHLLOKOSA-N 275.396 2.150 10 20 CECD C[C@@H](NCCCO[C@H]1CCOC1)c1c(O)cccc1F 886538998 RFUSUAGRMVMVMY-NEPJUHHUSA-N 283.343 2.378 10 20 CECD C[C@H](N[C@H]1C[C@@H](O)C1(C)C)c1c(O)cccc1F 886594117 GFWJYGGZTRYAMW-KPXOXKRLSA-N 253.317 2.341 10 20 CECD CN(C)c1cccc(CNCc2cc(F)cc(F)c2O)n1 883075962 QCOVGLKLYOUJSF-UHFFFAOYSA-N 293.317 2.421 10 20 CECD C[C@H](O)[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 780787560 VYBROLNIGNDUBS-DTWKUNHWSA-N 273.735 2.387 10 20 CECD C[C@H](N[C@@H](C)C1(CO)CC1)c1c(O)cccc1F 886636347 LXRLIGCSZQAJBP-UWVGGRQHSA-N 253.317 2.343 10 20 CECD COc1ccc(CN2CCC[C@](C)(OC)C2)c(O)c1OC 894141591 XYADGKIOMBUTHU-INIZCTEOSA-N 295.379 2.410 10 20 CECD COc1cc(C)cc(CN(C)[C@H]2CCN(C)C[C@H]2C)c1O 894783024 PGQHMPMGMBHOGV-HIFRSBDPSA-N 292.423 2.481 10 20 CECD Oc1ccc(Cl)cc1CN1CCO[C@@H]([C@@H]2CCCO2)C1 91927161 DRFJROCLRRZGKU-LSDHHAIUSA-N 297.782 2.425 10 20 CECD CCn1cnc2c(NCc3cc(C)ccc3O)ncnc21 1261792476 YQRGQTGOZCSRSZ-UHFFFAOYSA-N 283.335 2.472 10 20 CECD Cn1c(CNCc2cc(Cl)ccc2O)ccc1C(=O)O 1608088582 WDFZWBSZOMWYNS-UHFFFAOYSA-N 294.738 2.372 10 20 CECD CCOc1cccc(CN[C@@]2(C)CCCOC2)c1O 221356824 AEDBUPNIRMDLCH-HNNXBMFYSA-N 265.353 2.450 10 20 CECD CS(=O)(=O)c1cc(NCc2ccc(N)cc2)ccc1F 1579348453 CKPQJQOUNOPOJS-UHFFFAOYSA-N 294.351 2.424 10 20 CECD CCCN(Cc1cc(F)c(F)cc1O)[C@H]1CCNC1 1577526997 LQFCGOJWVACBLA-NSHDSACASA-N 270.323 2.244 10 20 CECD C[C@H]1CC[C@@H](COc2ccc(N(C)C)c(C(=O)O)c2)O1 1594306371 FVAFFYYIFGQOSW-JQWIXIFHSA-N 279.336 2.397 10 20 CECD COc1ccc(O)c(CNC2CCN(C(C)C)CC2)c1 20189499 FJJPFAJFXDXSTH-UHFFFAOYSA-N 278.396 2.363 10 20 CECD CN(C)c1ccc(CN[C@]2(C(=O)O)CCC[C@H]3C[C@H]32)cc1 1777039919 AQZCOQULOZBCJG-YSVLISHTSA-N 288.391 2.486 10 20 CECD COc1ncc(Cl)c(NCc2ccccc2O)n1 163769294 QRUMUPJTCUUNQO-UHFFFAOYSA-N 265.700 2.456 10 20 CECD COc1ccc(O)c([C@H](C)NC2CCOCC2)c1 36319392 RYZPLRJHHZYJOL-JTQLQIEISA-N 251.326 2.230 10 20 CECD Cc1nc(C)c(C(=O)N[C@H](C)c2ccccc2O)o1 827937191 NYKQKSDCRBXCTC-MRVPVSSYSA-N 260.293 2.488 10 20 CECD C[C@@H](c1cccnc1)N(C)C(=O)Cc1ccc(N)cc1 831880385 CYXYDFBYMTVHCT-LBPRGKRZSA-N 269.348 2.426 10 20 CECD C[C@H](NCCN1CCSCC1)c1cc(F)ccc1O 230661680 LAVOPLCGNWKEDS-NSHDSACASA-N 284.400 2.231 10 20 CECD Cc1ccc(NC(=O)c2cccc(O)c2O)cc1O 126575790 QHBVAEZADRXTPL-UHFFFAOYSA-N 259.261 2.364 10 20 CECD CCN1CC[C@@H](CNCc2ccc(OC)c(C)c2)C1 37644588 ODXMMIDLHJNNSD-HNNXBMFYSA-N 262.397 2.435 10 20 CECD CC[C@](C)(OC)C(=O)N(C)Cc1ccccc1O 280107101 VHMVMZSDVLQEFF-AWEZNQCLSA-N 251.326 2.166 10 20 CECD COc1ccc(O)c(CNC[C@@](C)(OC)C2CC2)c1 291033074 JGWAULHMEMOROQ-OAHLLOKOSA-N 265.353 2.306 10 20 CECD CC(C)S(=O)(=O)CCN[C@@H](C)c1ccc(F)cc1O 312030913 XQJQUKYTQRDEKW-JTQLQIEISA-N 289.372 2.005 10 20 CECD CCC[C@@]1(NC(=O)Nc2ccc(N)cc2)CCOC1 393478741 NHDKEPVQLSNWOX-CQSZACIVSA-N 263.341 2.350 10 20 CECD CC(C)NC(=O)NCc1ccc2c(c1)CCCN2C 58483286 FWULBFDVDUNAME-UHFFFAOYSA-N 261.369 2.277 10 20 CECD CN[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 53201289 JQYDFMVFBNCICX-GFCCVEGCSA-N 254.761 2.229 10 20 CECD COc1cccc(CNC(=O)CC[C@H]2CC[C@H](C)O2)c1O 175928783 IXXXBYKQFYVSPH-WCQYABFASA-N 293.363 2.365 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Nc2cnn(C)c2)c1 103568199 TZPGRBMSZYMRGC-SECBINFHSA-N 290.323 2.017 10 20 CECD CC(C)(C)[C@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 178657137 ZFUBFCLQWYDULK-OAHLLOKOSA-N 289.423 2.276 10 20 CECD CCC[C@](C)(O)C(=O)NCc1ccc(N2CCCC2)cc1 178462404 ORSTYJBKIWKVJG-KRWDZBQOSA-N 290.407 2.454 10 20 CECD CCn1cc(C(=O)NCc2ccc(N3CCCC3)cc2)cn1 172162998 LZBSKZYAZIHHRP-UHFFFAOYSA-N 298.390 2.433 10 20 CECD C[C@@H](Nc1ccnc(C(N)=O)c1)c1ccc(N(C)C)cc1 302458946 UYWGDWDXHSUQPB-LLVKDONJSA-N 284.363 2.420 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(O)c(O)c2)no1 182510739 MHLDZOOWPYEKSM-UHFFFAOYSA-N 276.292 2.139 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2cc(OC)ccc2O)C1 185787919 YTIBJUGELYAXCX-VXGBXAGGSA-N 292.379 2.062 10 20 CECD COc1ccc(N2CCN([C@H](C)c3cnccn3)CC2)cc1 184403857 NXNFSJGCIKWQFF-CQSZACIVSA-N 298.390 2.368 10 20 CECD CC[C@]1(C(=O)N(C)Cc2ccc(N(C)C)cc2)CCCN1 214497813 VVYNHTSTCGSZMD-QGZVFWFLSA-N 289.423 2.243 10 20 CECD CCCC(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 84815169 MKODLQMPNBUAEG-UHFFFAOYSA-N 280.343 2.283 10 20 CECD Oc1c(Cl)cccc1CN1CCOC[C@]12CCOC2 195018159 HLKWOBBPABZNKS-CQSZACIVSA-N 283.755 2.037 10 20 CECD CC(C)(C)[C@H](CCO)NCc1cc(F)ccc1O 231075719 WJLLNCHNZPILGL-ZDUSSCGKSA-N 255.333 2.418 10 20 CECD NCc1ccc(C(=O)NCCCSc2nccs2)o1 237909481 ZQHKDZKQUQUCNU-UHFFFAOYSA-N 297.405 2.107 10 20 CECD C[C@@H](NCCSCCCO)c1cc(F)ccc1O 185379248 ZXDSVTDXSITUIY-SNVBAGLBSA-N 273.373 2.298 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(=O)OC(C)(C)C 274074926 LODYYYNNWDOWHG-UHFFFAOYSA-N 292.379 2.053 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H]2CCCOC2)c1 273412864 QEVIAIVYXAHOBR-NWDGAFQWSA-N 293.363 2.256 10 20 CECD Cc1nc(CCN[C@@H](C)c2ccc(C)c(C)c2O)n[nH]1 273435106 LXBIPKROQIFQBS-NSHDSACASA-N 274.368 2.329 10 20 CECD COc1cccc(CNC(=O)N[C@H](C)C(F)(F)F)c1O 288805048 KZJDLXXHKSQWDI-SSDOTTSWSA-N 292.257 2.151 10 20 CECD COc1ccc(N2CCN(c3nccnc3C)CC2)cc1 290593482 XXMFYTYFYJVHJF-UHFFFAOYSA-N 284.363 2.120 10 20 CECD COc1cc(O)c(CN2CCC[C@@H](CO)CC2)cc1OC 293993766 LVSVVVDASCXWAV-GFCCVEGCSA-N 295.379 2.004 10 20 CECD C[C@@H](N[C@H]1CCCNCC1)c1cc([N+](=O)[O-])ccc1O 817967862 CVWAEUYSXKSFPB-MNOVXSKESA-N 279.340 2.093 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2cc(F)ccc2O)n1 818344917 IEZJLFQQLLQRGT-SECBINFHSA-N 278.331 2.302 10 20 CECD CCN(CCOCCO)Cc1cc(Cl)c(F)cc1O 816600438 XITFZFVLFPKCNG-UHFFFAOYSA-N 291.750 2.016 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)N[C@H](C)[C@@H](C)OC)c1 811957592 GCURIWUEJJYLSZ-OUAUKWLOSA-N 296.367 2.184 10 20 CECD Cc1cc([C@H](C)NCCc2ccc(N)cc2)n(C)n1 817957931 RASMKCVNTHVVNN-LBPRGKRZSA-N 258.369 2.204 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@]1(C)CO 827699847 MYSLQCFPNLNUAT-IINYFYTJSA-N 269.772 2.496 10 20 CECD Oc1ccc(Cl)cc1CN1CCC[C@@H](n2ccnn2)C1 822503316 FZNRMVZEHACNOK-CYBMUJFWSA-N 292.770 2.474 10 20 CECD CN1C(=O)c2ccccc2N[C@@H]1c1cc(C(=O)O)ccc1O 737505310 IDAQZOBTIQVNDM-AWEZNQCLSA-N 298.298 2.287 10 20 CECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)C1(C)CC1 830535617 UMLCAVPAFVBINP-UHFFFAOYSA-N 282.409 2.033 10 20 CECD CN(Cc1ccc(O)cc1)C(=O)/C=C\c1ccc(O)c(O)c1 588405226 SODBQIAIWYAYSV-UITAMQMPSA-N 299.326 2.475 10 20 CECD CCC[C@@H](CNC(=O)NCc1ccc(N(C)C)cc1)OC 836222428 YECMGDYCRLVRCW-HNNXBMFYSA-N 293.411 2.367 10 20 CECD CCn1ncc(/C=C2/C(=O)N(C)c3ccc(C)cc32)n1 901511666 ZOGQMSDNCFOGBV-MDWZMJQESA-N 268.320 2.123 10 20 CECD COC(=O)C1CCC(NCc2ccc3c(c2)CCO3)CC1 730107820 VBCKAXAVYCNSQI-UHFFFAOYSA-N 289.375 2.443 10 20 CECD CN[C@@H]1CCCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 843348650 VUUWURCYAOXPOD-CYBMUJFWSA-N 296.798 2.432 10 20 CECD Cc1cc(CC(=O)NCc2ccc(N(C)C)c(F)c2)on1 845334938 IZFZYEGKBAECBA-UHFFFAOYSA-N 291.326 2.047 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1cc(Cl)ccc1O 840833592 RFZKRGWTWPJYTP-NSHDSACASA-N 268.744 2.275 10 20 CECD CCOc1ccc(CN2CCCC[C@H]2CCN)c(O)c1 843123452 JOXDELFACMPMOH-AWEZNQCLSA-N 278.396 2.494 10 20 CECD O=S(=O)(CC1CCC1)NCc1cc(Cl)ccc1O 845996724 SJKYXLVFYLVNCG-UHFFFAOYSA-N 289.784 2.265 10 20 CECD Oc1ccccc1CN[C@H]1CCCN2CCCC[C@@H]12 848575651 URHHWBSKPCTISU-GJZGRUSLSA-N 260.381 2.499 10 20 CECD Cc1ccc(CNCc2ccc3c(c2)CCCO3)c(=O)n1C 922069389 VOMZKENFTLMFLO-UHFFFAOYSA-N 298.386 2.309 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](CO)CC2CC2)c1 850544574 IHGQLBOLBWKUMN-DGCLKSJQSA-N 279.380 2.460 10 20 CECD CO[C@@]1(C)C[C@H]1NCc1cc(F)c(N(C)C)cc1F 858194954 MTOIXQVSSKCOQP-KGLIPLIRSA-N 270.323 2.298 10 20 CECD CC(C)OCCCN(C)Cc1cc2c(cc1O)OC[C@H]2O 768449507 ZWJZDNIZUXQDBP-OAHLLOKOSA-N 295.379 2.065 10 20 CECD C[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)[C@H]1CO 862336871 MXJLPVKBOOVBDL-BONVTDFDSA-N 284.350 2.234 10 20 CECD CC[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccc(N(C)C)cc1 766435875 BJVONMVJVRJFTI-HZPDHXFCSA-N 289.423 2.414 10 20 CECD CC(C)[C@H]1NC(=O)N(Cc2ccc(N3CC=CC3)cc2)C1=O 761362393 PGNPOPADJNCXSY-OAHLLOKOSA-N 299.374 2.139 10 20 CECD CN(C)c1cc(F)c(CN[C@H](CO)CC(F)F)cc1F 1118859494 JQRCGDJIOHOJQU-VIFPVBQESA-N 294.292 2.137 10 20 CECD CCOCCOC1CN(Cc2cc(Cl)ccc2O)C1 779431760 DLPBKEJXJNDCNR-UHFFFAOYSA-N 285.771 2.283 10 20 CECD OC[C@H](CC1CC1)NCc1cc(Cl)cc(F)c1O 776252376 SJDLYBVLQFLADX-NSHDSACASA-N 273.735 2.435 10 20 CECD COc1cccc(O)c1CN1C[C@@H](O)Cc2ccccc21 789761891 LHNRUUXUNPQXMC-ZDUSSCGKSA-N 285.343 2.324 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](C(F)(F)F)C1 888021124 NAUROOMCEIMPRG-ZCFIWIBFSA-N 265.256 2.478 10 20 CECD CCN(CCNCc1cc(F)cc(F)c1O)C(C)C 882957940 PQUQMVNBLUHUFQ-UHFFFAOYSA-N 272.339 2.490 10 20 CECD CN(C)c1ccc([C@H](CNC(=O)C2(C)CC2)N(C)C)cc1 891251927 IERWIPFGLWHETO-HNNXBMFYSA-N 289.423 2.272 10 20 CECD COc1ccc(CN(C)Cc2cc(C)on2)c(O)c1OC 891670162 GTCLLPXSTUHANL-UHFFFAOYSA-N 292.335 2.338 10 20 CECD COC[C@H](O)CN[C@H](C)c1cccc(C(F)(F)F)c1O 788818122 NPPRNMCDERXPDM-RKDXNWHRSA-N 293.285 2.069 10 20 CECD Cc1cccc(CN2CCC3(CC2)C[C@H](O)CCO3)c1O 897260943 TUFJVOYNJMNDAT-OAHLLOKOSA-N 291.391 2.207 10 20 CECD CC1(C)CN(Cc2c(O)ccc(Cl)c2F)C[C@H]1O 790936315 AVLMNIXORDGIKD-LLVKDONJSA-N 273.735 2.387 10 20 CECD COc1ccc(CNC(=O)Cc2ccc(C)o2)c(O)c1 794376662 AIROGZANYWSIFF-UHFFFAOYSA-N 275.304 2.161 10 20 CECD Oc1ccccc1CNCc1cc(C(F)(F)F)n[nH]1 799337134 RREDYNQOWHPNHY-UHFFFAOYSA-N 271.242 2.424 10 20 CECD CCn1cnnc1CCNCc1ccc(N2CCCC2)cc1 1319025911 GOKYXGGUKIYXSX-UHFFFAOYSA-N 299.422 2.231 10 20 CECD O=[N+]([O-])c1ccc(NCCc2ccc(O)c(O)c2)nc1 301605594 YFSPWFXVHIUSDI-UHFFFAOYSA-N 275.264 2.056 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C1CC(O)C1 1320181240 SYPUHZVAGCGNJU-UHFFFAOYSA-N 260.381 2.242 10 20 CECD CC(=O)NCC1CCN(Cc2cc(F)cc(F)c2O)CC1 1333701916 JXVDJANXRLZYPA-UHFFFAOYSA-N 298.333 2.019 10 20 CECD Nc1ccc(Cc2noc(C34CCCN3CCC4)n2)cc1 1345956354 CQHUEPHKJLAISD-UHFFFAOYSA-N 284.363 2.328 10 20 CECD COc1ccc(CNCc2cnc(C)s2)c(O)c1OC 1355252704 NHGRFPIDMZMHRN-UHFFFAOYSA-N 294.376 2.464 10 20 CECD CCC[C@H]1C[C@H](C(=O)NCc2cccc(O)c2O)CCO1 1352658395 UGEAKNUVRPNXPH-YPMHNXCESA-N 293.363 2.309 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 1455316463 OAWSLXFWZAGHLA-NTZNESFSSA-N 273.332 2.316 10 20 CECD CN(C)c1ccc(CNCCC(=O)NC(C)(C)C)cc1 134593288 ZGCPCTLQNLFGLS-UHFFFAOYSA-N 277.412 2.147 10 20 CECD Cc1cc(F)ncc1C(=O)NCc1ccc(N)cc1 1579616881 HUAPHENLCWYMTC-UHFFFAOYSA-N 259.284 2.041 10 20 CECD COc1cc(C)cc(CN2CC[C@H]3CC[C@@H](C2)N3C)c1O 164434121 VSJXKURHPQLMGJ-CABCVRRESA-N 290.407 2.378 10 20 CECD CCCC[C@H](NCc1cc(OC)ccc1O)C(=O)OC 154619357 YGJVCTVTTIFGNQ-ZDUSSCGKSA-N 281.352 2.222 10 20 CECD COCCC1(CNCc2cc(F)ccc2O)CC1 226615872 DKGQHJPVISUKKH-UHFFFAOYSA-N 253.317 2.438 10 20 CECD COc1ccc(O)c(CNCCCCn2ccnc2)c1 45105661 WWBVQFHGCUGLLZ-UHFFFAOYSA-N 275.352 2.167 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@](C)(O)C2CC2)c1 311694748 SVOXSPGLBPRYOL-BONVTDFDSA-N 265.353 2.212 10 20 CECD Cc1ccc(O)c(CNCc2cccnc2N(C)C)c1 113321586 DVUQEJLHMBIHGT-UHFFFAOYSA-N 271.364 2.451 10 20 CECD Cc1cc(O)c(CN(C)[C@H](C)C[S@](C)=O)cc1C 187834563 KBHPJRDWIARFGC-XIKOKIGWSA-N 269.410 2.208 10 20 CECD COc1ccc(CNCCc2cnn(C)c2)cc1C 69786679 ITKWIWIQCGBOJF-UHFFFAOYSA-N 259.353 2.069 10 20 CECD CCO[C@@H]1C[C@](CO)(NCc2ccccc2O)C1(C)C 186597718 JFUAXCZFDKHORA-GDBMZVCRSA-N 279.380 2.048 10 20 CECD NC(=O)C[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 180560779 AYJSFKNXHOEVAR-SNVBAGLBSA-N 282.771 2.133 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@H](C)CN2CCOCC2)c1 185504773 GQSGABZFUCWGEE-GJZGRUSLSA-N 292.423 2.320 10 20 CECD C[C@@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(F)c(F)c1O 187792176 HWIKALZSQHLJEG-RKDXNWHRSA-N 296.317 2.084 10 20 CECD COc1ccc(N(C)Cc2ccnn2C)c(OC)c1 130383791 RSOOYGQNUIBTFN-UHFFFAOYSA-N 261.325 2.074 10 20 CECD O=C(O)CN1CCCc2cc(OC(F)F)ccc21 238158091 FNKXHDXJEFFBON-UHFFFAOYSA-N 257.236 2.125 10 20 CECD CC(C)[C@@H](CCO)NCc1ccc(N2CCOCC2)cc1 230688142 BMZSXGINGPUOIF-QGZVFWFLSA-N 292.423 2.020 10 20 CECD CCNC(=S)N[C@@H](C)c1ccc(N2CCOCC2)cc1 140015005 HJWOAICZTRDPPN-LBPRGKRZSA-N 293.436 2.068 10 20 CECD COC(=O)[C@@H](CC(F)(F)F)NCc1cc(F)ccc1O 276548580 YTTDSMNCUPRHEF-SECBINFHSA-N 295.232 2.115 10 20 CECD COC[C@H](CCO)N[C@@H](C)c1ccc(C)c(C)c1O 273587010 OAXGDCVGZICDDC-STQMWFEESA-N 267.369 2.057 10 20 CECD CCN(CC)c1ccc(CN2CCn3nc(C)nc3C2)cc1 271202113 UWKJPEPOXGSRND-UHFFFAOYSA-N 299.422 2.449 10 20 CECD CC[C@@H](NC[C@H](COC)OC)c1ccc(N(C)C)cc1 272725526 YOBPQWYRKALYLB-HZPDHXFCSA-N 280.412 2.455 10 20 CECD C[C@H](CO)CNCc1ccc(N(C)C)cc1C(F)(F)F 279536895 AAXBBEUMWGNQTM-JTQLQIEISA-N 290.329 2.489 10 20 CECD Cn1ccnc1[C@H]1CCN(Cc2cc(F)ccc2O)C1 377881912 AWGPCVGKHGSTRI-NSHDSACASA-N 275.327 2.254 10 20 CECD CC[C@@H](NC[C@H](O)C1CCOCC1)c1ccc(F)cc1O 286004643 HTNHXDJCVLWTIH-ZBFHGGJFSA-N 297.370 2.360 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H](CO)CCOC)cc1 281552302 JKHHXIMKZVLEJF-DZGCQCFKSA-N 280.412 2.191 10 20 CECD COc1ncccc1CCNCc1ccc2c(c1)CCO2 289415195 AQCBXJAAQJZFRY-UHFFFAOYSA-N 284.359 2.357 10 20 CECD COc1cc(Cl)cc(CN(C)C[C@H](O)C2CC2)c1O 809752727 WASCWFAILKWRRN-LBPRGKRZSA-N 285.771 2.257 10 20 CECD CC(=O)N1C[C@@H]2[C@@H](CCC[C@H]2NCc2ccccc2O)C1 808445182 AIIWYUARLCKPMM-ARFHVFGLSA-N 288.391 2.129 10 20 CECD CCN(C)C(=O)[C@@H](NCc1cccc(C)c1O)C(C)C 295114537 VNQPNWJUPLDWPM-AWEZNQCLSA-N 278.396 2.293 10 20 CECD CC(C)OCCCN(C)C(=O)c1c(F)ccc(O)c1O 295752890 HCTUCFMOCVFZKG-UHFFFAOYSA-N 285.315 2.124 10 20 CECD COc1ccc(N(C)C[C@@H]2CCNC(=O)CC2)cc1F 296747838 KIBGVIYZHWDKOY-NSHDSACASA-N 280.343 2.187 10 20 CECD C[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C(C)(F)F 816028426 FUKFFESWRRMZJN-BDAKNGLRSA-N 287.306 2.436 10 20 CECD COC[C@H](C)[C@@H](C)C(=O)NCc1ccc(N(C)C)cc1 812448909 FVMFTIXSJVISBS-QWHCGFSZSA-N 278.396 2.287 10 20 CECD COC(=O)[C@@H](C)NCc1cc(Cl)c(C)cc1O 825748457 BNTXRNSHHJOXIT-MRVPVSSYSA-N 257.717 2.005 10 20 CECD C[C@@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1cc(Cl)ccc1O 834906294 CYJHRXIDHROQQF-WCABBAIRSA-N 282.771 2.350 10 20 CECD COc1ccc(N(C)Cc2cn(C3CC3)nn2)cc1 906316457 LJKGZWPDXDYKEE-UHFFFAOYSA-N 258.325 2.258 10 20 CECD COc1ccc(CNCc2cnc(C3CC3)nc2)c(O)c1 839067388 VHGBUYVLDJIUJF-UHFFFAOYSA-N 285.347 2.358 10 20 CECD CN(C[C@@H]1CCC=CO1)c1ccc(OCC(=O)O)cc1 902017602 XJFXENCYHNFWNQ-AWEZNQCLSA-N 277.320 2.279 10 20 CECD CNCCCNCc1cc(C)cc(Br)c1O 841042123 LEGZLJHVCYZEGP-UHFFFAOYSA-N 287.201 2.162 10 20 CECD Cc1ccc(C(=O)O[C@H]2CCC(C)(C)C2=O)c(O)c1O 840222054 XGGCGKFOFJBRFW-JTQLQIEISA-N 278.304 2.321 10 20 CECD C[C@@H](CC(=O)O)CC(=O)NCc1cc(Cl)ccc1O 911331876 QUZSJFVWFSAGMP-MRVPVSSYSA-N 285.727 2.163 10 20 CECD CCc1cccc(CN2CC[C@@H](N3CCCC3=O)C2)c1O 848906324 SYBIHPONGOAFPW-OAHLLOKOSA-N 288.391 2.151 10 20 CECD CC[C@H](C[C@@H](C)CO)NCc1cc2c(cc1O)OCO2 743499721 PVTZIAQXPLAPAF-ZYHUDNBSSA-N 281.352 2.008 10 20 CECD CCC(O)(CC)CCNC(=O)NCc1cc(C)ccc1O 858384011 BGOFFCJSJHDYAL-UHFFFAOYSA-N 294.395 2.441 10 20 CECD COC1(CNCc2ccc(N(C)C)cc2C)CCOCC1 758340860 GFNDMNGFAOFPRJ-UHFFFAOYSA-N 292.423 2.346 10 20 CECD CCc1ncc(CNCc2cc(C)ccc2O)cn1 858239278 KTOPHEDVNZLANH-UHFFFAOYSA-N 257.337 2.343 10 20 CECD Cc1ncc(CNCCCSc2nccs2)n1C 850143996 HNULDTJXLFHZLI-UHFFFAOYSA-N 282.438 2.457 10 20 CECD CCC(=O)C1(C(=O)NCc2cc(C)ccc2O)CC1 862754413 DQQDUZUGMGIYNM-UHFFFAOYSA-N 261.321 2.076 10 20 CECD CC(C)[C@H](C)N(C)Cc1cc2c(cc1O)OC[C@H]2O 768439326 KITJRTKQHZJKIA-IINYFYTJSA-N 265.353 2.294 10 20 CECD C[C@@H]1[C@@H](N(C)C)CCN1Cc1ccc(N(C)C)cc1 931041061 GILQFVXMMBUDJS-CJNGLKHVSA-N 261.413 2.277 10 20 CECD CN(C)c1cc(F)c(CNCC(C)(C)C(=O)O)cc1F 1118978338 KXFMLIIDLWUQBQ-UHFFFAOYSA-N 286.322 2.231 10 20 CECD CC(C)[C@@](C)(O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 775402679 FSLNWLXCQSQPRB-MLGOLLRUSA-N 278.396 2.337 10 20 CECD C[C@H](C(=O)NCc1ccc(N2CCCCC2)cc1)N(C)C 874240005 KTEAHUFELCISSJ-CQSZACIVSA-N 289.423 2.243 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H](CCO)C2CC2)c1O 771796245 PQJZFKWDTIAMTO-AWEZNQCLSA-N 297.782 2.499 10 20 CECD CCc1ccc(CC(=O)NCCc2ccc(N)cc2)nc1 884028999 YCCWRHZSMFNFIX-UHFFFAOYSA-N 283.375 2.128 10 20 CECD COc1ccc(CN(C)C[C@@H]2CCCOC2)c(O)c1OC 891948497 JSZNQNUFKYQVIN-LBPRGKRZSA-N 295.379 2.268 10 20 CECD Cc1cccc(CN2CCc3ncncc3C2)c1O 895722076 CITYUADICUHIBB-UHFFFAOYSA-N 255.321 2.049 10 20 CECD Oc1cccc2c1[C@@H](NCc1cccnc1O)CC2 714954664 WAAYPLMBWMIVTP-LBPRGKRZSA-N 256.305 2.270 10 20 CECD COc1cccc(CNC[C@H](OC)C(F)(F)F)c1O 733330136 OWXPYIMHOJIPBL-JTQLQIEISA-N 279.258 2.068 10 20 CECD Cc1ccc([C@@H](C)C(=O)NCc2cccc(O)c2O)o1 1528771320 NGIVCZSFEWIMQW-SNVBAGLBSA-N 275.304 2.419 10 20 CECD Cc1cc(CCNC(=O)[C@H](C)N)c(C)n1-c1ccccc1 1574133275 AQBAUYJTKLAGMC-ZDUSSCGKSA-N 285.391 2.100 10 20 CECD C[C@@H](NCC1(O)CCC(C(=O)O)CC1)c1ccccc1O 1594206740 XEBLZWXYDZUREG-OPGSHWCFSA-N 293.363 2.049 10 20 CECD Oc1ccccc1CNCCc1ccc2c(c1)OCCO2 19913466 FCORAOABMNDNAX-UHFFFAOYSA-N 285.343 2.496 10 20 CECD c1cc2nc(-c3ccc(N4CCOCC4)cc3)[nH]c2cn1 154602210 KTDKBWHCMVDYMF-UHFFFAOYSA-N 280.331 2.462 10 20 CECD C[C@@H](NC[C@@H]1COC(C)(C)O1)c1ccccc1O 230206242 QZZFOKUVORUCME-GHMZBOCLSA-N 251.326 2.194 10 20 CECD c1cc2c(cc1CN[C@H]1CCN3CCCC[C@H]13)CCO2 37363293 WRNHFEGCICMEFG-JKSUJKDBSA-N 272.392 2.338 10 20 CECD C[C@@H](N[C@@H]1CCc2cccc(O)c21)c1cnn(C)c1 297704519 MOAUQPHCPXQASX-ZWNOBZJWSA-N 257.337 2.464 10 20 CECD Cn1cncc1CNCc1ccc(Br)cc1O 701161581 CWBMYKZXFOMOAY-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CO[C@@H]1CCC[C@H]1NCc1cc(F)cc(F)c1O 708558338 FRHMAOCBZCXADM-VXGBXAGGSA-N 257.280 2.328 10 20 CECD COc1ccc(O)c(CN[C@@H]2C[C@H]2C(F)(F)F)c1 877703539 NIQYGTNIEXVOPY-NXEZZACHSA-N 261.243 2.441 10 20 CECD Cc1cc(C(=O)O[C@@H]2CCOC2)c(C)n1-c1ccccn1 107016028 FMUGPTCZVISQRL-CYBMUJFWSA-N 286.331 2.435 10 20 CECD C[C@H](CNC(=O)Nc1ccc(N)cc1)CC1(C)OCCO1 841300086 MVPJFCAJDOIQET-NSHDSACASA-N 293.367 2.180 10 20 CECD CCN(CC)c1ccc(CNCC2(O)CCOCC2)cc1 112717001 RPEDKOMGVAESLX-UHFFFAOYSA-N 292.423 2.164 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCN1CCCC1=O 405365293 TVKRAWCTODFEQT-QWHCGFSZSA-N 288.391 2.461 10 20 CECD COc1ccc(O)c([C@H](C)NCCCO[C@@H]2CCOC2)c1 182391971 PUCSOOFZWJBXFE-GXTWGEPZSA-N 295.379 2.247 10 20 CECD CN(C)c1ccccc1N(C)C(=O)/C=C/c1cnn(C)c1 128713980 HHLQAFOUXSGXCW-MDZDMXLPSA-N 284.363 2.162 10 20 CECD C[C@H](O)C[C@H]1CCCCCN1C(=O)c1cccc(O)c1O 126645428 ISWNNDCOUCXOFK-NWDGAFQWSA-N 293.363 2.254 10 20 CECD Oc1ccc(F)cc1CN1CCC(Cn2ccnn2)CC1 180287896 WIQSCPZIDVOBES-UHFFFAOYSA-N 290.342 2.035 10 20 CECD Cc1nnc(NCc2cccc(Br)c2O)o1 134428751 QQMIUSPVHVOVDT-UHFFFAOYSA-N 284.113 2.458 10 20 CECD COc1cccc(CN(C)Cc2cccnc2)c1O 183660821 KMHWPPVQCITJKE-UHFFFAOYSA-N 258.321 2.428 10 20 CECD C[C@@H](N[C@@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1O 183613922 HFQRZEQSBQQIEK-VXGBXAGGSA-N 276.380 2.442 10 20 CECD CNC(=O)[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 93360797 JEEGOPJHRZOPIK-JTQLQIEISA-N 282.771 2.004 10 20 CECD CCCNC(=O)CN(CCC)Cc1cccc(C)c1O 271722379 KLCOUVNGZBSRIV-UHFFFAOYSA-N 278.396 2.439 10 20 CECD CCOC(C)(C)CNCc1ccc([N+](=O)[O-])c(OC)c1O 278453438 YIMAMPLUACVTJV-UHFFFAOYSA-N 298.339 2.214 10 20 CECD C[C@@H](NCc1cc([N+](=O)[O-])ccc1O)C(F)(F)F 277093566 KUYUCGMYDUMEOA-ZCFIWIBFSA-N 264.203 2.341 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](C)CC(C)(C)O)c1 296371893 JGJQQLNIVFZWCN-GHMZBOCLSA-N 295.379 2.379 10 20 CECD COCC1(CN[C@@H](C)c2ccc(F)cc2O)CCNCC1 817973948 HRRGDWIIIREHIF-LBPRGKRZSA-N 296.386 2.198 10 20 CECD CC(C)N(C)C[C@H](C)NC(=O)N(C)Cc1ccccc1O 812509291 LGFIODOSEPLOSS-ZDUSSCGKSA-N 293.411 2.262 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1ccc(N(C)C)c(C)c1 815078193 QWTJRBLLZKYAOE-MRXNPFEDSA-N 289.423 2.162 10 20 CECD C[S@](=O)CCN1CCCc2cc(OC(F)F)ccc21 828153914 YIJGVMLZHKJPCE-IBGZPJMESA-N 289.347 2.419 10 20 CECD CC1(C)C[C@H](O)CCN(Cc2cc3c(cc2O)OCO3)C1 825091009 QYRCYHFRBVRMSQ-GFCCVEGCSA-N 293.363 2.104 10 20 CECD CCN1CCC[C@@H](N[C@@H](C)c2cc(F)cc(F)c2O)C1=O 903392382 RJUDWBXUWRENQK-TVQRCGJNSA-N 298.333 2.332 10 20 CECD CO[C@@H]1C[C@H](N(C)C(=O)c2cccc(O)c2O)C12CCC2 837017844 RXDVZMVIXVRNNX-QWHCGFSZSA-N 291.347 2.127 10 20 CECD CC(C)N(CCC(=O)O)Cc1cccc(F)c1O 833497131 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840949667 AHTIVEOXLJVCGP-ZDUSSCGKSA-N 278.396 2.491 10 20 CECD CC(C)N1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 929402017 ADRVPQZLZLYFSI-MRXNPFEDSA-N 289.423 2.242 10 20 CECD COc1cc(Cl)cc(CN[C@@H](CCN)C(F)F)c1O 841073606 HLUATTWWSMAHKM-VIFPVBQESA-N 294.729 2.126 10 20 CECD CC(=O)NCCCN(Cc1ccc(N(C)C)cc1)C1CC1 920781275 MFSHISZEXXTNDS-UHFFFAOYSA-N 289.423 2.243 10 20 CECD COc1cc(N2CC[C@H]3C[C@H]3C2)c([N+](=O)[O-])cc1OC 853901755 JPINZUUHLKRSDL-UWVGGRQHSA-N 278.308 2.458 10 20 CECD Cc1nc(CCOC(=O)c2cccc(O)c2O)cs1 758557642 JTXBYHIQNAWSKS-UHFFFAOYSA-N 279.317 2.262 10 20 CECD CS/C=C\C(=O)NCc1ccc(N2CCOCC2)cc1 751459871 BFZGCNNLAQBNCN-WDZFZDKYSA-N 292.404 2.016 10 20 CECD CC[C@H](C)CCNC(=O)c1c(F)ccc(O)c1O 857307004 MYWXHBKOCJUBEI-QMMMGPOBSA-N 255.289 2.403 10 20 CECD C[C@@H](NCCN1CCC1)c1cc(F)cc(F)c1O 756769188 OSQAOKNGCPTWMR-SECBINFHSA-N 256.296 2.027 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)N[C@@H]2C=CCC2)c1 852510166 QXTLRXZHPYEMQX-WDEREUQCSA-N 276.336 2.480 10 20 CECD CCOc1ccccc1N(C)C(=O)/C=C\c1cnn(C)c1 755159480 VYYONHHFTZOOEY-KTKRTIGZSA-N 285.347 2.495 10 20 CECD CCC[C@@]1(NC(=O)c2cc(O)cs2)CCOC1 854431017 PBBVACJYESMTFD-GFCCVEGCSA-N 255.339 2.143 10 20 CECD COc1ccc(N(C)Cc2cnn(C)c2C)cc1OC 766027612 PQEUSHBYZWQENY-UHFFFAOYSA-N 275.352 2.382 10 20 CECD C[C@H](NC(=O)/C=C/c1cnn(C)c1)c1ccc(N(C)C)cc1 772999812 MQZNKDSOBLOXPV-KADSFNECSA-N 298.390 2.377 10 20 CECD Cc1ccc(C(=O)Nc2ccnn2CC2CC2)c(O)c1O 780983640 MNMMELGHRMHOKF-UHFFFAOYSA-N 287.319 2.265 10 20 CECD COc1ccc2c(c1)CCCN2Cc1cnc2n1CCOC2 893450323 LJOPZLIHXMKCBL-UHFFFAOYSA-N 299.374 2.375 10 20 CECD C[C@@H](C(=O)OCC(=O)c1ccc(O)c(O)c1)c1ccco1 783838677 MGETYCPFVWQMHW-SECBINFHSA-N 290.271 2.220 10 20 CECD COC(=O)CN(Cc1cc(C)cc(OC)c1O)C(C)C 893957362 CPEFPBDRHUBDNW-UHFFFAOYSA-N 281.352 2.093 10 20 CECD COc1cc(C)cc(CN(C)Cc2noc(C)n2)c1O 895354844 UAQAHZPOBKFIRL-UHFFFAOYSA-N 277.324 2.033 10 20 CECD COc1ccc(CNC(=O)/C=C/c2ccc(O)cc2)c(O)c1 794390119 HWYFFIXFEUIPSA-RUDMXATFSA-N 299.326 2.436 10 20 CECD CCC(=O)N1CCC(NCc2ccc(OC)c(C)c2)CC1 989834241 SDIWDBWXGDIFBK-UHFFFAOYSA-N 290.407 2.494 10 20 CECD COc1cccc(CN2CC[C@H](N3CCCC3)C2)c1O 133953561 DAXBRWFXKWRGBQ-AWEZNQCLSA-N 276.380 2.071 10 20 CECD CN1CCN(Cc2cc(F)ccc2O)C(C)(C)C1 272230558 DUTJEPKAONJTOV-UHFFFAOYSA-N 252.333 2.057 10 20 CECD C[C@@H](NCc1ccc(N(C)C)cc1)c1cn(C)cn1 709956129 YLJODDSDTZCARJ-GFCCVEGCSA-N 258.369 2.337 10 20 CECD Cc1cc(NCc2ccc(N(C)C)c(F)c2)nc(CO)n1 1324282612 SRRDFYISQJXNGF-UHFFFAOYSA-N 290.342 2.095 10 20 CECD CCc1cccc(CN[C@@H](CO)C(C)(C)C)c1O 691436560 RVEJMKIWXHOZMJ-ZDUSSCGKSA-N 251.370 2.451 10 20 CECD Nc1ccc(CN2CCC[C@H](C(=O)NCC3CC3)C2)cc1 1334775099 RFSLTHMRSGYHGL-HNNXBMFYSA-N 287.407 2.007 10 20 CECD CC[C@@H]1C[C@@H](C(=O)NCc2ccc(N)cc2)CCO1 1356228212 POOIDAJHVYLEGX-GXTWGEPZSA-N 262.353 2.090 10 20 CECD COc1cccc(CNc2cccc(C(=O)O)n2)c1O 1607322805 JKQRJGQPOWKWHO-UHFFFAOYSA-N 274.276 2.106 10 20 CECD O=C(C[C@@H]1CNc2ccccc21)NCc1cc(O)ccc1O 1580517242 JCTVZKYAAZGQPX-LLVKDONJSA-N 298.342 2.313 10 20 CECD Oc1cc(F)c(Cl)cc1CNCC12CC(CN1)C2 1580888452 LMIDIGAHQIQTCB-UHFFFAOYSA-N 270.735 2.026 10 20 CECD CN(C)CC1(NCc2ccc3c(c2)CCO3)CCC1 282421098 ZSJAPUZLWBYOQQ-UHFFFAOYSA-N 260.381 2.195 10 20 CECD N[C@@H]1CCCCCN(Cc2cc(F)ccc2O)C1 708996693 ZTSDLASBRHPXCY-CYBMUJFWSA-N 252.333 2.235 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1CCOCC1 115279661 IZHTWASWLSXLAC-UHFFFAOYSA-N 276.380 2.104 10 20 CECD CN(C)c1ccc(CNCc2cn(C(C)(C)C)nn2)cc1 189940776 MQSFWLKYZQZKBS-UHFFFAOYSA-N 287.411 2.389 10 20 CECD COC(=O)c1coc(CN(C)c2ccc3c(c2)OCO3)c1 121402381 WBKYBGWHTXAQFF-UHFFFAOYSA-N 289.287 2.431 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@@H](c2ccco2)C1 364828490 FJYYXSQLAXSWEL-SNVBAGLBSA-N 273.288 2.321 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2ccc(F)c(F)c2O)C1 187761307 HXFPLFGTRYUNIV-NXEZZACHSA-N 298.333 2.332 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H](C)c1cc(F)ccc1O 185512206 RZFVVKSISSIFOP-IGJMFERPSA-N 273.373 2.294 10 20 CECD CSC[C@H](C)NC(=O)NCc1ccc(N(C)C)c(F)c1 77798674 YFOCUVNZSHQDTP-JTQLQIEISA-N 299.415 2.442 10 20 CECD CN(CCO[C@@H]1CCCCO1)c1ccc2c(c1)OCO2 181773828 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CECD CC(C)c1n[nH]c(CN(C)c2ccc3c(c2)OCO3)n1 794433469 AOYYTFZXZBGZDM-UHFFFAOYSA-N 274.324 2.293 10 20 CECD CC[C@@H](N[C@H]1CCN(C)C1)c1ccc(F)cc1O 796748355 UNGJBFKNONQWKG-WCQYABFASA-N 252.333 2.276 10 20 CECD C[C@@H]1c2nncn2CCN1Cc1cc(Cl)cc(F)c1O 792187411 LLCRXBYZCFXUTC-MRVPVSSYSA-N 296.733 2.353 10 20 CECD NCC[C@@H](NCc1ccc(N2CCCC2)cc1)C(F)F 1325626492 QROUSMXTLCPLDU-CQSZACIVSA-N 283.366 2.359 10 20 CECD Cc1ccc(O)c(CN2CCOC3(CCOCC3)C2)c1 91895950 FIEPLILMEANOSE-UHFFFAOYSA-N 277.364 2.082 10 20 CECD COc1ccc(O)c(CNCc2cscn2)c1 108941567 JTTWGMXAPPMAIX-UHFFFAOYSA-N 250.323 2.147 10 20 CECD CC(C)c1ocnc1C(=O)NCc1cccc(O)c1O 1348045562 DNDBGXOZVRUKFH-UHFFFAOYSA-N 276.292 2.139 10 20 CECD COc1ccc(O)c(CNCCCOCC2CC2)c1 20191322 CYLSFVFTGGNYPR-UHFFFAOYSA-N 265.353 2.307 10 20 CECD Nc1ccc(CNC(=O)c2cccc3c2OCC3)cc1 1580445806 WUSGQMPDUHRAQC-UHFFFAOYSA-N 268.316 2.134 10 20 CECD CC(C)C[C@H](CO)N[C@H](C)c1cc(C(=O)O)ccc1O 1591446845 FHCXYSNXUMXWJC-ZYHUDNBSSA-N 281.352 2.148 10 20 CECD C[C@]1(C(=O)O)CC[C@@H](NCc2cc(F)cc(F)c2O)C1 1776501996 XUHVEIDWCZNWIN-YGRLFVJLSA-N 285.290 2.403 10 20 CECD CCN1CCCc2cc(CN[C@H](C(=O)O)C3CC3)ccc21 1776875241 QNQFOGKBJDOVON-INIZCTEOSA-N 288.391 2.412 10 20 CECD COc1cccc(CN[C@@H]2CCOC(C)(C)C2)c1O 160630790 GUWGTDRJIICNKK-GFCCVEGCSA-N 265.353 2.448 10 20 CECD CCOC[C@H](O)CN(c1ccc(OC)c(F)c1)C(C)C 156767575 WRORJQDIDACQAS-CYBMUJFWSA-N 285.359 2.447 10 20 CECD CC[C@@H](OC1CCCC1)C(=O)NCc1ccc(O)c(O)c1 159065206 BDTDTXVVWRMLNE-OAHLLOKOSA-N 293.363 2.452 10 20 CECD N[C@@H]1CCC[C@@H](NCc2ccc3c(c2)CCCO3)C1 904355635 PXCUKVVLEFAQAP-HUUCEWRRSA-N 260.381 2.371 10 20 CECD C[C@H](CCNCc1ccc2c(c1)CCCO2)N(C)C 922255629 VKRRESOBHMUEPV-CYBMUJFWSA-N 262.397 2.441 10 20 CECD CCCN1CC[C@@H](NCc2cccc(OCC)c2O)C1 389286679 WFYDRFBDFSAUJM-CQSZACIVSA-N 278.396 2.365 10 20 CECD COCC(=O)NCc1ccc(N2CCC(C)CC2)cc1 108295362 WFWZRQYMOWUZKU-UHFFFAOYSA-N 276.380 2.186 10 20 CECD COc1cccc(CNC(=O)c2cc(C)ccc2O)c1O 68488794 CZEKPPJYNASMAJ-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CCN(C)C(=O)CN[C@@H](C)c1cc2c(cc1O)CCCC2 186811905 DCOYOCCLXPECAV-LBPRGKRZSA-N 290.407 2.400 10 20 CECD C[C@H](NCC(F)(F)CO)c1cc(Cl)ccc1O 184694426 OQZOANDYTYQYJF-ZETCQYMHSA-N 265.687 2.324 10 20 CECD CN(CC(=O)OC(C)(C)C)Cc1cc(F)ccc1O 180024507 BEAPBWJQPIZRDC-UHFFFAOYSA-N 269.316 2.305 10 20 CECD CN1C[C@H]2CN(Cc3c(O)ccc(Cl)c3F)C[C@H]2C1 194540716 DKEGAUFDSMYBCX-AOOOYVTPSA-N 284.762 2.178 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](C)[C@H](CO)C2)c1O 191726761 QCIIORDGWWMNFH-KOLCDFICSA-N 285.771 2.114 10 20 CECD Oc1ccc(Cl)cc1CNCCOCC(F)F 190896881 ALGHBOOOZYKXJO-UHFFFAOYSA-N 265.687 2.417 10 20 CECD CN(C)c1ccc(CN(C(=O)[C@@H]2CCCO2)C2CC2)cc1 270711309 CRGZFIKHVZKGIT-INIZCTEOSA-N 288.391 2.423 10 20 CECD COc1ccc(O)c(CN[C@H]2CCCc3cn[nH]c32)c1 271805912 JXBJUYZSJRVZFY-ZDUSSCGKSA-N 273.336 2.291 10 20 CECD COC[C@H]1CN(Cc2c(O)cccc2Cl)C[C@@H](C)O1 275876566 ATGVBTCDJBRBAD-GHMZBOCLSA-N 285.771 2.281 10 20 CECD CCC(=O)N1CCCN(Cc2cccc(Cl)c2O)CC1 373224177 PXIVSABFMCCCLR-UHFFFAOYSA-N 296.798 2.490 10 20 CECD COC[C@@H](NCc1ccc(N(C)C)c(C)c1)[C@@H]1CCCO1 815104044 XRPCEQSSJAAUCN-WBVHZDCISA-N 292.423 2.345 10 20 CECD CCn1nc(C)c(C(=O)CSc2nccs2)n1 829100675 WXIHYYSKMYMFOS-UHFFFAOYSA-N 268.367 2.038 10 20 CECD Cc1cc(O)c(CN2CC[C@](C)(O)C2)cc1Cl 824905941 JHOLOORKUQFKRS-ZDUSSCGKSA-N 255.745 2.311 10 20 CECD Cc1cccc(-n2c(C)cc(CNC(=O)CCO)c2C)c1 902958649 YSZDZJDCIARQJN-UHFFFAOYSA-N 286.375 2.401 10 20 CECD COc1ccc(CN[C@H]2C[C@H]3CCCCN3C2=O)cc1C 835072272 DZEUVLCEQDWVMP-CABCVRRESA-N 288.391 2.247 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@]3(CN)C2)cc1F 844902469 NFWPNNLJNXAYBE-YOEHRIQHSA-N 291.414 2.453 10 20 CECD CN(C)C1(CNCc2cc(Cl)c(F)cc2O)CC1 841889530 BZFNORNUBRUSHZ-UHFFFAOYSA-N 272.751 2.369 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H]([C@H]2CCNC2)C1 843125190 NRLQZEAPUYUNBL-UONOGXRCSA-N 290.407 2.222 10 20 CECD CNC(=O)CCCN[C@H](C)c1ccc(Cl)cc1O 841747845 UJVVEGZRIASTHC-SECBINFHSA-N 270.760 2.222 10 20 CECD Nc1ccc(NC(=O)N2CCOCC3(CCC3)C2)cc1 841296540 UYHGTGVXNFHEKN-UHFFFAOYSA-N 275.352 2.303 10 20 CECD CCOC(=O)N1CCC(C(=O)Nc2ccc(N)cc2)CC1 746478589 AMPBHTBPDZIMLU-UHFFFAOYSA-N 291.351 2.076 10 20 CECD CCCC[C@H](C(=O)O)N(C)Cc1ccccc1O 829276399 KJOXQOMYEALHMG-GFCCVEGCSA-N 251.326 2.467 10 20 CECD CC[C@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CC[C@@H]1N 843376555 AXEXLBAIKFXIGQ-NHYWBVRUSA-N 294.370 2.293 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)CN2CCCC2=O)c1O 846145049 OHBXYXSHOMLUOK-RYUDHWBXSA-N 292.379 2.062 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@@H]3CNC[C@H]3C2)cc1F 843342786 ONWQFGIGBYGQFR-RBSFLKMASA-N 291.414 2.369 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843058315 RNUKOFMVILZBED-RKDXNWHRSA-N 299.758 2.123 10 20 CECD Cc1ccc(O)c([C@@H](C)NCc2ccnc(N(C)C)n2)c1 756787968 ACXHHMRONNFFDE-GFCCVEGCSA-N 286.379 2.407 10 20 CECD CCCN(C(=O)/C=C\c1cnn(C)c1)c1cccnc1 750123639 URFHNHHCKAPADE-SREVYHEPSA-N 270.336 2.272 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(C)CCOCC1 935946512 ITQQUGJCLNIUOO-UHFFFAOYSA-N 298.379 2.311 10 20 CECD COc1cc(O)c(CN[C@@H](CO)CCC(C)C)cc1OC 862480942 PMDZHPYVEYDJBM-CYBMUJFWSA-N 297.395 2.296 10 20 CECD CC(=O)CCCC(=O)NCc1ccc(N(C)C)cc1C 773022317 RVMDRIRQXMUIRR-UHFFFAOYSA-N 276.380 2.437 10 20 CECD CO[C@@H]1CCC[C@@H]1CNC(=O)/C=C\c1ccc(O)c(O)c1 779545103 QEJIRQHJLIUDDM-BALYKDRCSA-N 291.347 2.042 10 20 CECD CS/C=C\C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773749632 RUVXFJFKIKXRIY-UDIARPCQSA-N 267.350 2.022 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCO1)c1ccc(N(C)C)cc1 772994939 AAVURCBFSBLNTC-RISCZKNCSA-N 262.353 2.109 10 20 CECD CS/C=C/C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773749629 RUVXFJFKIKXRIY-CYNONHLPSA-N 267.350 2.022 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@H](C(=O)Nc2ccc(N)cc2)C1 884009450 WTDVCQFRWYQMII-NOZJJQNGSA-N 270.336 2.297 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1c(O)cccc1F 886548128 XVHMSGQDKVDZJN-UWVGGRQHSA-N 289.372 2.005 10 20 CECD COc1cccc(CN[C@@H]2CCCCC[C@H]2O)c1O 135657316 OEKYFMNLKWEPEL-CHWSQXEVSA-N 265.353 2.184 10 20 CECD C[C@H](N[C@H](C)CC[S@](C)=O)c1cc(F)ccc1O 168841559 DJEMVQXTELVNAJ-AUSHCKSDSA-N 273.373 2.339 10 20 CECD CCOC(=O)C[C@H]1CCCN1Cc1c(O)cccc1OC 1320469049 BWUXIROUHDQAGU-GFCCVEGCSA-N 293.363 2.318 10 20 CECD Cc1ccc(O)c(CN2CCC[C@@H](CC(=O)O)C2)c1 86757389 QQEGRXUJERMMIY-LBPRGKRZSA-N 263.337 2.387 10 20 CECD CC[C@@]1(C)CN(Cc2cc(OC)ccc2O)CCO1 191150072 SQSNRBLBQVQQMA-HNNXBMFYSA-N 265.353 2.402 10 20 CECD O=C(COC(=O)c1cccc(O)c1O)c1cccs1 1320741117 KGLQVQINFBSYNQ-UHFFFAOYSA-N 278.285 2.199 10 20 CECD CCOc1cccc(CN[C@H]2CC[C@H](CO)CC2)c1O 759294590 UTYPAEDZLBZPHW-MQMHXKEQSA-N 279.380 2.432 10 20 CECD COc1ccc(N2CCC(NC(=O)[C@H]3C[C@@H]3F)CC2)cc1 1337092685 NUWRNYUIHDZKKX-GJZGRUSLSA-N 292.354 2.138 10 20 CECD Nc1ccc(CNC(=O)N2CCCC[C@@H]2c2cc[nH]n2)cc1 1337018386 KKUXRKWYAFFRID-OAHLLOKOSA-N 299.378 2.429 10 20 CECD CC[C@@H](C)[C@@H](NCc1cc(F)cc(F)c1O)C(=O)O 1334842704 ZAKCOFXJLAZHJA-RDDDGLTNSA-N 273.279 2.259 10 20 CECD CC[C@H](C)C[C@@H](N)C(=O)N[C@@H](C)c1cc(OC)ccc1O 1340340612 NPSZLXPDCXHDGL-COPLHBTASA-N 294.395 2.342 10 20 CECD CO[C@H]1CCC[C@@H](CC(=O)NCc2cccc(O)c2O)C1 1352657850 NIUYQMXNBDIMTA-YPMHNXCESA-N 293.363 2.309 10 20 CECD Cc1cc(O)nc([C@@H](C)Sc2ncc(C(=O)O)s2)n1 1600286501 LDDYRKACDHARKU-ZCFIWIBFSA-N 297.361 2.499 10 20 CECD COc1cc(CN(C)C[C@@H]2CCOC2)c(O)cc1C 160363380 RBZGNIDGPNYQAV-LBPRGKRZSA-N 265.353 2.178 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)[C@H]2CCOC2)c1O 163076588 QPLCXMDQVCOHQC-KOLCDFICSA-N 281.327 2.249 10 20 CECD CCc1cccc(CN2CC[C@@H](OCCOC)C2)c1O 848905793 ODTVJXKDWLAEIN-OAHLLOKOSA-N 279.380 2.192 10 20 CECD CC[C@@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@H](C)O1 111167883 KAVPXYZNWDPPPX-CMPLNLGQSA-N 279.336 2.120 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@H](N)[C@H]3C2)c1 252870857 SPCVDHPUDCHZKK-QEJZJMRPSA-N 260.381 2.260 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1cc(Cl)ccc1O 38013769 NWONZGKXQOGWQL-SNVBAGLBSA-N 284.787 2.440 10 20 CECD CCOc1cccc(CNCC[C@@H](C)OC)c1O 263787528 GVVUPTYFAJZKBK-LLVKDONJSA-N 253.342 2.306 10 20 CECD C[C@@H]1NCCN(Cc2cc(Cl)ccc2O)[C@@H]1C 379501895 WWQPNGIJJIBBJI-VHSXEESVSA-N 254.761 2.228 10 20 CECD COc1cccc(CNCC2SCCS2)c1O 692903302 AUFURIMGPOIXIV-UHFFFAOYSA-N 271.407 2.297 10 20 CECD C[C@H]1C[C@@H](C)[C@H](CN)CN1Cc1cc(F)ccc1O 397304691 GHDXMDMMJZUQEV-NTZNESFSSA-N 266.360 2.337 10 20 CECD Oc1c(Cl)cccc1CNC[C@H](O)c1ccco1 305779371 NFPPHZKZAORSGU-NSHDSACASA-N 267.712 2.462 10 20 CECD COc1ccc(O)c(CN2CC[S@](=O)C(C)(C)CC2)c1 322128222 OPFJMXRNECCFDZ-FQEVSTJZSA-N 297.420 2.134 10 20 CECD CCC[C@](C)(CO)NCc1cc(OC)c(OC)cc1O 182212624 JLOOQVGIKWIQNH-OAHLLOKOSA-N 283.368 2.050 10 20 CECD COC(=O)COc1ccc(N(C)CC2=CCCOC2)cc1 183227531 RCMPXASJPBHFHT-UHFFFAOYSA-N 291.347 2.021 10 20 CECD CCOc1cccc(CN2CC[C@H](C(=O)O)[C@@H](C)C2)c1O 313741015 CABODUFKWLMYNB-AAEUAGOBSA-N 293.363 2.334 10 20 CECD COc1cccc(CN2CC[C@@H]3OCCC[C@H]3C2)c1O 245735191 KORRKFBCILBXLX-JSGCOSHPSA-N 277.364 2.402 10 20 CECD OCCO[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 180175730 VZQRWYJKPOHIEG-GFCCVEGCSA-N 285.771 2.019 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)C[C@H]1CCCCO1 266515240 YTASJRFTPJVIIY-GFCCVEGCSA-N 285.365 2.011 10 20 CECD COCCOC1CCN(Cc2cc(F)ccc2O)CC1 180140148 USEWZRLQHOZBIK-UHFFFAOYSA-N 283.343 2.159 10 20 CECD CCN1CCN(Cc2cc(Cl)cc(OC)c2O)CC1 184671862 DZAYSDSHZXGPJM-UHFFFAOYSA-N 284.787 2.192 10 20 CECD CC(=O)NC1CCC(NCc2cc(F)ccc2O)CC1 272243885 AYOWRIDMZPOYKO-UHFFFAOYSA-N 280.343 2.068 10 20 CECD CO[C@@]1(C)CCCN(C(=O)c2ccc(C)c(O)c2O)CC1 279990874 LSJGEARBYGQDDX-INIZCTEOSA-N 293.363 2.437 10 20 CECD COc1cc(O)c(CNC[C@H]2CCO[C@@H](C)C2)cc1OC 271819345 MOFDNVYTUHSNHT-RYUDHWBXSA-N 295.379 2.314 10 20 CECD OC[C@@]1(NCc2cc(-c3ccccc3)ccc2O)CCOC1 273484624 LWDXVMQTAQPRKP-SFHVURJKSA-N 299.370 2.300 10 20 CECD C[C@H](N[C@@H]1CCc2c[nH]nc2C1)c1ccccc1O 371684848 HWDKZKIOBPISDL-CMPLNLGQSA-N 257.337 2.323 10 20 CECD CC[C@H](NC[C@H](CO)[C@H]1CCOC1)c1ccc(F)cc1O 286937156 BAKKRVMJXDGVLM-ZOWXZIJZSA-N 297.370 2.217 10 20 CECD C[C@@H](CF)NC(=O)NCc1c(O)ccc2c1CCCC2 289268486 VXXQTIIDZAVJHJ-JTQLQIEISA-N 280.343 2.428 10 20 CECD CC(=O)NCC[C@H]1CCCN(Cc2cccc(C)c2O)C1 809777997 KTZFDZAJVMLXHN-OAHLLOKOSA-N 290.407 2.439 10 20 CECD CN1CCC[C@@H]1CNCc1cc(Cl)c(F)cc1O 294439913 XSMSVYWTMNHSII-SNVBAGLBSA-N 272.751 2.369 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NC1CCOCC1 298992347 RQOZZNLEZKFQIJ-UHFFFAOYSA-N 291.395 2.073 10 20 CECD CC[C@H](NCCNCCOC)c1cc(Cl)ccc1O 817965502 VUUURQOGQICLMV-ZDUSSCGKSA-N 286.803 2.322 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc2n(n1)CCC2 825874059 TZYQNYDHKSLTBX-UHFFFAOYSA-N 298.390 2.134 10 20 CECD COC(=O)C1(C)CN(Cc2c(O)cccc2Cl)C1 822534680 SVNSPDFNLIZFLX-UHFFFAOYSA-N 269.728 2.041 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H](N2CCCCC2)C1 732290549 ZFBODDGHGSNNNE-LLVKDONJSA-N 280.393 2.154 10 20 CECD COc1ccc(N(C)C(=O)/C=C/c2cnccc2C)nc1 492638030 AGLJJUQIARWNDV-QPJJXVBHSA-N 283.331 2.470 10 20 CECD CC(=O)NCc1ccc(NC(=O)c2cc(O)cs2)cc1 733363832 JNIUKGGHQOKXBB-UHFFFAOYSA-N 290.344 2.342 10 20 CECD CC(C)(C)C(=O)CCCC(=O)NCc1ccc(O)cc1O 910945356 SZITVVSRPAWAPN-UHFFFAOYSA-N 293.363 2.500 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1ccc(N(C)C)cc1C 840938743 GHYABJSPYGZSGF-SJORKVTESA-N 292.423 2.345 10 20 CECD COCC[C@@H](C)CNCc1cc([N+](=O)[O-])ccc1O 840954782 KBDHUQPPAGDAMC-SNVBAGLBSA-N 268.313 2.063 10 20 CECD CCC[C@@H](C)S(=O)(=O)NCc1ccccc1O 845865287 AIJLFKLJGLFCSP-SNVBAGLBSA-N 257.355 2.000 10 20 CECD CCc1cccc(CN[C@@H]2CC(=O)N(C(C)C)C2)c1O 848896553 CPJZNCXKSYIDQP-CQSZACIVSA-N 276.380 2.054 10 20 CECD COc1cccc([C@H](C)N[C@@H]2CCCC[C@H]2O)c1O 846145790 PGZMMEUHSNGPTL-CYZMBNFOSA-N 265.353 2.355 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@H](CN)C2)cc1F 841083264 ADYBKTAOQAIBAD-WCQYABFASA-N 265.376 2.109 10 20 CECD COc1cccc([C@H](C)NC[C@@H]2CCOC[C@H]2OC)c1O 846170738 ZFANGVDXMVWEAY-SLEUVZQESA-N 295.379 2.103 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](OC)[C@H](OC)C2)cc1 754155589 YFOBXEPLVXMEGY-CALCHBBNSA-N 292.423 2.378 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)NC/C=C/CO 855404248 RZSASNGSTYOTFG-ONEGZZNKSA-N 290.388 2.434 10 20 CECD CNC[C@H](C)N[C@H](C)c1ccc(Br)cc1O 854232168 NVBVIRLDNDTUBK-DTWKUNHWSA-N 287.201 2.413 10 20 CECD O=C(OCCCCCn1cccn1)c1cccc(O)c1O 758582991 VIDAFOLNFIEMCO-UHFFFAOYSA-N 290.319 2.322 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@H]2C=CCC2)c1 852510164 QXTLRXZHPYEMQX-MNOVXSKESA-N 276.336 2.480 10 20 CECD C[C@@H](NCCNc1cnccn1)c1ccc(N(C)C)cc1 766591129 NNMITWITKLOZHT-CYBMUJFWSA-N 285.395 2.305 10 20 CECD CC(C)N(Cc1cc2c(cc1O)OC[C@H]2O)CC1CC1 768439849 NVHPQGBXXYKDCT-OAHLLOKOSA-N 277.364 2.438 10 20 CECD CN(C)c1ccc(/C=C\CNC2CC(C(=O)O)C2)cc1 874053789 OBKLCDTXXAMHKY-ARJAWSKDSA-N 274.364 2.219 10 20 CECD COc1ccc(CNCc2ccc(C)n(C)c2=O)cc1C 785522770 PSBQRARPQZQTIU-UHFFFAOYSA-N 286.375 2.301 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C(=O)O)C(C)C)c1 43430582 MGFRQEVHTCSJQG-GXFFZTMASA-N 251.326 2.460 10 20 CECD COc1ccc(CNCc2nccs2)c(O)c1OC 892641860 XIIPDBXWEXLUAS-UHFFFAOYSA-N 280.349 2.156 10 20 CECD Cc1ccc(O)c(NC(=O)/C=C/c2ccc(O)c(O)c2)n1 790072372 LEWWIFBQCLDYTL-QPJJXVBHSA-N 286.287 2.159 10 20 CECD COc1ccc(CNC(=O)c2ccccc2F)c(O)c1 794387642 NHGJYKCLQPGTNO-UHFFFAOYSA-N 275.279 2.470 10 20 CECD CC(C)Cc1cc(NC(=O)c2c(F)ccc(O)c2O)n[nH]1 1324459124 NVBHFHBHBWZAFN-UHFFFAOYSA-N 293.298 2.411 10 20 CECD C[C@@H](N[C@@H]1CCn2ccnc2C1)c1ccccc1O 779060677 HXZMTXTWBQHKPI-VXGBXAGGSA-N 257.337 2.254 10 20 CECD C[C@H]1CN(CCSc2nccs2)C[C@@H](C)O1 1346808388 NNVIWAKKBKCDTP-AOOOYVTPSA-N 258.412 2.344 10 20 CECD Cc1nn(C)cc1CCC(=O)N[C@H](C)c1ccccc1O 1262024745 INAZANNVUMWWHY-GFCCVEGCSA-N 287.363 2.244 10 20 CECD CN(C)c1ccc(CN(c2cc(N)ncn2)C2CC2)cc1 1354079116 KDFDLWNKJAOUEK-UHFFFAOYSA-N 283.379 2.294 10 20 CECD Cc1ccc(O)c(CNCc2cc(C(=O)O)co2)c1 1607811662 RCFLALQCAKOZMC-UHFFFAOYSA-N 261.277 2.282 10 20 CECD CCOc1cccc(CN[C@H]2CCC[C@H]2C(=O)O)c1O 1610044724 ISPYTNSVEKWMNN-NEPJUHHUSA-N 279.336 2.134 10 20 CECD CN(C)c1ccc(CN2CC[C@H](O)C(C)(C)C2)cc1 258668334 FIYJMESILUFERO-HNNXBMFYSA-N 262.397 2.345 10 20 CECD C[C@@H]1CCn2cc(C(=O)Oc3ccc(N)cc3)nc2C1 1576760355 OQCXIHWLRNXZCJ-SNVBAGLBSA-N 271.320 2.267 10 20 CECD COc1cccc(CNCCCCCC(=O)O)c1O 1599674708 XAZKPUAUUKAFAD-UHFFFAOYSA-N 267.325 2.135 10 20 CECD CC[C@@H](C)N(C)CCNCc1ccc2c(c1)CCO2 217393628 XUIRBWGNNFFWMF-CYBMUJFWSA-N 262.397 2.441 10 20 CECD C[C@@H](NCc1nccs1)c1cc(C(=O)O)ccc1O 1593316469 IAQBLYRJUDEANK-MRVPVSSYSA-N 278.333 2.398 10 20 CECD O=C(O)[C@H]1C[C@H]2[C@H](C1)C[C@H]2NCc1cc(F)cc(F)c1O 1777608923 BNUOCHKCVSWXPR-TXUFFGGGSA-N 297.301 2.259 10 20 CECD CN(C[C@H]1CC12CC2)c1ccc(OCC(=O)O)cc1 1777051430 GPGGZTLBKYFNCV-LLVKDONJSA-N 261.321 2.386 10 20 CECD CC(C)CCS(=O)(=O)N(C)Cc1ccccc1O 269859820 YTYIKWQVGQSFGQ-UHFFFAOYSA-N 271.382 2.200 10 20 CECD C[C@H](N[C@H](C)C(=O)NC(C)(C)C)c1ccc(F)cc1O 181235102 MJBNQZWGYJUUEX-VHSXEESVSA-N 282.359 2.485 10 20 CECD CCc1cccc(CNC[C@H]2CCN(CC)C2)c1O 691522260 KQIINOPJPQNQIO-CYBMUJFWSA-N 262.397 2.386 10 20 CECD CON1CCC(N[C@H](C)c2ccc(C)cc2O)CC1 692096072 AGVAFZQALOMCCO-GFCCVEGCSA-N 264.369 2.377 10 20 CECD C[C@H](NCc1cc(Cl)ccc1O)[C@H]1C[C@@H]1C(=O)O 1593293724 XHNBQBOTQMZDBA-XROYCOCOSA-N 269.728 2.244 10 20 CECD C[C@@H](Nc1cnn(CCO)c1)c1ccc(N(C)C)cc1 305865612 YOULPINMOGFUAR-GFCCVEGCSA-N 274.368 2.115 10 20 CECD OC[C@]1(NCc2ccccc2O)CCc2ccccc21 305190203 UYYWZCVGZZUSCW-QGZVFWFLSA-N 269.344 2.316 10 20 CECD CN1CCCc2cc(CNC(=O)c3cncc(O)c3)ccc21 171867922 GJKFVDUGZYFHHP-UHFFFAOYSA-N 297.358 2.100 10 20 CECD CCOc1ccc(O)c(CN[C@@]2(C)CCOC2)c1 120159641 MYTUKSVJHJJVMW-AWEZNQCLSA-N 251.326 2.060 10 20 CECD CCOC1CC(CCNCc2cc3c(cc2O)OCO3)C1 188773487 JBZOXRISGMWYDY-UHFFFAOYSA-N 293.363 2.416 10 20 CECD C[C@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1cc(Cl)ccc1O 186088246 XLGDHNIPKOQBBG-GXSJLCMTSA-N 294.782 2.460 10 20 CECD CCOC(C)(C)CNC(=O)NCc1cccc(OC)c1O 187653132 UEYVMXZPAHXYIM-UHFFFAOYSA-N 296.367 2.015 10 20 CECD CCNC(=O)CN(C)Cc1cc(Cl)cc(Cl)c1O 133176180 YVGLFRWLLTZWLI-UHFFFAOYSA-N 291.178 2.267 10 20 CECD CCN(CC)CCCN(CC)C(=O)Cc1ccc(N)cc1 230695800 HERJFCXBENRXFY-UHFFFAOYSA-N 291.439 2.392 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1cc(Cl)cc(C(C)=O)c1O 280662152 FFXJYJPXJIYDKX-MRVPVSSYSA-N 299.754 2.242 10 20 CECD COc1ccc(O)c(CN2C[C@H](C3CC3)O[C@H](C)C2)c1 280467210 CINXODORQOFUPV-BDJLRTHQSA-N 277.364 2.400 10 20 CECD Cc1ccc(O)c(CN2C[C@@H](C)O[C@]3(CCOC3)C2)c1 280357248 UCGLWXMXWQMMNH-CZUORRHYSA-N 277.364 2.080 10 20 CECD CCC[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)OC 296293584 ZMDUKPJULGNSRJ-WAFBPQNNSA-N 279.336 2.042 10 20 CECD CC(C)c1nnc(CNCc2cc(F)ccc2O)[nH]1 294829901 PVWYQOZJVGYRKA-UHFFFAOYSA-N 264.304 2.063 10 20 CECD COc1ccc(CNC(=O)N[C@@H](C)C(F)(F)F)c(O)c1 808333663 PPPVTUCRMWUBIT-ZETCQYMHSA-N 292.257 2.151 10 20 CECD COc1ccc(N2CC[C@H](CN[C@H]3CCO[C@@H]3C)C2)cc1 818221457 MUFAEKODGHTQQA-CPUCHLNUSA-N 290.407 2.289 10 20 CECD Cc1cc(C)c([C@H](C)NCC2(CC(N)=O)CC2)c(O)c1 817587562 YREDAIDAPLDKSX-LBPRGKRZSA-N 276.380 2.315 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCC[C@H](N)C2)c1 817970046 KFSPTVNMUVBIOO-SDDRHHMPSA-N 264.369 2.321 10 20 CECD Cc1cc(C(=O)N2CCO[C@@H]3C[C@H]32)c(C)n1-c1ccccn1 816899222 PBHKGINOGDADIX-HUUCEWRRSA-N 297.358 2.102 10 20 CECD CCOc1cccc(CN[C@H](C)Cc2cnccn2)c1O 725849483 OKCRPUZSHXLHLB-GFCCVEGCSA-N 287.363 2.302 10 20 CECD COc1nc(C)cc(C)c1CNC(=O)c1cc(O)cs1 732284755 ZWHXDRQUMDCRFS-UHFFFAOYSA-N 292.360 2.404 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H]2CCCN(CCCO)C2)c1 834850618 OEILSIIZUMKOEF-GJZGRUSLSA-N 292.423 2.198 10 20 CECD CO[C@](C)(C1CC1)[C@@H](C)NC(=O)c1cc(O)cs1 839837817 TYDHAIOAOLROQQ-OQPBUACISA-N 269.366 2.387 10 20 CECD C[C@H]1SCCN(C(=O)c2cc(O)cs2)[C@@H]1C 735703787 LCPMQBCVHTZGOD-HTQZYQBOSA-N 257.380 2.420 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)C(=O)O 841768532 MUHMVMLDKQLUPW-GFCCVEGCSA-N 292.379 2.210 10 20 CECD COC1([C@@H](C)NCc2cc3c(cc2O)OCO3)CCC1 840970887 ZGWQNLGGKRYHQY-SNVBAGLBSA-N 279.336 2.168 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)C(=O)O)cc1 842519707 QARLELYZNPCGFU-LBPRGKRZSA-N 292.379 2.212 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NCCC(=O)O)cc1 740119324 NWJPEIGVWAUMSJ-UHFFFAOYSA-N 286.331 2.299 10 20 CECD CCN(CC)c1ccc(CN[C@H](CN)C2CC2)cc1 841028093 LNPFCCIIWAVSSC-MRXNPFEDSA-N 261.413 2.360 10 20 CECD COc1cccc([C@H](C)N[C@H](C)CC[S@@](C)=O)c1O 846152852 FBHJHVPEBZCGTE-RMDKCXRXSA-N 285.409 2.209 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CCCNCC1 841056927 FZPRZFFOGBJNLY-JTQLQIEISA-N 254.761 2.277 10 20 CECD COc1cccc(CNC(=O)c2ccc3n[nH]cc3c2)c1O 746689757 XHNDFDSFZFXNHO-UHFFFAOYSA-N 297.314 2.207 10 20 CECD COc1ccc(N(C)Cc2cnsn2)c(OC)c1 846833596 CKYIHATWHSZPNE-UHFFFAOYSA-N 265.338 2.192 10 20 CECD C[C@@H](NC(=O)NCc1cc(Cl)ccc1O)[C@H]1CCOC1 845009272 CYFNZKVTXSJMPV-ZJUUUORDSA-N 298.770 2.270 10 20 CECD Cc1cc(Br)cc(CN2CCCNCC2)c1O 843047640 SPUMYTIJVOBRSR-UHFFFAOYSA-N 299.212 2.258 10 20 CECD C=C1c2ccccc2C(=O)N1CC(=O)Nc1ccc(N)cc1 746478703 SUMBRKRKUGMVMC-UHFFFAOYSA-N 293.326 2.334 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)C[C@H](C)N)c1O 843129891 SRXJBXQYGXYVLA-DTWKUNHWSA-N 272.776 2.270 10 20 CECD Oc1ccc(Cl)c(F)c1CN[C@H]1CC12CCNCC2 841079791 NZSNRWLZRNSLLL-LBPRGKRZSA-N 284.762 2.416 10 20 CECD CC(C)NC(=O)[C@@H](C)NCc1cc(Cl)cc(F)c1O 840975467 YNTCISQMXNQYRK-MRVPVSSYSA-N 288.750 2.187 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)c2ccccn2)c1 851900103 PDDGCEFXMAJQKC-MEDUHNTESA-N 288.347 2.180 10 20 CECD CO[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)C(C)C 769910828 RDRZSBUQHUBGNP-AWEZNQCLSA-N 282.359 2.179 10 20 CECD C[C@@H]1SCCN(Cc2cc3c(cc2O)OC[C@@H]3O)[C@@H]1C 768447247 NSLHLZGKBNIORS-BFVZDQMLSA-N 295.404 2.144 10 20 CECD CCOCCCNC(=S)N[C@H](C)c1ccccc1O 865269339 JDANVFFCRFYUMR-LLVKDONJSA-N 282.409 2.344 10 20 CECD C[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768444586 MNJANGOANKXSCW-NHYWBVRUSA-N 277.364 2.440 10 20 CECD COCc1nc(CN[C@H](C)c2ccc(N(C)C)cc2)no1 775835646 HKFWNEBBYYDOSE-LLVKDONJSA-N 290.367 2.133 10 20 CECD CCN(C)c1ccc(CN(C)C[C@H](O)C2CC2)cc1 773757552 ZVWAZFCVGHSFAL-INIZCTEOSA-N 262.397 2.345 10 20 CECD COC[C@H](N[C@H](C)c1c(O)cccc1F)[C@H]1CCCO1 886602970 DNRBXESNBKAYJT-SCDSUCTJSA-N 283.343 2.376 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@H]1C(=O)NCCc1ccc(N)cc1 884028517 JDGRRFWDBGQXOG-BZNIZROVSA-N 298.390 2.017 10 20 CECD Cc1ccoc1C(=O)OCC(=O)c1ccc(O)c(O)c1 782151298 CDSQFPCAHSJUJB-UHFFFAOYSA-N 276.244 2.039 10 20 CECD COc1cc(C)cc(CNCCOC(F)(F)F)c1O 894540702 LSGMHHOGSBWLKF-UHFFFAOYSA-N 279.258 2.335 10 20 CECD O=C(COC(=O)c1cc(Cl)c[nH]1)c1ccc(O)c(O)c1 782557448 FOSXMNVBHYAHIC-UHFFFAOYSA-N 295.678 2.119 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@@H]2C=CCC2)c1O 895528677 ZZTATENOQSOKHN-SNVBAGLBSA-N 278.308 2.365 10 20 CECD C[C@H]1CCc2[nH]nc(C(=O)NCc3ccccc3O)c2C1 896015495 QQNTWKMTUBFRED-JTQLQIEISA-N 285.347 2.170 10 20 CECD COc1ccc(CNC(=O)NCCC(F)(F)F)c(O)c1 792961559 BJSFLCIUCVQBMH-UHFFFAOYSA-N 292.257 2.152 10 20 CECD CN1CCC[C@H](CNCc2cc(Cl)ccc2O)C1 44534555 PMEPOXUALPKRMS-LLVKDONJSA-N 268.788 2.477 10 20 CECD C[C@]1(NCc2c(O)cccc2Br)CCOC1 706868317 FADBNYHLLXNXIV-LBPRGKRZSA-N 286.169 2.423 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@@H]3C)CC2)cc1 1322869975 SDSZRQLFGPWMJF-XJKSGUPXSA-N 288.391 2.390 10 20 CECD C[C@@H](CCNCc1ccc2c(c1)CCO2)CC(=O)O 1320866104 DXWHVCQHTNTNSL-NSHDSACASA-N 263.337 2.212 10 20 CECD C[C@@H](N[C@@H]1CCn2ccnc2C1)c1cc(F)ccc1O 779067756 ZOEQBHSIFMLRNV-ZYHUDNBSSA-N 275.327 2.393 10 20 CECD CN(C)c1cc(F)c(CNCCCCCO)cc1F 1261788801 JMZGJKIVLSAPPH-UHFFFAOYSA-N 272.339 2.283 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1C[C@@H]1F 1354922616 JOHBHWOCZANGLI-NJGYIYPDSA-N 255.636 2.173 10 20 CECD CCCC[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(=O)O 1605247175 GRGFZRXKXLRIEF-CFNZNRNTSA-N 294.303 2.298 10 20 CECD CO[C@@H](CN[C@H](C)c1cc(C(=O)O)ccc1O)C1CC1 1606680138 OKWBVANHFXMXRU-OTYXRUKQSA-N 279.336 2.166 10 20 CECD COc1cc(C)c(CN2CCC(C(=O)O)CC2)c(O)c1 1594054049 CCJSUXCNADWURV-UHFFFAOYSA-N 279.336 2.006 10 20 CECD CN(C)c1ccc(CNCc2ccc(C(=O)O)cn2)cc1 1777040089 SACCFSNQGUNDOG-UHFFFAOYSA-N 285.347 2.136 10 20 CECD C[C@H](NC[C@@H](O)C1CCC1)c1cc(F)ccc1O 315953915 IZGOWLHRVLUAML-LKFCYVNXSA-N 253.317 2.343 10 20 CECD CN(C)c1ccc(CN[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C(=O)O)cc1 115603245 PXVSSDRTSUZZOU-SDADXPQNSA-N 288.391 2.342 10 20 CECD CCCCOCCNC(=O)CSc1nccs1 64669865 SXHWSGYLMXNFAX-UHFFFAOYSA-N 274.411 2.168 10 20 CECD CO[C@@]1(C)C[C@@H](NC(=O)c2ccc(C)c(O)c2O)C1(C)C 179531809 ZOJJBYUJMKIKIN-BZNIZROVSA-N 293.363 2.340 10 20 CECD C[C@H](NCCNC(=O)c1ccco1)c1ccc(F)cc1O 184916998 HMXYZOIICSQMJX-JTQLQIEISA-N 292.310 2.205 10 20 CECD Cc1cc(CNC(=O)NCc2ccc(N(C)C)cc2)no1 146068469 PFORBUDBZGIJNJ-UHFFFAOYSA-N 288.351 2.048 10 20 CECD CNC(=O)c1ccc(C)c(NC(=O)Cc2ccc(N)cc2)c1 192777668 NKUKZKDRQIQRQH-UHFFFAOYSA-N 297.358 2.118 10 20 CECD COc1ccc(O)c([C@@H](C)NCC[C@@H](C)CCO)c1 295106746 LBHJMICZHBFLJH-VXGBXAGGSA-N 267.369 2.460 10 20 CECD CCc1nn(C)cc1NCc1cc([N+](=O)[O-])ccc1O 91070307 VXDBNONIQNXLHR-UHFFFAOYSA-N 276.296 2.208 10 20 CECD Oc1ccccc1CN(C[C@H]1CCCO1)c1ncccn1 92926035 UZVUSGOYRCXJAN-CQSZACIVSA-N 285.347 2.368 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCC1CC1 274885702 BTGCHYRRSREDRQ-JTQLQIEISA-N 263.337 2.335 10 20 CECD COc1cc(O)c(CN2CC[C@H](OC)C[C@H]2C)cc1OC 282364312 PVYMTIWKKMZDDS-YPMHNXCESA-N 295.379 2.409 10 20 CECD CC[C@H](NC[C@@H](COC)OC)c1ccc(C)cc1O 280269072 XSTPRBNEUPVDIO-JSGCOSHPSA-N 267.369 2.403 10 20 CECD C[C@@H]1CC=CC[C@H]1C(=O)NCc1ccc(O)c(O)c1 286746999 LIIDWZMBBXPILJ-ZYHUDNBSSA-N 261.321 2.316 10 20 CECD CCOc1ccc(CN(C)C[C@H](C)OC)c(O)c1 809717941 OQLVGZJSWOFXFD-NSHDSACASA-N 253.342 2.258 10 20 CECD CCOC1CC(COC(=O)c2ccc(C)c(O)c2O)C1 803327732 JHLAIMJRDHFWOH-UHFFFAOYSA-N 280.320 2.378 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC(=O)NCC(F)F 393675364 WAIDVUFBLMVMHI-NXEZZACHSA-N 298.333 2.220 10 20 CECD OC[C@]1(F)CCN(Cc2cc(Cl)c(F)cc2O)C1 816601131 SJDLNWKUWVBZSB-LBPRGKRZSA-N 277.698 2.091 10 20 CECD COC(=O)[C@@H](NCc1ccc(N(C)C)c(C)c1)C1CC1 815098731 NAXUXUZBQJZIEH-HNNXBMFYSA-N 276.380 2.102 10 20 CECD Cc1cc(CC(=O)NCc2ccc3c(c2)CCCN3C)on1 816910721 PPELXCBNJILZBE-UHFFFAOYSA-N 299.374 2.224 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCC12OCCO2)c1ccccc1O 827946426 HOROEDMTRLINLB-DGCLKSJQSA-N 291.347 2.113 10 20 CECD CC[C@H]1NCC[C@@H]1C(=O)N(C)Cc1ccc(N(C)C)cc1 825942567 CWTVZOOOCNSROC-JKSUJKDBSA-N 289.423 2.099 10 20 CECD COc1ccc(N(C)Cc2cnc3n2CCC3)cc1OC 825508987 COCMQRYBYZAAIW-UHFFFAOYSA-N 287.363 2.483 10 20 CECD Cc1cccc(CN[C@@H](C)C(=O)OC(C)C)c1O 825117934 MVWYIDHJOYZHOM-NSHDSACASA-N 251.326 2.130 10 20 CECD Oc1cc(F)c(Cl)cc1CNCCOCCF 827951412 YRZRRMPOQHBMOV-UHFFFAOYSA-N 265.687 2.260 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2(CN)CCCC2)c1 828666501 FERDMEGRDYXAMZ-NSHDSACASA-N 292.379 2.097 10 20 CECD CCN(CCC(=O)O)Cc1c(O)ccc2ccncc12 737096516 OOWBKODLNDGOLC-UHFFFAOYSA-N 274.320 2.237 10 20 CECD COC/C(C)=C\CN(C)c1ccc(OCC(=O)O)cc1 903903295 BOEWXUNPLZGTQH-WQLSENKSSA-N 279.336 2.179 10 20 CECD CNC[C@@H]1CCCN1Cc1cc(Cl)cc(C(C)=O)c1O 843352639 JLVITOOFAKARNN-ZDUSSCGKSA-N 296.798 2.432 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCc2cncn2C)c1 846844928 RNYLJNHFIGKLOS-GFCCVEGCSA-N 289.379 2.418 10 20 CECD CCCc1cc(C(=O)NCCc2ccc(N)cc2)cc(O)n1 911782181 DLFBGIQDDNQHIF-UHFFFAOYSA-N 299.374 2.294 10 20 CECD CCN(C)c1ccc(CN(CC(=O)O)C2CC2)cc1 846224803 AEZFPQNVTDTSDY-UHFFFAOYSA-N 262.353 2.192 10 20 CECD O=C(NCc1cc(Cl)ccc1O)OC[C@@H]1CCCO1 845996463 PUGGQEHESLOGGO-NSHDSACASA-N 285.727 2.451 10 20 CECD CC1(C)C(=O)N[C@H]1C1CCN(Cc2ccccc2O)CC1 848919268 VAHVEBGFRSBACJ-HNNXBMFYSA-N 288.391 2.129 10 20 CECD CCCN(Cc1cc(F)cc(C(C)=O)c1O)[C@H]1CCNC1 843349433 ZFQCVEPNFOUPHA-AWEZNQCLSA-N 294.370 2.308 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@@H]1CCSC1 846475814 KAMWQLDWTFVONZ-MRVPVSSYSA-N 271.769 2.415 10 20 CECD Cc1cc(O)c(CN2CC[C@@]3(CCNC3)C2)cc1C 843120885 XGPUQCKGKVIECD-MRXNPFEDSA-N 260.381 2.194 10 20 CECD C[C@@H](CNC(=O)Cc1ccc(N)cc1)N1CCCC[C@H]1C 844171219 HABVOROWJKVLDT-KGLIPLIRSA-N 289.423 2.190 10 20 CECD CC(C)(CO)C(=O)NCc1cc(Cl)cc(Cl)c1O 848079293 HCFMWXPJFQACPV-UHFFFAOYSA-N 292.162 2.334 10 20 CECD C[C@@H]1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CCS1 754872659 OBGCQBJWNZYXLB-YGRLFVJLSA-N 295.404 2.145 10 20 CECD C[C@H](NC[C@@H](O)c1ccco1)c1cc([N+](=O)[O-])ccc1O 756382687 SNHWIFFVUGEALP-TVQRCGJNSA-N 292.291 2.278 10 20 CECD CCn1cc(CN[C@H](C)c2ccc(C)c(C)c2O)nn1 850522487 RNDYBROFGZOVRM-GFCCVEGCSA-N 274.368 2.471 10 20 CECD CCCN1CC[C@H](N[C@H](C)c2cc([N+](=O)[O-])ccc2O)C1 850557322 WGKTYVATGCYTNC-NEPJUHHUSA-N 293.367 2.435 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@@H]2O)C[C@@H]1CC1(C)C 853628029 LTVMIQXMYVUHIE-FZMZJTMJSA-N 277.364 2.296 10 20 CECD COC(=O)N1CC(N[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)C1 756757809 DPYHNOBYUDUHCY-LDYMZIIASA-N 294.326 2.120 10 20 CECD C[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C[C@@H]1CO 862425497 YEBQUKAOYPJWKF-WCQYABFASA-N 298.377 2.481 10 20 CECD CCC[C@@H](OCC)C(=O)NCc1ccc(OC)cc1O 861489611 GPXPAELEGRKPKG-CQSZACIVSA-N 281.352 2.222 10 20 CECD COc1cccc(O)c1CN(C)[C@@H]1CCSC1 768261318 BGDPMJDDWAWHES-SNVBAGLBSA-N 253.367 2.338 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C(=O)O 863740241 UDGZUTKDKILDII-AAEUAGOBSA-N 294.370 2.434 10 20 CECD Cc1ccc(CNC[C@H](O)COc2ccccc2)c(O)c1 876918248 IYTRWKJMNVDXRP-HNNXBMFYSA-N 287.359 2.230 10 20 CECD Cc1ccc(CNC(=O)NCc2cc(C)ccc2O)nc1 875688442 RCASUQSERBEFNO-UHFFFAOYSA-N 285.347 2.403 10 20 CECD CCN(CC(=O)N(C)C)Cc1cc(Cl)cc(F)c1O 775652523 MJBZZBFEDHGBGI-UHFFFAOYSA-N 288.750 2.095 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](O)[C@@H]2CCCC[C@H]21 871199667 ZHGBISWSDRNDGV-UTUOFQBUSA-N 281.377 2.219 10 20 CECD CN(CCN1CCCC1=O)Cc1cccc(Cl)c1O 775692252 TVJGEFSLWXKYQN-UHFFFAOYSA-N 282.771 2.100 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](O)c2ccco2)c1 775369705 FTCZWILPZSCTBU-QMTHXVAHSA-N 277.320 2.378 10 20 CECD C[C@H](c1ccccc1)[C@@H](CO)NC(=O)c1cc(O)cs1 778511508 CCEHNQANRSRQER-ZWNOBZJWSA-N 291.372 2.348 10 20 CECD Cc1ccc(CNCC(=O)N(C)Cc2ccccc2)c(O)c1 876947265 AWLHNIMUHZNICU-UHFFFAOYSA-N 298.386 2.449 10 20 CECD Cc1cccc(O)c1CNCCc1nccnc1C 877552039 JSTJFWONUKIAJZ-UHFFFAOYSA-N 257.337 2.131 10 20 CECD CC(C)CO[C@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773762914 LRTYQRMWPDBNBI-NWDGAFQWSA-N 295.379 2.206 10 20 CECD COc1cc(C)cc(CN[C@@H](C)CCCCO)c1O 894881762 GALYFSJRSUVCHY-LBPRGKRZSA-N 267.369 2.350 10 20 CECD COc1ccc(CNC(=O)NC[C@@H]2CCCS2)c(O)c1 792991088 BXVBUCVOVQLBHO-LBPRGKRZSA-N 296.392 2.096 10 20 CECD CCOc1cc(O)ccc1NS(=O)(=O)CCC1CC1 790411875 SFPHJKQEJZORJU-UHFFFAOYSA-N 285.365 2.333 10 20 CECD CCC(=O)NCCC1=CCN(c2cncc(Cl)n2)CC1 1089794138 ATOHPBNSHIGEMV-UHFFFAOYSA-N 294.786 2.183 10 20 CECD CCN1CCC[C@@H](NCc2ccc(OC)c(C)c2)C1=O 722361600 NOZNCTGDUCIWIV-CQSZACIVSA-N 276.380 2.104 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 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Cc1ccc([C@H](C)NCC2([S@@](C)=O)CC2)c(O)c1 282187400 GAUHKKWQJCDNPA-BBATYDOGSA-N 267.394 2.262 10 20 CECD CC[C@@H](NCC(C)(C)OCCO)c1ccccc1O 287520120 ZOYPTLLSENGVSP-CYBMUJFWSA-N 267.369 2.220 10 20 CECD COc1cccc(CN2CCCC[C@H]2[C@@H](C)N)c1O 63191263 XHYLCCOROGYTHP-YPMHNXCESA-N 264.369 2.103 10 20 CECD CCC[C@](C)(CO)NCc1cccc(OCC)c1O 304825410 FTIKXXPMMNNSEG-OAHLLOKOSA-N 267.369 2.432 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CCN)C2)cc1 70169392 WOVIGAMHFHAMII-AWEZNQCLSA-N 261.413 2.313 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCOC 66096834 WHZZZMYJJSAKRO-UHFFFAOYSA-N 251.326 2.167 10 20 CECD CCN(CC)CCC[C@H](C)NC(=O)c1cccc(O)c1O 126211512 BRDXEMKLDMDWTA-LBPRGKRZSA-N 294.395 2.338 10 20 CECD Cc1c(/C=C/C(=O)N(C)Cc2ccccc2O)cnn1C 128695008 ASYFGSCJNAHNSB-CMDGGOBGSA-N 285.347 2.106 10 20 CECD CC[C@@H](COC)N[C@H](C)c1cc(OC)ccc1O 79735694 LUYKQNIJVVZYDG-MNOVXSKESA-N 253.342 2.476 10 20 CECD CCOC1CC(NCc2cccc(OC)c2O)C1 218986941 LPDRIOATIRDNSW-UHFFFAOYSA-N 251.326 2.058 10 20 CECD CC1(C)COCCN1Cc1ccc(N2CCOCC2)cc1 130878477 SZFBLJWYZWDYIT-UHFFFAOYSA-N 290.407 2.134 10 20 CECD C[C@@H](O)CN[C@H](C)c1cc(Br)cc(F)c1O 134899439 YUYZSWHBMHJHRX-RNFRBKRXSA-N 292.148 2.325 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1C[C@H]2CC[C@H]1C2 246412952 ABOAHXXFXVICIF-AVGNSLFASA-N 275.348 2.193 10 20 CECD CCOC(=O)c1cnc(S[C@H](C)CCO)s1 380965295 CNLOWNFOFKFDLA-SSDOTTSWSA-N 261.368 2.183 10 20 CECD Nc1ccc(NC(=O)NC[C@@H]2CSCCS2)cc1 229617757 RHEUEKIZCNHFQZ-LLVKDONJSA-N 283.422 2.239 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](C)CCN(C)C)c1 273363267 AUFQVJNPHHBURH-NEPJUHHUSA-N 294.395 2.170 10 20 CECD CCN(CC)CCN[C@H](C)c1cc(C(=O)OC)ccc1O 273402579 NNXLFPFXYMZTTI-GFCCVEGCSA-N 294.395 2.171 10 20 CECD COc1cccc(CNCc2ncnn2C(C)(C)C)c1O 282543741 CJAFFBSKEOKDPZ-UHFFFAOYSA-N 290.367 2.037 10 20 CECD COC[C@H](CO)N[C@@H](C)c1ccc(Cl)c(Cl)c1O 280840396 AMUACHAAKABINP-YUMQZZPRSA-N 294.178 2.357 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](O)C(C)C 285066191 ISSRMNPWOIWHOM-OAHLLOKOSA-N 278.396 2.118 10 20 CECD CC(C)(C)n1ncnc1CNCc1ccccc1O 282606069 HVPRMBGJCXZFQP-UHFFFAOYSA-N 260.341 2.029 10 20 CECD COc1cccc(CNCc2cn(C)nc2C(F)F)c1O 290993269 AICDIEQQIKGBNZ-UHFFFAOYSA-N 297.305 2.362 10 20 CECD Cc1noc(CCCN[C@@H]2CCc3cccc(O)c32)n1 296671944 FVSPLUMFGNGKMU-GFCCVEGCSA-N 273.336 2.293 10 20 CECD O=C1CCC(COC(=O)c2cccc(O)c2O)CC1 803440778 RUXSSHLWNQVQAQ-UHFFFAOYSA-N 264.277 2.014 10 20 CECD Oc1c(Cl)cccc1CN1CC2(CCOC2)C1 293993817 LWGGLEQHDGOOOB-UHFFFAOYSA-N 253.729 2.268 10 20 CECD Cc1n[nH]cc1[C@@H](C)NC[C@H](N)c1ccc(N(C)C)cc1 817941399 JQKHDWZPNKNUTB-BZNIZROVSA-N 287.411 2.135 10 20 CECD CCC[C@]1(CO)CCN(C(=O)c2cc(O)cs2)C1 811566100 OFNADEQFLHRYGW-ZDUSSCGKSA-N 269.366 2.078 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@H]2CCCNC2)c1 817947113 KOEKPIWTHAUCCX-AGIUHOORSA-N 278.396 2.440 10 20 CECD CCN(C/C=C/c1ccc(N(C)C)cc1)CC(=O)O 901426102 AVZKCOHCQHMZOW-AATRIKPKSA-N 262.353 2.172 10 20 CECD CCOc1ccc(CNC(C)(C)CC(=O)O)c(O)c1 737203321 LCYJUWNWXMMEQR-UHFFFAOYSA-N 267.325 2.134 10 20 CECD COc1cc(Cl)cc(CN2CC(OC(F)F)C2)c1O 839143066 DQKKMMMHFJEFLC-UHFFFAOYSA-N 293.697 2.478 10 20 CECD Cc1cccc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c1 832292410 GPIGXMUJLPOARW-QGZVFWFLSA-N 297.402 2.491 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cc2c(nc1O)CCC2 917313760 ZNXZGSHOFPERNH-UHFFFAOYSA-N 298.342 2.254 10 20 CECD CCOCc1cc(CN[C@H](C)CCCN)ccc1OC 841078931 DNPDYPXXXHGZDK-CYBMUJFWSA-N 280.412 2.449 10 20 CECD O=C(NCc1cc(Cl)ccc1O)C1=CCOCC1 846474666 YZTAAFZDUTWAHP-UHFFFAOYSA-N 267.712 2.009 10 20 CECD COc1ccc(N(C)CCN(C)c2nccc(C)n2)cc1 845673190 QRDZQDALOYUMOA-UHFFFAOYSA-N 286.379 2.366 10 20 CECD CCC[C@@H](OC)C(=O)NCc1cc(Cl)ccc1O 846476500 NBOOQYHVVUTNCC-GFCCVEGCSA-N 271.744 2.477 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)C[C@H](C)OC)cc1 844853225 CRHPVGGLMPPKCS-ZDUSSCGKSA-N 294.395 2.015 10 20 CECD Cc1cc(=NC(=O)NCCc2ccc(N)cc2)c(C)c[nH]1 841170202 XPUZUAQFGJQGBG-UHFFFAOYSA-N 284.363 2.067 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H]([C@H](C)N)C2)c1O 843364441 IGBOMRCSZSTVJL-GXSJLCMTSA-N 296.798 2.417 10 20 CECD C[C@H](CCCN)NCc1cc(Br)ccc1O 841078320 AUOHRZYPALETQR-SECBINFHSA-N 287.201 2.372 10 20 CECD CC[C@H](NC(=O)NCCc1ccc(N)cc1)C(F)F 841955822 ORCOQWYJIGMMKX-NSHDSACASA-N 271.311 2.154 10 20 CECD C[C@H](NC[C@H]1CCCNC1=O)c1ccc(Cl)cc1O 841756480 VYIFTPNUDPAEQX-VHSXEESVSA-N 282.771 2.222 10 20 CECD O=C(CCCc1ccccn1)NCc1ccc(O)cc1O 910955212 PDDYBOADOLJGBD-UHFFFAOYSA-N 286.331 2.132 10 20 CECD CCC1(CNC(=O)NCCc2ccc(N)cc2)CC1 841857207 RMAUUEASIKYFSZ-UHFFFAOYSA-N 261.369 2.301 10 20 CECD COC[C@H](C)n1ccc(NC(=O)Nc2ccc(N)cc2)n1 841296150 PFJOWRZHBDCECH-JTQLQIEISA-N 289.339 2.317 10 20 CECD COc1cccc(CN[C@@H](C)[C@H]2CCCOC2)c1O 388841975 UPUKCDMGUBIAGI-AAEUAGOBSA-N 265.353 2.306 10 20 CECD Cc1nnc(CN(C)Cc2ccc(N(C)C)c(C)c2)o1 852471392 NUMVXAPOGBTEOZ-UHFFFAOYSA-N 274.368 2.384 10 20 CECD O=C(NC[C@@H]1CCCN(CC2CC2)C1)c1cc(O)cs1 856480770 XMCJWJLHISZTII-LBPRGKRZSA-N 294.420 2.306 10 20 CECD CCc1cccc(CN2CC[C@@H](C)[C@H](CO)C2)c1O 857061064 JESXYKHCMCMLIH-DOMZBBRYSA-N 263.381 2.405 10 20 CECD C[C@@H](NCc1cc(F)c(N(C)C)cc1F)c1nncn1C 858125682 KNKLWJMXKAXNFS-SECBINFHSA-N 295.337 2.010 10 20 CECD CC(=O)c1cc(C(=O)N[C@H](C)c2ccccc2O)n(C)c1 866161091 JOFCVLWTUHMMNZ-SNVBAGLBSA-N 286.331 2.424 10 20 CECD C[C@@H](NC(=O)NCc1ccn(C)c1)c1ccccc1O 868332830 NPTXPVGUJYZRBU-LLVKDONJSA-N 273.336 2.291 10 20 CECD O=S(=O)(C[C@H]1C[C@H]2CC[C@H]1C2)NCc1ccccc1O 866829758 KRDLTTYVFUBFJJ-SGMGOOAPSA-N 295.404 2.248 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CN(C)C2CCC2)c1 863865621 IGTORJGPNNLKOF-LLVKDONJSA-N 292.379 2.062 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H](C)CC(N)=O)cc1 763399508 WZJPSMYGUYLZDE-RYUDHWBXSA-N 263.385 2.057 10 20 CECD C[C@@H]1[C@@H](C)[S@@](=O)CCN1Cc1cc(Cl)ccc1O 769464750 AABIPSPIBYVNPX-MHNGPXOMSA-N 287.812 2.387 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2CC3(CC3)C(=O)O2)c1 763728027 CSJPBDWZCJZSBX-PWSUYJOCSA-N 291.347 2.147 10 20 CECD COC/C=C\C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 867504721 ZDGJJQPQAXOEGR-FJOGCWAESA-N 262.353 2.132 10 20 CECD CNC(=O)CN(Cc1ccccc1)Cc1c(C)cccc1O 877772601 KBHPULCYTLECMJ-UHFFFAOYSA-N 298.386 2.449 10 20 CECD CNC[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1118242040 VAJAKFOPJPQYOE-MRXNPFEDSA-N 273.424 2.328 10 20 CECD CCCN1CCCN(Cc2ccc(C)cc2O)CC1=O 877470484 DNIJKJHAFBJZIB-UHFFFAOYSA-N 276.380 2.145 10 20 CECD CCN[C@@H](C)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 876713242 HRCPOTTWEXJGMH-AWEZNQCLSA-N 291.439 2.489 10 20 CECD CN(C)c1ccc(CNCCc2cnccn2)cc1F 774831521 HNXJZNFIMRASAX-UHFFFAOYSA-N 274.343 2.014 10 20 CECD COc1ccc(CN2CCC[C@H]([C@H](C)O)C2)c(O)c1OC 893417120 BXUKMIXLOXYDRK-RYUDHWBXSA-N 295.379 2.002 10 20 CECD CC[C@@H](C)NC(=O)[C@@H](C)NCc1cc(C)cc(OC)c1O 894386652 KPXMEFDLQJBLHA-VXGBXAGGSA-N 294.395 2.102 10 20 CECD COc1ccc(CN2CCC[C@@](C)(O)CC2)c(O)c1OC 894145458 LNBNNBYBVLPTJO-MRXNPFEDSA-N 295.379 2.146 10 20 CECD C[C@H]1CN(Cc2ccc3ccccc3c2O)C[C@@H]1O 897681187 YRUSVPLOFDNCNC-NHYWBVRUSA-N 257.333 2.358 10 20 CECD Cc1ccc(C(=O)Oc2ccc3c(c2)CC(=O)N3)c(O)c1O 797766506 FHXIJQYUMSNVPS-UHFFFAOYSA-N 299.282 2.120 10 20 CECD CC[C@H](C(=O)NCc1ccc(OC)cc1O)N(CC)CC 794378462 ICPOTSNQCRFRDQ-CQSZACIVSA-N 294.395 2.137 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnc(C2CC2)[nH]1 1319249400 HAIJTVSNFKDUMY-UHFFFAOYSA-N 271.320 2.265 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CC12CCCC2 762275596 WHGVEQGTFBIIOR-GFCCVEGCSA-N 275.348 2.337 10 20 CECD Cc1cc(C(=O)OCC2COC2)c(C)n1-c1ccccn1 1345982411 QZNKPUKKSWSXIS-UHFFFAOYSA-N 286.331 2.292 10 20 CECD Cc1oc(C(=O)O)cc1COC(=O)c1cccc(O)c1O 1600833267 IDFWZFMFMHFZTC-UHFFFAOYSA-N 292.243 2.054 10 20 CECD O=C(O)CN(Cc1ccc(Cl)cc1O)C1CC1 1608747556 RUBSEVNEZTUZEZ-UHFFFAOYSA-N 255.701 2.095 10 20 CECD COC(=O)c1ccc(CNCc2ccc(N)cc2)cc1 1578867652 OHYSBVNMXGLVEC-UHFFFAOYSA-N 270.332 2.345 10 20 CECD C[C@H](N[C@@H](C)c1cc(C(=O)O)ccc1O)c1cnn(C)c1 1593196792 IPGAZKVFDOPMDT-UWVGGRQHSA-N 289.335 2.236 10 20 CECD Cc1occc1CN[C@H](C)c1cccc(-c2nn[nH]n2)c1O 1592512303 KAUWDOPSYDYESV-SECBINFHSA-N 299.334 2.325 10 20 CECD COc1cc(CN2CCN(C)C[C@@H]2C(C)C)c(O)cc1C 160279142 HZZJASZBRDYKRO-OAHLLOKOSA-N 292.423 2.481 10 20 CECD C[C@@H](NCc1ccccc1O)c1nnc2ccccn12 36968882 XFTWUHJHRMEWQF-LLVKDONJSA-N 268.320 2.286 10 20 CECD Cc1ccc([C@H](C)N[C@@H](C)CN2CCCC2=O)c(O)c1 37782954 JDAXDSIGEBLNMK-STQMWFEESA-N 276.380 2.362 10 20 CECD C[C@@H](N[C@H]1CCc2cccc(O)c21)c1cnn(C)c1 297704515 MOAUQPHCPXQASX-MFKMUULPSA-N 257.337 2.464 10 20 CECD Oc1cc2c(cc1CNCCC1CCOCC1)OCO2 383579834 OMERZKBUGSUBJM-UHFFFAOYSA-N 279.336 2.027 10 20 CECD COc1cccc(CN[C@H]2COC(C)(C)C2)c1O 396560420 WGLLALQNLLEBIQ-LLVKDONJSA-N 251.326 2.058 10 20 CECD CCOc1cccc(CN2CCCOC[C@@H]2C)c1O 398910762 HSRTXDQFDOKQKH-LBPRGKRZSA-N 265.353 2.402 10 20 CECD O=C(NCCCSc1nccs1)C1(O)CCCC1 304285100 LFBLNCXGXOQSLG-UHFFFAOYSA-N 286.422 2.047 10 20 CECD CCN(CC)c1ccc(CN[C@@H](CO)CCOC)cc1 282344217 VFIHMQXTNFLZJH-OAHLLOKOSA-N 280.412 2.020 10 20 CECD Oc1ccccc1CN1CCC[C@@H](c2nnc3n2CCC3)C1 179570912 PWFIUDSCKGHHHW-CQSZACIVSA-N 298.390 2.310 10 20 CECD COc1cc(O)c(CN(CC(C)(C)O)C2CC2)cc1OC 189941649 ZAMDXPOKIZHIGU-UHFFFAOYSA-N 295.379 2.145 10 20 CECD Cc1cnccc1NC(=O)NCCc1ccc(O)c(O)c1 120422992 YBNWVXCWQUVUSY-UHFFFAOYSA-N 287.319 2.165 10 20 CECD CC[C@@H](NC[C@@H]1CCCS(=O)(=O)C1)c1ccccc1O 283963445 FBXJAAGVYPNIAF-GXTWGEPZSA-N 297.420 2.258 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCOC1CCCC1 180952983 QWNSHHGZYSWGKF-SOFGYWHQSA-N 291.347 2.186 10 20 CECD COc1cccnc1N(C)C(=O)/C=C/c1cncc(F)c1 121897386 HSKZOLRMRAJYFP-AATRIKPKSA-N 287.294 2.301 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2nnc(C)s2)c1 185419597 QBANHTJMEHXIDZ-SSDOTTSWSA-N 293.348 2.052 10 20 CECD Cc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1F 182522466 MRZIDVCCMMACAA-UHFFFAOYSA-N 275.279 2.475 10 20 CECD CC1CCN([C@@H](C)CNC(=O)Cc2ccc(N)cc2)CC1 236716769 QXVRYPGWMXLATB-AWEZNQCLSA-N 289.423 2.048 10 20 CECD CCOc1cccc(CN[C@@H](C)CCCCO)c1O 295038221 MKIBFHWQTHRSRI-LBPRGKRZSA-N 267.369 2.432 10 20 CECD Cc1cc(C(=O)N[C@@H](C)CN)c(C)n1-c1ccccc1 262475802 PSAUXRSEOZCKIB-NSHDSACASA-N 271.364 2.171 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H]2CCN(C)C2=O)cc1 265649060 NCKOLLBFMQWVRR-INIZCTEOSA-N 289.423 2.195 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1cncnc1 274257498 UFLNKUAWFPKYAL-UHFFFAOYSA-N 282.347 2.007 10 20 CECD COC(=O)[C@H]1C[C@H](C)CCN1Cc1cc(C)ccc1O 274896527 GAQCAXXALIPWGW-TZMCWYRMSA-N 277.364 2.474 10 20 CECD O=C1CCC[C@H]1[C@@H]1COCCN1Cc1cc(F)ccc1O 373752170 VQYBIOAJZRSSJX-KBPBESRZSA-N 293.338 2.101 10 20 CECD Cc1cccc(CN[C@]2(CO)CCOc3ccccc32)c1O 282159757 DHPUYOUMVWKVTC-SFHVURJKSA-N 299.370 2.461 10 20 CECD CSCCCN(C)C(=O)c1ccc(C)c(O)c1O 281464640 FYMQBZMEHHKFLO-UHFFFAOYSA-N 269.366 2.231 10 20 CECD COc1cccc(CNC(=O)NCCSC(C)C)c1O 807573551 VTVLCKUDBLYDHN-UHFFFAOYSA-N 298.408 2.342 10 20 CECD CNC(=O)[C@H](C)N[C@H](C)c1ccc(Cl)c(Cl)c1O 291993674 WWDLUARULBCKJR-RQJHMYQMSA-N 291.178 2.484 10 20 CECD C[C@@H](C[C@@H](C)O)NCc1cc(Cl)c(F)cc1O 816566940 LYHINPJQSBQVSD-JGVFFNPUSA-N 261.724 2.434 10 20 CECD CC[C@@H](NCCc1ccc(N)cc1)c1ccn(C)n1 817956817 DKIFLTVBNSENBQ-CQSZACIVSA-N 258.369 2.286 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@H]2CNCCCO2)cc1 817983238 ZXXDMVRYXLITLC-RHSMWYFYSA-N 291.439 2.172 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)[C@@H]3C[C@H]3C)C2)cc1 819578444 LRJUYDBYUZNHOX-XJKCOSOUSA-N 288.391 2.294 10 20 CECD CCc1nocc1C(=O)NCc1ccc(N(C)C)c(F)c1 824669099 FGUXBHUSWCCBFK-UHFFFAOYSA-N 291.326 2.372 10 20 CECD CCN(C)C(=O)[C@@H](C)NCc1cc(Cl)c(C)cc1O 825671400 IRRKCSYRUSZYIR-SNVBAGLBSA-N 284.787 2.310 10 20 CECD N[C@H]1C[C@@H](CN(Cc2ccccc2O)C[C@H]2CCCO2)C1 904333754 FMROHGRFYCBPMA-VNQPRFMTSA-N 290.407 2.111 10 20 CECD COc1ccc(N(C)C[C@@H]2CC3(CCNCC3)CO2)cc1 903763430 JTQQMJZEGHZJQO-INIZCTEOSA-N 290.407 2.290 10 20 CECD O=C(O)CN(CCCF)Cc1cc(Cl)ccc1O 833248398 PKHWFYZJAFFZQP-UHFFFAOYSA-N 275.707 2.292 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)NCc1ccc(N(C)C)cc1C 734405691 WUTNQFKQVNDYTE-HUUCEWRRSA-N 276.380 2.102 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H](C)CC(=O)NC)cc1 834898759 GNFAGTNTIRQGMT-CHWSQXEVSA-N 277.412 2.318 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](n2cncn2)C1 840938711 QWZGHTBEIRHBDX-INIZCTEOSA-N 285.395 2.100 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NOC1CCC1 845233730 NIMYIQDLWLXIBM-UHFFFAOYSA-N 270.716 2.329 10 20 CECD COCCOC[C@@H](C)N[C@H](C)c1cccc(OC)c1O 846156000 RKDQTBBVVCOCAY-VXGBXAGGSA-N 283.368 2.103 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@H](C)S1 743373871 DIURSCVAGUGVHP-UWVGGRQHSA-N 281.377 2.447 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C)[C@H](CN)C1 841099572 MEQGGSQAESGADI-CZUORRHYSA-N 275.440 2.478 10 20 CECD CC[C@]1(C(=O)N[C@@H](C)c2cc(OC)ccc2O)CCCN1 843489466 PIRCSKKSPKCJJO-MEDUHNTESA-N 292.379 2.110 10 20 CECD C[C@@H](c1ccccc1)[C@@H](O)CNC(=O)c1cc(O)cs1 856291870 GGPNRFJQWFNZJP-GWCFXTLKSA-N 291.372 2.348 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCSC2)c1 858257123 CPGISHUSORRKHU-LLVKDONJSA-N 266.366 2.005 10 20 CECD CC(C)[C@H](O)CNCc1cc(F)c(N(C)C)cc1F 858139349 RTWAZISSUVLHDJ-CQSZACIVSA-N 272.339 2.137 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H](O)COCC2CC2)c1 756511934 SLIALROZVLCBKW-GXTWGEPZSA-N 279.380 2.139 10 20 CECD Cc1nccnc1CN1CCOc2cc(N(C)C)ccc21 857039526 NHZKCDDSLQTNIH-UHFFFAOYSA-N 284.363 2.250 10 20 CECD O=C(NCc1cccc(Br)c1O)c1ccc[nH]1 765751209 AGHNUCASNUKLHX-UHFFFAOYSA-N 295.136 2.413 10 20 CECD Cc1cccc(O)c1CN1CCCC2(C1)OCCO2 877170734 VFTAPAQKODVPKY-UHFFFAOYSA-N 263.337 2.040 10 20 CECD CC(C)(O)CCNCc1cc(Cl)cc(F)c1O 776016164 ZGBZIRZTDGLWFI-UHFFFAOYSA-N 261.724 2.435 10 20 CECD C[C@H]1C[C@H](O)CN1Cc1cc(Cl)cc(F)c1O 788270797 RURAHZQUSDUWCY-XVKPBYJWSA-N 259.708 2.140 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cn(C(C)C)nn2)c1 794461425 JPCBWDCMTPALKI-LLVKDONJSA-N 290.367 2.424 10 20 CECD COc1ccc(CNC(=O)NCC2(C3CC3)CC2)c(O)c1 793010419 AOLVDOJTFKQISP-UHFFFAOYSA-N 290.363 2.390 10 20 CECD O=C(NCCCOC1CCCC1)c1cccc(O)c1O 188320022 ZCKNEFOQWWDMRV-UHFFFAOYSA-N 279.336 2.177 10 20 CECD CN(C)c1ccc(CN[C@](C)(CN)C2CC2)cc1F 1578426156 WHRZKUUCVANNDI-OAHLLOKOSA-N 265.376 2.109 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccsc1C(=O)O 1598530538 KDCGVGSLNAJVTI-UHFFFAOYSA-N 291.328 2.424 10 20 CECD C[C@H]1CCC[C@@]1(NCc1ccc2c(c1)CCO2)C(=O)O 1776639644 PSDZAOCJGXGTMD-ZBEGNZNMSA-N 275.348 2.355 10 20 CECD CCN1CCc2cc(CNC3([C@@H](C)C(=O)O)CC3)ccc21 1776877584 WAYZJXFWFBMGMC-LBPRGKRZSA-N 288.391 2.412 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@](F)(C(=O)O)C2)cc1 1777039997 UKKHNFUTUUHMBG-WFASDCNBSA-N 280.343 2.188 10 20 CECD CCN1CC[C@H](CNCc2ccc3c(c2)CCCO3)C1 921547057 KUTPMORIHLSWDF-OAHLLOKOSA-N 274.408 2.443 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)[C@H]1CCCNC1 841032873 GPABYYXFIZNBHE-WFASDCNBSA-N 260.381 2.099 10 20 CECD CCC[C@@]1(NCc2cc(OC)ccc2O)CCOC1 289828432 UFEXZOAMHRYZJW-OAHLLOKOSA-N 265.353 2.450 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCCSC1 810275997 YUDHBEVNFUNEKY-LLVKDONJSA-N 251.351 2.152 10 20 CECD COc1ccc(O)c(CN2CCCOC[C@@H]2C)c1 398962107 ZXAVOKYOEMOLRK-NSHDSACASA-N 251.326 2.012 10 20 CECD Cc1cccc(CN2CCNC(=O)[C@@H]2c2ccccc2)c1O 179921217 PKNIDQMVAVPXAZ-INIZCTEOSA-N 296.370 2.374 10 20 CECD O=C(NCC1CC1)[C@H]1CCCN(Cc2ccccc2O)C1 179561388 HTVFDSJKMPFGEU-HNNXBMFYSA-N 288.391 2.130 10 20 CECD COc1ccc(O)c(CNC(=O)c2c(O)cccc2F)c1 184986246 SORLRMWNPSMITO-UHFFFAOYSA-N 291.278 2.176 10 20 CECD CCN(C)C(=O)[C@@H](C)NCc1cccc(Cl)c1O 188486206 KSDOEVQREDAPBJ-SECBINFHSA-N 270.760 2.002 10 20 CECD COc1cccc(CN2CC[C@@H]([C@@H]3CCOC3)C2)c1O 371310500 LIQCONOOWRFZQO-TZMCWYRMSA-N 277.364 2.259 10 20 CECD Cc1ccc([C@@H](C)NCC2(N(C)C)CCOCC2)c(O)c1 185450016 ZSGJQMWLYODEHG-CQSZACIVSA-N 292.423 2.462 10 20 CECD CN(C(=O)Nc1ccc(N)cc1)[C@@H]1CCSC1 35408174 AFGQZLKRYGBXTO-LLVKDONJSA-N 251.355 2.238 10 20 CECD COCCN1[C@@H](C)CN(Cc2cc(F)ccc2O)C[C@H]1C 180168407 WGJKMNBNNLIAAX-BETUJISGSA-N 296.386 2.072 10 20 CECD Oc1ccccc1CNC[C@H](O)Cc1ccccc1 238053971 IPLDJDYDYLLQOY-OAHLLOKOSA-N 257.333 2.085 10 20 CECD NCC[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 236179639 XNLNWSWFIXQOEL-NSHDSACASA-N 252.333 2.092 10 20 CECD CC(=O)c1cc(F)cc(CN2CCOC[C@@H]2C2CC2)c1O 90007401 AXFVEDGZAXPIOJ-OAHLLOKOSA-N 293.338 2.345 10 20 CECD CN(C)c1ccc(CNCCCCCO)cc1F 279908125 HLRATAPJTIGAKP-UHFFFAOYSA-N 254.349 2.144 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1c(O)cccc1Cl 271174187 GCNBYCFKHIQIQP-LBPRGKRZSA-N 282.771 2.146 10 20 CECD O=C(CCc1ncc[nH]1)NCc1ccc(N2CCCC2)cc1 279098143 AFFIVFCITUDJGQ-UHFFFAOYSA-N 298.390 2.259 10 20 CECD CC[C@H](NCCNC(=O)C1CC1)c1ccc(F)cc1O 285811345 VUBDTSDIKIFGRC-ZDUSSCGKSA-N 280.343 2.098 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N(C)CCC(N)=O)cc1 286294304 VDVQJNGGTMRWAS-UHFFFAOYSA-N 299.374 2.042 10 20 CECD O=C(NCc1ccccc1O)NC[C@H]1COc2ccccc21 808368541 FEHRAEGYQWJXIG-ZDUSSCGKSA-N 298.342 2.368 10 20 CECD CN(CCN[C@H]1CCc2cccc(O)c21)CC(F)(F)F 297911657 WRBBAELSPQDMRJ-NSHDSACASA-N 288.313 2.463 10 20 CECD CCC[C@]1(CO)CCN(C(=O)c2ccc(C)c(O)c2O)C1 293015898 MNHXDLLQWIGMKU-INIZCTEOSA-N 293.363 2.031 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)[C@H]1CCCN1 817895038 SZDASKODWMCHAM-CZUORRHYSA-N 261.413 2.291 10 20 CECD CCOCCC(=O)N[C@@H](C)c1cc(OC)ccc1O 728978649 MBRCRZZTVGKVNI-JTQLQIEISA-N 267.325 2.005 10 20 CECD Cc1cc(O)c(CN2CCC[C@@H](CC(N)=O)C2)cc1Cl 824895415 WRBDNKDXVVPFIX-NSHDSACASA-N 296.798 2.441 10 20 CECD CCCONC(=O)NCCCSc1nccs1 828288321 GXVZJWXXFLXJEX-UHFFFAOYSA-N 275.399 2.266 10 20 CECD Cc1nc(CN(C)Cc2ccc(N(C)C)c(F)c2)no1 827891820 NXCSTNWQBXBGHO-UHFFFAOYSA-N 278.331 2.215 10 20 CECD COc1cccnc1CNCc1ccc(N(C)C)cc1 825249926 QZNFBKVOAVEDTO-UHFFFAOYSA-N 271.364 2.446 10 20 CECD C[C@@H](OC[C@H]1CCCO1)C(=O)N[C@H](C)c1ccccc1O 827930858 SKFMWWCKZGPASK-JHJVBQTASA-N 293.363 2.154 10 20 CECD Cc1cc(CN2C[C@@H]3CCN(C)[C@@H]3C2)ccc1N(C)C 831729388 SWPAEGTYXJPPTA-DOTOQJQBSA-N 273.424 2.197 10 20 CECD CC(C)[C@@H](C)C(=O)N(CC(=O)O)Cc1ccccc1O 911486495 OLEAGRYFWQHHCD-LLVKDONJSA-N 279.336 2.098 10 20 CECD C[C@@H]1CCN(S(=O)(=O)Nc2ccc(O)cc2Cl)C1 849308321 KHKMYANNDNPOHY-MRVPVSSYSA-N 290.772 2.044 10 20 CECD C[C@H](NC[C@@H](O)CN1CCCC1)c1ccc(Cl)cc1O 841744519 IHVAKDHUHVLCOP-WCQYABFASA-N 298.814 2.153 10 20 CECD CC(C)(N)CCC(=O)NCc1c(O)ccc2c1CCCC2 843489378 DUXAITKCWNEABG-UHFFFAOYSA-N 290.407 2.405 10 20 CECD C[C@H](CN)NCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 841060043 DUBJYTKQNZIBPP-GFCCVEGCSA-N 292.383 2.022 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H](O)C(C)(C)C)cc1 844402303 SKQURTCMPNINEP-MRXNPFEDSA-N 294.439 2.470 10 20 CECD C[C@@H](Nc1ccc(C(=O)O)nn1)c1ccc(N(C)C)cc1 844212073 QHGBGSDSJQGSEH-SNVBAGLBSA-N 286.335 2.414 10 20 CECD CCO[C@H]1C[C@@H]1C(=O)NCc1cc(Cl)ccc1O 846471915 DLQMZGWRZOPQNR-JQWIXIFHSA-N 269.728 2.087 10 20 CECD CC(C)OC(=O)[C@@H](NC(=O)Nc1ccc(N)cc1)C(C)C 841300377 WFMXVDQEKDFVBW-ZDUSSCGKSA-N 293.367 2.367 10 20 CECD Cc1cc(Br)c(O)c(CNC[C@@H]2CCN2C)c1 922575982 IXCOGMGXQBSQQI-NSHDSACASA-N 299.212 2.257 10 20 CECD Cc1ccccc1OC[C@@H](O)CN(C)c1ccc(N)cc1 923401851 YEKXIHXTUKKPJB-INIZCTEOSA-N 286.375 2.453 10 20 CECD CC[C@H](N[C@@H]1CCN(C(C)=O)C1)c1ccc(F)cc1O 857084339 NKMVSUCPGAUAOQ-OCCSQVGLSA-N 280.343 2.193 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2C[C@@H](C)Cc3c[nH]nc32)c1 857871900 YEZIGQFKUWNAME-FZMZJTMJSA-N 299.374 2.406 10 20 CECD COC[C@@](C)(O)CN[C@@H](C)c1ccc(C)c(C)c1O 756578588 WXZYXXLMUYNJBH-WFASDCNBSA-N 267.369 2.057 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC(=O)C1CCC1 759578337 HVALMRFVDQELLE-ALCCZGGFSA-N 276.288 2.023 10 20 CECD Cn1cnc(/C=C\C(=O)N2CCCc3cccc(O)c32)c1 935168351 BJHNDYUMJPLHBF-FPLPWBNLSA-N 283.331 2.118 10 20 CECD CCCn1nccc1C(=O)NCc1cc(C)ccc1O 862753768 GTQWAMGTBGAULV-UHFFFAOYSA-N 273.336 2.237 10 20 CECD CC[C@@]1(C)CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768464180 OARHNSSODOJADR-ZBFHGGJFSA-N 277.364 2.440 10 20 CECD CCOCC[C@@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 769790064 UHQOBAYFBBBMKR-XJKSGUPXSA-N 280.412 2.191 10 20 CECD Cc1ccc(CN[C@@H]2CCc3c[nH]nc3C2)c(O)c1 877084855 ONJSRBJDMMNNQM-CYBMUJFWSA-N 257.337 2.071 10 20 CECD Cc1ccc(CN[C@@H]2CCN(C(C)(C)C)C2=O)c(O)c1 877602969 AVISDQNGHUIJLS-CYBMUJFWSA-N 276.380 2.190 10 20 CECD Cc1ccc(CN[C@@H](C)C(=O)NCc2ccccc2)c(O)c1 876964538 IOYNKAMAAGDNPK-AWEZNQCLSA-N 298.386 2.495 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccc(O)cc1 779535102 IBLXQMLNXGJKSB-YWEYNIOJSA-N 285.299 2.133 10 20 CECD OC1CCN(c2ccc(CN3CC[C@H](F)C3)cc2)CC1 877558993 HODVSDIQOJWHIC-AWEZNQCLSA-N 278.371 2.192 10 20 CECD CCCOc1ccc(CNCCN2CCOCC2)cc1C 873006534 KJTDKCOVTDATNH-UHFFFAOYSA-N 292.423 2.206 10 20 CECD COC1CCC(NC(=O)NCc2ccc(N)cc2)CC1 1120625797 KLHBTEHNNLJRAZ-UHFFFAOYSA-N 277.368 2.026 10 20 CECD C[C@@H](C(=O)NCc1ccc(O)c(O)c1)c1ccco1 778918142 MMEJTKMQFQRJJU-SECBINFHSA-N 261.277 2.111 10 20 CECD COCCCCCn1cc(COc2ccc(N)cc2)nn1 881303044 QJASECDBHUJYGD-UHFFFAOYSA-N 290.367 2.256 10 20 CECD C=CC(=O)NCc1ccc(N2C[C@H](C)O[C@H](C)C2)c(F)c1 1120461406 MFILGHOGIHFGQW-TXEJJXNPSA-N 292.354 2.242 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@@H](CF)C2)cc1F 883241273 RPPPSUYHGNIPAD-LBPRGKRZSA-N 297.349 2.393 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)Cc1ncc[nH]1 894585401 HKTOEMSMQRYUMY-UHFFFAOYSA-N 262.332 2.247 10 20 CECD CC[C@@H]1CN(Cc2ccc(OC)c(OC)c2O)[C@@H](C)CO1 895147551 MOPHCXTXCVELOV-WCQYABFASA-N 295.379 2.409 10 20 CECD CCOc1ccc(CN2CC[C@](O)(C3CC3)C2)c(O)c1 1326657519 NHGLJNBMBGWVBX-MRXNPFEDSA-N 277.364 2.138 10 20 CECD CCc1cccc(CNC[C@H](C)C[C@H](C)O)c1O 709492897 VSGHLGCSONIPOC-NEPJUHHUSA-N 251.370 2.451 10 20 CECD Cc1cc(CNCc2cc(Cl)ccc2O)n[nH]1 716461878 CXANNFBYKGCOJM-UHFFFAOYSA-N 251.717 2.367 10 20 CECD CCN1CCC[C@@H](N[C@H](C)c2ccc(F)cc2O)C1=O 722357602 PWGQWVONSXYCIG-ZWNOBZJWSA-N 280.343 2.193 10 20 CECD CCOc1cccc(CN2CCCC[C@@H]2C(=O)O)c1O 86729944 LXZCZSKCXXCNQB-GFCCVEGCSA-N 279.336 2.230 10 20 CECD CCc1cccc(CNCC[C@H](C)N(C)C)c1O 697849249 QCWOBSNYUCQQSQ-LBPRGKRZSA-N 250.386 2.384 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H]3C[C@@]3(CO)C2)c1O 782624092 IYPIZGZGDFTJOX-NHYWBVRUSA-N 295.766 2.062 10 20 CECD COc1cccc(O)c1CNC[C@H]1CCSC1 790484643 GKTJBSGWSYWCKB-SNVBAGLBSA-N 253.367 2.244 10 20 CECD O=C(COC1CCCCC1)NCc1cccc(O)c1O 1347234016 LSZLHZNRFVDBPX-UHFFFAOYSA-N 279.336 2.063 10 20 CECD CC(C)C[C@](C)(CN)C(=O)N1Cc2cccc(O)c2C1 1575534765 JWTBJVFDBSTZME-MRXNPFEDSA-N 276.380 2.246 10 20 CECD CC[C@H](NC1CCC1)c1cccc(-c2nn[nH]n2)c1O 1590465572 IXPKFZLGNGECAR-LBPRGKRZSA-N 273.340 2.166 10 20 CECD CC[C@@H](CN[C@@H](C)c1cc(C(=O)O)ccc1O)OC 1595166544 UVYFIMWVHHWLTP-ONGXEEELSA-N 267.325 2.166 10 20 CECD CN1CCc2cc(/C=C/c3cnc(C(=O)O)cn3)ccc21 1777093674 NMMNSWLFMPMYCW-DUXPYHPUSA-N 281.315 2.338 10 20 CECD CN(Cc1ccccc1O)C(=O)COc1ccccc1O 153012344 WNCCIJVFYZPMOX-UHFFFAOYSA-N 287.315 2.135 10 20 CECD Cc1ccc(CN2CCC[C@@H](CC(=O)O)C2)c(O)c1 1574367156 YYESIMCBFGVMOS-LBPRGKRZSA-N 263.337 2.387 10 20 CECD CC[C@H](C)N1CCN(Cc2cc(F)ccc2O)CC1 233982662 PKXMQYZRUWZUCS-LBPRGKRZSA-N 266.360 2.447 10 20 CECD COc1ccc(O)c([C@H](C)NCCN2CC=CCC2)c1 280972455 LKUFESRJCBAWOD-ZDUSSCGKSA-N 276.380 2.313 10 20 CECD COc1cccc(CN2CCC[C@H](C)[C@@H]2CCN)c1O 404429492 NTDWOENJCGIRKU-JSGCOSHPSA-N 278.396 2.350 10 20 CECD COC[C@]1(C)CCN(C(=O)Nc2ccc(N)cc2)C1 381729441 KUHCBHTVMMKZOF-CQSZACIVSA-N 263.341 2.159 10 20 CECD Cc1nccn1CCN[C@@H]1CCc2cccc(O)c21 389076827 ZGUXPZVQCRZTIO-CYBMUJFWSA-N 257.337 2.174 10 20 CECD Oc1ccc(CNCc2ccc3c(c2)CCO3)cn1 392869139 ZLKPVAWPSZZGHJ-UHFFFAOYSA-N 256.305 2.012 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)OC 55501371 XMUDRJLFNOVKJX-LBPRGKRZSA-N 264.369 2.136 10 20 CECD COc1cccc(CNC(=O)CCC2CCOCC2)c1O 175931008 GDRXZEVEHBPHAH-UHFFFAOYSA-N 293.363 2.224 10 20 CECD COc1cccc(CNC(=O)NC[C@@H]2CCCS2)c1O 127146985 MGZRKZKQFCCCJP-NSHDSACASA-N 296.392 2.096 10 20 CECD COC(=O)CC(C)(C)NCc1ccc2c(c1)CCO2 237137120 GTHSMTVBVHEIDK-UHFFFAOYSA-N 263.337 2.053 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C/c1cccnc1 183474787 VNFFLQLFPIEYIZ-HOSRBBHYSA-N 298.342 2.253 10 20 CECD COc1ccc(O)c(CN2CCOC[C@H]2C2CC2)c1 180426177 NTUCBTFEAQGICQ-AWEZNQCLSA-N 263.337 2.012 10 20 CECD CC(C)(CCO)NCc1cccc(Br)c1O 127128377 FEWQCLPSZZTVKQ-UHFFFAOYSA-N 288.185 2.405 10 20 CECD CC(C)CONC(=O)NCc1ccc(N2CC=CC2)cc1 120755758 LKHLRLPFXVHBQU-UHFFFAOYSA-N 289.379 2.450 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCOC(C)(C)C2)c1 185361196 JPRDOMFKOVMFRJ-AWEZNQCLSA-N 292.423 2.462 10 20 CECD Nc1ccc(NC(=O)NC2CCSCC2)cc1 136435182 BFFSXBOOGKRPBN-UHFFFAOYSA-N 251.355 2.286 10 20 CECD COC[C@H](NC(=O)Nc1ccc(N)cc1)C(C)C 86703452 QDLSNAPFMVRNLO-LBPRGKRZSA-N 251.330 2.061 10 20 CECD C[C@@H](NCCCO)c1cc(Br)c(F)cc1O 134904041 RBZCAUPMNPNJAE-SSDOTTSWSA-N 292.148 2.327 10 20 CECD CCCCN(CC(N)=O)Cc1cc(C)c(C)cc1O 91950341 WMPNHFMFGXQZDM-UHFFFAOYSA-N 264.369 2.096 10 20 CECD COc1ccc(N2CCC(N[C@@H]3CCC[C@H]3O)CC2)cc1 362035173 ZOCZTKBQDHRTDN-IAGOWNOFSA-N 290.407 2.167 10 20 CECD CCCOc1ccc(CNCc2n[nH]c(CC)n2)c(O)c1 296023667 MNYIZLKBWITGAI-UHFFFAOYSA-N 290.367 2.151 10 20 CECD COc1nccc(CN(C)c2ccc(OC)c(F)c2)n1 295501578 UEAGUAQPBLBKHK-UHFFFAOYSA-N 277.299 2.269 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1cc(F)ccc1O 293798661 DCALDHUNJXIHOU-NSHDSACASA-N 282.359 2.173 10 20 CECD Cc1noc([C@H](C)NCc2ccc(N(C)C)cc2)n1 729683823 BWXOTXCJWDWFAX-JTQLQIEISA-N 260.341 2.295 10 20 CECD Cc1cc(N(C)C)ccc1CNC(C)(C)C(=O)O 901490925 ZXFSQVLUSRTCHB-UHFFFAOYSA-N 250.342 2.014 10 20 CECD CCN(C(=O)/C=C/c1cnccn1)c1ccccc1C(=O)O 737051800 CVYONTUNCDFBAM-BQYQJAHWSA-N 297.314 2.241 10 20 CECD Nc1ccc(NC(=O)[C@H]2CC(c3ccccc3)=NO2)cc1 746478735 XBFLDVYZWCURLS-OAHLLOKOSA-N 281.315 2.401 10 20 CECD C[C@H](N)C[C@@H](C)NCc1cccc(Br)c1O 843129934 UXUMSKDFABPWLG-DTWKUNHWSA-N 287.201 2.370 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@H](N)C1 841058499 SANLXSAWVBVTAH-LSDHHAIUSA-N 261.413 2.421 10 20 CECD C[C@H](NCCOCCN(C)C)c1ccc(Cl)cc1O 841751795 KBENSEQVASQMPX-NSHDSACASA-N 286.803 2.274 10 20 CECD CC[C@H]1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(N)cc1 841138106 UCJPEUQBUHWBAL-RYUDHWBXSA-N 289.379 2.150 10 20 CECD C[C@@H](N[C@@H]1CCCCNC1=O)c1ccc(Cl)cc1O 841743561 AYNQOOHFGFRZDN-BXKDBHETSA-N 282.771 2.365 10 20 CECD CC[C@@H](N[C@@H](CO)CCF)c1ccc(C)cc1O 846209380 QSKNJFYUWJSZHP-DGCLKSJQSA-N 255.333 2.462 10 20 CECD CCOCCCN[C@@H](C)c1cccc(OC)c1O 846136609 IDRVYQJIJGHPJH-NSHDSACASA-N 253.342 2.478 10 20 CECD CC[C@H](CCO)N[C@H](C)c1cccc(OC)c1O 846145515 OGOXGPFQPBBZAZ-GHMZBOCLSA-N 253.342 2.212 10 20 CECD CC(C)O[C@@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 846658699 FPJQRKIZVCMCSG-SNVBAGLBSA-N 297.326 2.267 10 20 CECD C[C@@H]1CCN(Cc2cccc(Cl)c2O)C[C@H]1CO 857061311 OGTNMWXQUPEDFZ-PWSUYJOCSA-N 269.772 2.496 10 20 CECD COC(=O)N(C)CCN[C@H](C)c1cc(Cl)ccc1O 850547398 FRSVFFROXBSBIN-SECBINFHSA-N 286.759 2.394 10 20 CECD O=C(COC(=O)c1cccc(O)c1O)c1ccccc1F 758562615 SPZZSLHMOXCFFH-UHFFFAOYSA-N 290.246 2.277 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 756595143 UFDDTDFUNUJNAQ-JOAULVNJSA-N 291.363 2.433 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NC(=O)NCc1cc(C)ccc1O 858521274 LZWRTHUWAKNWHV-ABAIWWIYSA-N 292.379 2.313 10 20 CECD COc1cncc(CNCc2cccc(OC)c2O)c1 699789695 VJBQOCUTBOIWNL-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CO[C@H](CC(C)C)C(=O)NCc1cc(C)ccc1O 862755700 WOSZYALHWSHHPU-CQSZACIVSA-N 265.353 2.378 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1c(O)ccc2ccncc12 765716355 GMLNRBPVUYPTCX-HNNXBMFYSA-N 299.374 2.041 10 20 CECD Cc1ccc(CNCCS(=O)(=O)C(C)(C)C)c(O)c1 877036861 TXBLDMQQQMCMQU-UHFFFAOYSA-N 285.409 2.004 10 20 CECD Cc1ccc(O)c(CNC(=O)COC(C)(C)C)c1 862757549 YEFJIOAPNIKQQC-UHFFFAOYSA-N 251.326 2.132 10 20 CECD CC[C@@H]1CN(Cc2c(C)cccc2O)C[C@H](C)[S@@]1=O 877519692 ZLLGIPMCTITWMW-QUJCMNEKSA-N 281.421 2.432 10 20 CECD CO[C@@H](CNCc1ccc2c(c1)CCO2)C1CCOCC1 876995298 DJKAMKRBMOUNOR-KRWDZBQOSA-N 291.391 2.153 10 20 CECD C[C@@H](NCc1cc2c(cn1)OCCO2)c1ccccc1O 877755421 AQMYGQUXRCPCIQ-LLVKDONJSA-N 286.331 2.409 10 20 CECD CC(=O)NC[C@@H]1CCCN(Cc2ccc(C)cc2O)C1 876512470 PFSSOCFQTGMSNU-AWEZNQCLSA-N 276.380 2.049 10 20 CECD CC[C@@H](NCCNc1cnccn1)c1ccccc1O 775512686 AGPKWECVUBTMNZ-CYBMUJFWSA-N 272.352 2.335 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cnc(C2CC2)s1 778916545 KWUMEFJDYFEXPK-UHFFFAOYSA-N 290.344 2.362 10 20 CECD COCCN1CCC(N[C@@H](C)c2c(O)cccc2F)CC1 886513076 SRYBWJSNTSJWAM-LBPRGKRZSA-N 296.386 2.293 10 20 CECD COc1ccc(/C=C2\SC(=S)N(C3CC3)C2=O)cn1 780143569 PLGSLFSPRQHYMK-POHAHGRESA-N 292.385 2.454 10 20 CECD C[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)[C@H]1CO 785984683 RGYPHHHNCDBFSM-PELKAZGASA-N 273.735 2.387 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cccc(Cl)c2O)C1 896959572 BZPJNFRBVABWMY-NSHDSACASA-N 283.755 2.431 10 20 CECD C[C@@H](NC(=O)N[C@H](C)[C@H]1CCCNC1)c1ccccc1O 891981520 LNIDZYWCTMKIFJ-UPJWGTAASA-N 291.395 2.141 10 20 CECD COc1ccc(CN(C)CC2(O)CCCC2)c(O)c1OC 892067393 POAFVLFVYKAHOM-UHFFFAOYSA-N 295.379 2.146 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)[C@](C)(CO)C2)c1O 895345873 WYTJJFAVKDWBDG-WBMJQRKESA-N 279.380 2.160 10 20 CECD Cc1cccc(CNC(C)(C)C(=O)N2CCCC2)c1O 793396043 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1261140084 HNLALRYXWGAHCJ-BQBZGAKWSA-N 281.699 2.240 10 20 CECD C[C@H](NC(=O)[C@@H]1C[C@@H]1F)c1ccc(N2CCOCC2)cc1 1262725675 FUSXOPGCYLOXPC-GLQYFDAESA-N 292.354 2.058 10 20 CECD O=C(O)c1ccc(COC(=O)c2cccc(O)c2O)s1 1608889666 MXUGPFMYLLQVII-UHFFFAOYSA-N 294.284 2.215 10 20 CECD CS[C@H](C)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1610380019 CZTQOGYQAUKIDU-BDAKNGLRSA-N 269.366 2.493 10 20 CECD C[C@H](N[C@@H]1CCN(C)[C@@H](C)C1)c1cc(C(=O)O)ccc1O 1593220067 QCFZBWAAXZRYIU-GMXVVIOVSA-N 292.379 2.224 10 20 CECD CCN(C)c1ccc([C@H](C)NCCS(=O)(=O)CC)cc1 163479870 ZFNAAAJJQOJYNK-ZDUSSCGKSA-N 298.452 2.228 10 20 CECD COCCN(CCOC)Cc1cc(C)cc(C)c1O 163817955 KPTPXMOMGUCYSP-UHFFFAOYSA-N 267.369 2.104 10 20 CECD Cc1cc(CNCc2ccc3c(c2)CCCO3)n(C)n1 922112448 DITXCWDXTNVGNK-UHFFFAOYSA-N 271.364 2.343 10 20 CECD Oc1c(Cl)cccc1CN1CCO[C@@H](CF)C1 840954977 OLQVTUKIENMYGC-JTQLQIEISA-N 259.708 2.216 10 20 CECD CCC[C@@](C)(N)C(=O)N(C)Cc1ccc(N(C)C)cc1 37801180 RRPWEOBVHONCQZ-MRXNPFEDSA-N 277.412 2.229 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](O)C2CCC2)c1 315761470 CLDDRFCIQRJQJZ-ZUZCIYMTSA-N 265.353 2.212 10 20 CECD Nc1ccc(NC(=O)c2cnn(-c3ccccc3)n2)cc1 59974134 YXWLBOCQBGONDA-UHFFFAOYSA-N 279.303 2.102 10 20 CECD Cc1nccn1CCCC(=O)N(C)Cc1ccccc1O 101645683 ZKJCINNGIOVZIB-UHFFFAOYSA-N 287.363 2.336 10 20 CECD CCCCOCC(=O)NCc1ccc(N(C)C)c(F)c1 118217699 XKYXRKVAJXTNLE-UHFFFAOYSA-N 282.359 2.325 10 20 CECD CS[C@H](C)C(=O)NCc1ccc(N(C)C)cc1C 115279873 PXRMIUOCEWRJLL-LLVKDONJSA-N 266.410 2.429 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2oc(C)nc2C)c1 175220259 IZQRBCGEMCTZGM-QMMMGPOBSA-N 290.319 2.497 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccccc2C(=O)O)cc1 314565863 BWYURNKJEGWGPO-UHFFFAOYSA-N 298.342 2.381 10 20 CECD CC(=O)c1cc(F)cc(CN2CCN(C(C)C)CC2)c1O 37328914 WARIDHVYRNDSHP-UHFFFAOYSA-N 294.370 2.260 10 20 CECD CN(C)c1ccc(CN(CC(=O)O)CC2CC2)cc1 83663505 CMELYGBRNJDAOL-UHFFFAOYSA-N 262.353 2.049 10 20 CECD Oc1ccc(Cl)cc1CNCCCn1cccn1 134491294 WXTANOBJKWGERN-UHFFFAOYSA-N 265.744 2.422 10 20 CECD C[C@H](O)CCN(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 93481329 MNVJGLKAZYLCEE-QMMMGPOBSA-N 288.731 2.157 10 20 CECD C[C@@H]1CCN(C(=O)NCc2ccc(N(C)C)c(F)c2)C1 263765260 SBCPUCYOTTWSKK-LLVKDONJSA-N 279.359 2.443 10 20 CECD Fc1cc(CNc2nncs2)ccc1N1CCOCC1 271979228 MCYFYNVYIQCFAF-UHFFFAOYSA-N 294.355 2.126 10 20 CECD CCN(CC)c1ccc(CN2CC[C@H](O)C2)cc1F 271057976 BEUYPOHSOWOINP-ZDUSSCGKSA-N 266.360 2.239 10 20 CECD C[C@H]1C[C@H](NCCN(C)C)c2c(O)ccc(F)c21 806171463 JMXXIMDYWSHNHI-ONGXEEELSA-N 252.333 2.231 10 20 CECD COc1ccc(O)c(CN(C)Cc2nncn2C(C)C)c1 292840852 SCDSUHMBUMYUFY-UHFFFAOYSA-N 290.367 2.205 10 20 CECD CC(=O)c1cc(F)cc(CN(CC(=O)O)C(C)C)c1O 819796997 SWXNRFWWYCVSSD-UHFFFAOYSA-N 283.299 2.029 10 20 CECD CC[C@H](NC[C@H]1CNCCCO1)c1ccc(N(C)C)cc1 817982291 QXLHDEFFUUCOAF-SJORKVTESA-N 291.439 2.172 10 20 CECD CCCN1C[C@@H](CNCc2cccc(Cl)c2O)CC1=O 817410352 ATTOCLVGCGDSAG-LLVKDONJSA-N 296.798 2.394 10 20 CECD CCCN1C[C@@H](CNCc2ccc(N(C)C)cc2)CC1=O 817411020 LEFMZGNEVIWIMQ-OAHLLOKOSA-N 289.423 2.101 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCc2n[nH]cc2C1)c1ccccc1O 827941781 YCONBYJZCNQEKS-GHMZBOCLSA-N 285.347 2.098 10 20 CECD OC[C@@H](C1CC1)[C@H](NCc1ccccc1O)C1CC1 824845092 HOMWBWCCNVISTP-GOEBONIOSA-N 261.365 2.279 10 20 CECD C[C@@H](NC(=O)c1ccnn1CC(F)F)c1ccccc1O 827946540 LGNKOAKPHPXCIS-SECBINFHSA-N 295.289 2.345 10 20 CECD CCOc1ccc(N(C)Cc2ccn(C)c(=O)c2)cc1 739922888 OKLRWQSFUXGJNE-UHFFFAOYSA-N 272.348 2.420 10 20 CECD Cn1nc2c(c1-c1nc(Cc3ccc(N)cc3)no1)CCC2 904078052 PSRBCFOOYPITFZ-UHFFFAOYSA-N 295.346 2.132 10 20 CECD CCn1ncc(/C=C2/C(=O)N3CCCc4cccc2c43)n1 901523803 YWYNXJWQZMYSRA-NTEUORMPSA-N 280.331 2.131 10 20 CECD C[C@@H]1C[C@H](NC[C@@]2(C)CCC(=O)N2)c2c(O)ccc(F)c21 834909430 RLWKKRBDSSANQA-SEFYAATASA-N 292.354 2.338 10 20 CECD CC(C)Cc1cc(NC(=O)Cc2ccc(N)cc2)n[nH]1 831865931 QWBXFFAUKVSTRE-UHFFFAOYSA-N 272.352 2.372 10 20 CECD C[C@@H](NC[C@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 834908151 HGCWGJGBVGRLJR-WBMJQRKESA-N 275.396 2.072 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CC(N)=O)cc1F 749132698 VCOBQKCCOFHNIW-NSHDSACASA-N 281.375 2.025 10 20 CECD CCc1cccc(CN2CCc3nnc(O)cc3C2)c1O 848904505 VQDQIWXWNXBQRE-UHFFFAOYSA-N 285.347 2.009 10 20 CECD N[C@@H](CNCc1ccc2c(c1)CCO2)c1ccccc1 841036851 NLAHDSUWSRRKAW-INIZCTEOSA-N 268.360 2.411 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)cc2C)ncn1 840935685 ABSOGLFPLRNXCO-UHFFFAOYSA-N 270.380 2.449 10 20 CECD Cc1cc(Br)cc(CNC[C@H]2CCCN2)c1O 841034453 CMRLFKYJOYGUBD-GFCCVEGCSA-N 299.212 2.305 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](NC)C2)cc1F 843045561 VDFUEQLOZNJKGN-CQSZACIVSA-N 279.403 2.466 10 20 CECD CCc1nn(C)c(CC)c1CNC(=O)c1cc(O)cs1 755306040 VEGDKEKRJJZOPP-UHFFFAOYSA-N 293.392 2.242 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(Cl)cc1O 858588860 SDQPENXAWJJVPT-RKDXNWHRSA-N 286.759 2.105 10 20 CECD Cc1cc(C)c(O)c(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c1 754732686 UTKHMXRPKJEKRT-QUJCMNEKSA-N 281.421 2.350 10 20 CECD CCC1(C(=O)N[C@@H](C)c2cc(OC)ccc2O)COC1 755787637 WIGUHWUNVXVPPJ-JTQLQIEISA-N 279.336 2.005 10 20 CECD Nc1ccc(CCNC(=O)CCCc2cccnc2)cc1 851631941 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CC[C@@](C)(O)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881378293 LUQFNVCBMZQJHW-MRXNPFEDSA-N 288.395 2.318 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 896963235 XFCZFAYKZIJNJT-JTQLQIEISA-N 283.755 2.431 10 20 CECD COc1cccc(CNCCc2cccnc2C)c1O 898257199 PPGHOPZDEFWJBJ-UHFFFAOYSA-N 272.348 2.437 10 20 CECD COC(=O)C(C)(C)CCN(C)c1ccc2c(c1)OCO2 793062377 KHBMIMLFPWUHNY-UHFFFAOYSA-N 279.336 2.441 10 20 CECD CSC1(CNC(=O)c2cc(O)cs2)CCC1 791005836 CGOBIGNDEGUSST-UHFFFAOYSA-N 257.380 2.469 10 20 CECD CC[C@H](C)NC(=O)CCN[C@H](C)c1ccc(F)cc1O 62747827 OCKIPYMGIATOOZ-WDEREUQCSA-N 282.359 2.487 10 20 CECD Oc1cccc(Br)c1CNC[C@H]1C[C@H](O)C1 720919232 PVEPTKKMSDHWTM-KYZUINATSA-N 286.169 2.015 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@H]3CC[C@H]2[C@H](O)C3)c1 1333333601 LXNPBDIPKNVEPW-AEGPPILISA-N 261.365 2.354 10 20 CECD CC(C)(CNCc1cc(F)cc(F)c1O)CC(=O)O 1331983247 PRZNEVBMWANPGK-UHFFFAOYSA-N 273.279 2.261 10 20 CECD CON(C)c1nnc(-c2sccc2O)n1CC1CC1 1350547597 LGVQXHMCDAPZFW-UHFFFAOYSA-N 280.353 2.120 10 20 CECD CC[C@@H](C)n1nccc1C(=O)NCc1ccccc1O 1528038285 WUYWIHDULXRUDW-LLVKDONJSA-N 273.336 2.490 10 20 CECD O=C(O)C1CCC(NCc2ccc(F)c(F)c2O)CC1 1605990731 HWGCIQYANGPLRT-UHFFFAOYSA-N 285.290 2.403 10 20 CECD O=C(O)c1cnc(SC[C@@H]2C[C@]23CCOC3)s1 1602536980 JHDYYUVMBSOMQM-CPCISQLKSA-N 271.363 2.360 10 20 CECD Cc1ccc(C(=O)N[C@@H](CC(=O)O)C(C)(C)C)c(O)c1O 1600338487 XQHUMVISXXGCMS-JTQLQIEISA-N 295.335 2.025 10 20 CECD O=C(O)[C@@H](CC(F)(F)F)NCc1cc(F)ccc1O 1610716287 ZCTSPIWTOHJFMV-MRVPVSSYSA-N 281.205 2.027 10 20 CECD CNc1ccc(OC(=O)c2cccc(O)c2O)cc1 1578760037 IQUISJAINYAXNI-UHFFFAOYSA-N 259.261 2.359 10 20 CECD C[C@H](N[C@@H]1CC[C@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589953726 FQQMVPBFOZYIEW-NNYUYHANSA-N 299.378 2.412 10 20 CECD CC[C@H](C)N[C@@H](CC)c1cccc(-c2nn[nH]n2)c1O 1590413555 ANXKNZZJQHUUTB-CABZTGNLSA-N 275.356 2.412 10 20 CECD CN(Cc1ccoc1C(=O)O)c1ccc2c(c1)OCCO2 1777078204 XZMLDQFAJNGRDW-UHFFFAOYSA-N 289.287 2.385 10 20 CECD CN(C)c1ccc(CNC(=O)Nc2cccnn2)cc1F 151781242 VCLDVEVSKJNRGI-UHFFFAOYSA-N 289.314 2.003 10 20 CECD CN(C)c1ccc(CNC[C@H](O)CC(F)(F)F)cc1 818941362 IFXYZLLHALTIQZ-GFCCVEGCSA-N 276.302 2.156 10 20 CECD O=C(NCc1cc(F)ccc1F)c1cccc(O)c1O 126420238 GDDDAZTWXCCKOZ-UHFFFAOYSA-N 279.242 2.306 10 20 CECD O=C(NC[C@@H]1C[C@H]2CC[C@H]1C2)c1cccc(O)c1O 253087983 DVKDPEQCMOMZIF-DCAQKATOSA-N 261.321 2.264 10 20 CECD CCOc1cccc(CNC[C@H]2CCCOC2)c1O 38044035 NJLQHGVQVBGWPW-GFCCVEGCSA-N 265.353 2.307 10 20 CECD COc1cccc(CNCc2cc(C)ns2)c1O 404266425 FHDMGLRCEJLUPT-UHFFFAOYSA-N 264.350 2.456 10 20 CECD CO[C@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)C12CCC2 713079530 RYBKIFPNGGCDPP-OLZOCXBDSA-N 275.352 2.348 10 20 CECD Cc1nc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)n[nH]1 103256037 CCEISHHWKXMMPJ-UHFFFAOYSA-N 296.334 2.168 10 20 CECD OCCCN(Cc1ccccc1O)CC(F)(F)F 179569422 CDXDZMQMUQNLLQ-UHFFFAOYSA-N 263.259 2.139 10 20 CECD CCn1ccnc(NCc2ccc(N3CCCC3)cc2)c1=O 179705346 PSGXJNRBCBTKBK-UHFFFAOYSA-N 298.390 2.476 10 20 CECD CC[C@@H](C)[C@H](C)C(=O)NCCc1ccc(O)c(O)c1 184232499 PEYBOYLMCQOWOY-MNOVXSKESA-N 265.353 2.439 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCCC[C@H]2O)c1 185169580 QNWNVKQQBOGDOZ-UKRRQHHQSA-N 265.353 2.184 10 20 CECD C[C@@]1(O)CCCN(Cc2cc(Cl)ccc2O)C1 129477208 GSALAFUXPZSLDJ-CYBMUJFWSA-N 255.745 2.392 10 20 CECD C[C@@H](O)C[C@@H]1CCCN1Cc1cc(F)ccc1O 180170867 MZHHCRRAQOXSQF-MFKMUULPSA-N 253.317 2.267 10 20 CECD CC[C@H](C)[C@H](C)NCC(=O)NCc1ccc(N(C)C)cc1 183060969 UMUYRTXGBZPSBD-KBPBESRZSA-N 291.439 2.393 10 20 CECD COCC[C@@H](C)N[C@H](C)c1cc(OC)ccc1O 81708034 NBIWOEVZHJPEJJ-GHMZBOCLSA-N 253.342 2.476 10 20 CECD Cc1cccc(CN2CCc3ccccc3[C@@H]2C(N)=O)c1O 361797616 JUQSOMLKCXCIPN-MRXNPFEDSA-N 296.370 2.285 10 20 CECD COc1cc(O)c(CN2CC[C@H](C)C2)cc1OC 271112967 UWEFHPWJAMGNEA-JTQLQIEISA-N 251.326 2.251 10 20 CECD COCCN(C)CCN[C@H](C)c1ccc(C)c(C)c1O 273597421 QZJGNQSJUFTJCV-CQSZACIVSA-N 280.412 2.238 10 20 CECD CNC(=O)CCCN[C@@H](C)c1cc2c(cc1O)CCCC2 273557642 HCDOTNIVUMUEPH-LBPRGKRZSA-N 290.407 2.448 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCCC[C@@H]2O)c1 273359378 AEBBDKCEVHSEHU-XEGUGMAKSA-N 293.363 2.133 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@H]2[C@@H]2CCCC2=O)c1 372756984 ICHRQMRYFAFHJI-GJZGRUSLSA-N 289.375 2.271 10 20 CECD C[C@H](N[C@H](C)C(=O)NCCF)c1cc(Cl)ccc1O 282791848 QGWQSNNDESBELX-DTWKUNHWSA-N 288.750 2.170 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2OC)C[C@H](C)[S@]1=O 809699236 LZUVTJYITZRZLD-XXRNEEKGSA-N 297.420 2.132 10 20 CECD Cc1cccc(CN(C)CCCn2ccnc2)c1O 290363288 GWYGOQOYKKBZCO-UHFFFAOYSA-N 259.353 2.419 10 20 CECD C[C@H](NC(=O)c1cccc(O)c1O)c1c(F)cncc1F 804825850 IBULKAZWHYSEGJ-ZETCQYMHSA-N 294.257 2.262 10 20 CECD CN(C)[C@@]1(CN[C@H]2CCc3cccc(O)c32)CCSC1 297507183 CIXRNGJQIVTLAC-XJKSGUPXSA-N 292.448 2.406 10 20 CECD CC(=O)c1c(C)[nH]c(C(=O)NCc2ccccc2O)c1C 299534683 HMOQVKFZADWPBT-UHFFFAOYSA-N 286.331 2.470 10 20 CECD CCc1noc(NCc2ccc(N3CCOCC3)cc2)n1 814255381 LLUZANLBBRJZSL-UHFFFAOYSA-N 288.351 2.081 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1ccc(N(C)C)c(C)c1 815094460 BURGVDIUFJMTON-NVXWUHKLSA-N 292.423 2.345 10 20 CECD CCCCN(C)C[C@H](C)NC(=O)Cc1ccc(N)cc1 831933312 CVPAWYVPFMUHFO-ZDUSSCGKSA-N 277.412 2.048 10 20 CECD O=C(NCCCN1CCCCC1)c1cc(O)cs1 732258833 XTTKNFHQSCDOCW-UHFFFAOYSA-N 268.382 2.060 10 20 CECD CN(C)c1ccc(CNC(=O)NCC(C)(F)F)cc1F 836481237 KCUUJMDQNCUXRA-UHFFFAOYSA-N 289.301 2.346 10 20 CECD O=C(NC[C@@H](O)C1CCCCC1)c1cc(O)cs1 732284825 DDBZVDOBAPDMBQ-LLVKDONJSA-N 269.366 2.125 10 20 CECD CC[C@@H](N[C@@H]1COC[C@H]1OC)c1ccc(C)cc1O 842909558 JACBOJSUWBZUGS-UMVBOHGHSA-N 265.353 2.155 10 20 CECD CC[C@@H](NC[C@@H]1CNC(=O)C1)c1cc(Cl)ccc1O 840833745 PJKRJVYMUUFRQM-BXKDBHETSA-N 282.771 2.222 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843058312 RNUKOFMVILZBED-BDAKNGLRSA-N 299.758 2.123 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H](C)OC)cc1 844402464 YJKHZBDXSQPKSR-CYBMUJFWSA-N 266.385 2.098 10 20 CECD Cc1cc(O)c(CN(C)CC(C)(C)CN)cc1C 843056517 OWSKUPCXSCQRHE-UHFFFAOYSA-N 250.386 2.426 10 20 CECD CNCCNCc1ccc(N(C)C)cc1C(F)(F)F 841035445 GGIRGEHXTKLOLU-UHFFFAOYSA-N 275.318 2.080 10 20 CECD COc1ccc(CN[C@@H]2CCN(C(C)=O)C[C@H]2C)cc1C 742218428 HOZPOLYMTPGJRK-CZUORRHYSA-N 290.407 2.350 10 20 CECD CC[C@@H](C(=O)NCc1ccc(N(C)C)cc1C)[C@@H](C)O 842231599 MIIFBJFMWKYEQA-IUODEOHRSA-N 278.396 2.084 10 20 CECD CN(CCN)Cc1ccc(OCc2ccccc2)cc1O 841100923 OLYFZMMBOTXUFU-UHFFFAOYSA-N 286.375 2.362 10 20 CECD COC(=O)c1cncc(CN(C)Cc2ccccc2O)c1 929975712 IWOCTFRKQOZYBN-UHFFFAOYSA-N 286.331 2.206 10 20 CECD CN(C)c1cc(F)c(CNCCC2(CO)CC2)cc1F 858172374 RZMJOKAODOLFIY-UHFFFAOYSA-N 284.350 2.283 10 20 CECD Cc1cc(CN2CCn3cncc3C2)ccc1N(C)C 852065010 GZVDLFNWLFDKCP-UHFFFAOYSA-N 270.380 2.273 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1cc(F)cc(F)c1O 756585609 KZTRVYOBLXVCBB-YMTOWFKASA-N 289.322 2.109 10 20 CECD CC(=O)N1CCC(N[C@@H](C)c2cc(F)cc(F)c2O)CC1 756365760 ZMTJRHUGSGUMMI-VIFPVBQESA-N 298.333 2.332 10 20 CECD CCOc1cccc(CN2CC[C@H](C)[C@H](CO)C2)c1O 857061971 XESQPEPROHZYGH-JSGCOSHPSA-N 279.380 2.241 10 20 CECD CCn1cc(C(=O)NCc2cc(C)ccc2O)c(C)n1 862754233 VIICIYHCVOJNPU-UHFFFAOYSA-N 273.336 2.155 10 20 CECD CC[C@H](COC)NC(=O)N[C@H](C)c1ccccc1O 868292968 OVJNUUXWJXYDNH-GHMZBOCLSA-N 266.341 2.177 10 20 CECD CC(C)N(C)CCNC(=O)N[C@H](C)c1ccccc1O 868219078 RQHNWVJVMMVYIS-GFCCVEGCSA-N 279.384 2.093 10 20 CECD CN(CC(=O)NCCCSc1nccs1)C1CCC1 863874161 NTDHFKNPHIAMLO-UHFFFAOYSA-N 299.465 2.226 10 20 CECD COC(=O)CCC(C)(C)NCc1cccc(OC)c1O 762788712 WPKOJONSEOGNEK-UHFFFAOYSA-N 281.352 2.222 10 20 CECD CCCOc1ccc(CNCCc2nc[nH]n2)cc1C 873073325 QPLLQCCCOBEUQN-UHFFFAOYSA-N 274.368 2.234 10 20 CECD C[C@H](N[C@H](C)c1nncn1C)c1c(O)cccc1F 886523298 ZXWPIIXPAGMGRA-DTWKUNHWSA-N 264.304 2.072 10 20 CECD C[C@@H](NC[C@](C)(O)C(F)(F)F)c1c(O)cccc1F 886558376 ITVIVNUPZKKLLR-HQJQHLMTSA-N 281.249 2.495 10 20 CECD C[C@@H]1C[C@H](O)CN1Cc1cc(Br)ccc1O 788269414 NITHILVXFLXPDM-KCJUWKMLSA-N 286.169 2.110 10 20 CECD CCN(CC)C[C@H](C)NCc1ccc(OC)c(OC)c1O 892939681 UQVYONOYUAJKCC-LBPRGKRZSA-N 296.411 2.229 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC[C@H](O)CC1 894866132 IOZSDSSNYUGAJJ-NSHDSACASA-N 257.280 2.017 10 20 CECD CC[C@]1(C)CN(Cc2ccc(OC)c(OC)c2O)CCO1 893908255 UTQCXDRCISUILM-MRXNPFEDSA-N 295.379 2.410 10 20 CECD C[C@@H]1NC(=O)[C@@H](C)N(Cc2cccc(Cl)c2O)[C@H]1C 895119476 YQVHPVXLIPKLCX-LPEHRKFASA-N 282.771 2.143 10 20 CECD C[C@@H]1CCSCCN1Cc1cc2c(cc1O)OC[C@@H]2O 790477323 JILOWLYIWHWMBC-YGRLFVJLSA-N 295.404 2.145 10 20 CECD Cc1noc([C@H](C)NCc2cc(F)ccc2O)n1 792177101 RXFXBRREXPVTKZ-ZETCQYMHSA-N 251.261 2.074 10 20 CECD Nc1ccc(CC(=O)NCCc2ccccc2F)cc1 19399366 ZPBDCYJXBXETGV-UHFFFAOYSA-N 272.323 2.309 10 20 CECD OCCCCCNCc1c(O)cccc1Br 706804738 OQBMCSVOQDGMTN-UHFFFAOYSA-N 288.185 2.407 10 20 CECD CCc1cccc(CNC[C@@H]2CCCCS2(=O)=O)c1O 694587927 FIWCFJWQUORNGJ-AWEZNQCLSA-N 297.420 2.012 10 20 CECD C[C@@H]1C[C@H](C(=O)N(C)Cc2ccccc2O)CCO1 776466535 YVPGAKWNNPBLBK-VXGBXAGGSA-N 263.337 2.166 10 20 CECD C[C@H]1CC[C@H](CCC(=O)NCc2cccc(O)c2O)O1 1347543126 WXARMUSKPPAKGM-CMPLNLGQSA-N 279.336 2.062 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1cc(F)cc(F)c1O 1262110548 HMTHKXJLIFKZEJ-RNCFNFMXSA-N 299.317 2.444 10 20 CECD CCc1cccc(CN2CC[C@@](C)(C(=O)O)C2)c1O 1605830742 OCZWRBMCWPOHTF-OAHLLOKOSA-N 263.337 2.251 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C(=O)O)[C@@H]2C)cc1C 1610475662 HXOWKLBLBGJSLA-AAEUAGOBSA-N 263.337 2.304 10 20 CECD Nc1ccc(/C=C/C(=O)Oc2ccc(N)cc2)cc1 141482274 LDSPUPOZPVNYFP-XCVCLJGOSA-N 254.289 2.470 10 20 CECD CCCNCCNCc1cc(Br)ccc1O 841046639 KDQDTTPTYHMIFT-UHFFFAOYSA-N 287.201 2.244 10 20 CECD Nc1ccc(OC(=O)C2(c3cccnc3)CC2)cc1 1580449139 DBSGPSSKAQXGOS-UHFFFAOYSA-N 254.289 2.301 10 20 CECD CN(C)c1ccc(/C=C/c2cnc(C(=O)O)cn2)cc1 1777039140 KKGCFZKQGWFITQ-ZZXKWVIFSA-N 269.304 2.411 10 20 CECD CC[C@H]1C[C@H](NCc2cc(OC)ccc2O)CCO1 823871922 RPICZBHKWONUSS-OLZOCXBDSA-N 265.353 2.448 10 20 CECD Cc1cc(C)nc(NCCc2ccc(O)c(O)c2)n1 24799 MBQFMGMUXJIKMH-UHFFFAOYSA-N 259.309 2.159 10 20 CECD COc1cccc(CN[C@@H](CCO)C(C)(C)C)c1O 231074205 NQNGIFHXDSJAFX-ZDUSSCGKSA-N 267.369 2.288 10 20 CECD O=C(NCc1ccc(F)cc1F)c1cccc(O)c1O 126378011 UXOKQDXJUBQSHX-UHFFFAOYSA-N 279.242 2.306 10 20 CECD COc1cccc(CNCCC2CCOCC2)c1O 311367023 SEFNYGZBSVZFSA-UHFFFAOYSA-N 265.353 2.307 10 20 CECD COc1cccc(CNC2C[C@@H]3CC[C@H](C2)N3C)c1O 322848867 OISSSAUTMAODOZ-AGUYFDCRSA-N 276.380 2.116 10 20 CECD C[C@H]1C[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 68535647 WSXIYTFXKGMCEZ-BBRMVZONSA-N 288.391 2.138 10 20 CECD CCCNC(=O)[C@H]1CCCN(Cc2cccc(C)c2O)C1 179939722 HKZVGBQFZDMFBS-HNNXBMFYSA-N 290.407 2.439 10 20 CECD CCN(CC)C(=O)[C@H](C)N[C@H](C)c1cc(OC)ccc1O 37126599 FREOPVUQABEYJX-NEPJUHHUSA-N 294.395 2.308 10 20 CECD C[C@@H]1OCC[C@H]1NCc1ccc2c(c1)CCCN2C 120712725 RAEMXINPJMEBBT-SWLSCSKDSA-N 260.381 2.336 10 20 CECD COCCN(C[C@H](C)OC)c1ccc(OC)c(OC)c1 182342609 FACJPJSNBLNXPS-LBPRGKRZSA-N 283.368 2.192 10 20 CECD COc1ccc(O)c([C@H](C)NCc2nc(C3CC3)n[nH]2)c1 182894730 ASTVTKHCPVVKPY-VIFPVBQESA-N 288.351 2.247 10 20 CECD O=C(NCc1ccccc1O)c1cc(Cl)c[nH]1 133769885 QXWPSACXHUQOFT-UHFFFAOYSA-N 250.685 2.304 10 20 CECD C[C@@H](NCC1(C(N)=O)CCCC1)c1ccc(N(C)C)cc1 268919246 OSSLQDRBZYYISC-CYBMUJFWSA-N 289.423 2.449 10 20 CECD CN(CC(=O)NCc1ccc(N(C)C)cc1)CC(C)(C)C 263748206 GCTLODSMDBSESR-UHFFFAOYSA-N 291.439 2.347 10 20 CECD CCC[C@@](C)(O)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273565233 JFLZTFVEAHPLOS-MEDUHNTESA-N 295.379 2.381 10 20 CECD CC(C)OC[C@@H]1CN(Cc2ccccc2O)CCO1 372115620 FFXPHKXUXMCRPJ-AWEZNQCLSA-N 265.353 2.018 10 20 CECD CC(=O)C(=O)CSc1nncn1[C@H](C)c1ccccc1 289754730 VAYVPZOQMOYZBK-SNVBAGLBSA-N 289.360 2.138 10 20 CECD C[C@H](NC[C@H]1CCCNC1)c1ccc(F)cc1O 817945956 OHYFCOLFXNSAQK-QWRGUYRKSA-N 252.333 2.182 10 20 CECD C[C@@H](NC[C@@H]1CCCCN1)c1ccc(F)cc1O 817949368 JWHPXMIDSRLWTH-PWSUYJOCSA-N 252.333 2.324 10 20 CECD CCOCCC(=O)N[C@H](C)c1cc(OC)ccc1O 728978650 MBRCRZZTVGKVNI-SNVBAGLBSA-N 267.325 2.005 10 20 CECD COc1cccc(CNC(=O)c2scnc2Cl)c1O 729859075 GZALJABMINSFLS-UHFFFAOYSA-N 298.751 2.441 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1=COCC1 729262422 MSCJAEMBRUUUEO-UHFFFAOYSA-N 274.364 2.405 10 20 CECD O=C(N[C@H]1CCC(F)(F)C1)c1c(F)ccc(O)c1O 826993695 NAWLSINCHGCEPA-LURJTMIESA-N 275.226 2.155 10 20 CECD CCOc1ccc(CN2CC(C)(OC)C2)c(O)c1 839101485 DFQCONTUYGTYND-UHFFFAOYSA-N 251.326 2.012 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCCO1 839912614 GAABJHJOJBUWPE-CJNGLKHVSA-N 290.407 2.287 10 20 CECD CCOc1ccc(O)c(CN[C@H](C)c2ccn(C)n2)c1 839191397 OVFZKVBYZLOINX-LLVKDONJSA-N 275.352 2.375 10 20 CECD COc1ccc(CNCCC(C)(C)S(C)(=O)=O)cc1C 840960813 VKZYEJAWAMSOCI-UHFFFAOYSA-N 299.436 2.307 10 20 CECD CC[C@@H](C[C@H](C)CO)NC(=O)Nc1ccc(N)cc1 841299751 JLPPAQJEZJXWTD-JQWIXIFHSA-N 265.357 2.187 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CC12CCNCC2 841081162 XDXDTXKSJNYKEI-CYBMUJFWSA-N 266.772 2.277 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1CN 841101388 VSBSIARERROASK-GXTWGEPZSA-N 279.403 2.308 10 20 CECD C[C@@H]1C[C@@H](N)CCN1Cc1c(O)ccc(Cl)c1F 846703696 PMKYGZSFHNYCSY-BDAKNGLRSA-N 272.751 2.496 10 20 CECD CCN(CC)c1ccc(CN(C)CCNC(C)=O)cc1F 843427469 CDUIHIMFZFOMAA-UHFFFAOYSA-N 295.402 2.240 10 20 CECD Cc1ccc(N(C)Cc2ccc(N3CCOCC3)cc2)nn1 853095903 DUBIEORGGQUBOY-UHFFFAOYSA-N 298.390 2.258 10 20 CECD CCN(CC)CCOCCNCc1cc(C)c(C)cc1O 757943698 SYJZRYARHOOUKS-UHFFFAOYSA-N 294.439 2.457 10 20 CECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccccc1 758775081 QUHLJUFEBXFPIF-UHFFFAOYSA-N 291.328 2.396 10 20 CECD CC(C)N1CC[C@H](N[C@@H](C)c2cc(F)cc(F)c2O)C1=O 756708269 BFPVFCMPDCKRGZ-ZANVPECISA-N 298.333 2.330 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)CC(C)(C)OC 935945848 NBPDQQWTMFOLFG-UHFFFAOYSA-N 286.368 2.309 10 20 CECD C[C@@H](NCc1nc(C2CC2)nn1C)c1ccccc1O 879649621 ZFGMRBMLXGYEGI-SNVBAGLBSA-N 272.352 2.249 10 20 CECD Cc1ccc(CN2C[C@@H](C)O[C@]3(CCCOC3)C2)c(O)c1 877495550 YLSTWCCXUIPOEA-RHSMWYFYSA-N 291.391 2.471 10 20 CECD Cc1ccc(CN[C@@]2(CO)CCOc3ccccc32)c(O)c1 877498324 BRWHXFITYFPUJQ-GOSISDBHSA-N 299.370 2.461 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cc1cncn1C 776344482 SFKKKANPQBFSLS-UHFFFAOYSA-N 287.363 2.107 10 20 CECD COc1cc(O)c(CN[C@@H]2CCSC2)cc1OC 776222882 MOKVWBJRQOIQAE-SNVBAGLBSA-N 269.366 2.005 10 20 CECD CCOc1ccc([C@@H]2NC(=O)[C@@H]3C[C@@H](C)CCN32)c(O)c1 777899205 KGNFTWNYQWFBIC-VZJVUDMVSA-N 290.363 2.020 10 20 CECD COCC[C@H](CO)NCc1ccc2ccccc2c1O 894656660 UBIHVXHNSRTKIP-CQSZACIVSA-N 275.348 2.032 10 20 CECD COc1ccc(CN[C@@]23CCC[C@@H]2C3)c(O)c1OC 897375070 KCNASRHBQUWFMT-IAQYHMDHSA-N 263.337 2.442 10 20 CECD CC1=NO[C@H](CNCc2cc(Cl)c(F)cc2O)C1 895304355 IGUIUFYSZKUPKD-VIFPVBQESA-N 272.707 2.439 10 20 CECD CN1CCN(c2ccc(CNc3ccon3)cc2F)CC1 1320554927 HTMJLZBOLSDJLX-UHFFFAOYSA-N 290.342 2.178 10 20 CECD C[C@@H]1COC[C@@H]1NCc1ccc2c(c1)CCCN2C 699460937 CMTQYQZNNBSGCB-DOMZBBRYSA-N 260.381 2.194 10 20 CECD Cn1c(-c2sccc2O)nnc1N1C[C@H]2C=C[C@H]1C2 1338750984 OZCFKLVVYURQSQ-IUCAKERBSA-N 274.349 2.014 10 20 CECD C[C@@H](NCCOCCO)c1ccc2ccccc2c1O 20198672 XCTMEPANSSDTEG-GFCCVEGCSA-N 275.348 2.205 10 20 CECD CC(C)CN(CC(=O)O)Cc1cccc(F)c1O 1603804417 FAPPLGLUJJNFMY-UHFFFAOYSA-N 255.289 2.074 10 20 CECD CC[C@H](C)N(CC(=O)O)Cc1cc(OC)c(OC)cc1O 1594979704 ZGNKYHIEFLVIOP-JTQLQIEISA-N 297.351 2.095 10 20 CECD C[C@H](NC[C@@H]1CCC=CO1)c1cc(C(=O)O)ccc1O 1593251362 DJKVTMPXKJOUKC-JQWIXIFHSA-N 277.320 2.434 10 20 CECD COc1cccc(CNC[C@@H](CC(C)C)N(C)C)c1O 20201392 BCQJSYLFBGMZAC-CQSZACIVSA-N 280.412 2.467 10 20 CECD CCN(CC(=O)NCc1ccc(N(C)C)cc1C)C1CC1 152694223 JWFLKEAEMOKMNO-UHFFFAOYSA-N 289.423 2.162 10 20 CECD CCOCCCSc1ncc(C(=O)OC)s1 829680745 DMCZDKSQXWVBIQ-UHFFFAOYSA-N 261.368 2.448 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccncc2F)cc1 124234944 GQDIBKQMWMVCRU-UHFFFAOYSA-N 273.311 2.217 10 20 CECD COc1cc(Cl)cc(CN[C@H]2C[C@H](O)C2(C)C)c1O 128219377 PLNOHVBZBSVPQD-RYUDHWBXSA-N 285.771 2.303 10 20 CECD CC(C)S(=O)(=O)CCN[C@@H](C)c1cc(F)ccc1O 290313172 NUOFAUDYMNXMNC-JTQLQIEISA-N 289.372 2.005 10 20 CECD C[C@H]1C[C@@H](NCc2ccc3c(c2)CCCN3C)CO1 402373580 ZFRLDFMXJXRDLO-SWLSCSKDSA-N 260.381 2.336 10 20 CECD CCC[C@H](N)C(=O)NCc1ccc(N(CC)CC)cc1 178711623 FCLPFQBKTOSLFB-HNNXBMFYSA-N 277.412 2.276 10 20 CECD Oc1ccc(F)cc1CN1CC[C@H]([C@@H]2CCOC2)C1 361050584 HRSKWOYHYXLUSD-NWDGAFQWSA-N 265.328 2.390 10 20 CECD CCNC(=O)C(C)(C)CN[C@@H](C)c1cc(OC)ccc1O 186354026 KBMVIXZCCCVLQO-NSHDSACASA-N 294.395 2.214 10 20 CECD CC[C@@H](COC)NCc1cc(Cl)cc([N+](=O)[O-])c1O 120229134 PWEOOECSNZKXOU-JTQLQIEISA-N 288.731 2.468 10 20 CECD CCN(CC)c1ccc(CNC[C@@]2(O)CCO[C@H]2C)cc1 227975328 YQLWHSWYEOUZFQ-YOEHRIQHSA-N 292.423 2.162 10 20 CECD O=C(NC[C@@H]1CCOc2ccccc21)c1cccc(O)c1O 193049710 OABRQDOIVPKRCU-NSHDSACASA-N 299.326 2.394 10 20 CECD CN(C)c1ccc(CN2CC[C@H]3CC[C@H](C2)N3C)cc1 130265844 DLDIAVJYYLSVCL-IAGOWNOFSA-N 273.424 2.421 10 20 CECD COc1ccc(O)c(CN(CCC(=O)O)C(C)C)c1 86748412 OOIABDLQBJAXKK-UHFFFAOYSA-N 267.325 2.086 10 20 CECD COc1csc(C(=O)NCc2ccccc2O)c1 80087170 ZDMWZFAAQWVQAF-UHFFFAOYSA-N 263.318 2.392 10 20 CECD Oc1ccc(F)cc1CN1CC[C@@H](N2CCCC2)C1 180025214 MDTSUWOOCGVGJG-CQSZACIVSA-N 264.344 2.201 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1cc(F)cc(F)c1 98074648 BCPXUVUXMSTWEJ-UHFFFAOYSA-N 293.269 2.349 10 20 CECD COc1ccc2c(c1)CCCCN2CC(=O)NC1CC1 270898829 QPVKPEUGXHVHRE-UHFFFAOYSA-N 274.364 2.117 10 20 CECD CC(C)N1CC(=O)N(Cc2ccc(N(C)C)c(F)c2)C1=O 277838522 NGBZESFJIWKUEN-UHFFFAOYSA-N 293.342 2.064 10 20 CECD CC[C@H](NCC(F)(F)CO)c1ccc(F)cc1O 286356812 ZNKBGBKOCQTXFL-JTQLQIEISA-N 263.259 2.200 10 20 CECD Cc1noc([C@@H]2CCCN2Cc2ccccc2O)n1 289910494 UYLLBROHECOVOU-LBPRGKRZSA-N 259.309 2.421 10 20 CECD CC[C@H](NC[C@H](O)CN1CCCC1)c1ccc(C)cc1O 280117726 OCLLFHRNMZWVNN-HOCLYGCPSA-N 292.423 2.198 10 20 CECD COc1ccc(CNC(=O)CCc2cncs2)c(O)c1 816551036 MJDVOTURTGPWIV-UHFFFAOYSA-N 292.360 2.106 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2C[C@H](F)CN2)c(O)c1 817976422 LVBVKULVVBKKOG-WOPDTQHZSA-N 252.333 2.051 10 20 CECD CCN(C)c1ccc(CN2C[C@H](CO)OC(C)(C)C2)cc1 817279792 UTZGPBZAFRBBNT-MRXNPFEDSA-N 292.423 2.114 10 20 CECD Cn1nc(NC(=O)c2cc(O)cs2)cc1C1CC1 811609435 GRURGARMPZGZGR-UHFFFAOYSA-N 263.322 2.317 10 20 CECD CC[C@H]1CN(C)CCN1Cc1cc(F)ccc1O 816660829 QTPZTUWIVNLWKL-ZDUSSCGKSA-N 252.333 2.057 10 20 CECD CCO[C@@H]1COC[C@H]1NCc1c(O)ccc(Cl)c1F 825196575 JOZNZFANFIOKAZ-ZYHUDNBSSA-N 289.734 2.078 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@H]1CC12CCSCC2 827316828 IIXZYCCIMAFTCZ-LLVKDONJSA-N 293.388 2.247 10 20 CECD O=C(CCCC(=O)C1CC1)NCc1ccccc1O 825659046 UKTQHNSIHSZZHI-UHFFFAOYSA-N 261.321 2.158 10 20 CECD CC[C@H](O)[C@H](C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 907494271 XTENROXURWXWLK-HUBLWGQQSA-N 278.396 2.337 10 20 CECD COC(=O)c1cnc(SCC2CCOCC2)s1 829680765 DPTNPDSKSYSLTE-UHFFFAOYSA-N 273.379 2.448 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCCON)cc1 902417164 GNSOHOYUKFGPGG-GFCCVEGCSA-N 251.374 2.074 10 20 CECD CCOc1ccc(CN2CCCC[C@@H]2[C@H](C)N)c(O)c1 843045866 LHTNHQJKIBBPQM-SWLSCSKDSA-N 278.396 2.493 10 20 CECD CC1CCN(c2ccc(CN[C@@H](C)CC(N)=O)cc2)CC1 749132475 PNLPESIMLGOMIZ-AWEZNQCLSA-N 289.423 2.276 10 20 CECD COc1cccc(O)c1CN1CCCc2c(cnn2C)C1 840954809 OMMFARODXNDMRI-UHFFFAOYSA-N 287.363 2.083 10 20 CECD CCC[C@]1(CO)CCCN1C(=O)Nc1ccc(N)cc1 841297531 SLEUEHRLFILRQR-OAHLLOKOSA-N 277.368 2.428 10 20 CECD CC[C@@H](NC[C@@H]1CC(=O)N(CC)C1)c1ccc(F)cc1O 846208405 JNJXOGZPONGAFF-SMDDNHRTSA-N 294.370 2.440 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCOC[C@]12CCOC2 840942411 KHJVTBRSSLALTL-QGZVFWFLSA-N 290.407 2.052 10 20 CECD COc1cccc([C@H](C)NCCOC[C@H]2CCCO2)c1O 846142579 ATWPFCQRXLMCDI-QWHCGFSZSA-N 295.379 2.247 10 20 CECD CCN(C)c1ccc(CN2CCC3(CC2)OCCO3)cc1 741752971 LNACVDIBXWYJQO-UHFFFAOYSA-N 290.407 2.482 10 20 CECD COc1cc(C)cc(CN2CC[C@@H]3OCC[C@@H]3C2)c1O 842621958 FLAMHNNRIXPBBG-OCCSQVGLSA-N 277.364 2.320 10 20 CECD C[C@H](N[C@@H](CO)c1cnn(C)c1)c1ccc(Cl)cc1O 841752463 TVKMKQGUWOHRDW-ZANVPECISA-N 295.770 2.163 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1cnc(C)n1C 850138817 JYLGXGQQUSULGA-UHFFFAOYSA-N 272.396 2.393 10 20 CECD Cc1cc(O)c(CNC2COC(C)(C)OC2)cc1C 758047062 VZCVWUOXXKMEHN-UHFFFAOYSA-N 265.353 2.250 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCNc2cnccn2)c1 756645142 DUXHFEYFMCGRHS-GFCCVEGCSA-N 272.352 2.253 10 20 CECD CC[C@@H](O)CCN[C@@H](C)c1cc(F)cc(F)c1O 756657203 BGPXOWIDUJLTRN-WCBMZHEXSA-N 259.296 2.482 10 20 CECD CO[C@H](CNC(=O)N[C@H](C)c1ccccc1O)C(C)C 868381501 SWTQWQWSDKBDLO-BXUZGUMPSA-N 280.368 2.423 10 20 CECD Cc1ccc(CNC2CCC3(CC2)OCCO3)c(O)c1 876941968 RVHCBZYWPZYTBX-UHFFFAOYSA-N 277.364 2.476 10 20 CECD OCCN(Cc1c(O)cccc1Br)C1CC1 862220465 OFNDRYULFNGSNY-UHFFFAOYSA-N 286.169 2.111 10 20 CECD Oc1ccccc1CN(Cc1cn[nH]c1)C[C@@H]1CCCO1 768161534 GTVKIBYNZZBHEI-HNNXBMFYSA-N 287.363 2.297 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCc3cccnc32)c1 862754986 AARMXCZENDDDRR-AWEZNQCLSA-N 282.343 2.442 10 20 CECD CCC[C@H](CCO)NC(=O)NCc1ccc(N(C)C)cc1 866037625 OSEMWZIZHBGCOL-CQSZACIVSA-N 293.411 2.103 10 20 CECD Cc1cccc(O)c1CNCC1(CS(C)(=O)=O)CCC1 877591590 GPSGGRJKHQZNAE-UHFFFAOYSA-N 297.420 2.005 10 20 CECD Cc1ccc(CN[C@H](C)C(=O)NCc2ccco2)c(O)c1 877150437 SFSMEZPYRFGFJT-GFCCVEGCSA-N 288.347 2.088 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CCO[C@@]2(CCOC2)C1 770752356 NMLUBMIOKFMOPD-NHYWBVRUSA-N 297.782 2.473 10 20 CECD CCC1(CC)[C@@H](NC(=O)c2cccc(O)c2O)C[C@H]1OC 776678320 SQGPWJOCDHNRRY-QWHCGFSZSA-N 293.363 2.421 10 20 CECD CCN(C)c1ccc(CN2CC[S@](=O)C[C@@H](C)C2)cc1 773889522 WNXFRKSTYPLHRQ-XOBRGWDASA-N 294.464 2.343 10 20 CECD CC(C)OC(=O)C1CCN(Cc2ccc(N)cc2)CC1 1120268164 AYIWJMIMLQBHQF-UHFFFAOYSA-N 276.380 2.432 10 20 CECD C[C@@H](N[C@H](C)c1c(O)cccc1F)c1ncn(C)n1 886596356 COPKXEFIGDJZKL-RKDXNWHRSA-N 264.304 2.072 10 20 CECD C[C@@H](O)CCCNCc1cc(Cl)cc(F)c1O 789757088 KYQPTMDZXBWSBN-MRVPVSSYSA-N 261.724 2.435 10 20 CECD C[C@H](Cc1ccco1)NC(=O)NCc1ccc(N)cc1 1120570672 IEVNVTWTCMPFHA-LLVKDONJSA-N 273.336 2.292 10 20 CECD CC1=NO[C@H](CNCc2ccc(N(C)C)c(F)c2)C1 895308593 NQCUBYBQWOTUCE-LBPRGKRZSA-N 265.332 2.146 10 20 CECD CCC(=O)NCCC1=CCN(c2ncncc2Cl)CC1 1089795349 XXXDYFASVICMQO-UHFFFAOYSA-N 294.786 2.183 10 20 CECD C[C@H](N[C@H](C)CCS(C)(=O)=O)c1ccc(F)cc1O 185790637 DBHUPHHFCCJRHJ-ZJUUUORDSA-N 289.372 2.005 10 20 CECD COc1ccc(CNc2nc(C)cc(C)n2)c(O)c1 83432050 XUPSRADBOYBCOF-UHFFFAOYSA-N 259.309 2.420 10 20 CECD CC(C)N(CCC(=O)O)Cc1ccc(N(C)C)cc1 83662634 BUNXZMJYICTROD-UHFFFAOYSA-N 264.369 2.438 10 20 CECD Cc1cc(O)c(CNCc2nnc(C)n2C)cc1Cl 1347391458 MQMPXBFGKBSHEM-UHFFFAOYSA-N 280.759 2.081 10 20 CECD O=C(c1cc(O)cs1)N1[C@H]2CC[C@H]1c1cncnc1C2 1347902225 XEVFTKBKXLVYSG-UFBFGSQYSA-N 287.344 2.146 10 20 CECD COc1cc2c(c(OC)c1)N(CC(=O)OC(C)C)CCC2 1348459779 PYPUDPZMILIUDH-UHFFFAOYSA-N 293.363 2.408 10 20 CECD C[C@H]1CN(C(=O)C2=CCCNCC2)c2ccc(F)cc2O1 1521379109 GDPXBDSHHWGUQZ-NSHDSACASA-N 290.338 2.249 10 20 CECD CC[C@@H](CN[C@@H](C)c1cccc(OC)c1O)C(=O)O 1603567876 KYJDPMJZHMGDKE-UWVGGRQHSA-N 267.325 2.162 10 20 CECD C[C@H]1C[C@H](NCc2ccc3c(c2)CCCO3)CCN1 904356312 VPVSDZWSUMAVKI-SWLSCSKDSA-N 260.381 2.242 10 20 CECD OCC[C@H](NCc1ccc2c(c1)CCCO2)C1CC1 921769348 BTVIQDCXQOZPOT-HNNXBMFYSA-N 261.365 2.262 10 20 CECD CC[C@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2O)C[C@H]1O 270835111 DDYJJRNICYVRPI-IINYFYTJSA-N 297.782 2.451 10 20 CECD CCOc1cccc(CNC[C@@H](C)CCCO)c1O 294777111 KRZTUVBABOQEQE-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CN(C)CCCCNCc1ccc2c(c1)CCCO2 390403336 IOPKTBMBOIEMJT-UHFFFAOYSA-N 262.397 2.443 10 20 CECD C[C@H](N[C@H](C)C1(CO)CC1)c1ccc(F)cc1O 829208500 KITMMSGGEODBMK-VHSXEESVSA-N 253.317 2.343 10 20 CECD COc1cccc(CNC(=O)c2cc(C(C)C)[nH]n2)c1O 105651376 KHTRHJGDTNVSCD-UHFFFAOYSA-N 289.335 2.177 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC(=O)N2CCCC2)c1 20127268 PBMCJHQKXOGLBL-GFCCVEGCSA-N 292.379 2.064 10 20 CECD O=C(NCCCC(F)(F)F)c1cccc(O)c1O 126502470 WZWTUGASRXQHHK-UHFFFAOYSA-N 263.215 2.170 10 20 CECD COc1cccc(CNC(=O)c2cnn(C(C)C)c2)c1O 188449428 FKJWCPVZRWPPAN-UHFFFAOYSA-N 289.335 2.108 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)Nn2cnnc2)cc1 180725605 JQXCSHBTLUIPFO-UHFFFAOYSA-N 281.319 2.070 10 20 CECD CC(=O)NCCCN[C@@H](C)c1cc(Cl)ccc1O 184921590 XKYQVAHNFQGQME-VIFPVBQESA-N 270.760 2.222 10 20 CECD C[C@@H](NCC1(C)OCCO1)c1ccc(N(C)C)cc1 179571912 HAPPCHDEVCPGGU-GFCCVEGCSA-N 264.369 2.166 10 20 CECD CC[C@@]1(CO)CCCN1Cc1cccc(OC)c1O 191958398 PAPSZABDVYYNNC-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CCN(CC)C[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1 236900735 BLZXFMSSRAKNSE-HNNXBMFYSA-N 289.423 2.002 10 20 CECD Cc1cccc(N(C)C(=O)/C=C\c2cccnc2)n1 255075037 RDPUMNPUKWMOJC-HJWRWDBZSA-N 253.305 2.461 10 20 CECD CN(C)C(=O)c1ccc(NCc2ccc(N(C)C)cc2)nc1 264854841 JHVZTLYVQCFAMS-UHFFFAOYSA-N 298.390 2.462 10 20 CECD COC[C@@H](C)N(C)Cc1ccc(N(C)C)c(F)c1 271122792 KZQAUZQUMVAZFW-LLVKDONJSA-N 254.349 2.358 10 20 CECD COc1ccc(O)c(CNC[C@](C)(O)c2ccccc2)c1 271814187 LKOKLIMJHOSOHQ-KRWDZBQOSA-N 287.359 2.398 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@](C)(O)C2CC2)cc1F 270027333 GUWQMMJBHAJTOM-MRXNPFEDSA-N 294.370 2.059 10 20 CECD C[C@@H](NC[C@@H](O)CN1CCCC1)c1cc(Cl)ccc1O 273383853 IVOFPZIJKWOLMX-DGCLKSJQSA-N 298.814 2.153 10 20 CECD CC[C@@H](NCc1ccc2c(c1)CCO2)[C@@H](O)C(F)(F)F 270966524 ILMXHBLJAMGBIY-DGCLKSJQSA-N 289.297 2.413 10 20 CECD C[C@H](NCC1(N2CCOCC2)CC1)c1cc(F)ccc1O 278597578 ZHRYRLQJRVWFPE-LBPRGKRZSA-N 294.370 2.047 10 20 CECD CC[C@H](COC)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273562299 ILIAFNMTWQSXGL-NXEZZACHSA-N 268.313 2.376 10 20 CECD CCc1sc(=O)n(CC(=O)C(C)=O)c1-c1ccccc1 289679762 PQBIRHPXLABWLJ-UHFFFAOYSA-N 289.356 2.297 10 20 CECD Cc1cc(CN2CC[C@H](CN(C)C)C2)ccc1N(C)C 293212267 UZPIAAGBUIIVCM-MRXNPFEDSA-N 275.440 2.445 10 20 CECD COc1cc(O)c(CN(C(C)C)C2COC2)cc1OC 295987463 JZTYUYQXSSGBJX-UHFFFAOYSA-N 281.352 2.019 10 20 CECD CC(F)(F)CCNC(=O)/C=C/c1ccc(O)c(O)c1 295925792 JJOLWISXAWRAPF-HWKANZROSA-N 271.263 2.273 10 20 CECD CCCCN1CC(=O)N[C@H]1c1cccc(Cl)c1O 298779650 KMNKTZGKYFOLBB-CYBMUJFWSA-N 268.744 2.276 10 20 CECD Cc1cccc(CN2CC[C@H](n3cccn3)C2)c1O 291192791 GUUSFKLOIHIOBM-AWEZNQCLSA-N 257.337 2.344 10 20 CECD Cn1cnc(CNCCCSc2nccs2)c1 808388166 CCUCHMYLYIHNOP-UHFFFAOYSA-N 268.411 2.149 10 20 CECD O=C(O)/C=C/c1ccc(N2CC[C@@H]3C[C@@H]32)c([N+](=O)[O-])c1 706901880 PJKSOAVLKPFWMM-WKLDVVIOSA-N 274.276 2.291 10 20 CECD Cc1nc(C(=O)NCCCSc2nccs2)co1 801620290 DFSFZDXXIQPIPJ-UHFFFAOYSA-N 283.378 2.352 10 20 CECD CCCOc1ccc([C@@H]2NC(=O)CN2CC(C)C)c(O)c1 298782331 MGOAIERKQYNOSZ-MRXNPFEDSA-N 292.379 2.267 10 20 CECD Cc1cc(O)c(CNCCc2nccnc2C)cc1C 293141014 UGDJQTIJTJBLFR-UHFFFAOYSA-N 271.364 2.440 10 20 CECD COc1ccc(O)c(CN2CC(O)(c3ccccc3)C2)c1 291524136 JLYMGDSILRLCPR-UHFFFAOYSA-N 285.343 2.104 10 20 CECD CC[C@@H]1C[C@@H](C(=O)NCCc2ccc(N)cc2)CCO1 818545235 QXRUVCJPJQNYSC-DZGCQCFKSA-N 276.380 2.133 10 20 CECD C[C@](O)(CNCc1cc(Cl)c(F)cc1O)C1CC1 816549841 ZWJFYVKPVOAXIN-ZDUSSCGKSA-N 273.735 2.435 10 20 CECD CCCN1C[C@H](CNCc2cc(C)ccc2O)CC1=O 817411008 LALDKHNUPQFQAU-ZDUSSCGKSA-N 276.380 2.049 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@@H](C(=O)N(C)Cc2ccccc2O)C1 816889026 JPFOODOODBKNFJ-FZMZJTMJSA-N 299.374 2.440 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCC2CNC2)c1O 817965140 MQSCZFUSEPDDRE-SECBINFHSA-N 254.761 2.224 10 20 CECD CC(C)Cn1cc(C(=O)Nc2ccc(N)cc2)cn1 818556502 XCJOOSQBJRAGJC-UHFFFAOYSA-N 258.325 2.374 10 20 CECD COc1ccc(O)c(CNC(=O)NCc2occc2C)c1 813642529 QXSMTGOOOFVKHT-UHFFFAOYSA-N 290.319 2.302 10 20 CECD CCN(CC(=O)NCc1ccccn1)c1ccc(OC)cc1 727829569 HHRMGWRBTTWGKG-UHFFFAOYSA-N 299.374 2.233 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](C)n2cccn2)c1 729534991 HGDGDRZLCNNYRH-QWRGUYRKSA-N 289.335 2.036 10 20 CECD CC[C@H](NCc1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H](C)O 824921554 NDUWEYRCTSFXAM-XCBNKYQSSA-N 288.731 2.203 10 20 CECD CCOc1ccc(CNCC[C@H](C)CCO)c(O)c1 824517428 UVGVFRYJGJAJOP-LBPRGKRZSA-N 267.369 2.289 10 20 CECD COc1ccc2c(c1)CCCN2C[C@H](N)CC(F)F 903901965 BZENDGXPHPWSHI-LLVKDONJSA-N 270.323 2.430 10 20 CECD CCOc1ccc(CNCCC(C)(C)CO)c(O)c1 824603201 NRQWNUIXLSQOSI-UHFFFAOYSA-N 267.369 2.289 10 20 CECD CC1(C)OCC(N[C@@H]2CCc3cccc(O)c32)CO1 834764828 HIHJCOUBNWOWJN-GFCCVEGCSA-N 263.337 2.121 10 20 CECD C[C@@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 834908150 HGCWGJGBVGRLJR-MLGOLLRUSA-N 275.396 2.072 10 20 CECD CC[C@H](CN1CCOCC1)N[C@H](C)c1cc(C)ccc1O 903342481 FIDMTBLLZQQGCL-HUUCEWRRSA-N 292.423 2.462 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)C=C2CCCC2)cc1 832281977 WQKBDBMLAQGIKA-INIZCTEOSA-N 287.407 2.369 10 20 CECD CC[C@@H]1C[C@H]1CNC(=O)/C=C/c1ccc(O)c(O)c1 836829631 KPXLKGKCWNVDTC-XCOQAZTISA-N 261.321 2.273 10 20 CECD Cc1nccn1CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 837540692 CRWVNRMISFGGAI-GFCCVEGCSA-N 286.379 2.135 10 20 CECD Cc1cc(CN2CC[C@@](C)(C(=O)O)C2)ccc1N(C)C 846275632 RMAWFCNCHYUPTM-MRXNPFEDSA-N 276.380 2.358 10 20 CECD CC[C@H]1CCCC[C@@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841011925 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2.189 10 20 CECD CCOC1CC(O)(CNCc2ccc3c(c2)CCCO3)C1 922065657 LHXLGCZXETVNJU-UHFFFAOYSA-N 291.391 2.031 10 20 CECD CN1CCCc2cc(CNC[C@H](O)c3ccccn3)ccc21 853098587 OAPWHAIOTKVUDU-SFHVURJKSA-N 297.402 2.287 10 20 CECD COc1ccc(N2CCCN(C(=O)OCCF)CC2)cc1 858914098 RCPJGZQGEOCZMN-UHFFFAOYSA-N 296.342 2.313 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnc([C@H](C)O)s2)c1 862755137 DUHYZYWEGLOOKT-VIFPVBQESA-N 292.360 2.140 10 20 CECD COc1cc(C)nc(N[C@@H](C)Cc2ccc(O)c(O)c2)n1 762800639 VEGMXKORELINOR-VIFPVBQESA-N 289.335 2.248 10 20 CECD OCCCN(Cc1c(O)cccc1Cl)C1CC1 769405698 WSOKEOCNYMBCDS-UHFFFAOYSA-N 255.745 2.392 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@]3(CCO[C@H]3C)C2)c(O)c1 877487036 UBSHXDBPRRLSAR-GRDNDAEWSA-N 291.391 2.469 10 20 CECD CC(C)N(C)C(=O)[C@H](C)N[C@H](C)c1ccccc1O 879648592 VHFIKXJMSCHBCZ-NEPJUHHUSA-N 264.369 2.298 10 20 CECD COC(=O)[C@H]1CC[C@H](C(=O)N(C)c2ccc(N)cc2)CC1 877076953 YDIUIWRMOSIIPQ-HAQNSBGRSA-N 290.363 2.211 10 20 CECD CCCNC(=O)CCN[C@@H](C)c1c(O)cccc1F 886508593 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COc1cc(Cl)cc(CNC[C@@H]2CC[C@H](O)C2)c1O 187985348 KNGNNEMKBUALRY-SKDRFNHKSA-N 285.771 2.305 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)C(=O)NC(C)(C)C 67502446 RGUFTYXLPPPZIH-NSHDSACASA-N 276.380 2.014 10 20 CECD C[C@@H]1NC[C@H](C)N(Cc2cc(F)ccc2O)[C@H]1C 401202615 ANXPKMXJPOQPJD-DCAQKATOSA-N 252.333 2.102 10 20 CECD COc1ccc(N2CCN(C[C@H]3CCCCO3)CC2)cc1 66313578 LZHMDRDZNAZTJF-QGZVFWFLSA-N 290.407 2.386 10 20 CECD CCCCCN(CCO)C(=O)c1ccc(C)c(O)c1O 182908597 UORPFWHDDOUQKB-UHFFFAOYSA-N 281.352 2.031 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C2=CCCCO2)c1 178745117 OPOVZYSBQUXFFW-JTQLQIEISA-N 277.320 2.272 10 20 CECD COCCN(Cc1cc(OC)ccc1O)CC(F)F 180013954 MCOCPDJTSCUZSQ-UHFFFAOYSA-N 275.295 2.114 10 20 CECD CCC(CC)[C@H](O)CNC(=O)/C=C/c1ccc(O)c(O)c1 181204901 DLWXDSYNUSEEES-PMGBHYCQSA-N 293.363 2.024 10 20 CECD CN(CCc1ccncc1)Cc1cc2c(cc1O)OCO2 183760244 LQUMJEIQFSWTAU-UHFFFAOYSA-N 286.331 2.190 10 20 CECD COC[C@H](C)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 131890416 LWRDNYNVFKEPTM-QWHCGFSZSA-N 296.386 2.348 10 20 CECD CCCOc1ccc(CN(CCOC)CCOC)c(O)c1 133421382 RHMRGNGWCWZECW-UHFFFAOYSA-N 297.395 2.276 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(C)C1)c1ccc(N(C)C)cc1 268802953 DZXNSTASFIFWFY-DZGCQCFKSA-N 275.396 2.024 10 20 CECD COCCNC(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 266291224 JUOIXVFWCBTVQT-UHFFFAOYSA-N 293.411 2.319 10 20 CECD CCOc1ccc(O)c(CN2CC[C@](O)(C3CC3)C2)c1 369683487 LXRMJUXPSZPRKJ-MRXNPFEDSA-N 277.364 2.138 10 20 CECD COC[C@@H](O)CCN[C@@H](C)c1ccc(C)c(C)c1O 273347924 BBHLHQWMNUBPDS-STQMWFEESA-N 267.369 2.057 10 20 CECD CC[C@@H](NCCNC(=O)C(C)C)c1ccc(F)cc1O 285719832 QCLBWNAKALDOSU-CYBMUJFWSA-N 282.359 2.344 10 20 CECD COCCn1cc(CN[C@@H]2CCc3cccc(O)c32)cn1 296368002 IMWBYDVMGVEDPR-CQSZACIVSA-N 287.363 2.012 10 20 CECD Cc1ccc([C@@H](C)NCCCc2cnn(C)n2)c(O)c1 293035562 ALXITERKXUUQCD-GFCCVEGCSA-N 274.368 2.113 10 20 CECD CCOc1cccc(CN(C)CCN(C)C2CC2)c1O 290339942 FIKJNXVLGLKOEH-UHFFFAOYSA-N 278.396 2.317 10 20 CECD CCOc1cccc(CN2CCOC[C@@H]2CCOC)c1O 291302231 QSHFXBPUYCDLLQ-AWEZNQCLSA-N 295.379 2.028 10 20 CECD C[C@@H]1C[C@H](N[C@H](C)c2cc(F)ccc2O)CCN1 817970710 CPXVZKNHNZINKO-CKYFFXLPSA-N 252.333 2.322 10 20 CECD CCC[C@](C)(NCc1cc(F)cc(C(C)=O)c1O)C(=O)O 829202535 PYXFXKOTYBSXAU-HNNXBMFYSA-N 297.326 2.467 10 20 CECD C[C@H]1[C@@H](C)SCCN1C(=O)c1cc(O)cs1 735703789 LCPMQBCVHTZGOD-JGVFFNPUSA-N 257.380 2.420 10 20 CECD CCOc1ccc(O)c(CNCc2nn(C)cc2Cl)c1 824758549 XUQHBYOUMFILNF-UHFFFAOYSA-N 295.770 2.468 10 20 CECD O=C(NCCNCc1c(O)cccc1Cl)c1ccco1 733322557 MGZSNKPQGAUZIH-UHFFFAOYSA-N 294.738 2.158 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1[C@@H]2CCC(=O)[C@@H]12 906110772 HCPCCXGKIPCXRI-PVAVHDDUSA-N 298.386 2.128 10 20 CECD COCC(COC)N[C@H](C)c1cc(Cl)ccc1O 834891583 OXMXKLMQJXAHCV-SECBINFHSA-N 273.760 2.358 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1CCCO1 839912617 GAABJHJOJBUWPE-XJKSGUPXSA-N 290.407 2.287 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H](C)CCCO)c1 834871335 NDNKHAWBJHLDMZ-VXGBXAGGSA-N 295.379 2.238 10 20 CECD Cc1ncc(CNC(=O)NCc2ccccc2O)s1 748459883 KRJOWBGLLWVGOO-UHFFFAOYSA-N 277.349 2.157 10 20 CECD O=C(NCCOC1CCC1)NCc1cc(Cl)ccc1O 845018324 PYXXRGMIQRFFQG-UHFFFAOYSA-N 298.770 2.414 10 20 CECD Cc1noc(C)c1[C@@H](C)C(=O)NCc1ccccc1O 749941421 LCJOXUMBGUYOLT-SECBINFHSA-N 274.320 2.417 10 20 CECD CCOc1ccc(CNC2(C)CCNCC2)c(O)c1 841065578 QTWXUAOJCFICLZ-UHFFFAOYSA-N 264.369 2.023 10 20 CECD C[C@@H]1C[C@@H](N)CCN1Cc1ccc(N(C)C)c(F)c1 846698209 CHBNLGIMFDWPGY-YPMHNXCESA-N 265.376 2.203 10 20 CECD COc1cccc([C@H](C)NC[C@H](C)C[C@H](C)O)c1O 846145145 MYINUAQMRMBVGF-WOPDTQHZSA-N 267.369 2.458 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)[C@H](C)CN1 843119947 QBYKJINNIZLXOJ-DTWKUNHWSA-N 272.751 2.367 10 20 CECD COc1cccc([C@H](C)NC[C@@H](O)CC(C)C)c1O 846142317 RIJVZYVHZXWDKX-RYUDHWBXSA-N 267.369 2.458 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCS(=O)(=O)CC2CC2)c1 756763134 UNFCDQBXJKPZOE-GFCCVEGCSA-N 297.420 2.176 10 20 CECD CCO[C@@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)C1 751533926 FACIIYRHSYFKCN-LLVKDONJSA-N 279.336 2.047 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H]2CCCN(C)C2=O)cc1 766437531 PAZXPFKBNLCGHK-BBRMVZONSA-N 289.423 2.414 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1c(C)cccc1O 876945193 VMCWNLDWFZGHGC-GFCCVEGCSA-N 264.369 2.095 10 20 CECD CCc1cnc(Cn2cc(COc3ccc(N)cc3)nn2)o1 881300600 JFYFNXKUXFCFDF-UHFFFAOYSA-N 299.334 2.038 10 20 CECD C[C@H](NC(=O)NC[C@@H]1CCCO1)c1ccc(N(C)C)cc1 774018188 RINJIGCLTFQTIC-WFASDCNBSA-N 291.395 2.292 10 20 CECD Nc1ccc(CN2C[C@@H](N)Cc3ccccc32)cc1 1120371745 PNJQRGNOGJUBHJ-HNNXBMFYSA-N 253.349 2.159 10 20 CECD CCC(O)(CC)CCNCc1c(O)cccc1OC 788078526 WQFJWBRORQHAOD-UHFFFAOYSA-N 267.369 2.432 10 20 CECD COc1cc(C)cc(CNC[C@H]2CCOC[C@@H]2C)c1O 894749794 KSYHIDOOIWRDDC-QWHCGFSZSA-N 279.380 2.471 10 20 CECD COc1ccc(CN2CCO[C@@H](C)[C@@H]2C)c(O)c1OC 892048080 HNGPDPCXPGONBG-QWRGUYRKSA-N 281.352 2.019 10 20 CECD COc1cc(C)cc(CNC[C@]2(O)CCC[C@H]2C)c1O 894865130 MRJNXHJMXKNKFD-MLGOLLRUSA-N 279.380 2.350 10 20 CECD CC(C)(CO)CNCc1c(O)ccc(Cl)c1F 790981295 MRCNIVNODUXATQ-UHFFFAOYSA-N 261.724 2.293 10 20 CECD CC[C@H](NCc1ccc(N(CC)CC)cc1)C(=O)O 75423918 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10 20 CECD CC(=O)N1CC[C@H](CN(C)Cc2cc(Cl)ccc2O)C1 92100869 GXRDIXXVBXPOIB-GFCCVEGCSA-N 296.798 2.346 10 20 CECD CCC[C@](C)(N)C(=O)NCc1c(O)ccc2c1CCCC2 272463739 OXHJJRUFILMHRH-KRWDZBQOSA-N 290.407 2.405 10 20 CECD C[C@H]1C[C@H](NC(=O)NCc2ccc(N(C)C)cc2)CCO1 271206688 KKMDBDRXSILWOZ-GXTWGEPZSA-N 291.395 2.119 10 20 CECD COCCN1CC[C@H](N[C@H](C)c2cc(Cl)ccc2O)C1 273599710 RRKKIAYNCBUYTI-YPMHNXCESA-N 298.814 2.417 10 20 CECD COCCN1CC[C@@H](N[C@@H](C)c2c(C)cc(C)cc2O)C1 284206271 SLLXVSRWVLYHJM-LSDHHAIUSA-N 292.423 2.380 10 20 CECD COC[C@]1(C)CCN(Cc2cc(OC)c(OC)cc2O)C1 295094331 JRIIQRZIJDRTOU-MRXNPFEDSA-N 295.379 2.268 10 20 CECD C[C@@H](CN(C)C)NCc1c(O)ccc(Cl)c1F 808422950 GZVKAYHOBFLDPU-QMMMGPOBSA-N 260.740 2.224 10 20 CECD Nc1ccc(NCCc2ccc(O)c(O)c2)c([N+](=O)[O-])c1 811811461 VDXFUPZIOPFAQW-UHFFFAOYSA-N 289.291 2.243 10 20 CECD O=C1NN(c2ccccc2)C(=O)/C1=C/c1ccsc1 726876635 YQZXAXIGAIFSOJ-XYOKQWHBSA-N 270.313 2.210 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=S)NC2CC2)c1 728791769 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CN(C)c1ccc(CNC(=O)N2O[C@H]3C=C[C@H]2CC3)cc1 866186956 ZEHWYDDLSBJIOG-GJZGRUSLSA-N 287.363 2.297 10 20 CECD CCOc1ccc(CN2CCCOC[C@H]2C)c(O)c1 769457154 NWDRINAASNFVBF-GFCCVEGCSA-N 265.353 2.402 10 20 CECD COc1cccc(CNC(=O)[C@H]2CCC(=O)[C@H](C)C2)c1O 764103515 YRLTXAXRGKWYOF-MNOVXSKESA-N 291.347 2.022 10 20 CECD CC(C)Cn1nccc1C(=O)N(C)c1ccc(N)cc1 877076673 SOHQWXNEAHSFCU-UHFFFAOYSA-N 272.352 2.398 10 20 CECD CN(C(=O)c1cnn(C(C)(C)C)c1)c1ccc(N)cc1 877080028 FFERTJUNUAGSFY-UHFFFAOYSA-N 272.352 2.497 10 20 CECD Cc1ccc([C@@H](O)CNCc2cc(F)cc(F)c2O)o1 883016964 SLKXBRJRXJDFLW-LBPRGKRZSA-N 283.274 2.395 10 20 CECD CN(Cc1cc(F)cc(F)c1O)[C@@H]1CC(C)(C)OC1=O 894851910 QTNWBTMOLFCSMW-LLVKDONJSA-N 285.290 2.196 10 20 CECD COCC[C@H](CO)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 798940875 OJLCNYZNCMQNON-CKYFFXLPSA-N 283.343 2.067 10 20 CECD O=S(=O)(CCc1ccccc1)NCc1ccccc1O 135101679 WMNOEDPBPXCNFG-UHFFFAOYSA-N 291.372 2.054 10 20 CECD CO[C@@]1(C)CCCN(C(=O)c2cccc(O)c2O)CC1 280125337 WBNTZWJBCJNTHN-HNNXBMFYSA-N 279.336 2.129 10 20 CECD CC(C)CC[C@H](N)C(=O)N(C)Cc1ccccc1O 704467093 SVCRQBJSKFTNJN-ZDUSSCGKSA-N 264.369 2.114 10 20 CECD CCn1ccnc1[C@H](C)NC(=O)NCc1ccc(N)cc1 1336974870 DAACTCCECRETRX-NSHDSACASA-N 287.367 2.046 10 20 CECD Nc1ccc(CN2CCC(OC[C@H]3CCOC3)CC2)cc1 1352788467 DVLDTODIUPLHSR-HNNXBMFYSA-N 290.407 2.286 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CC[C@H](C(=O)O)C2)c1 1607277036 LYYMRWQAUDIAIK-DCAQKATOSA-N 279.336 2.305 10 20 CECD O=C(O)c1cnc(S[C@@H]2CCN(C3CCC3)C2=O)s1 1602537619 XMXVDWHTQPQQTJ-MRVPVSSYSA-N 298.389 2.087 10 20 CECD Cn1nc(C2CC2)nc1CSc1ncc(C(=O)O)s1 1601008918 KGIXPLAEZHNORG-UHFFFAOYSA-N 296.377 2.140 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)[C@@H]1C[C@@H]1C(=O)O 1600236048 HYYWDCVQVGSBIW-UGFHNGPFSA-N 276.380 2.260 10 20 CECD C[C@@]1(N)CCCC[C@H]1C(=O)N1Cc2cccc(O)c2C1 1576531515 SVBUVCWZMRWRDZ-XJKSGUPXSA-N 274.364 2.142 10 20 CECD C[C@H]1CCN(Cc2ccc(F)c(F)c2O)C[C@H]1C(=O)O 1589355121 NAQQDAAAJVLRNR-WCBMZHEXSA-N 285.290 2.213 10 20 CECD C[C@H](N[C@H](C)Cn1ccnc1)c1cc(C(=O)O)ccc1O 1592929945 FOHDTPZTECXPKH-MNOVXSKESA-N 289.335 2.026 10 20 CECD C[C@H](N[C@H](C)CC[S@@](C)=O)c1ccc(F)cc1O 168839506 UWEBFDITFIEQRO-JJQCHNSYSA-N 273.373 2.339 10 20 CECD COc1cccc(CNC(=O)CC2(O)CCCCC2)c1O 155361154 OKPBLPQDMGJRRU-UHFFFAOYSA-N 293.363 2.102 10 20 CECD CCOC(C)(C)CNCc1cc(OC)ccc1O 159209724 FXVITODDFDQWTD-UHFFFAOYSA-N 253.342 2.306 10 20 CECD COc1ccc(O)c([C@@H](C)NC2CCOCC2)c1 36319393 RYZPLRJHHZYJOL-SNVBAGLBSA-N 251.326 2.230 10 20 CECD Oc1ccc(F)cc1CN1CCC([C@@H]2CCCN2)CC1 219569685 MPPRCNLWYSHTGZ-HNNXBMFYSA-N 278.371 2.495 10 20 CECD CC(=O)Nc1ccc(C(=O)Nc2ccc(N)cc2)cc1 146408427 DGMPIISNJMBYJI-UHFFFAOYSA-N 269.304 2.480 10 20 CECD CN(C)C[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 179633875 MTTVWNHYJNEVHK-LLVKDONJSA-N 268.788 2.429 10 20 CECD C[C@@H]1NC[C@@H](C)N(Cc2ccc(N(C)C)cc2)[C@@H]1C 401219576 DZHWHHIREFVQCZ-HZSPNIEDSA-N 261.413 2.323 10 20 CECD Cc1ccc(C(=O)NCc2ccc(F)cc2)c(O)c1O 177659480 HAKHXXNAOIREPJ-UHFFFAOYSA-N 275.279 2.475 10 20 CECD C[C@@H](NC[C@@]1(O)CCOC1)c1cc2c(cc1O)CCCC2 186178189 HLFHLRHZPOLXED-PXAZEXFGSA-N 291.391 2.073 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1csnn1 127773631 WOXIGUOZZKLIBY-UHFFFAOYSA-N 262.382 2.236 10 20 CECD CCc1ccnc(C(=O)NCc2cccc(OC)c2O)c1 181668134 BYPNMCJBLBTEII-UHFFFAOYSA-N 286.331 2.288 10 20 CECD C[C@@H](Cn1cccn1)N[C@H]1CCc2cccc(O)c21 296686116 GWVUHQMARXSWQO-AAEUAGOBSA-N 257.337 2.254 10 20 CECD COc1ccc(N(C)Cc2nnc3n2CCCC3)cc1F 268167553 KUYSJSNRGCJKCD-UHFFFAOYSA-N 290.342 2.399 10 20 CECD C[C@@H]1Oc2ccccc2[C@@H]1NC(=O)c1cccc(O)c1O 365676761 OMSCJFPKLBGOAP-LKFCYVNXSA-N 285.299 2.350 10 20 CECD CNC(=O)C1CCC(N[C@H](C)c2cc(F)ccc2O)CC1 273623215 ZTNTZFZNBBXISP-XSRFYTQQSA-N 294.370 2.487 10 20 CECD CCOc1ccc(O)c(CN(C)CCCCCO)c1 279485796 UJSVBFQNVOOWON-UHFFFAOYSA-N 267.369 2.385 10 20 CECD C[C@@H](CN(C)C)N[C@H](C)c1ccc(F)c(F)c1O 286904569 DSDSCKYWPNMUST-DTWKUNHWSA-N 258.312 2.271 10 20 CECD CC[C@@H](NCc1nnc2n1CCC2)c1ccc(F)cc1O 285509234 DGRNFUABQMQTJY-GFCCVEGCSA-N 290.342 2.310 10 20 CECD CCCNC(=O)CN[C@H](C)c1c(C)cc(C)cc1O 293651453 IPGAXEJXCBXHTA-GFCCVEGCSA-N 264.369 2.186 10 20 CECD CCOc1ccc(O)c(CNC[C@]2(O)CCC[C@H]2C)c1 293001624 NBNXEQPXOYDBPE-MLGOLLRUSA-N 279.380 2.432 10 20 CECD COc1cccc(-n2ccnc2SCC(=O)C(C)=O)c1 808015968 BUUGFAIVMWKJBF-UHFFFAOYSA-N 290.344 2.131 10 20 CECD COc1cc(O)c(CN[C@@H](C)C(F)(F)F)cc1OC 290117142 IOTCYPUOPKYAPZ-ZETCQYMHSA-N 279.258 2.450 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@H]2CNCCCO2)cc1 817983240 ZXXDMVRYXLITLC-YOEHRIQHSA-N 291.439 2.172 10 20 CECD CC[C@@H](NC[C@H]1CNCCCO1)c1cccc(Cl)c1O 817982976 XEXHYKCQMOBKFN-BXUZGUMPSA-N 298.814 2.465 10 20 CECD CCc1nc(C)c(C(=O)NCc2ccc(OC)cc2O)o1 816550004 FUKGKGPSJMLRNG-UHFFFAOYSA-N 290.319 2.190 10 20 CECD C[C@H]1C[C@@H](NCCc2ccc(N)cc2)c2nccn21 817957801 PGFAYDPOPIXJAG-SMDDNHRTSA-N 256.353 2.303 10 20 CECD CNC(=O)CN(C)Cc1ccc(N2CCCCC2)c(C)c1 827401090 YDELNTCBHDGRPX-UHFFFAOYSA-N 289.423 2.163 10 20 CECD CC[C@@](C)(CNCc1cc([N+](=O)[O-])ccc1O)OC 824743470 CRDZGHGZPHNXRM-ZDUSSCGKSA-N 268.313 2.205 10 20 CECD C[C@H]1C[C@@H](C)O[C@H]1C(=O)N[C@H](C)c1ccccc1O 827946496 KCFWZQHIKXWTBY-ICUOPCATSA-N 263.337 2.383 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc(CO)cc1 827956794 QUHIIADOUUEZSD-UHFFFAOYSA-N 298.386 2.483 10 20 CECD OC[C@@H]1CCC[C@@H]1NCc1cc(Cl)cc(F)c1O 825183627 OLANIPQVHUZLML-UFBFGSQYSA-N 273.735 2.435 10 20 CECD C[C@@H](Cc1cnn(C)c1)C(=O)N[C@H](C)c1ccccc1O 827952400 QZGJZOCZCIZNKH-NWDGAFQWSA-N 287.363 2.182 10 20 CECD Cc1nccn1CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 837540693 CRWVNRMISFGGAI-LBPRGKRZSA-N 286.379 2.135 10 20 CECD NC1CC(NCc2ccc(N3CCCCC3)cc2)C1 906508062 JRUFVMZYVMSJQB-UHFFFAOYSA-N 259.397 2.256 10 20 CECD C[C@@H]1CCCCN1C(=O)COC(=O)c1cc(O)cs1 731910917 WSZSKUQCGCKYDN-SECBINFHSA-N 283.349 2.012 10 20 CECD COC(=O)c1ccc(CNCc2c(O)cccc2OC)o1 734159861 JYHQKONJFODVMV-UHFFFAOYSA-N 291.303 2.070 10 20 CECD CCN(CC)c1ccc(CNC[C@@]2(C)CCC(=O)N2)cc1 835061726 NLBWEEFODPRTMN-QGZVFWFLSA-N 289.423 2.291 10 20 CECD COc1cccc(CNC(=O)c2cnccc2C)c1O 743332382 POXNPJBMPRIMTR-UHFFFAOYSA-N 272.304 2.034 10 20 CECD COC(=O)[C@H](NCc1ccc(N(C)C)cc1C)C1CC1 840941451 ATZNBVKIIFRUMN-OAHLLOKOSA-N 276.380 2.102 10 20 CECD CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)CC(C)(C)N 849349728 GBYMFTYRNMHYFF-UHFFFAOYSA-N 287.747 2.123 10 20 CECD COc1cccc([C@H](C)N[C@H](C)Cc2cnn(C)c2)c1O 846168834 MOVCUBPQSLTABO-NEPJUHHUSA-N 289.379 2.416 10 20 CECD C[C@H]1C[C@@H](NC(=O)NCc2ccc(N(C)C)cc2)CS1 840243318 COKNYDLVCQWISB-WCQYABFASA-N 293.436 2.446 10 20 CECD C[C@H](NCc1nccn1C)c1cc(F)cc(F)c1O 756539717 SIKLBMXVPVUUFF-QMMMGPOBSA-N 267.279 2.255 10 20 CECD COC[C@H](CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21)OC 757638537 QMVUTPGSBFJIOW-JFGNBEQYSA-N 283.343 2.331 10 20 CECD CC[C@H](NCCN(C)OC)c1ccc(C)cc1O 850478286 RHRNXTUMMKVOMW-ZDUSSCGKSA-N 252.358 2.235 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnc3n2CCCC3)cc1 750690184 ARFISGRQRDBFDU-UHFFFAOYSA-N 298.390 2.215 10 20 CECD COc1cccc(O)c1CN1CC[C@@H]2OCC[C@@H]2C1 843421457 ZPMYHOBNDNCHFO-RISCZKNCSA-N 263.337 2.012 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCO[C@@H](C)C2)c(O)c1 756542564 BIRMEUWWDYKFJB-UONOGXRCSA-N 278.396 2.072 10 20 CECD C[C@@H]1CN(Cc2cccc(F)c2O)CC[C@H]1C(=O)O 863739594 MWSBISXSUALTGW-MWLCHTKSSA-N 267.300 2.074 10 20 CECD CCC(CC)(CO)C(=O)NCc1cc(C)ccc1O 862755025 NHYLAFRSEGGYRO-UHFFFAOYSA-N 265.353 2.116 10 20 CECD CCc1cccnc1C(=O)NCc1cc(OC)ccc1O 767088965 QGRAGHBNTROKLK-UHFFFAOYSA-N 286.331 2.288 10 20 CECD CCN1C(=O)/C(=C/c2cncs2)SC1=S 767717098 UJIOSRZPBSAAHL-CLTKARDFSA-N 256.377 2.364 10 20 CECD C[C@@H](NC(=O)NOC1CCC1)c1ccccc1O 868666866 UKLDKVLRSQXKQR-SECBINFHSA-N 250.298 2.237 10 20 CECD CN(C)c1ccc(CN(CCCO)C2CC2)cc1F 769403272 BOBORGXQXAEJEQ-UHFFFAOYSA-N 266.360 2.239 10 20 CECD CCCOc1ccc(CN[C@@H](CO)CCOC)cc1C 873120313 RBVADIAEEKFOOC-OAHLLOKOSA-N 281.396 2.271 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773028134 YBQQPPWBKHNATP-TUKIKUTGSA-N 276.380 2.355 10 20 CECD C[C@@H](NCc1cc2n(n1)CCC2)c1ccccc1O 877755967 VBYPCAXRHORAEJ-LLVKDONJSA-N 257.337 2.386 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)Cc1cn(C)nn1 771935579 YLCLGQRMAVIPHH-UHFFFAOYSA-N 299.422 2.437 10 20 CECD COc1ccc2c(NC(=O)c3cccc(O)c3O)n[nH]c2c1 773865552 OOFUQBDGUMUQJJ-UHFFFAOYSA-N 299.286 2.235 10 20 CECD CC(=O)C(=O)COc1cccc(C)c1Br 882348984 GNWQJIMMXVUUAF-UHFFFAOYSA-N 271.110 2.294 10 20 CECD CC(C)[C@@H](F)C(=O)N1CCOc2cc(N(C)C)ccc21 784124947 JFCYFMUNFQGOGA-CQSZACIVSA-N 280.343 2.472 10 20 CECD Cc1nc([C@H]2CCN(Cc3cccc(C)c3O)C2)n[nH]1 895008280 UVIZERBQCNFEOW-ZDUSSCGKSA-N 272.352 2.117 10 20 CECD COc1ccc(CN2CC[C@H](SC)C2)c(O)c1OC 894691863 IQEUKXKVAIGXNS-NSHDSACASA-N 283.393 2.347 10 20 CECD Oc1c(F)cc(F)cc1CN1CCOCC12CC2 894686502 PNEODMLODYBCBD-UHFFFAOYSA-N 255.264 2.035 10 20 CECD COc1cccc(CNCc2ccccc2O)c1O 134235652 ITPMUKDFPNSNBT-UHFFFAOYSA-N 259.305 2.396 10 20 CECD CN(Cc1ccc(N(C)C)cc1)CN1C(=O)CC1(C)C 1318747333 BNMSCPBCQOYURY-UHFFFAOYSA-N 275.396 2.153 10 20 CECD CCc1cccc(CN[C@H](CO)CC(C)C)c1O 691485350 ZHNNCWHCYOEGPV-AWEZNQCLSA-N 251.370 2.451 10 20 CECD Oc1cc(Br)ccc1CNCC1(O)CCC1 691427028 BKTFLFQTZLWFGJ-UHFFFAOYSA-N 286.169 2.159 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CC=C(C(=O)O)C2)cc1F 1329681642 ITYCFBDDKGEIES-NSHDSACASA-N 296.317 2.294 10 20 CECD O=C(O)[C@H]1CC[C@H](NCc2ccc3c(c2)CCO3)CC1 710000657 ZJLCBVALHMTSGH-MQMHXKEQSA-N 275.348 2.355 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)n1ccnc1 1251885769 DNPVZJOBHQOCNF-ZDUSSCGKSA-N 286.379 2.135 10 20 CECD CCCCCS(=O)(=O)NCc1cc(C)ccc1O 1348156635 IPHFPNBGZICZQG-UHFFFAOYSA-N 271.382 2.310 10 20 CECD CS[C@H]1CC[C@@H](NC(=O)c2c(F)ccc(O)c2O)C1 1344100350 YYZQSDGYQVMOFM-SFYZADRCSA-N 285.340 2.251 10 20 CECD C[C@H](N[C@H]1CCC[C@@H]1CCO)c1cc(C(=O)O)ccc1O 1609774977 DJFFUIXZRFVRAP-WDMOLILDSA-N 293.363 2.292 10 20 CECD CCc1cccc(CNCCC2=CCNCC2)c1O 1578266485 JXWZASCHUOMNAD-UHFFFAOYSA-N 260.381 2.354 10 20 CECD C[C@H](NC(=O)C1(C(=O)O)CCC1)c1ccc(N(C)C)cc1 1589090324 QCAJLOKEKFJZSO-NSHDSACASA-N 290.363 2.185 10 20 CECD COc1cc(C)cc(CNCCCCC(=O)O)c1O 1594054469 LTZYZFRHGWOWFB-UHFFFAOYSA-N 267.325 2.054 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CC[C@@H](C(=O)O)C2)cc1F 1593711431 WYURGPWEKQQZIE-KOLCDFICSA-N 298.333 2.374 10 20 CECD C[C@H]1SCC[C@@H]1NC(=O)Nc1ccc(N)cc1 383932237 CBTSKUIBNQHGTR-KCJUWKMLSA-N 251.355 2.284 10 20 CECD Nc1ccc(CC(=O)Nc2ccc(Cl)nc2)cc1 106044645 UFYGBDHUNMITAU-UHFFFAOYSA-N 261.712 2.498 10 20 CECD CCC[C@](C)(CO)NCc1cc(OCC)ccc1O 177582342 XUUOKCWJUQYDFW-OAHLLOKOSA-N 267.369 2.432 10 20 CECD COc1ccc(O)c(CNC(=O)c2cccc(C)n2)c1 114543655 XJLMCAKGVTYILY-UHFFFAOYSA-N 272.304 2.034 10 20 CECD Cc1cc(C(=O)N2CCOc3cc(N(C)C)ccc32)no1 173198045 AWCIXPVCBSYAJB-UHFFFAOYSA-N 287.319 2.088 10 20 CECD OCC[C@H](NCc1cc(F)ccc1O)c1ccco1 187528286 UFTYXENGSRJBPU-LBPRGKRZSA-N 265.284 2.338 10 20 CECD CC[C@](C)(CNCc1ccc(N2CCOCC2)cc1)OC 322552188 VPNHIPXEHOOGOL-QGZVFWFLSA-N 292.423 2.428 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC[C@@H]2OCC[C@H]21 268507138 WSAGFBSXMSZQIV-GUTXKFCHSA-N 290.363 2.149 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCCCCCO)c1 273510345 RQPCAKFYNXROMS-GFCCVEGCSA-N 295.379 2.382 10 20 CECD C[C@H](NCCOCC1CC1)c1cc([N+](=O)[O-])ccc1O 273591900 PLDADYFHHNRWMW-JTQLQIEISA-N 280.324 2.378 10 20 CECD COc1ccc(O)c(CN2CC[C@](CO)(C(C)C)C2)c1 378129360 MDDDXJRNMAIRNC-INIZCTEOSA-N 279.380 2.241 10 20 CECD CC[C@H](NCC(C)(C)C(N)=O)c1ccc(F)cc1O 286066153 KWLFKVXSYWVMEN-NSHDSACASA-N 268.332 2.084 10 20 CECD CCNC(=O)[C@H](C)N[C@@H](CC)c1ccc(F)cc1O 285606846 KCHXWWNEWGEAON-CABZTGNLSA-N 268.332 2.097 10 20 CECD CCC[C@@H](C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 297976251 VTNIBQKXTKWWPM-CQSZACIVSA-N 291.439 2.489 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)[C@H]1CCN(C)C1 801549359 LELXSPCOIIYEPH-HNNXBMFYSA-N 290.407 2.473 10 20 CECD O=C(NCc1noc2c1CCCC2)c1cc(O)cs1 807901015 JIUVOGFYQJFNLK-UHFFFAOYSA-N 278.333 2.251 10 20 CECD COC(=O)c1cnc(SCC(=O)c2cccn2C)s1 295276909 KCKOXMVYRDERPN-UHFFFAOYSA-N 296.373 2.243 10 20 CECD CCNC(=O)C1(CN[C@H]2CCc3cccc(O)c32)CCC1 296452221 NJGLFBJBPCLUBU-ZDUSSCGKSA-N 288.391 2.276 10 20 CECD CON1CCC(N[C@H](C)c2cc(F)cc(F)c2O)CC1 817589107 UGZYEIAUOFHYII-SECBINFHSA-N 286.322 2.347 10 20 CECD COCC1(NCc2cccc(Cl)c2O)CCOCC1 816626131 WJKGYWQDWLOZKR-UHFFFAOYSA-N 285.771 2.331 10 20 CECD Cc1cccc(CNC[C@H]2CC[C@H](C(N)=O)CC2)c1O 817411634 WLHFBQNEKNZZRF-JOCQHMNTSA-N 276.380 2.082 10 20 CECD CC[C@H](NCC(F)(F)CN)c1ccc(F)cc1O 817967402 HIESICWAUUOOJP-JTQLQIEISA-N 262.275 2.166 10 20 CECD CO[C@]1(CNCc2ccc3ccccc3c2O)CCOC1 816569994 DNUZTIKOFLQDIH-KRWDZBQOSA-N 287.359 2.441 10 20 CECD COc1cccc(CNC(=O)c2c(C)nsc2C)c1O 815834323 DUSPPKDWXMKQHN-UHFFFAOYSA-N 292.360 2.404 10 20 CECD CCCN1C[C@H](CNCc2cc(C)c(C)cc2O)CC1=O 817410719 GLHRNRRGUXAHRT-AWEZNQCLSA-N 290.407 2.357 10 20 CECD COC(=O)c1cnc(SCC(=O)C2CCC2)s1 829677794 LVZVCWMPEFPTRZ-UHFFFAOYSA-N 271.363 2.391 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)C[C@@]1(C)CO 827699047 DIPJBUOXBAQTFC-HZMBPMFUSA-N 269.772 2.496 10 20 CECD CCN(CC)c1ccc(CNC(=S)NC)cc1F 731320648 WWCRGQWDEYZVOQ-UHFFFAOYSA-N 269.389 2.266 10 20 CECD CCOc1ccc(O)c(CN[C@@H](C)C(C)(C)O)c1 734841325 MBCFOBRPYMWWDD-JTQLQIEISA-N 253.342 2.040 10 20 CECD CCC[C@H](CNC(=O)NCc1ccc(OC)cc1O)OC 836522301 CLFADXUTNZZUAA-CYBMUJFWSA-N 296.367 2.015 10 20 CECD O=C(NCCc1ccc2c(c1)OCO2)c1cc(O)cs1 732258242 OJCVUAOGUODIEM-UHFFFAOYSA-N 291.328 2.155 10 20 CECD CCOc1ccc(CN2[C@H]3CC[C@H]2COC3)c(O)c1 839179772 POPWRAYFXBOENF-STQMWFEESA-N 263.337 2.154 10 20 CECD CC(C)[C@H]1C[C@H](C(=O)NCCc2ccc(N)cc2)CCO1 911783030 OQXVKJHMGUUCLW-GDBMZVCRSA-N 290.407 2.379 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1C[C@H]2CC(=O)[C@@H]1C2 846476885 PKUZYRRPOIWDKX-AXTRIDKLSA-N 293.750 2.277 10 20 CECD Cc1ccccc1C(=O)OCC(=O)c1ccc(O)c(O)c1 916590329 ONNZJTHPIBBNCH-UHFFFAOYSA-N 286.283 2.446 10 20 CECD CC[C@@H](NC[C@@H]1CCCNC1=O)c1ccc(C)cc1O 840825805 MOTWYCXWAWUPDL-GXTWGEPZSA-N 276.380 2.268 10 20 CECD COc1cc(N(C)C[C@@H]2CCOC2)cc(OC)c1OC 741799326 YVUAHVSCZPJFKG-NSHDSACASA-N 281.352 2.185 10 20 CECD C[C@H](C(=O)N[C@H](C)c1ccccc1O)c1cnccn1 913763524 JEUUMVPRJGILAK-WDEREUQCSA-N 271.320 2.163 10 20 CECD Cc1cc(O)c(CN2CC(=O)N[C@H](C)C2)cc1C(C)C 840134942 VWPDLKGXUSHQRX-GFCCVEGCSA-N 276.380 2.144 10 20 CECD CN(C)c1ccc(OCc2nc(C3CC3)nn2C)cc1 842650317 MVHVIUFWNWUGCT-UHFFFAOYSA-N 272.352 2.338 10 20 CECD COc1cccc([C@H](C)NC[C@H](O)C(C)C)c1O 846145201 NFAHWWSKNLDSKA-JQWIXIFHSA-N 253.342 2.068 10 20 CECD CCCC[C@@H](COC)NC(=O)NCCc1ccc(N)cc1 841827714 CJJLBFIQKRYPIA-HNNXBMFYSA-N 293.411 2.316 10 20 CECD CN(C)c1ccc([C@@H]2NC3(CCCC3)C(=O)N2C)cc1 742438318 ANTZOOPZWVWKGR-CQSZACIVSA-N 273.380 2.126 10 20 CECD NC[C@@H]1CC[C@@H](NCc2cc(Cl)cc(F)c2O)C1 841084654 MNQSMHHSVMEDJH-LDYMZIIASA-N 272.751 2.402 10 20 CECD COC/C(C)=C/C(=O)NCc1ccc2c(c1)CCCN2C 844356974 JYVLCUDTEXHFOY-UKTHLTGXSA-N 288.391 2.278 10 20 CECD O=C(O)c1cnc(NCCCSc2nccs2)nc1 844210974 CLJQKYDBXZJDKJ-UHFFFAOYSA-N 296.377 2.226 10 20 CECD CN(CC[N+](=O)[O-])Cc1ccc(N2CCCCC2)cc1 929185275 RSUNPNXFDSPMLC-UHFFFAOYSA-N 277.368 2.385 10 20 CECD COCC[C@](C)(O)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756583611 CIMWWDOKVZLHDL-SIVJFFJCSA-N 297.370 2.457 10 20 CECD COc1cccc([C@@H](C)NC[C@H](CO)CC2CC2)c1O 850546410 LRXZEBHZRGDWHP-DGCLKSJQSA-N 279.380 2.460 10 20 CECD Cc1cc(CCC(=O)NCc2ccc(N(C)C)cc2)no1 929406799 YJFXZTHOFWIJLD-UHFFFAOYSA-N 287.363 2.298 10 20 CECD Cc1cc(C(=O)NCc2cc(Cl)ccc2O)nn1C 857547724 REORBMJREULORA-UHFFFAOYSA-N 279.727 2.018 10 20 CECD CCOC(=O)/C=C/CN[C@H](C)c1cc(OC)ccc1O 930215770 ZENHOVRMUYWWGF-MVIFTORASA-N 279.336 2.171 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1c(O)ccc2ccncc12 765716357 GMLNRBPVUYPTCX-OAHLLOKOSA-N 299.374 2.041 10 20 CECD CN(Cc1cn[nH]c1)Cc1cc(Cl)ccc1O 769425632 RAESPUDNQNYRNG-UHFFFAOYSA-N 251.717 2.401 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@H]2CCC(=O)[C@@H](C)C2)c1 862757913 IDRQCFWBGHNGGW-NWDGAFQWSA-N 275.348 2.322 10 20 CECD Cc1cccc(O)c1CNCCN(C)CC(F)(F)F 877026518 BRJJPPROHGOEOA-UHFFFAOYSA-N 276.302 2.284 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCC[C@@]1(C)N)c1ccccc1O 870988474 QPFKKVBWPMONMD-AXAPSJFSSA-N 276.380 2.477 10 20 CECD C[C@@H](NC(=O)C[C@H]1CCCO1)c1ccc(N(C)C)cc1 773011285 FNIDXVSMICXDFR-IUODEOHRSA-N 276.380 2.499 10 20 CECD CCN(CC)c1ccc(CN2CC(OCCOC)C2)cc1 779431853 FXKKEQJUIJEXNJ-UHFFFAOYSA-N 292.423 2.380 10 20 CECD Cc1cccc(O)c1CN1CCO[C@@H]([C@@H]2CCCO2)C1 876805659 DSHRYPBTZZAKPL-JKSUJKDBSA-N 277.364 2.080 10 20 CECD CC(=O)N[C@H](CCC(C)C)C(=O)N(C)c1ccc(N)cc1 877074189 BLNXYCNWQHYCCI-OAHLLOKOSA-N 291.395 2.173 10 20 CECD Cc1cc(NS(=O)(=O)N2CC[C@@H](C)C2)c(C)c(C)c1O 775291908 QVFJAAQSXSDIJN-SECBINFHSA-N 298.408 2.316 10 20 CECD COc1ccc(CN2CCSC[C@@H]2C)c(O)c1OC 892046714 WRLAZUQCZBXITI-JTQLQIEISA-N 283.393 2.347 10 20 CECD CCCC[C@@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423480 UDCBYDGHVDVXDQ-CQSZACIVSA-N 264.369 2.486 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)N2CCC(=O)CC2)s1 1537962847 GINVTBCCVJAVIH-UHFFFAOYSA-N 264.310 2.364 10 20 CECD CCOC(=O)[C@@H](NCc1ccc(N(C)C)c(F)c1)C1CC1 1255649440 PYDFGJKASHOBBB-HNNXBMFYSA-N 294.370 2.323 10 20 CECD CCc1cccc(CN[C@@H]2CCCN(CC)C2=O)c1O 722354297 RIWFUGVCLCAUDQ-CQSZACIVSA-N 276.380 2.055 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCO3)CCN1C 90720251 FNDIGJYMDPSVHM-DOMZBBRYSA-N 260.381 2.194 10 20 CECD CN(C)CCCC(C)(C)NC(=O)NCc1ccc(N)cc1 1335737369 OCNMLKSOLCOUEG-UHFFFAOYSA-N 292.427 2.188 10 20 CECD CC(=O)C1(NC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 1332149637 UVSGUXFPJLLPOO-UHFFFAOYSA-N 297.358 2.341 10 20 CECD COCCN(CC(=O)O)Cc1ccc2ccccc2c1O 1606881588 AASLHTDEXHZBFM-UHFFFAOYSA-N 289.331 2.078 10 20 CECD C[C@@H]1OCC[C@H]1COc1ccc(N(C)C)c(C(=O)O)c1 1594646480 XYLPIYAHFDHTEK-QWRGUYRKSA-N 279.336 2.255 10 20 CECD CCOc1cccc(CN2C[C@@H](C)[C@H](CC(=O)O)C2)c1O 1597156147 YBYMGSXLRYLWEW-DGCLKSJQSA-N 293.363 2.334 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@](C)(C(=O)O)C2)cc1 1777039944 HBHOLAPMQGKNNI-CJNGLKHVSA-N 276.380 2.486 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2CCCOC2)c1 38043966 VUWDCXPWQNHNLH-NWDGAFQWSA-N 265.353 2.478 10 20 CECD CCOC[C@@H](C)NCc1ccc(N2CCOCC2)cc1 44690214 IEFNKMDOBZOJOA-CQSZACIVSA-N 278.396 2.038 10 20 CECD CN1CCC(CN(C)Cc2cc(F)cc(F)c2O)CC1 708432896 FYRMTVCDSNGPCX-UHFFFAOYSA-N 284.350 2.444 10 20 CECD CO[C@H](C)CC(=O)NCc1ccc(N(C)C)cc1C 115281391 MGJNAZBIJVKGAO-GFCCVEGCSA-N 264.369 2.102 10 20 CECD CNC(=O)NCc1ccc(N2CCC(C)CC2)cc1 171744785 ZHVSPQCWOMERFW-UHFFFAOYSA-N 261.369 2.352 10 20 CECD CCc1cc(NCc2cccc(OC)c2O)n2ncnc2n1 301156348 QFXDDBVDFXJQKC-UHFFFAOYSA-N 299.334 2.013 10 20 CECD Oc1ccccc1CNC[C@H](O)c1ccccc1F 60358335 GETZZGBUQGSYET-HNNXBMFYSA-N 261.296 2.355 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Cc2cccnc2)c1 171870310 XEZOHUBMGGECEV-LLVKDONJSA-N 286.331 2.216 10 20 CECD COc1cccc(CNC(=O)NC[C@H]2CCCS2)c1O 127147218 MGZRKZKQFCCCJP-LLVKDONJSA-N 296.392 2.096 10 20 CECD CNC(=O)[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 180219679 CFRKFZZMEGCYQO-NSHDSACASA-N 282.771 2.004 10 20 CECD C[C@H](CN1CCOCC1)N[C@H](C)c1cc(Cl)ccc1O 185028692 JAUQQINCCNMSAX-VXGBXAGGSA-N 298.814 2.417 10 20 CECD Cc1ccc(C(=O)N2CC(C)(C)OC(C)(C)C2)c(O)c1O 189577071 ACYCKUKBSSAULP-UHFFFAOYSA-N 293.363 2.436 10 20 CECD CCOc1ccc(O)c(CNCCOCC(F)F)c1 190896901 WOZXNQIVMGWKMZ-UHFFFAOYSA-N 275.295 2.162 10 20 CECD COc1ccc(O)c(CNC2CCSCC2)c1 134650467 BPSYZKHWILKASG-UHFFFAOYSA-N 253.367 2.386 10 20 CECD C[C@@H](CN1CCCCC1)NC(=O)Nc1ccc(N)cc1 49502608 YBSRJSOHYJHVFV-LBPRGKRZSA-N 276.384 2.265 10 20 CECD CCNC(=O)[C@H](C)N[C@H](C)c1ccc(N(C)CC)cc1 268739540 RETFCABGMJFRJS-OLZOCXBDSA-N 277.412 2.318 10 20 CECD C[C@H](N[C@@H]1C[C@@H](O)C1(C)C)c1ccc(F)c(F)c1O 276986867 WUASNRXCRZVGJP-WHGOUJPWSA-N 271.307 2.480 10 20 CECD COC(OC)c1ccc(C(=O)NCc2ccccc2O)o1 287489396 XMFSLPSQHCYTJN-UHFFFAOYSA-N 291.303 2.207 10 20 CECD COCCN(CCN(C)C)Cc1cc(C)c(C)cc1O 289475271 PWWSKGHXCPECOP-UHFFFAOYSA-N 280.412 2.019 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2ccc(C)cc2)n1C 289013176 XMBYUQNMFAYLPH-UHFFFAOYSA-N 289.360 2.041 10 20 CECD CC[C@H](NC[C@@H](O)CN1CCCC1)c1ccc(C)cc1O 280117729 OCLLFHRNMZWVNN-ZBFHGGJFSA-N 292.423 2.198 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCNC(C)C)c1 817952595 GDPDUNVCVLNTMZ-GFCCVEGCSA-N 266.385 2.440 10 20 CECD COc1cccc(O)c1CN1CCC2(CC1)OCCCO2 816645583 BHDBZEXWQBDYOB-UHFFFAOYSA-N 293.363 2.130 10 20 CECD C[C@@H](NC[C@@H]1CCCCN1)c1cc(F)cc(F)c1O 817948928 FLVNHHVVQQNSLP-KOLCDFICSA-N 270.323 2.463 10 20 CECD C[C@@H](NC(=O)/C=C\[C@H]1CCOC1)c1ccccc1O 827952566 XRGJCYUNOGJJFD-PBWNMSGQSA-N 261.321 2.162 10 20 CECD COC(=O)c1cnc(SCc2noc(C3CC3)n2)s1 829683764 BNXDDHKTGXZEMG-UHFFFAOYSA-N 297.361 2.482 10 20 CECD CC[C@H](CO)N(C)Cc1c(O)ccc(Cl)c1F 824534028 XULZLXOAVMNQHG-MRVPVSSYSA-N 261.724 2.387 10 20 CECD CCOc1cccc(CNCc2ncccc2OC)c1O 825250349 YWCOAGAGNLIAPP-UHFFFAOYSA-N 288.347 2.484 10 20 CECD CCN1CCC[C@@H](N[C@@H](C)c2cc(OC)ccc2O)C1=O 903392759 YKVBDQDVMPIHQC-SMDDNHRTSA-N 292.379 2.062 10 20 CECD COC1(CNC(=O)c2cc(O)cs2)CCCC1 832958138 YASMELOTCJMIIU-UHFFFAOYSA-N 255.339 2.143 10 20 CECD CCC(=O)[C@@H]1CCCCN1C(=O)c1cc(O)cs1 831454571 RHFQGRSPUIMCGR-JTQLQIEISA-N 267.350 2.428 10 20 CECD Cc1cnc(CCNCc2c(O)cccc2Cl)cn1 835062720 WRNJUVKGBSSVII-UHFFFAOYSA-N 277.755 2.476 10 20 CECD CC(C)(C)c1noc(COC(=O)c2cc(O)cs2)n1 731910910 WKZDHXGJDICIJU-UHFFFAOYSA-N 282.321 2.491 10 20 CECD O=C(CCNC(=O)c1cc(O)cs1)Nc1ccccc1 733366480 UXKAAIXAOMARET-UHFFFAOYSA-N 290.344 2.212 10 20 CECD Oc1ccccc1CNC1CCN(C[C@H]2CCCO2)CC1 733331052 YJSJATSVFXUWSH-MRXNPFEDSA-N 290.407 2.125 10 20 CECD CCON1CCC(CC(=O)NCc2ccccc2O)CC1 830526078 CWBVIHHJSSRXCJ-UHFFFAOYSA-N 292.379 2.062 10 20 CECD Oc1ccc(Cl)cc1CN[C@@H]1CCN(CC(F)F)C1 841894167 PBHBPEGIVXXJFZ-LLVKDONJSA-N 290.741 2.475 10 20 CECD CC(C)[C@H](N)CNCc1cc(Cl)cc([N+](=O)[O-])c1O 841028868 JMGWMVAHNGLHDZ-SNVBAGLBSA-N 287.747 2.027 10 20 CECD CCCN(CCCN(C)C)C(=O)Nc1ccc(N)cc1 841297770 UXLDIRFNZGTEKE-UHFFFAOYSA-N 278.400 2.464 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCCNC1CC1 841928884 DPOGDAJGOCUQHU-UHFFFAOYSA-N 291.395 2.066 10 20 CECD CCNC(=O)C(C)(C)CNCc1cccc(CC)c1O 848899617 QRIOFYGJYLTMNJ-UHFFFAOYSA-N 278.396 2.207 10 20 CECD CN[C@@H]1CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843048701 QSACQUHRQBDCES-LLVKDONJSA-N 299.758 2.138 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCNC1CC1 848397778 LKDBWYIHESZGCL-UHFFFAOYSA-N 276.380 2.273 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@](C)(O)C1CC1 840933955 KCYIOORQMWGWJT-MRXNPFEDSA-N 262.397 2.312 10 20 CECD O=C(Cc1ccc2c(c1)CCO2)NCc1ccccc1O 748349990 OMUHGAGNYZXWFK-UHFFFAOYSA-N 283.327 2.186 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)c2nccc(N)n2)c1 846844820 PXTYUHVOILHRTJ-UWVGGRQHSA-N 288.351 2.185 10 20 CECD O=C1CC[C@@H](C(=O)NCc2c(O)ccc3c2CCCC3)C1 843831258 ODWRINGFQVTEHK-GFCCVEGCSA-N 287.359 2.256 10 20 CECD C[C@]1(C(=O)O)CCC[C@H]1NCc1ccc2c(c1)CCO2 756388565 PHTGUDLROVSNNV-ZBFHGGJFSA-N 275.348 2.355 10 20 CECD O=C(Cc1ncccc1F)NCc1cc(Cl)ccc1O 857548153 GGXONMVJCMIVEO-UHFFFAOYSA-N 294.713 2.439 10 20 CECD CC[C@@H](O)CN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 850530774 CNPXLJGHJUHRLR-TZMCWYRMSA-N 296.386 2.084 10 20 CECD C[C@@H](NC(=O)NC(CF)CF)c1ccccc1O 868662252 LCJAIXMJMWXRCZ-MRVPVSSYSA-N 258.268 2.060 10 20 CECD CC[C@@H]1CC[C@H](C(=O)NCc2cc(C)ccc2O)O1 862758137 PXDRVVBPQNCBMF-TZMCWYRMSA-N 263.337 2.274 10 20 CECD CC1=C(C(=O)NCc2ccccc2O)CCN1C(C)C 934935936 PSMOHECPSRKHKX-UHFFFAOYSA-N 274.364 2.397 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2ncc(C)s2)c1 862757920 IGTJQGFXKCILON-UHFFFAOYSA-N 276.361 2.324 10 20 CECD CCCn1cc(CNCc2ccc(N(C)C)cc2C)nn1 865466113 QIVNHVUOBFTNHF-UHFFFAOYSA-N 287.411 2.352 10 20 CECD CN(C)c1cc(F)c(CN2CCOCC23CC3)cc1F 862358146 WIAVRZZWNDNRDX-UHFFFAOYSA-N 282.334 2.396 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](n2ccnc2)C1 769310599 IVOAOOJAUIEOJZ-ZDUSSCGKSA-N 287.363 2.434 10 20 CECD C[C@@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)[C@@H]1CO 862336872 MXJLPVKBOOVBDL-MEBBXXQBSA-N 284.350 2.234 10 20 CECD Cc1cccc(O)c1CNC1CCN([C@@H]2CCOC2)CC1 877636212 QGMWIBPERBQZAH-OAHLLOKOSA-N 290.407 2.044 10 20 CECD CCOC(=O)C1(C)CC(NCc2ccc(OC)cc2O)C1 877494561 YHCWXNWYTBAGRS-UHFFFAOYSA-N 293.363 2.222 10 20 CECD CCOC(=O)[C@H](NCc1ccc(C)cc1O)C1CC1 1119245778 UBHRXVAYGCUTGJ-CQSZACIVSA-N 263.337 2.132 10 20 CECD C[C@@H](NC(=O)Nc1cccnn1)c1ccc(N(C)C)cc1 775667894 HSQKMSMLJZRRMB-LLVKDONJSA-N 285.351 2.425 10 20 CECD CCC[C@H](O)CC(=O)N[C@H](C)c1ccc(N(C)C)cc1 775404370 NENOATFONHYVNT-DOMZBBRYSA-N 278.396 2.481 10 20 CECD Cc1ccc(CN(CCCO)CC(F)(F)F)c(O)c1 876685692 ULNJZPDNDQGOQJ-UHFFFAOYSA-N 277.286 2.447 10 20 CECD CCn1ncc(C(=O)NCCc2ccc(N)cc2)c1C1CC1 884028226 AVPQPERRQIDSFN-UHFFFAOYSA-N 298.390 2.335 10 20 CECD COc1nc(C)ccc1C(=O)NCc1ccc(N(C)C)cc1 776754120 ZFURRYDPVVVZFQ-UHFFFAOYSA-N 299.374 2.395 10 20 CECD CCC1(O)CCC(NC(=O)c2ccc(C)c(O)c2O)CC1 781012869 HHGVYOZXUVLTFT-UHFFFAOYSA-N 293.363 2.220 10 20 CECD CC[C@](C)(CCO)NCc1ccc(OC)c(OC)c1O 893120171 VQZSANAEJITRIX-OAHLLOKOSA-N 283.368 2.050 10 20 CECD C[C@H]1CCN(Cc2c(O)ccc(Cl)c2F)[C@H]1CO 792181184 XPCJLWNDQXWDIH-KWQFWETISA-N 273.735 2.387 10 20 CECD COc1cccc(CN[C@]2(C)CCCOC2)c1O 221362436 JNBLRGLOUZJPJE-CQSZACIVSA-N 251.326 2.060 10 20 CECD CC[C@@H](CCO)CN[C@H](C)c1cc(OC)ccc1O 94948705 MPQOIBJNDFCXKU-NEPJUHHUSA-N 267.369 2.460 10 20 CECD O=C(NCc1cccc(O)c1O)[C@@H]1[C@H]2Cc3ccccc3[C@@H]21 1263896445 ZJWFZMDJNFPTMU-CWRNSKLLSA-N 295.338 2.300 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)[C@H]1C[C@H]1F 1262801104 JDRXCWAYPNFPFD-TUKIKUTGSA-N 278.371 2.466 10 20 CECD Cc1cc(CN2CC[C@@](F)(C(=O)O)C2)ccc1N(C)C 1607638121 NPNGVPREWZDTNB-HNNXBMFYSA-N 280.343 2.060 10 20 CECD CCOc1cccc(CN2C[C@@H](C)[C@](C)(C(=O)O)C2)c1O 1605705484 XSMOOAHNYKQGKY-BDJLRTHQSA-N 293.363 2.334 10 20 CECD C[C@@H]1CCN(Cc2cc(F)cc(F)c2O)[C@H](C(=O)O)C1 1594423912 KYSRBLWYGWSLGN-PELKAZGASA-N 285.290 2.356 10 20 CECD COc1cc(C)cc(CN2CC[C@](C)(C(=O)O)C2)c1O 1599391567 ACZAEPMWZLWEEQ-HNNXBMFYSA-N 279.336 2.006 10 20 CECD CN(Cc1cncc(C(=O)O)c1)c1ccc2c(c1)OCO2 1598532872 JLFBNVZTBLODLE-UHFFFAOYSA-N 286.287 2.145 10 20 CECD CCCOc1ccc(CN[C@](C)(COC)C(=O)O)cc1C 1776818763 VJSWRAPMPKNORM-MRXNPFEDSA-N 295.379 2.363 10 20 CECD CN(Cc1ccc(C(=O)O)o1)c1ccc2c(c1)OCCO2 1777070011 RAPXZERMTUJGDY-UHFFFAOYSA-N 289.287 2.385 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCCO1 161146917 GHNNYZWUAADGMW-HNNXBMFYSA-N 276.380 2.280 10 20 CECD CCCNC(=O)CN[C@H](CC)c1ccc(N(C)C)cc1 158329272 FGVJEZUQCZJKQS-OAHLLOKOSA-N 277.412 2.320 10 20 CECD COc1cc(CN2C[C@@H](C)OC[C@@H]2C)c(O)cc1C 159766383 NBELWAXYRWEWAJ-NWDGAFQWSA-N 265.353 2.318 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@@H](C(=O)O)C1 846279447 AFEAYCMOYVVALN-IUODEOHRSA-N 276.380 2.438 10 20 CECD CC(C)NC(=O)CCNCc1ccc2c(c1)CCCO2 921526465 SIFNCNSSBSDNAY-UHFFFAOYSA-N 276.380 2.016 10 20 CECD CCc1nnsc1C(=O)N[C@H](C)c1ccccc1O 827923610 VSDGLPUYHUVULZ-MRVPVSSYSA-N 277.349 2.297 10 20 CECD CN(C)c1ccc(CN2CCC(C)(C)[C@@H]2C(=O)O)cc1 1777039419 DAXHZEXDZHLSLZ-AWEZNQCLSA-N 276.380 2.438 10 20 CECD CCOc1cccc(CN2CCC([C@@H](C)N)CC2)c1O 110643910 FYTDQKFMJGGSRS-GFCCVEGCSA-N 278.396 2.350 10 20 CECD O=C(NCCc1ccc(F)cc1)c1cccc(O)c1O 126201349 LGYNHOYUSHQRTO-UHFFFAOYSA-N 275.279 2.209 10 20 CECD Oc1cc2c(cc1CN1C[C@@H]3CCC[C@H]3C1)OCO2 147937073 VAXNJMZMWCSZGM-QWRGUYRKSA-N 261.321 2.353 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)CN2CCCC2=O)c(O)c1 37782955 JDAXDSIGEBLNMK-CHWSQXEVSA-N 276.380 2.362 10 20 CECD CC[C@@H](NCCc1n[nH]c(C)n1)c1ccccc1O 274764013 KSIRREFDLZFFON-GFCCVEGCSA-N 260.341 2.102 10 20 CECD CCN1CCC[C@@H]1CN[C@H]1CCc2cccc(O)c21 296095305 UBHLPRDTZSMVCI-KGLIPLIRSA-N 260.381 2.453 10 20 CECD CN(C(=O)Cn1cc(C2CC2)cn1)c1ccc(N)cc1 402198403 WORWVDLSFHNYSZ-UHFFFAOYSA-N 270.336 2.006 10 20 CECD 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10 20 CECD CC[C@@H](NCc1cc(F)ccc1O)[C@H](O)C(C)C 840967052 CSMABXLGPBWROL-TZMCWYRMSA-N 255.333 2.416 10 20 CECD CCc1cccc(CN2CCC[C@H]2CC(=O)OC)c1O 848888407 SXPXGFNSDNBNLO-AWEZNQCLSA-N 277.364 2.482 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CS[C@@H](C)C2)c(O)c1 840413293 GQBVRTYWPVSFRV-ONGXEEELSA-N 296.392 2.094 10 20 CECD CCNC(=O)[C@H](C)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756355140 JMQLDYWDMHFPPD-QXEWZRGKSA-N 280.343 2.194 10 20 CECD CC[C@H](NCCN1CC[C@@H](O)C1)c1cc(Cl)ccc1O 858549652 XZDGYTDVTUEYTG-OCCSQVGLSA-N 298.814 2.153 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2C[C@@H](O)C2)c2c(O)ccc(F)c21 858545809 VHCGOZYDJTZSCO-SVDPJWKOSA-N 265.328 2.440 10 20 CECD C[C@@H]1C[C@H](NCC(=O)NCC2CC2)c2c(O)ccc(F)c21 757630975 AZUVSIXVRSFAPJ-SKDRFNHKSA-N 292.354 2.195 10 20 CECD Oc1cc2c(cc1CN1CCCC3(CC3)C1)[C@@H](O)CO2 769798600 NMAYDBIXCAPVHS-AWEZNQCLSA-N 275.348 2.194 10 20 CECD Cc1ccn(C[C@H](C)C(=O)Nc2ccc(N)cc2)n1 867965981 KRXLWDPORMQWDJ-JTQLQIEISA-N 258.325 2.049 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1cn(C)nn1 766267307 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XHXHDYWFNLUPOC-UHFFFAOYSA-N 256.664 2.463 10 20 CECD CCCNC(=S)N[C@H](C)c1cc(OC)ccc1O 728793211 QTRPJKIWRBUXQE-SECBINFHSA-N 268.382 2.336 10 20 CECD C[C@H]1C[C@H](C)CN(C(=O)COC(=O)c2cc(O)cs2)C1 731910759 BVAAVTRBXRFYDR-UWVGGRQHSA-N 297.376 2.115 10 20 CECD CCOc1ccc(O)c(CNC[C@@]2(C)CCOC2)c1 733328072 RSYVCDCDPIOCIX-OAHLLOKOSA-N 265.353 2.307 10 20 CECD C[C@H](N)C1CCN(Cc2ccc(N(C)C)c(F)c2)CC1 843052532 NBZDGSDMIGPOKU-LBPRGKRZSA-N 279.403 2.451 10 20 CECD O=C1CC[C@@H](CN(Cc2ccccc2O)C2CCCC2)N1 844295409 AVTWCFPRUQEYCY-AWEZNQCLSA-N 288.391 2.415 10 20 CECD NC[C@H]1CC[C@H](NCc2c(O)ccc(Cl)c2F)C1 841085223 XBVLPBPKDYZOFL-IUCAKERBSA-N 272.751 2.402 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NC[C@@H](N)CC 842009109 XKRBGMRFHIQFDQ-AWEZNQCLSA-N 293.411 2.441 10 20 CECD COc1cccc(CNC(=O)[C@@H]2Cc3ccccc32)c1O 743331909 FCCKZXUBRRPHSN-CQSZACIVSA-N 283.327 2.357 10 20 CECD Cc1cc(CN2C[C@@H]3CCNC[C@@H]3C2)ccc1N(C)C 923516015 QSRGKQZOVWZWMO-JKSUJKDBSA-N 273.424 2.102 10 20 CECD COc1cc(Cl)cc(CNCCCNC2CC2)c1O 841094642 ZTESZBXUMJFMJU-UHFFFAOYSA-N 284.787 2.286 10 20 CECD Oc1c(F)cccc1CN1CCC[C@@H]([C@H]2CCNC2)C1 843125438 WNVLESYWUYWOOI-QWHCGFSZSA-N 278.371 2.353 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)c2ccccn2)c1 851900104 PDDGCEFXMAJQKC-ZBEGNZNMSA-N 288.347 2.180 10 20 CECD CO[C@@H](C)CNCc1cc(F)c(N(C)C)cc1F 858189443 RJPFFTLALDDFFD-VIFPVBQESA-N 258.312 2.155 10 20 CECD O=C(COC(=O)[C@@]12CCC[C@@H]1C2)c1ccc(O)c(O)c1 924430785 VDASPOOHFLBDHE-MEBBXXQBSA-N 276.288 2.014 10 20 CECD COc1cccc(CN[C@@H](C)C[C@H]2CCOC2)c1O 759836819 KNKHPZKQBHZLJQ-NWDGAFQWSA-N 265.353 2.306 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@H](O)COCC2CC2)c1 756511935 SLIALROZVLCBKW-JSGCOSHPSA-N 279.380 2.139 10 20 CECD CCC(=O)[C@@H](C)OC(=O)/C=C\c1ccc(O)c(O)c1 759596204 OBNDEUPVSOUBOW-WILPJHFFSA-N 264.277 2.022 10 20 CECD C[C@H](NCCc1ccnn1C)c1cc(F)cc(F)c1O 762778804 PYOYZYGXPGYPGQ-VIFPVBQESA-N 281.306 2.297 10 20 CECD Cc1cccc(O)c1CNCC(C)(C)[C@]1(O)CCCOC1 877636835 BUJWQPWVGZHANG-KRWDZBQOSA-N 293.407 2.358 10 20 CECD CN(C(=O)c1ocnc1C1CC1)c1ccc(N)cc1 877075040 YYSGIJQLJZFAOL-UHFFFAOYSA-N 257.293 2.411 10 20 CECD C[C@@H]1C[C@H](CNC(=O)NCc2ccccc2O)CCO1 770818845 JDWDNSVJZFUPFZ-VXGBXAGGSA-N 278.352 2.007 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1CCCC(F)F 1119624624 NCVJVOYDDMXGQJ-UHFFFAOYSA-N 298.289 2.202 10 20 CECD COc1ccc(CN[C@@H](C)[C@H]2CCN(C(C)=O)C2)cc1C 1047655607 AVYBKTVIAWWULQ-BBRMVZONSA-N 290.407 2.350 10 20 CECD CC[C@H](C)[C@](C)(O)CNC(=O)/C=C/c1ccc(O)c(O)c1 779525845 SUIPCFBZOVHNEM-WFTDUIAPSA-N 293.363 2.024 10 20 CECD CNC(=O)C1(NCc2ccc(N(C)C)c(F)c2)CCCC1 779176072 JEQMOISIYDGWHG-UHFFFAOYSA-N 293.386 2.040 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1CCc2ccccc2C1 789942819 QRCOPVFJEOLMGV-UHFFFAOYSA-N 287.290 2.435 10 20 CECD COc1ccc(CN2CC[C@@H](OC)C[C@H]2C)c(O)c1OC 894254761 UWGSYEBTOWEWKG-DGCLKSJQSA-N 295.379 2.409 10 20 CECD CCn1nccc1CNCc1ccc2c(c1)CCO2 753850090 YSXRBENUXMFMQY-UHFFFAOYSA-N 257.337 2.128 10 20 CECD O=C(NCc1ccccc1O)Nc1cccc2c1OCO2 782649622 AWCYSRLFKVOFAC-UHFFFAOYSA-N 286.287 2.443 10 20 CECD C[C@H](NCC1([S@](C)=O)CC1)c1cc(F)cc(F)c1O 799727415 JNQALMCEKXEURQ-RLBGWGEZSA-N 289.347 2.232 10 20 CECD C[C@@H]1CCCN1c1nnc(-c2sccc2O)n1C 1339452581 ARSLLMLHLRTACJ-MRVPVSSYSA-N 264.354 2.238 10 20 CECD CCOc1cccc(CN2CCC[C@H]2CC(=O)O)c1O 86791889 TWCUQTUJQHUSHU-LBPRGKRZSA-N 279.336 2.230 10 20 CECD CCCN1CCC[C@H](C(=O)NCCc2ccc(N)cc2)C1 1356626530 CRVHRQMNXITRKE-HNNXBMFYSA-N 289.423 2.050 10 20 CECD O=C(O)Cc1cccc(NCc2cccc(F)c2O)n1 1608786931 BSLOIWJTSQCKMF-UHFFFAOYSA-N 276.267 2.166 10 20 CECD Oc1c(CN2CC[C@H]3CNC[C@H]32)ccc2ccccc12 1580886053 WAXHVWOQXGPYEC-XJKSGUPXSA-N 268.360 2.339 10 20 CECD Nc1ccc(CN[C@H]2CCN(c3ccccc3)C2=O)cc1 1580445791 WDNFFBGXRHGIBN-INIZCTEOSA-N 281.359 2.164 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCN3CCC[C@H]3C2)c1 250379532 KPYGUAVDDCEKSU-KGLIPLIRSA-N 276.380 2.117 10 20 CECD COc1ccc(N2CCC(NC[C@@H]3CCCO3)CC2)cc1 153098311 WEQXMFIHPCPXJM-KRWDZBQOSA-N 290.407 2.433 10 20 CECD CC[C@@H](N[C@H]1CCc2nc(C)nn2C1)c1ccccc1O 155587309 VHMMPXHOLIFALG-GXTWGEPZSA-N 286.379 2.348 10 20 CECD C[C@H](CO)N[C@H](C)c1cc(Br)ccc1O 134913582 PBUYEHVRCDLXQT-HTQZYQBOSA-N 274.158 2.186 10 20 CECD C[C@H]1CSCCN1Cc1cc2c(cc1O)OCO2 172515453 CNDKJTAEYWKIIA-VIFPVBQESA-N 267.350 2.058 10 20 CECD Cc1nc2n(n1)C[C@H](NCc1c(O)cccc1Cl)CC2 113333715 VBTALGYRWRSELE-SNVBAGLBSA-N 292.770 2.050 10 20 CECD C[C@@H](NCCCCN1CCC[C@@H]1CO)c1ccccc1O 183506390 ZCZQCRCPATTXBT-HUUCEWRRSA-N 292.423 2.280 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](COC)O[C@H](C)C2)c1 188391439 TYBFXEYQZACIBL-DOMZBBRYSA-N 295.379 2.027 10 20 CECD CC1CCN(CCCNC(=O)Cc2ccc(N)cc2)CC1 40316822 YQFDLRUOXHEROB-UHFFFAOYSA-N 289.423 2.050 10 20 CECD CC[C@@H](CO)NCc1cc(Br)cc(C)c1O 132569635 ANSAOFMFDYUWRJ-NSHDSACASA-N 288.185 2.324 10 20 CECD CO[C@H](C)[C@@H](C)NCc1ccc(N(C)C)c(F)c1 269057617 WYMMUZPULDSVRQ-GHMZBOCLSA-N 254.349 2.405 10 20 CECD COc1cccc(CNc2nnc(C3CC3)o2)c1O 278345795 JIKLSYQMPGKTIZ-UHFFFAOYSA-N 261.281 2.273 10 20 CECD CCN(C[C@@H](O)CSC)c1ccc(OC)cc1 275488143 YELTVHCUSXSALX-GFCCVEGCSA-N 255.383 2.245 10 20 CECD CCN(Cc1nnc(C)n1C)c1ccc(OC)cc1 299377695 MUHJYJUNBZUMJV-UHFFFAOYSA-N 260.341 2.159 10 20 CECD CCN(Cc1cnn(C)c1)c1ccc(OC)c(OC)c1 299528482 DEIHKVXSIFRXPS-UHFFFAOYSA-N 275.352 2.464 10 20 CECD CCc1nc(CC(=O)NCc2ccc(N)cc2)cs1 297284685 UIYFMCWQZRTYJB-UHFFFAOYSA-N 275.377 2.147 10 20 CECD COCC1(NCc2ccc(N3CCOCC3)cc2)CCC1 393518365 MPOSXPZDVHHYKL-UHFFFAOYSA-N 290.407 2.182 10 20 CECD Cc1cnn([C@@H]2CCN(Cc3ccccc3O)C2)c1 290374992 ATDKUZCUZFPXAI-CQSZACIVSA-N 257.337 2.344 10 20 CECD CC(C)OCC[C@@H](O)CNCc1ccc(N(C)C)cc1 818941252 GOYSTOQNVWOBSE-MRXNPFEDSA-N 280.412 2.018 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(O)ccc1Cl 815835871 IIIBXBPHJRUOOS-UHFFFAOYSA-N 293.706 2.387 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cncc(O)c1 816822300 HBQYPVPQRNAOTK-UHFFFAOYSA-N 299.374 2.054 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCN1C1CC1)c1ccccc1O 827946297 CUVZPNGCSHACFB-BXUZGUMPSA-N 274.364 2.196 10 20 CECD CCc1nocc1CN(C)C(=O)c1cc(O)cs1 832894310 MBNWHWTYUYEYEL-UHFFFAOYSA-N 266.322 2.276 10 20 CECD Cn1c(=O)oc2ccc(NC(=O)c3cc(O)cs3)cc21 732281821 AJSVPINPQDSPOS-UHFFFAOYSA-N 290.300 2.151 10 20 CECD C[C@H](C(=O)OC(C)(C)C)C(=O)N(C)Cc1ccccc1O 840396495 PZMSOKFHPDJABY-NSHDSACASA-N 293.363 2.328 10 20 CECD Nc1ccc(CCNC(=O)c2cccc3c2CCOC3)cc1 911782723 LOASGDWHXZIECS-UHFFFAOYSA-N 296.370 2.314 10 20 CECD CC(C)n1ccc(CNC(=O)Nc2ccc(N)cc2)n1 841299883 JKJJVEJZBWGSFL-UHFFFAOYSA-N 273.340 2.368 10 20 CECD Cc1ccc(NC(=O)NCc2ccccc2O)nc1 752817791 YKFNTDVJJBOHFJ-UHFFFAOYSA-N 257.293 2.417 10 20 CECD CO[C@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)C1(C)C 753558366 REFGGVJRJVNEGC-KBPBESRZSA-N 292.379 2.347 10 20 CECD c1cc2c(cc1CN[C@H]1[C@H]3OC[C@H]4C[C@@H]1C[C@@H]43)CCO2 924899447 FUCIVZHYRFDJEQ-WDTWZTHCSA-N 271.360 2.135 10 20 CECD O=C(OCC(=O)C1CCCC1)c1cccc(O)c1O 758557536 JEVHKZNLJBVYFU-UHFFFAOYSA-N 264.277 2.014 10 20 CECD N[C@]12CCC[C@H]1CN(Cc1cccc(Cl)c1O)C2 857226323 KSYNLASUUPKLPG-FZMZJTMJSA-N 266.772 2.359 10 20 CECD CC[C@@H](NCCN1CC[C@H](O)C1)c1cccc(Cl)c1O 858602236 UNHMCWKLSXZDRE-SMDDNHRTSA-N 298.814 2.153 10 20 CECD CCOC(C)(C)C(=O)N[C@@H](C)c1cc(OC)ccc1O 866763875 IXPOEAZTBWESIO-JTQLQIEISA-N 281.352 2.393 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@]2(C)CCCOC2)c1 862757351 QFAAMUMEFICBJN-HNNXBMFYSA-N 263.337 2.134 10 20 CECD C[C@H]1C[C@@H](NC[C@H]2C[C@@H](N)C2)c2c(O)ccc(F)c21 873250448 HRGDXMLYXKFHRT-UXCLJVHYSA-N 264.344 2.407 10 20 CECD CC(=O)NCC1CCN(Cc2ccc(C)cc2O)CC1 876636343 UMGQIJFPUDUDON-UHFFFAOYSA-N 276.380 2.049 10 20 CECD Cc1ccc(CNCC(C)(C)C2(O)CCOCC2)c(O)c1 877593929 JUYZYLJVQRHTHQ-UHFFFAOYSA-N 293.407 2.358 10 20 CECD Cc1nonc1CN[C@@H](C)c1ccc(N(C)C)cc1 775834942 WLAILBFVAUUDEW-JTQLQIEISA-N 260.341 2.295 10 20 CECD C[C@@H](NC(=O)N[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccccc1O 875693966 BPXWEWATZSWOFK-FTUHBYGFSA-N 276.336 2.072 10 20 CECD CCN(C)c1ccc(CN(CC(N)=O)C2CCCC2)cc1 773747916 LAOBQGMRWKOHCD-UHFFFAOYSA-N 289.423 2.373 10 20 CECD CCN1CCN(Cc2ccc(N(C)CC)cc2)CC1 773733567 JRBDDKCEHVWVCF-UHFFFAOYSA-N 261.413 2.280 10 20 CECD CCOC(=O)N(C)CCCC(=O)Nc1ccc(N)cc1 884009354 UGFABUGFOAICKT-UHFFFAOYSA-N 279.340 2.076 10 20 CECD O=C(NCCc1ccccc1)c1c(F)ccc(O)c1O 789943416 YGQWYUKIDCVTGV-UHFFFAOYSA-N 275.279 2.209 10 20 CECD O=C(OCCN1CCc2ccccc21)c1cccc(O)c1O 795536531 TXKAWUJHFOXSLC-UHFFFAOYSA-N 299.326 2.317 10 20 CECD CSCCCN(C)Cc1cc2c(cc1O)OC[C@H]2O 799159166 DQPNDBXDJVSIST-CYBMUJFWSA-N 283.393 2.003 10 20 CECD CCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)[C@@H]1C 985839865 UZRQXQKYSIEXPQ-DZGCQCFKSA-N 290.407 2.493 10 20 CECD OC[C@@H](NCc1ccc(N2CCCC2)cc1)C1CC1 1318847915 QGRQGRLBAQUXAQ-MRXNPFEDSA-N 260.381 2.147 10 20 CECD CC(C)[C@@H](O)CNCc1c(O)cccc1Br 706871990 VENHIQYOMIZWBG-LBPRGKRZSA-N 288.185 2.261 10 20 CECD C[C@H]1[C@@H](C)SCCN1C(=O)NCc1ccc(N)cc1 1262603192 AGIXUUBCYTZYMM-WDEREUQCSA-N 279.409 2.304 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)Cc1nncn1C 1347221289 CHXDZHZBMYWMJA-UHFFFAOYSA-N 285.395 2.047 10 20 CECD C/C(=C\CN[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 1609503419 NRSBNNREVJBDSC-ZKQHCESOSA-N 262.353 2.434 10 20 CECD O=C(O)C[C@]1(NCc2cccc(Cl)c2O)CCCOC1 1608688457 IGZNGDNEEVMQFX-CQSZACIVSA-N 299.754 2.159 10 20 CECD CC/C=C\CN[C@H](C)c1cccc(-c2nn[nH]n2)c1O 1604120395 RBDRMVFUIIMLSE-UMCURTJPSA-N 273.340 2.189 10 20 CECD CCOc1ccc(CN2CC[C@H](C)C[C@@H]2C(=O)O)c(O)c1 1605690677 MZMVZILMRCFVOS-SMDDNHRTSA-N 293.363 2.476 10 20 CECD CCN1C(=O)/C(=C\c2cc(C(=O)O)co2)SC1=S 1610005297 CCLHDHYIKZSDAJ-XBXARRHUSA-N 283.330 2.199 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cn1ncn(C)c1=S 14213280 NEDMUGRTROLPAK-UHFFFAOYSA-N 291.424 2.107 10 20 CECD CC(C)COC[C@@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 151421349 CCKZNNJCKSZGOT-YOEHRIQHSA-N 294.439 2.437 10 20 CECD COc1cc(Cl)cc(CN(CC(=O)O)C2CCC2)c1O 848640349 QKYDEIRFWNUEKM-UHFFFAOYSA-N 299.754 2.493 10 20 CECD O=C(C[C@@H]1CC[C@@H]2C[C@H]12)NCCc1ccc(O)c(O)c1 827085519 UQSGXPIISGAOMA-AGIUHOORSA-N 275.348 2.193 10 20 CECD COc1ccc(CNC2(C(N)=O)CCCCC2)cc1C 930017085 GWILQKAGTDXMCW-UHFFFAOYSA-N 276.380 2.281 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCC(C)(C)C(N)=O 230670428 PCIWXUOFOLFWIN-WDEREUQCSA-N 276.380 2.350 10 20 CECD Cc1cc(CNCc2c(O)cccc2Cl)n(C)n1 283921945 LFBIYNUBXYGQHS-UHFFFAOYSA-N 265.744 2.377 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccnc1N(C)C 101645576 OBOCRHOPJCKDQQ-UHFFFAOYSA-N 285.347 2.125 10 20 CECD C[C@H]1SCCN(Cc2cc3c(cc2O)OCO3)[C@@H]1C 118381772 RZMFINMSBWQIDD-NXEZZACHSA-N 281.377 2.447 10 20 CECD COc1ccnc(C(=O)NCc2ccc(N(C)C)cc2C)c1 116027810 CSUMOCNNPZRALF-UHFFFAOYSA-N 299.374 2.395 10 20 CECD Cc1cc(O)c(CN2CCn3cnnc3C2)cc1C(C)C 111174703 PIODQLAHYAFEQH-UHFFFAOYSA-N 286.379 2.431 10 20 CECD CN(Cc1cnn(C)c1)Cc1c(O)cccc1Cl 119704497 WFHRYEBKCNWOTL-UHFFFAOYSA-N 265.744 2.411 10 20 CECD C[C@H](NCC(C)(C)CO)c1ccc(N(C)C)cc1 122043123 IJSFVNJAXMVMST-LBPRGKRZSA-N 250.386 2.422 10 20 CECD C[S@@](=O)CCNCc1cc(Cl)cc(Cl)c1O 124193050 GYEPZNJCZAGPHE-INIZCTEOSA-N 282.192 2.167 10 20 CECD C[C@@H](CC(=O)N(C)Cc1ccccc1O)[C@H]1CCCNC1 127232426 WTDCWRIYZYWCHL-KBPBESRZSA-N 290.407 2.376 10 20 CECD COc1ccc(N(C)CCCn2ccnc2)c(OC)c1 183060086 DAEQZYPJUNVBED-UHFFFAOYSA-N 275.352 2.427 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCc3[nH]ncc3C2)c1 186115115 ZVOMIEFVOHYSTR-JQWIXIFHSA-N 287.363 2.332 10 20 CECD O=C(Cc1cccc([N+](=O)[O-])c1)NCc1ccccc1O 135358669 XHUVSCRANIXGLJ-UHFFFAOYSA-N 286.287 2.159 10 20 CECD CC[C@@]1(C(=O)NCCCSc2nccs2)CCCN1 134499383 PWEJDBHTHOGJLO-ZDUSSCGKSA-N 299.465 2.274 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](N)c1ccccc1 193934372 DGWYUAVHISKGGM-KRWDZBQOSA-N 297.402 2.411 10 20 CECD CC(=O)N(C)C1CCN(Cc2cc(C)ccc2O)CC1 92538780 CSDJXPNYLUCTJC-UHFFFAOYSA-N 276.380 2.143 10 20 CECD COc1ccc(N2CCN(C(=O)C(C)C)CC2)c(OC)c1 242973916 HOPOYBROIWAJPU-UHFFFAOYSA-N 292.379 2.008 10 20 CECD Oc1cc2c(cc1CN1[C@H]3C=CC[C@H]1CC3)OCO2 366608776 TUQPGHDLWWHVON-RYUDHWBXSA-N 259.305 2.414 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C[C@](C)(O)C1CC1 270120211 MBMWPEVSHIRFIS-KRWDZBQOSA-N 290.407 2.262 10 20 CECD COCCN1CC[C@H](N[C@H](C)c2ccc(C)c(C)c2O)C1 273567922 JYPVYINEVGVRGN-CABCVRRESA-N 292.423 2.380 10 20 CECD O=C(NCc1cccc(Br)c1O)NC1CC1 278302871 HPTKRSCFSZGCBT-UHFFFAOYSA-N 285.141 2.116 10 20 CECD COc1ccc(N(C)C[C@H](O)CN(C)C2CC2)cc1Cl 289426173 XAGHQNMEFSYWFM-CYBMUJFWSA-N 298.814 2.240 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@H]1CC1(F)F 295391651 TWGXPIIZIPVOQV-SNVBAGLBSA-N 282.290 2.133 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1 295638109 QLAXDYPSLKEREB-NAKRPEOUSA-N 291.322 2.355 10 20 CECD C[C@@H](N[C@H]1CC(=O)N(C)C1)c1ccc2ccccc2c1O 386973554 RDFTXUIWGBPXIL-YPMHNXCESA-N 284.359 2.427 10 20 CECD Cc1cccc(CNc2cccc(C(=O)NC(N)=O)c2)c1O 802660185 DHCSUCBDYQSNIU-UHFFFAOYSA-N 299.330 2.121 10 20 CECD Nc1ccc(CCNC(=O)c2cc(C3CC3)no2)cc1 818544809 POALIQDLPQTJLW-UHFFFAOYSA-N 271.320 2.107 10 20 CECD Cc1cccc(CN[C@@H](CC(N)=O)c2ccccc2)c1O 816652993 BGBRXHYHEXUOBQ-HNNXBMFYSA-N 284.359 2.407 10 20 CECD CS(=O)(=O)CCCNCc1ccc2ccccc2c1O 816548110 VARXDSQWYHJTOS-UHFFFAOYSA-N 293.388 2.070 10 20 CECD CC(C)[C@H](Cn1cccn1)NCCc1ccc(N)cc1 817957811 PHFUKABERJCOQN-INIZCTEOSA-N 272.396 2.322 10 20 CECD CC(=O)NC1CCN(Cc2cc(Cl)c(C)cc2O)CC1 824645378 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Cc1cc(CN2CCOc3cc(N(C)C)ccc32)n(C)n1 841875502 SSNASDCTCCDTPY-UHFFFAOYSA-N 286.379 2.194 10 20 CECD CN(Cc1ccccc1O)C(=O)NC1CCC(C)(O)CC1 749593687 RDZBFYUQLSHMKY-UHFFFAOYSA-N 292.379 2.227 10 20 CECD CCN(C(=O)/C=C/c1cnn(C)c1)c1ccccc1 917107174 XOQIIIPJYAJQLP-MDZDMXLPSA-N 255.321 2.486 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H]1CCCNC1 841941104 KVKBUUNEZCSUKY-AWEZNQCLSA-N 291.395 2.066 10 20 CECD Nc1ccc(NC(=O)NCCCOCC(F)(F)F)cc1 841302076 KWWYXSAZLDJZDR-UHFFFAOYSA-N 291.273 2.359 10 20 CECD CO[C@@H]1COCC[C@H]1CNCc1ccc2c(c1)CCCO2 922157054 VNHZXWYIUVNEQI-DOTOQJQBSA-N 291.391 2.153 10 20 CECD CCc1cccc(CN2CCC[C@@H]2c2nncn2C)c1O 848889980 PTMQHCCSPXCEOC-CQSZACIVSA-N 286.379 2.420 10 20 CECD CC(C)OCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 757688334 XXJRLQGJHGHDJW-SNVBAGLBSA-N 268.313 2.376 10 20 CECD CC[C@@H](CCO)N[C@H](C)c1cc(F)cc(F)c1O 756602974 HGZZFQYIVPEISX-SCZZXKLOSA-N 259.296 2.482 10 20 CECD CCn1cnnc1CN[C@@H](C)c1cc(F)cc(F)c1O 756420369 JIQPVSGRXIOTMY-QMMMGPOBSA-N 282.294 2.133 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](N)C[C@H]2C)c1O 866684006 UIXCNYRFRFXZPS-PRHODGIISA-N 282.771 2.170 10 20 CECD CN(C)c1ccccc1N(C)C(=O)/C=C\c1cn(C)cn1 934993549 HALDPNWNYXFTEU-KTKRTIGZSA-N 284.363 2.162 10 20 CECD O=C(N[C@@H]1CCC[C@H]2OCC[C@H]12)c1cc(O)cs1 761607288 GYPXRDDAXZFKFD-GMTAPVOTSA-N 267.350 2.141 10 20 CECD C[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768438033 OQQYSNPMFGOMRN-QMTHXVAHSA-N 263.337 2.050 10 20 CECD CCC[C@H](CCO)NCc1ccc(N2CCOCC2)cc1 865662613 BVUMHDPQTMYGBF-MRXNPFEDSA-N 292.423 2.164 10 20 CECD CO[C@@H](C)[C@@H](C)NC(=O)N[C@H](C)c1ccccc1O 868627311 UITWSWHAUBOAHY-MXWKQRLJSA-N 266.341 2.176 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)CC[C@@H]1N 1118241675 KBEZQXQIVTVVFD-YOEHRIQHSA-N 273.424 2.456 10 20 CECD COc1ccccc1NCC(=O)NCc1ccccc1O 769359691 FXRIMZVRYREVRW-UHFFFAOYSA-N 286.331 2.129 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2ccc(N(C)C)cc2)C[C@@H]1C 877666293 DWHXZNGJUCIAIS-GUYCJALGSA-N 290.407 2.384 10 20 CECD CCCCNC(=O)[C@H](C)N[C@H](C)c1ccccc1O 879649362 RDYNGXPJHOKLML-NEPJUHHUSA-N 264.369 2.348 10 20 CECD CC[C@@H](O)CCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776239946 SLGQWUFBERWASL-SWLSCSKDSA-N 293.411 2.274 10 20 CECD C[C@@H](Cc1ccncc1)NC(=O)/C=C\c1ccc(O)c(O)c1 779529407 PPGBBCBOCNTAAS-FHMRSRPSSA-N 298.342 2.253 10 20 CECD Cc1c(CN[C@H](C)c2c(O)cccc2F)cnn1C 886557071 QWNUATOOGUTJBJ-SECBINFHSA-N 263.316 2.424 10 20 CECD CCC[C@@H](NCc1cccc(OCC)c1O)C(=O)OC 897835610 UJUBCEHVPYKZSM-GFCCVEGCSA-N 281.352 2.222 10 20 CECD O=C(COC(=O)[C@@H]1CC12CCC2)c1ccc(O)c(O)c1 784141369 XZLYJHKEILQDTD-JTQLQIEISA-N 276.288 2.014 10 20 CECD C[C@@H]1C[C@H](O)CN1Cc1cccc(Br)c1O 788269423 NOUQDWOFXMRTLC-SCZZXKLOSA-N 286.169 2.110 10 20 CECD C[C@H](NCCC1(O)CCOCC1)c1cc(F)ccc1O 797033666 YIZVUJNCNHXYSK-NSHDSACASA-N 283.343 2.114 10 20 CECD COc1ccc(CNC(=O)NCC2CCC2)c(O)c1 792806751 JTJQGCDIPVLBMS-UHFFFAOYSA-N 264.325 2.000 10 20 CECD CC[C@H](C)C[C@H](N)C(=O)N[C@H](C)c1ccccc1O 1341541038 MNWIWLFCWVVVHB-LOWVWBTDSA-N 264.369 2.333 10 20 CECD Cc1ccc(O)c(CN2CCN(CC(F)(F)F)CC2)c1 134083784 TVZLWEWFINGRMF-UHFFFAOYSA-N 288.313 2.381 10 20 CECD CON1CCC(NCc2cc(Cl)ccc2O)CC1 692192929 WUXIVMWEZRDULS-UHFFFAOYSA-N 270.760 2.161 10 20 CECD COc1cc(/C=C2\SC(=S)NC2=O)ccc1F 1319479198 PWTRCEWGYSOOFB-UITAMQMPSA-N 269.322 2.323 10 20 CECD CCn1ccnc1[C@@H](C)NC(=O)NCc1ccc(N)cc1 1336974869 DAACTCCECRETRX-LLVKDONJSA-N 287.367 2.046 10 20 CECD c1cc(N2CCCC2)ccc1CN1CC[C@@H]2CNC[C@@H]21 1261369876 QCARKAHTEIGKAB-WBVHZDCISA-N 271.408 2.081 10 20 CECD CN(Cc1ccccc1O)C(=O)NC/C=C/C1CC1 1344550858 ACLPAFZXGPONKI-SNAWJCMRSA-N 260.337 2.500 10 20 CECD C[C@@H](NC(=O)Nc1ccnnc1)c1ccc(N(C)C)cc1 1348075456 RJTHBCBGRZRWNY-LLVKDONJSA-N 285.351 2.425 10 20 CECD CCO[C@@H]1CCC[C@H]1NC(=O)NCc1ccc(N)cc1 1353412777 BMKNZLDPCXAGGR-ZIAGYGMSSA-N 277.368 2.026 10 20 CECD C[C@H](N[C@@H]1CC=C(C(=O)O)C1)c1cc(F)ccc1O 1604330561 RBJBWWTWLZXBIH-GZMMTYOYSA-N 265.284 2.355 10 20 CECD CN(C)Cc1ccc(C(=O)Oc2ccc(N)cc2)o1 1578421507 SOPPNIYVZVVTLO-UHFFFAOYSA-N 260.293 2.143 10 20 CECD CC1(C)C[C@@]1(C(=O)O)C(=O)NCc1cc(Cl)ccc1O 1589218649 WRIQPMGJXZGKNH-AWEZNQCLSA-N 297.738 2.163 10 20 CECD O=C(O)[C@]1(NCc2cc(F)cc(F)c2O)CC[C@@H]2C[C@H]21 1777600588 CQBWWLNMURUQTR-LXORQNMDSA-N 283.274 2.013 10 20 CECD CCN(CC)CCC[C@@H](C)NC(=O)Cc1ccc(N)cc1 19393000 AVYBRXDSOXQAJZ-CQSZACIVSA-N 291.439 2.438 10 20 CECD Cc1cc(NC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)no1 152987742 BJHSBEVSQZKFPA-MRVPVSSYSA-N 291.307 2.147 10 20 CECD COc1ccc(O)c(CN[C@H](C)CCn2cccn2)c1 159045775 MIQXHNMCTKZDJX-GFCCVEGCSA-N 275.352 2.166 10 20 CECD C[C@H]1COC(C)(C)CN1C(=O)Nc1ccc(N)cc1 841297946 VZJMBAQOPWWUHB-JTQLQIEISA-N 263.341 2.300 10 20 CECD COCCC1(CNCc2cc3c(cc2O)OCO3)CC1 151222658 BCDYCNCMFCFBRI-UHFFFAOYSA-N 279.336 2.027 10 20 CECD CCN(CC)c1ccc(CNC[C@]2(O)CCSC2)cc1 267098923 WFCFZCHDTREBIS-MRXNPFEDSA-N 294.464 2.490 10 20 CECD C[C@@H](NCc1cc(F)cc(F)c1O)[C@H]1CCOC1 708438576 WURUMJUNYLBWJH-BDAKNGLRSA-N 257.280 2.185 10 20 CECD CC(=O)c1cc(F)cc(CN2CCOC[C@H](C)C2)c1O 374351429 CIHHSNJUYBTYFB-SNVBAGLBSA-N 281.327 2.202 10 20 CECD CN(C)[C@@H](CNCc1ccc(N)cc1)c1ccco1 1578408382 KPWWHEUDVGQDNK-AWEZNQCLSA-N 259.353 2.254 10 20 CECD CCOc1ccc(O)c(CN2CCO[C@H](C)C2)c1 179868054 QHQSWXZNWIHZSK-LLVKDONJSA-N 251.326 2.012 10 20 CECD C[C@@H](N[C@H]1CCCn2ncnc21)c1ccc(F)c(F)c1O 187751596 RYRWCURNASOQKY-KCJUWKMLSA-N 294.305 2.448 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(N(C)C)CCOCC2)c1 185449730 XNMHQZBCHUITAM-AWEZNQCLSA-N 292.423 2.462 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1ccco1 186399961 NCOXEMWJFSVXCA-NSHDSACASA-N 289.331 2.371 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@H]2CCCNC2)cc1 43591070 HTJMVEMXFKEXIF-CQSZACIVSA-N 289.423 2.149 10 20 CECD Cc1cc(C(=O)NC2(C(=O)O)CC2)c(C)n1-c1ccccc1 237710564 RJEJLYWKAKMUDE-UHFFFAOYSA-N 298.342 2.441 10 20 CECD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Cc1ccc(N)cc1 237548855 PCRGZAUCFBWJRT-KGLIPLIRSA-N 289.423 2.048 10 20 CECD COC[C@H](C)NCc1cc(Br)ccc1O 163751895 OGUXEQNWORITSU-QMMMGPOBSA-N 274.158 2.279 10 20 CECD COc1ccc(CNC(C)C)cc1Cn1cccn1 50125470 DGQKJTBJMQQSTJ-UHFFFAOYSA-N 259.353 2.438 10 20 CECD CC[C@@H](NCC1(N2CCOCC2)CC1)c1ccccc1O 278468816 NLYMIOXBFDCYIW-OAHLLOKOSA-N 290.407 2.298 10 20 CECD Cc1ccc([C@H](C)N[C@@H](CO)c2cnn(C)c2)c(O)c1C 273499681 PTWZNTVAUBHNOX-WFASDCNBSA-N 289.379 2.127 10 20 CECD Cc1cc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)ccn1 279666901 GEXCFNOJFYTGJC-LLVKDONJSA-N 286.331 2.162 10 20 CECD CCN(CC)c1ccc(CNC2CCN(C=O)CC2)cc1 278330417 WEYJZWYJVCYQDD-UHFFFAOYSA-N 289.423 2.243 10 20 CECD CC(C)N1C[C@@H](N[C@@H](C)c2ccc(F)cc2O)CC1=O 273461800 IHDAUCQFXPGTEF-JQWIXIFHSA-N 280.343 2.191 10 20 CECD CC(C)N1C[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)CC1=O 271554017 WLEHMXLDYZPZQK-HIFRSBDPSA-N 289.423 2.413 10 20 CECD C[C@H]1c2nncn2CCN1Cc1ccc(N(C)C)c(F)c1 276752597 FRMLDMCSLGARRC-NSHDSACASA-N 289.358 2.060 10 20 CECD CC(C)c1[nH]ccc1C(=O)NCc1ccc(O)c(O)c1 286843982 WGESFFOUFYLFFP-UHFFFAOYSA-N 274.320 2.479 10 20 CECD CCN(CC)c1ccc(CN2CCNC(=O)C[C@H]2C)cc1 377889487 OVKJCSPMJCQQBG-CQSZACIVSA-N 289.423 2.243 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@@H]1O 293698153 CMOGHEJFSZYMMF-ZBFHGGJFSA-N 262.397 2.264 10 20 CECD COCc1cc(CNCc2ccc(N(C)C)cc2)no1 298580377 XRYSHVJBEZWPOY-UHFFFAOYSA-N 275.352 2.177 10 20 CECD C[C@@H]1C[C@@H](NC2CCNCC2)c2c(O)ccc(F)c21 817937114 TXHBCXRNJZGMOD-BXKDBHETSA-N 264.344 2.421 10 20 CECD CCOc1cccc(CN2C[C@H](C)[C@@](C)(CO)C2)c1O 827699254 FUMZEXZIAVVANV-BLLLJJGKSA-N 279.380 2.241 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2cccnc2)c1 728984210 NRBIXQSRTUTCJG-SNVBAGLBSA-N 272.304 2.287 10 20 CECD C[C@H](CC[S@@](C)=O)NCc1cccc(Cl)c1O 164759248 DXRRTDYVHJKGJT-XLFHBGCDSA-N 275.801 2.292 10 20 CECD CCN(C)c1ccc(CN2CC(F)(F)C[C@H]2C(=O)O)cc1 903613842 BSGZLMSEZQLGBQ-ZDUSSCGKSA-N 298.333 2.437 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@@H](C)c1cc(C)ccc1O 903342480 FIDMTBLLZQQGCL-GJZGRUSLSA-N 292.423 2.462 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C[C@@H]1C[C@H]1C 822511541 HWTSRFFOBRCTFT-OCCSQVGLSA-N 277.364 2.413 10 20 CECD COc1ccc(N(C)C(=O)/C=C\c2cccnc2)nc1 492592236 IMYZRCXKZAFVIC-YVMONPNESA-N 269.304 2.161 10 20 CECD CCN(C(=O)/C=C/c1cnn(C)c1)c1cccc(OC)c1 914528743 CXWQVYWKKATZFV-CMDGGOBGSA-N 285.347 2.495 10 20 CECD CN(Cc1cccc(Cl)c1O)C1(CN)CCC1 843124691 FLKZYJXHISIWKY-UHFFFAOYSA-N 254.761 2.359 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1ccc(N)nc1 843065055 CEQKEJYTINYLSH-UHFFFAOYSA-N 284.363 2.129 10 20 CECD CCCOC(=O)[C@H](C)N(C)c1ccc(OC)cc1 844353321 NBACQOKCQJODKN-NSHDSACASA-N 251.326 2.473 10 20 CECD C[C@@H](Nc1cnn(CCO)c1)c1ccc(Cl)cc1O 841749401 DTWDQFFOQWPXGF-SECBINFHSA-N 281.743 2.408 10 20 CECD Cc1noc(C(C)C)c1C(=O)NCc1ccc(O)cc1O 910958366 QZAPJKQAOHOLKS-UHFFFAOYSA-N 290.319 2.448 10 20 CECD Cc1cc(Br)cc(CN[C@H](CN)C2CC2)c1O 841029124 SXTOKBHZHHNKGZ-GFCCVEGCSA-N 299.212 2.290 10 20 CECD CCOC1(C(=O)NCc2ccc(O)cc2O)CCCC1 910946929 VYDIFXXRMLLKTM-UHFFFAOYSA-N 279.336 2.063 10 20 CECD CCOc1ccc(CNC[C@@H]2CCCCN2)c(O)c1 841033621 XXIJLLUYCWBVPJ-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N[C@@H]1C[C@H]2CC[C@@H]1O2 845438712 UJYHVILBBLBFGO-WZRBSPASSA-N 296.754 2.165 10 20 CECD CC[C@@H](OC(=O)c1cccc(O)c1O)C(=O)OC(C)(C)C 758571540 GQWZOTRQOHOCFK-LLVKDONJSA-N 296.319 2.375 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H](OC)[C@@H]1CCOC1 851722603 OLILAZLAZUMQLO-RHSMWYFYSA-N 291.391 2.499 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H]3CCC[C@@]3(N)C2)c1O 857226738 YGXJSOSILQBGOV-XHDPSFHLSA-N 296.798 2.367 10 20 CECD COC1CCN(CCN[C@@H](C)c2cc(C)ccc2O)CC1 756643961 WNZHOBXHVSCWOQ-AWEZNQCLSA-N 292.423 2.462 10 20 CECD C[C@H]1C[C@H](NCC(C)(C)O)c2c(O)ccc(F)c21 756564914 TZSJZCFFMCNYGZ-WPRPVWTQSA-N 253.317 2.440 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnn(C3CC3)c2)c1 862754248 VWZIBFCDEHNCHI-UHFFFAOYSA-N 271.320 2.162 10 20 CECD CN(CC(=O)NCC1CCCCC1)c1ccc(N)cc1 863556556 UEQFHTQMEGMORW-UHFFFAOYSA-N 275.396 2.402 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@H]2CCCNC2=O)cc1 766837984 DAXAMYHFNZSTJF-MRXNPFEDSA-N 289.423 2.243 10 20 CECD C[C@H](NC[C@@H]1CC2(CC2)C(=O)O1)c1ccc(N(C)C)cc1 763784434 ZQPHTIJJBIJLJL-WFASDCNBSA-N 288.391 2.499 10 20 CECD Nc1ccc(CCNC(=O)NCC2CC=CC2)cc1 861640449 LONKERVTKZFNBU-UHFFFAOYSA-N 259.353 2.077 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCC[C@]1(C)N)c1ccccc1O 870988478 QPFKKVBWPMONMD-KFNAQCHYSA-N 276.380 2.477 10 20 CECD COc1ccc2c(c1)CCCN2Cc1ccnn1C 773407776 FDXMSNLRMHIMNU-UHFFFAOYSA-N 257.337 2.382 10 20 CECD Cc1nc(CNC(=O)c2ccc(C)c(O)c2O)cs1 780894832 TWJBKXNUDBIQBM-UHFFFAOYSA-N 278.333 2.101 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](C)[S@](=O)CC2)c1O 894568010 VAIBMKFWDAWDQT-MPBGBICISA-N 297.420 2.052 10 20 CECD CC(=O)OC[C@H](C)NCc1cc(Cl)ccc1O 895156061 RHDYAZJFJVKNDJ-QMMMGPOBSA-N 257.717 2.087 10 20 CECD C/C=C/C=C\C(=O)NCc1ccc(N2CCN(C)CC2)cc1 893608501 VNTCUXMLZVWTGL-ICWBMWKASA-N 299.418 2.187 10 20 CECD CCOc1ccc(CNC2(COC)CCC2)c(O)c1 790653079 YMEMTAONQQBOBM-UHFFFAOYSA-N 265.353 2.450 10 20 CECD COc1ccc(CNC(=O)CC[C@@H]2CC[C@@H](C)O2)c(O)c1 794383335 LFSRZQYFNZRGRX-YPMHNXCESA-N 293.363 2.365 10 20 CECD Cc1ccc(O)c(CN[C@H](C)C(=O)NC(C)(C)C)c1 134653153 KCAPLWBNGNSAGG-LLVKDONJSA-N 264.369 2.093 10 20 CECD COc1ccc(CNC2CCN(OC)CC2)cc1C 692098271 SMNXJLWMFSQLBQ-UHFFFAOYSA-N 264.369 2.119 10 20 CECD CC(C)(CNCc1c(O)ccc(Cl)c1F)C(=O)O 1326324243 VNRXXPLZZMKLRE-UHFFFAOYSA-N 275.707 2.385 10 20 CECD COc1cc(C)cc(CN2CCC[C@@]2(C)CO)c1O 1331569602 QACSAXSWDZTDCZ-HNNXBMFYSA-N 265.353 2.056 10 20 CECD Cc1cc(Cn2cc(CNCC3CC3)nn2)ccc1N(C)C 1333547813 JKCWOTASBODYCD-UHFFFAOYSA-N 299.422 2.200 10 20 CECD CN(C(=O)c1cc(C2CC2)nn1C)c1ccc(N)cc1 1344368587 KSKSBLDJZIEJBH-UHFFFAOYSA-N 270.336 2.156 10 20 CECD CO[C@@H]1CCC[C@H]1C(=O)N(C)Cc1ccccc1O 1358032711 HZDBEQAFKSHTIJ-TZMCWYRMSA-N 263.337 2.166 10 20 CECD Cc1cc(C)c(O)c(CN2[C@H]3CC[C@H]2[C@@H](C(=O)O)C3)c1 1600163853 XCDCFJNXNBEOQS-IHRRRGAJSA-N 275.348 2.447 10 20 CECD Oc1ccc(Cl)cc1CN1CCO[C@H](CF)C1 840953778 AKTGJPWKGLFJCY-LLVKDONJSA-N 259.708 2.216 10 20 CECD COc1cccc(CN[C@H](C(=O)O)c2cccs2)c1O 1599674485 QAKJKYXBSONSDZ-LBPRGKRZSA-N 293.344 2.378 10 20 CECD O=C(O)[C@]1(NCc2cc(F)cc(F)c2O)CC[C@H]2C[C@@H]21 1777600586 CQBWWLNMURUQTR-BNOYYICYSA-N 283.274 2.013 10 20 CECD COc1cccc(O)c1CN(C)CC[C@H](N)C(C)C 843056616 SQQYSDDGMNSTKO-ZDUSSCGKSA-N 266.385 2.206 10 20 CECD OCC1(CNCc2ccc(N3CCCC3)cc2)CC1 118906796 LYRISUVWRBFTSZ-UHFFFAOYSA-N 260.381 2.149 10 20 CECD COc1cccc(CN2CC[C@@H](OC)C[C@@H]2C)c1O 282395575 RJHXGEFLWXVUKS-WCQYABFASA-N 265.353 2.400 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](CO)C2)c1O 50132057 JSYNLUSTSCKCJR-LLVKDONJSA-N 297.782 2.453 10 20 CECD Oc1ccccc1CN1CCC[C@@H](N2CCCC2)C1 374258071 IDFOHJFEMVCYHF-OAHLLOKOSA-N 260.381 2.452 10 20 CECD CCc1cccc(CNC(C)(C)CN(C)C)c1O 691463896 HCJCAIRMKDGTGU-UHFFFAOYSA-N 250.386 2.384 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2C[C@]2(C)OC)c1O 694427341 DLGOUOQIUACQQI-YPMHNXCESA-N 271.744 2.321 10 20 CECD O=S(=O)(Cc1ccccc1F)NCc1ccccc1O 396463268 KGLKDLDUDZINGN-UHFFFAOYSA-N 295.335 2.151 10 20 CECD COc1ccc(CNCc2ccc(OC)cc2O)nc1 894185239 KMZZQHANQVUEJU-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCOCCOC 66096069 LLBOIPBESGCUKX-UHFFFAOYSA-N 295.379 2.184 10 20 CECD COCCCN(CCOC)c1ccc(OC)c(OC)c1 177131155 WDCPODKZWAFORF-UHFFFAOYSA-N 283.368 2.193 10 20 CECD Cc1cccc(CN2CCC[C@H]2c2nncn2C)c1O 180561756 RSGWMZLEDJLPNI-ZDUSSCGKSA-N 272.352 2.166 10 20 CECD COCCOCCOc1ccc(N2CCCC2)cc1 183262897 RIMDPFHPCITKKC-UHFFFAOYSA-N 265.353 2.329 10 20 CECD CCCCOC(=O)CN1CCOc2cc(N(C)C)ccc21 181130849 LMVSXFZVKPMUIT-UHFFFAOYSA-N 292.379 2.295 10 20 CECD C[C@@H]1CCSCCN1Cc1cc2c(cc1O)OCO2 189912479 VVNHOSCDHRQQRX-SNVBAGLBSA-N 281.377 2.448 10 20 CECD CN(C)c1ccc(CNC(=O)CCc2ccncc2)cc1 47343726 UXQOHMPRWIOXPL-UHFFFAOYSA-N 283.375 2.397 10 20 CECD C[C@H](CC(N)=O)NCc1cc(Cl)cc(Cl)c1O 161576600 FXEBQMLNVXGIGD-ZCFIWIBFSA-N 277.151 2.053 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCCO1 46686232 PDMVQZLCYZRMDM-OAHLLOKOSA-N 274.364 2.082 10 20 CECD CCC[C@H](N)C(=O)NCc1ccc(N(CC)CC)c(F)c1 236880589 UFXGZQXDVRIAJQ-AWEZNQCLSA-N 295.402 2.416 10 20 CECD CC[C@@H](C)NC(=O)CN(C)c1ccc(OC)c(OC)c1 140272686 PCKTUMUXHQKBCS-LLVKDONJSA-N 280.368 2.055 10 20 CECD Cc1ccc(C(=O)N2CCC[C@]2(C)CCCO)c(O)c1O 273347338 SDGDCKABDGNMKT-MRXNPFEDSA-N 293.363 2.173 10 20 CECD Cc1ccc(C(=O)NCC[C@@H]2CCO[C@@H](C)C2)c(O)c1O 273222723 UBXWPYNOOZKLEU-NWDGAFQWSA-N 293.363 2.341 10 20 CECD CN(C)c1ccc(CN2CCCC3(C2)OCCO3)cc1F 272731663 HCWAZYLWEORCDT-UHFFFAOYSA-N 294.370 2.231 10 20 CECD Cc1cc(C)c([C@H](C)NCCNC(=O)C(C)C)c(O)c1 285065108 JAKZGVQRAMKWPX-ZDUSSCGKSA-N 278.396 2.432 10 20 CECD C[C@@H](CN)N[C@@H](C)c1ccc(N2CCOCC2)cc1Cl 817970567 ZZTNMZHXVGYIAY-RYUDHWBXSA-N 297.830 2.174 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)cc1 834906338 DGONNEQMEPCXSS-AEGPPILISA-N 289.423 2.447 10 20 CECD Cc1ccc(C(=O)OCc2nc(C3CC3)no2)c(O)c1O 733475286 DHRUSNJXOPXELK-UHFFFAOYSA-N 290.275 2.024 10 20 CECD Cc1nnc(N(C)Cc2ccccc2O)n1CC1CC1 830468450 IZGWDPLNQHJYRZ-UHFFFAOYSA-N 272.352 2.339 10 20 CECD CC/C(C)=C/C(=O)N(CC(=O)O)Cc1ccccc1O 911488771 NQVSXYNZSQBKRG-DHZHZOJOSA-N 277.320 2.162 10 20 CECD O=C(NCC[C@@]1(O)C[C@H]2CC[C@H]1C2)c1cc(O)cs1 832517568 LITVDBBMQFYMBD-PKFCDNJMSA-N 281.377 2.125 10 20 CECD CC[C@H](NCc1cc2c(cc1O)OCO2)C1CCOCC1 746054261 PHRNEJLCTSTOSI-ZDUSSCGKSA-N 293.363 2.416 10 20 CECD Nc1ccc(CCNCc2cc(C(F)(F)F)n[nH]2)cc1 841037913 CSYUENRTIQODCR-UHFFFAOYSA-N 284.285 2.343 10 20 CECD COc1cc(O)c(CN2C[C@H]3[C@H](C2)C3(F)F)cc1OC 844759347 XFXSLVXQORJPSN-UWVGGRQHSA-N 285.290 2.106 10 20 CECD COC(=O)CCCC(=O)NCc1cc(Cl)ccc1O 846659959 AWOCEXQNRBSUFU-UHFFFAOYSA-N 285.727 2.005 10 20 CECD Nc1ccc(CCNC(=O)NCCOC2CCCC2)cc1 841719535 BDJJTMZVQWVBEB-UHFFFAOYSA-N 291.395 2.070 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)CNC)cc1F 853248421 GCPYQJXQMRZVJI-GFCCVEGCSA-N 267.392 2.369 10 20 CECD Cc1ccc([C@H](C)NCCO[C@@H]2CCOC2)c(O)c1C 927081855 XOPCSSJYZOCAIP-UONOGXRCSA-N 279.380 2.465 10 20 CECD CCO[C@H](C(=O)NCc1ccc(N(C)C)cc1C)C1CC1 859419471 NRUXAMBAOXTPGA-INIZCTEOSA-N 290.407 2.492 10 20 CECD CC1(C)CCCN1CCNC(=O)c1cc(O)cs1 854892896 AJVDEAMGCAWQDV-UHFFFAOYSA-N 268.382 2.058 10 20 CECD Cc1nc(O)c2c(n1)CN(Cc1ccc(N(C)C)cc1)C2 931313991 UNSUTGZSCQXXKQ-UHFFFAOYSA-N 284.363 2.072 10 20 CECD COc1ccc(CNC(=O)[C@@]23CCC[C@@H]2C3)c(O)c1 935770963 MRIBDUMBZMAJHN-IAQYHMDHSA-N 261.321 2.207 10 20 CECD CCC[C@@H](OCC)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 860696803 ZUMVEBAEYGXDTR-XHDPSFHLSA-N 295.379 2.350 10 20 CECD CCOC(=O)C1(C(=O)NCc2cc(C)ccc2O)CCC1 862758217 STBHXKGQUXKRQY-UHFFFAOYSA-N 291.347 2.050 10 20 CECD Cc1ccc(O)c(CNC(=O)CCCCN(C)C)c1 862759358 CKSVYSURSYMKBQ-UHFFFAOYSA-N 264.369 2.049 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](N)CCC(C)C)c1 876878737 JTGSRCXDJOOZKG-SMDDNHRTSA-N 294.395 2.342 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H]2CN(C)C[C@H]21 877598494 GTTTYDWJBXRLPC-DZGCQCFKSA-N 260.381 2.227 10 20 CECD C[C@@H](NC(=O)N1CC=CC1)c1ccc(N(C)C)cc1 875507912 MZFXTAVCKIOSON-GFCCVEGCSA-N 259.353 2.395 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1C[C@H](O)C1(C)C 779347192 LENVIYYQQCXAHY-CABCVRRESA-N 262.397 2.310 10 20 CECD CCc1nc([C@@H](C)NCc2cc(F)cc(F)c2O)n[nH]1 883078320 NFRLSOGSHMAIMM-SSDOTTSWSA-N 282.294 2.202 10 20 CECD CCN(Cc1ccc(OC)c(OC)c1O)C[C@H]1CCOC1 891659229 GUHMLLVKZOBBLX-GFCCVEGCSA-N 295.379 2.268 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@H](CF)C2)c1O 895546315 ZJPBEYVOQGKJHG-SNVBAGLBSA-N 298.314 2.491 10 20 CECD O=C(OCCO[C@@H]1CCCCO1)c1cc(O)cs1 791885643 MKHLWKUORKDOKJ-LLVKDONJSA-N 272.322 2.154 10 20 CECD OCC[C@H]1CCC[C@@H]1NCc1cc(F)ccc1O 190307058 BNGGIUZDXZNYFA-MFKMUULPSA-N 253.317 2.172 10 20 CECD CC(C)(C)CN1C(=O)C(C)(C)N[C@H]1c1cc(O)ccc1O 1331383011 ZKILYECLNCSBSA-CYBMUJFWSA-N 292.379 2.353 10 20 CECD COCn1ncc(C)c1CNCc1cc(C)ccc1O 1333781879 OVAIMAYFJKPGLJ-UHFFFAOYSA-N 275.352 2.099 10 20 CECD Nc1ccc(CNC(=O)N[C@H]2CCOC3(CCC3)C2)cc1 1262578371 OLGQBEFFIUUVIC-AWEZNQCLSA-N 289.379 2.170 10 20 CECD C[C@@H](NC(=O)OC[C@H]1CCCO1)c1ccccc1O 1348699017 UZRVOLYQVPTNJO-GHMZBOCLSA-N 265.309 2.358 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cc(C)cc(OC)c1O 1589441718 WCFAETCIGYXFCJ-LLVKDONJSA-N 267.325 2.004 10 20 CECD CCn1ccc(CN[C@H](C)c2cc(C(=O)O)ccc2O)n1 1597907427 PWVFAAOHNNTBFG-SNVBAGLBSA-N 289.335 2.158 10 20 CECD CN(C)c1ccc(CNc2cccc(C(=O)O)n2)cc1 1598320384 BJBAHOGILVMWLA-UHFFFAOYSA-N 271.320 2.458 10 20 CECD CCN(C)c1ccc(CN2[C@H]3C=C[C@@H](C3)[C@@H]2C(=O)O)cc1 1776855503 FUHNFJTWIOOULA-CWRNSKLLSA-N 286.375 2.356 10 20 CECD CC[C@@H](NCCS(=O)(=O)CC)c1ccc(N(C)C)cc1 163507278 GQLMVEFYWYPJDJ-OAHLLOKOSA-N 298.452 2.228 10 20 CECD c1cn(CCCNCc2ccc3c(c2)CCCO3)cn1 921472525 IZPCNVZRILJTIC-UHFFFAOYSA-N 271.364 2.388 10 20 CECD C[C@@H](NC(=O)[C@]1(C)CCCOC1)c1ccccc1O 827940830 JBRAUCNAJAKMLJ-IAQYHMDHSA-N 263.337 2.386 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@@H](C)c1cc(F)ccc1O 228943733 YLCIWZVHQKIAKW-UWVGGRQHSA-N 268.332 2.095 10 20 CECD CN(CCO)Cc1cc(Cl)cc(Cl)c1O 127920049 YZDVYSZFZWUSKO-UHFFFAOYSA-N 250.125 2.123 10 20 CECD CCC[C@]1(NC(=O)Nc2ccc(N)cc2)CCOC1 393478739 NHDKEPVQLSNWOX-AWEZNQCLSA-N 263.341 2.350 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CCC[C@@H](CF)C1 1355345221 SNQWNKWJOOLPCQ-VIFPVBQESA-N 296.371 2.435 10 20 CECD CCCNC(=O)[C@@H]1CCCN(Cc2cccc(C)c2O)C1 179939708 HKZVGBQFZDMFBS-OAHLLOKOSA-N 290.407 2.439 10 20 CECD CC[C@@H](C)NC(=O)CN(C)c1ccc(OC)c(F)c1 177068011 IRQARZAXLJWXPQ-SNVBAGLBSA-N 268.332 2.185 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cccn1C 173195302 XLJMVZHEMSARSX-UHFFFAOYSA-N 285.347 2.130 10 20 CECD CO[C@@]1(C)C[C@H](NCc2cc3c(cc2O)OCO3)C1(C)C 174137510 ZUGLWJSAXKVUPF-HOCLYGCPSA-N 293.363 2.414 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@@]2(CCNC2)C1 31994849 DHKDJUZINNPYCT-CQSZACIVSA-N 266.772 2.231 10 20 CECD COc1ccc(O)c(CNC(=O)NC[C@H]2CCCS2)c1 121473120 LSUUTYNMNYLIAT-GFCCVEGCSA-N 296.392 2.096 10 20 CECD Cc1ccc([C@@H](C)NCC2(CS(C)(=O)=O)CC2)c(O)c1 186090074 UNIGSVFHUOHLCT-GFCCVEGCSA-N 297.420 2.176 10 20 CECD C[C@H](NCCCO[C@@H]1CCOC1)c1cc(F)ccc1O 185705576 QWDDTBJWKLMDEW-WCQYABFASA-N 283.343 2.378 10 20 CECD CC(C)Cn1ncnc1CN(C)c1ccc2c(c1)OCO2 182935596 BDNPLCKRSRTSBE-UHFFFAOYSA-N 288.351 2.299 10 20 CECD COc1cccc(CNC(=O)C[C@@H](C)SC)c1O 133757463 XGACTUVSIIYQAA-SECBINFHSA-N 269.366 2.159 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@](C)(O)C2)c1O 177371170 SQFQIBHCRJEUSL-CQSZACIVSA-N 283.755 2.205 10 20 CECD Oc1ccccc1CNC[C@@H](O)c1c(F)cccc1F 134987692 QBHJSJFCKLSYBI-CQSZACIVSA-N 279.286 2.494 10 20 CECD CCc1ocnc1C(=O)N(C)Cc1ccccc1O 265886321 QUWFSSXWLRATCF-UHFFFAOYSA-N 260.293 2.215 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CC[C@@H](C)N 193227067 JAIOQAPJCIVODI-GFCCVEGCSA-N 264.369 2.258 10 20 CECD C[C@@H](N)CCC(=O)NCc1ccc(N2CCCC2)cc1 193300733 HLWNJQDNJMOULO-CYBMUJFWSA-N 275.396 2.030 10 20 CECD CCN(CC)[C@@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 97987273 OHFQEVNGKOUATK-CYBMUJFWSA-N 292.379 2.037 10 20 CECD Cc1cocc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 528994183 AJIHJLPTQOHLOE-SNVBAGLBSA-N 275.304 2.360 10 20 CECD CC[C@@H](NCc1cc(F)ccc1O)[C@H](O)C(F)(F)F 272520638 YFPDBPGHVAHJJS-KOLCDFICSA-N 281.249 2.323 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2CCS(=O)(=O)C2)c(O)c1C 273444049 ZJXMTRKCGDBIJT-OLZOCXBDSA-N 297.420 2.094 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@H](CO)C2)cc1F 295125438 XHFSGGHCIVOEOZ-OLZOCXBDSA-N 266.360 2.142 10 20 CECD C[C@H]1CCC[C@H]1NC(=O)c1c(F)ccc(O)c1O 295392738 YOMYJCJHFVXGIC-IONNQARKSA-N 253.273 2.155 10 20 CECD COC(=O)[C@H](C)NCc1ccc2ccccc2c1O 816591313 ACJTWNNIZYBDJR-JTQLQIEISA-N 259.305 2.197 10 20 CECD Cc1cc(Br)cc([C@@H](C)N[C@H](C)CN)c1O 817966750 VBHDUXMXQCNFIH-RKDXNWHRSA-N 287.201 2.461 10 20 CECD CC[C@@H](CCO)NCc1cc(Cl)c(F)cc1O 816552075 ABWJHWYLIVLELQ-VIFPVBQESA-N 261.724 2.435 10 20 CECD Cc1cc(CN[C@H](C)c2nncn2C)ccc1N(C)C 815090246 UJJNXORYUQGRFY-GFCCVEGCSA-N 273.384 2.040 10 20 CECD CCCCN(C)C[C@H](C)NC(=O)c1cc(O)cs1 811583511 LBAARMLLGVZNHO-JTQLQIEISA-N 270.398 2.304 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)N[C@H](C)C1CNC1 817934691 MYZZEFWILOVWBD-ZIAGYGMSSA-N 275.440 2.190 10 20 CECD Cc1ncc(NC(=O)N(C)Cc2ccccc2O)cn1 728689536 FAQUEDMMPQFUAL-UHFFFAOYSA-N 272.308 2.155 10 20 CECD CC[C@](C)(CNC(=O)NCc1ccc(N(C)C)cc1)OC 836231276 CQASHLYGCVXIPZ-MRXNPFEDSA-N 293.411 2.367 10 20 CECD COC(=O)[C@@H]1CCCCCN1C(=O)c1cc(O)cs1 831931610 RWTBIIVVAHQBCL-JTQLQIEISA-N 283.349 2.012 10 20 CECD Cc1ccc([C@H](C)NC[C@]2(C)CCC(=O)N2)c(O)c1C 834910210 VWTDKYSCOXNKMW-LRDDRELGSA-N 276.380 2.328 10 20 CECD N=C(NCc1cccc(Br)c1O)NC1CCC1 849023000 DFOYTFIGTOHEIX-UHFFFAOYSA-N 298.184 2.321 10 20 CECD C[C@@H](CN1CCOCC1)N[C@@H](C)c1ccc(Cl)cc1O 841744685 JYIJYAFKKYIYNF-RYUDHWBXSA-N 298.814 2.417 10 20 CECD CC(C)C[C@@H](CN)NCc1ccc(N(C)C)c(F)c1 841038753 PNESJSYHQFOPFD-ZDUSSCGKSA-N 267.392 2.355 10 20 CECD CCOc1ccc(CNC[C@@H](O)c2ccco2)c(O)c1 747098920 HLYHHLHHFPDFDK-CQSZACIVSA-N 277.320 2.207 10 20 CECD COC[C@@H](CC(C)C)NC[C@H](N)c1ccc(N(C)C)cc1 841045920 SQQATQOLHWBISW-WBVHZDCISA-N 293.455 2.403 10 20 CECD N=C(NCc1cc(Cl)cc(Cl)c1O)N1CCC1 849028064 ANWFBVVFPKNGTL-UHFFFAOYSA-N 274.151 2.429 10 20 CECD Cc1nn(C(C)C)cc1C(=O)NCCc1ccc(N)cc1 848393976 FAHQNCFSQIJMAV-UHFFFAOYSA-N 286.379 2.327 10 20 CECD CNCCCNCc1ccc(N(C)C)cc1C(F)(F)F 841043158 SBMSJSDGBSLOER-UHFFFAOYSA-N 289.345 2.471 10 20 CECD C[C@H](CCCN)NCc1cccc(Br)c1O 841081331 URUGXWSESKGYEE-SECBINFHSA-N 287.201 2.372 10 20 CECD CC(=O)N1CC[C@@H](N[C@H](C)c2c(C)cc(C)cc2O)C1 857084597 XLNYOVBQVSUBDL-TZMCWYRMSA-N 276.380 2.280 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCOCC1CC1 759595303 PSSIDILTSIQXGT-GQCTYLIASA-N 278.304 2.081 10 20 CECD COc1cc(CN[C@@H]2CC[C@H]2O)c(O)c(C(C)(C)C)c1 850332615 OCDAKQLUHJJKKN-ZIAGYGMSSA-N 279.380 2.311 10 20 CECD CN(C)c1cc(F)c(CNC2(C(=O)O)CCC2)cc1F 864510718 CPEPSPOJLYBBLL-UHFFFAOYSA-N 284.306 2.128 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@H]2O)C1CCCC1 768442046 NZQYPLIFIQUPPN-CQSZACIVSA-N 263.337 2.192 10 20 CECD CCOC(=O)/C=C\CN[C@@H](C)c1cc(OC)ccc1O 930215768 ZENHOVRMUYWWGF-GZTOBOFZSA-N 279.336 2.171 10 20 CECD CCOc1ccc(CN2CCC[C@H]([C@@H](C)O)C2)c(O)c1 768518950 JRIJIKBADOPYFK-OLZOCXBDSA-N 279.380 2.384 10 20 CECD Cc1ccc(O)c(CNC(=O)Cc2c(C)noc2C)c1 862761059 BXSYLAJXUKJBLT-UHFFFAOYSA-N 274.320 2.164 10 20 CECD COC(=O)c1occc1CNCc1cc(C)ccc1O 862475896 BAJLVFKGRNDUDN-UHFFFAOYSA-N 275.304 2.370 10 20 CECD Cc1ccc(CN2CCC3(CC2)OCCCO3)c(O)c1 877553122 ZRARYMQBGROVBA-UHFFFAOYSA-N 277.364 2.430 10 20 CECD Cc1ccc(CN2CCN(Cc3ccccn3)CC2)c(O)c1 876553275 MMYIOUWONAHQGB-UHFFFAOYSA-N 297.402 2.413 10 20 CECD CN1CCN(c2ccc(CN3CC(C)(C)C3)cc2)CC1 877717362 JTBUFODLBGNUIV-UHFFFAOYSA-N 273.424 2.280 10 20 CECD C[C@@H]1[C@@H](C)N(Cc2ccc(N(C)C)cc2)CCN1C 775986909 SNMLISOYSZIKOX-ZIAGYGMSSA-N 261.413 2.277 10 20 CECD C[C@@H](Nc1nccn2cnnc12)c1ccc(N(C)C)cc1 772295569 HPCJHJFKUYGLNO-LLVKDONJSA-N 282.351 2.363 10 20 CECD COc1ccc(NC(=O)c2ccc(C)c(O)c2O)c(O)c1 785427836 VSBAJKYGVFWEIT-UHFFFAOYSA-N 289.287 2.373 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H](O)COCC2CC2)c(O)c1 788584285 NIFVZRJSEJXWJR-UKRRQHHQSA-N 293.407 2.447 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)CC1CC(O)C1 792180164 MZNOWPJJWBIGQG-UHFFFAOYSA-N 273.735 2.387 10 20 CECD CCN(CC)c1ccc(CNC[C@H](C)CNC)cc1 1325321759 ZKNHXEHDZPHGCS-CQSZACIVSA-N 263.429 2.478 10 20 CECD CC[C@H](C)NCc1ccc(N2CCN(C)CC2)cc1 775784768 IEELOIBFOHCVQT-AWEZNQCLSA-N 261.413 2.327 10 20 CECD Nc1ccc(CN[C@@]2(CO)CCOc3ccccc32)cc1 1336287250 ZIFUAQVIXSZLBO-QGZVFWFLSA-N 284.359 2.029 10 20 CECD O=C(O)CN(Cc1ccc(Cl)cc1O)C1CCC1 1606229605 PWOYDMBPZMCQHD-UHFFFAOYSA-N 269.728 2.485 10 20 CECD COc1ccc(N(C)Cc2ccc(C(=O)O)[nH]2)cc1OC 1607268473 WQDIEXVAEQOLBC-UHFFFAOYSA-N 290.319 2.367 10 20 CECD O=C(O)[C@H]1CC[C@@H](NCc2cc(Cl)ccc2O)C1 1601794590 LXUXGUBHCFIGRX-GZMMTYOYSA-N 269.728 2.389 10 20 CECD C[C@@H](NC[C@H]1CCCN(C)C1)c1cc(C(=O)O)ccc1O 1593257155 LWSWVLMGOGGYLH-VXGBXAGGSA-N 292.379 2.083 10 20 CECD CCCOc1ccc(CN2CCCC[C@@H]2C(N)=O)c(O)c1 162072749 JLSFLCPDQKRGOO-CQSZACIVSA-N 292.379 2.021 10 20 CECD C[C@H]1CCN(Cc2c(O)cccc2Cl)C[C@@H]1CN 163492951 GQFSAHIEOFEREF-QWRGUYRKSA-N 268.788 2.462 10 20 CECD Oc1ccc(Br)cc1CNC[C@@H]1CCOC1 163758734 JFDFUZOMGDHCCB-VIFPVBQESA-N 286.169 2.281 10 20 CECD Cn1cc(NC(=O)NCCCSc2nccs2)cn1 151110521 DXBUYOWQFQNETD-UHFFFAOYSA-N 297.409 2.181 10 20 CECD COc1cc(O)c(CN(C)C[C@@H]2CCCCO2)cc1OC 159920264 UJOZLJAFICBZCU-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD COCc1cc(CN(C)c2ccc(OC)cc2)no1 845997668 BLJSXHSPQAAWNZ-UHFFFAOYSA-N 262.309 2.466 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(C(=O)O)s1 917310882 JLJMRYCKCQUFMK-UHFFFAOYSA-N 291.328 2.424 10 20 CECD COc1cccc(O)c1CNCC[C@H]1C[C@H]2CC[C@H]1O2 839162633 BJPGUPCAWZOIGN-YWPYICTPSA-N 277.364 2.448 10 20 CECD CCN(CC)C[C@H](C)NCc1cc(F)ccc1O 226607203 KFTKWDKXDMIOIZ-NSHDSACASA-N 254.349 2.351 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@](C)(O)C(F)(F)F)c1 273450700 FYTNCGNWXBFCRK-PELKAZGASA-N 293.285 2.365 10 20 CECD CC(C)N1CC[C@H](N[C@H](C)c2ccccc2O)C1=O 179895969 SEODMLLVZASLGJ-YPMHNXCESA-N 262.353 2.052 10 20 CECD CC(C)OCCCCNC(=O)c1cccc(O)c1O 193159583 WCOLWVRXTWSNJN-UHFFFAOYSA-N 267.325 2.033 10 20 CECD CC[C@H]1CO[C@H](CC)CN1C(=O)c1cccc(O)c1O 403780311 ADPAIQHCSRKLNT-WDEREUQCSA-N 279.336 2.127 10 20 CECD Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc32)c(O)c1O 179438857 BSXGSHCEGGIZHQ-LBPRGKRZSA-N 283.327 2.476 10 20 CECD CO[C@H](C)CC(=O)NCc1c(O)ccc2c1CCCC2 174516788 ILPSQHOHZOBTOQ-LLVKDONJSA-N 277.364 2.312 10 20 CECD Cc1ccc(C(=O)N2C[C@H]3CCC[C@H]3C2)c(O)c1O 179543244 NFMZEQBWZNSXTN-PHIMTYICSA-N 261.321 2.278 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](C)N(C)C)c1 38088602 DAXLOCSNWZXRGZ-MNOVXSKESA-N 252.358 2.002 10 20 CECD C/C=C/C[C@H](CO)N[C@@H](C)c1cc(OC)ccc1O 186520270 YTLTYINZTHCIDD-RUULKOMLSA-N 265.353 2.379 10 20 CECD COc1ccc(N(CCOCCO)[C@H](C)C2CC2)cc1 133024815 DESLUIHURUVYGL-CYBMUJFWSA-N 279.380 2.309 10 20 CECD COCCOCCN(C)Cc1cccc(Cl)c1O 290217229 RFHPUUAVSDRFJF-UHFFFAOYSA-N 273.760 2.140 10 20 CECD Oc1ccc(F)cc1CNc1cccc(-n2cnnn2)c1 226561172 WVHRCFGDFDHXAQ-UHFFFAOYSA-N 285.282 2.119 10 20 CECD c1cc(CNCc2ccc(N3CCOCC3)cc2)c[nH]1 86251617 QTRFWBJCVKMFOC-UHFFFAOYSA-N 271.364 2.141 10 20 CECD Cc1ccc(C(=O)N[C@@H]2C[C@]2(C)OC(C)C)c(O)c1O 529970181 JQJLIDBSYOXJLL-ABAIWWIYSA-N 279.336 2.092 10 20 CECD CCOc1cccc(CN[C@@H](COC)[C@H]2CCCO2)c1O 278604504 ICLJSEJQRKOOQR-UONOGXRCSA-N 295.379 2.075 10 20 CECD CN(C)c1ccc(CN2CCOC[C@@H]2[C@@H]2CCCO2)cc1 367604470 UCEMKHZJARSYAQ-SJORKVTESA-N 290.407 2.132 10 20 CECD COc1cc(O)c(CN2CC[C@@H](C)C2)cc1OC 271112968 UWEFHPWJAMGNEA-SNVBAGLBSA-N 251.326 2.251 10 20 CECD COC(=O)CN(Cc1c(O)cccc1Cl)C1CC1 271310763 WYCYISZMNUHFMZ-UHFFFAOYSA-N 269.728 2.183 10 20 CECD CC(C)(C)[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCO1 279792011 OKDWTLREMRQNHL-HNNXBMFYSA-N 293.363 2.368 10 20 CECD C[C@H](CO)CCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273359613 DLHUSNJLNZHSQD-WDEREUQCSA-N 282.340 2.360 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1cnnn1C 289444527 ZJTZWXBHQOMTMQ-UHFFFAOYSA-N 272.352 2.167 10 20 CECD C[C@H](N[C@H]1CCN[C@H](C)C1)c1cc(F)ccc1O 817970713 CPXVZKNHNZINKO-SCVCMEIPSA-N 252.333 2.322 10 20 CECD NC(=O)[C@H]1CC[C@H](CNCc2cc(Cl)ccc2O)CC1 817413559 ZBQYPOPRACESPU-XYPYZODXSA-N 296.798 2.427 10 20 CECD Cc1cc(C)c([C@@H](C)NCC2(CC(N)=O)CC2)c(O)c1 817587561 YREDAIDAPLDKSX-GFCCVEGCSA-N 276.380 2.315 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1cc(Cl)c(C)cc1O 825384894 LIBKUUGZPQZSGF-YPMHNXCESA-N 296.798 2.358 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@H](N)CC(F)F 903873860 MWFKRSFGRDIDBV-GFCCVEGCSA-N 271.355 2.167 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H](C(=O)O)C1 901416554 UBXPDEPFEOZYTQ-AWEZNQCLSA-N 276.380 2.358 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H]2CC(=O)O)cc1F 902008820 XLUWHMHHSXNMTF-GFCCVEGCSA-N 280.343 2.331 10 20 CECD C[C@@H]1C[C@H](NC(=O)c2cc(O)cs2)c2nccn21 839785779 IWPNHVHKQVDXCD-APPZFPTMSA-N 263.322 2.086 10 20 CECD CCOCc1cc(CN[C@H](C)COC)ccc1OC 747855099 ZXZONKLWQZBYCQ-GFCCVEGCSA-N 267.369 2.356 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1C(=O)NCCc1ccc(N)cc1 841961967 IRYIRGULGWSYSK-SWLSCSKDSA-N 291.395 2.020 10 20 CECD CC(C)OCCNC(=O)NCc1cc(Cl)ccc1O 845107992 MWKUOLVEKXUZST-UHFFFAOYSA-N 286.759 2.270 10 20 CECD CCc1cccc(CN2CCC3(CC2)OCCO3)c1O 848880783 JUBJTXZJJPFGHT-UHFFFAOYSA-N 277.364 2.294 10 20 CECD CC(C)(C)[C@@H]1CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841086498 JWGWOJYLQPITMS-LLVKDONJSA-N 289.379 2.102 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)CC[S@](C)=O 840939050 RPWBJCWPEKASRZ-YJYMSZOUSA-N 282.453 2.308 10 20 CECD CCOc1ccc(CN[C@@H](C)C2(CO)CC2)c(O)c1 850360625 IFLCCRNWCKKBOR-NSHDSACASA-N 265.353 2.042 10 20 CECD CC[C@](C)(O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 935463621 KIBGIEPUMBTCHC-ABAIWWIYSA-N 264.369 2.091 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H]2CCCNC2=O)cc1 766837983 DAXAMYHFNZSTJF-INIZCTEOSA-N 289.423 2.243 10 20 CECD CCc1cc(NC(=O)NCc2cc(C)ccc2O)nn1C 861182425 MJTNFZNUYBPYFO-UHFFFAOYSA-N 288.351 2.318 10 20 CECD Cc1nnc(O)c(CN[C@H]2CCc3cccc(O)c32)c1C 1117831009 JVIDMKSUHZQDBI-ZDUSSCGKSA-N 285.347 2.282 10 20 CECD COc1cccc(O)c1CNc1ccc(N(C)C)cn1 776250011 CCIAFDJBHACTKC-UHFFFAOYSA-N 273.336 2.474 10 20 CECD Cc1cnccc1CCNC(=O)NCc1ccc(N)cc1 1120526948 IWPJKYBLJWHENF-UHFFFAOYSA-N 284.363 2.014 10 20 CECD COc1ccc(CNCCNC(=O)/C=C/C2CC2)cc1C 1125242793 JHABPTTZJQVFOC-SOFGYWHQSA-N 288.391 2.176 10 20 CECD CC[C@@H]1OCC[C@H]1NCc1cc(C)cc(OC)c1O 894984086 IORQYMQSNMDTOW-OLZOCXBDSA-N 265.353 2.366 10 20 CECD Cc1ccnc(COC(=O)c2ccc(C)c(O)c2O)c1 791365094 YWMWBAOQAWRBSQ-UHFFFAOYSA-N 273.288 2.467 10 20 CECD O=C(NCCOc1ccc(F)cc1)c1cccc(O)c1O 790527633 IEQWKUCOFWPYLU-UHFFFAOYSA-N 291.278 2.046 10 20 CECD CCOc1cccc(CNC[C@@H]2CC[C@@H](O)C2)c1O 188839403 GPRKPBYVFVULEV-DGCLKSJQSA-N 265.353 2.042 10 20 CECD Cc1ccc(O)c(CNc2nc(C)nc3c2cnn3C)c1 1328804091 MWYQFCDBWBURII-UHFFFAOYSA-N 283.335 2.298 10 20 CECD OCC1(CNCc2c(O)cccc2Br)CC1 706863838 QJLXOSTXBAVJSS-UHFFFAOYSA-N 286.169 2.017 10 20 CECD O=C(NC1CC1)[C@H]1CCCN(Cc2cc(F)ccc2O)C1 1320720889 LWTPSTMGYPQSOQ-NSHDSACASA-N 292.354 2.022 10 20 CECD Oc1ccc(F)cc1CN1CCO[C@H](C(F)(F)F)C1 698953993 VNOPXXLSSPNNCC-NSHDSACASA-N 279.233 2.294 10 20 CECD CO[C@H]1CCC[C@H]1C(=O)NCc1cc(C)ccc1O 1347202438 HKVHXMBFVZSEGW-OCCSQVGLSA-N 263.337 2.132 10 20 CECD O=C(O)CC1(CNCc2ccc3c(c2)CCCO3)CC1 1352144634 WXCZMPSVIGRYFS-UHFFFAOYSA-N 275.348 2.356 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc(CC(=O)O)c1 1606170209 WKJPGBNXLCQLIL-UHFFFAOYSA-N 299.326 2.292 10 20 CECD COc1cccc(CNCc2cc(C(=O)O)c(C)[nH]2)c1O 1599673628 HBHYSANCAVATAI-UHFFFAOYSA-N 290.319 2.025 10 20 CECD CN(C)c1ccc(CN2C[C@@H](C(=O)O)CC(F)(F)C2)cc1 1777039410 XTHRZVWDZSWPSD-LBPRGKRZSA-N 298.333 2.294 10 20 CECD O=C(O)c1cccnc1CNCc1cc(F)cc(F)c1O 1777690101 UDOIEVJJSNSJNL-UHFFFAOYSA-N 294.257 2.053 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)c(C)cc2O)CCO1 159716555 PGCDZQHSGSEDSY-CYBMUJFWSA-N 265.353 2.320 10 20 CECD COc1ccc(O)c(CN[C@H]2C[C@@H](OC)C23CCC3)c1 713481311 SPWMOAGPEKDHKW-LSDHHAIUSA-N 277.364 2.448 10 20 CECD C[C@H](N[C@@H](CCO)C(F)(F)F)c1ccccc1O 886800863 CVGQEZBCYDYSGN-KWQFWETISA-N 263.259 2.356 10 20 CECD CCc1ncncc1C(=O)N[C@H](C)c1ccccc1O 827931104 YFYHUOBJPDICGR-SNVBAGLBSA-N 271.320 2.236 10 20 CECD COc1ccc(N(C)C[C@@H](O)COCc2ccco2)cc1 8697953 IIPAJMXHXLBGDI-CQSZACIVSA-N 291.347 2.302 10 20 CECD CC[C@H](C)CN(C)CC(=O)NCc1ccc(N(C)C)cc1 171948771 IWUZUWUVAKVEAX-AWEZNQCLSA-N 291.439 2.347 10 20 CECD Oc1c(Cl)cccc1CNCCn1cccn1 124726202 MVPLXJGHHCVQHZ-UHFFFAOYSA-N 251.717 2.032 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](C)c2cc(OC)ccc2O)C1 185787864 YTIBJUGELYAXCX-RYUDHWBXSA-N 292.379 2.062 10 20 CECD COc1ccsc1C(=O)NCCc1ccc(O)c(O)c1 156583315 QVBBLDHWXUQIAM-UHFFFAOYSA-N 293.344 2.140 10 20 CECD CC[C@H](NCC1(CS(C)(=O)=O)CC1)c1ccccc1O 121107786 YESDNKZCLXRIET-ZDUSSCGKSA-N 297.420 2.258 10 20 CECD CCc1nnc(NCCc2ccc(O)c(O)c2)nc1CC 276316974 SZLRJNJWCLFSJA-UHFFFAOYSA-N 288.351 2.062 10 20 CECD CCCN(Cc1ccccc1O)C[C@H](O)CN(C)C1CC1 290066072 TVDSVLDHLBJKKZ-MRXNPFEDSA-N 292.423 2.059 10 20 CECD CO[C@H]1CN(Cc2ccc3ccccc3c2O)C[C@H]1OC 816591702 LRWYCWAVBKDCBM-IYBDPMFKSA-N 287.359 2.391 10 20 CECD C[C@@H](NC1CNC1)c1ccc(N2CCCCC2)c(F)c1 817955245 UAXSMOAEVIYMFT-GFCCVEGCSA-N 277.387 2.438 10 20 CECD CC[C@H](NC[C@H]1CNCCCO1)c1ccc(C)cc1O 817982467 SSIJGZIHVRKEEZ-HIFRSBDPSA-N 278.396 2.120 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2CNCCCO2)c(O)c1C 817982241 PSXQDRBTLFCHLM-UONOGXRCSA-N 278.396 2.038 10 20 CECD CC1(C)C(NC(=O)c2c(F)ccc(O)c2O)C1(C)C 826643331 MMQBBJVKZVAZGD-UHFFFAOYSA-N 267.300 2.401 10 20 CECD CCCN1CCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O 827930891 TUHZYIGPAYGJJU-TZMCWYRMSA-N 276.380 2.444 10 20 CECD CO[C@H](C1CC1)[C@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 837012478 ISZNDQXNTMFCPX-ITDOAVQJSA-N 291.347 2.041 10 20 CECD CC1(C)C[C@@H](CNC(=O)c2c(F)ccc(O)c2O)CCO1 839793583 UYFGJMHSRCBCNR-VIFPVBQESA-N 297.326 2.172 10 20 CECD CC[C@@H]1OCC[C@H]1NC(=O)N(C)Cc1ccccc1O 838776832 VIDNOWRHOMXNQA-OCCSQVGLSA-N 278.352 2.101 10 20 CECD NC[C@H]1CC[C@H](NCc2cc(Br)ccc2O)C1 841084522 KFPXFGAKUOIWCZ-CABZTGNLSA-N 299.212 2.372 10 20 CECD COc1ccc(CNC[C@]2(C)CCCNC2)cc1C 841058375 WPQPSOHBUKJJHP-MRXNPFEDSA-N 262.397 2.483 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](N)C[C@H]1C 846703818 QLINSTAQXHMYMC-UKRRQHHQSA-N 261.413 2.373 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CCCSC2)c1 748972358 QAERAIHQWRFSSJ-NSHDSACASA-N 296.392 2.096 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNC[C@H]2CCCNC2)c1O 841033595 WRSQDWCNKBALNI-VIFPVBQESA-N 299.758 2.043 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1CCCNCC1 846670200 ATBIWPPPLZAHFM-NSHDSACASA-N 299.465 2.131 10 20 CECD COc1cc(O)c(CN[C@H]2CS[C@@H](C)C2)cc1OC 840958825 OLZJOGMFWYKJHO-GXSJLCMTSA-N 283.393 2.393 10 20 CECD Oc1cccc2c1[C@@H](N[C@H]1CCN(CC(F)F)C1)CC2 841762525 PUPZDXMEUHUKPP-RYUDHWBXSA-N 282.334 2.309 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H](CN)C1CCCC1 841988942 VXFFAMBUYBLIRM-CQSZACIVSA-N 291.395 2.051 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1cccnc1O 857547666 OXCOQYMGEIGZPU-UHFFFAOYSA-N 278.695 2.076 10 20 CECD Cc1ccc(N[C@@H](C)Cc2ccc(O)c(O)c2)nn1 853474126 WISIZDMMWQPPCO-JTQLQIEISA-N 259.309 2.239 10 20 CECD CCc1cc(C(=O)NCc2cc(C)ccc2O)c(C)nn1 862757382 RNHHHQICFZRGNN-UHFFFAOYSA-N 285.347 2.291 10 20 CECD COCCC(C)(C)CNC(=O)c1cc(O)cs1 760449204 CHBFGTZTWROLRG-UHFFFAOYSA-N 257.355 2.246 10 20 CECD OCC[C@H](NCc1cccc(Cl)c1O)C1CCOCC1 764677109 FRSKBYBLMLLMAB-AWEZNQCLSA-N 299.798 2.313 10 20 CECD CCN(CC(=O)NC)Cc1ccc(N2CCCCC2)cc1 768304229 ZRQLAHIRLJQHFP-UHFFFAOYSA-N 289.423 2.245 10 20 CECD OCCc1nnc(NCc2c(O)cccc2Cl)s1 865294348 KZGBAIHLHYOKBB-UHFFFAOYSA-N 285.756 2.044 10 20 CECD COCc1noc([C@H](C)N[C@H](C)c2ccccc2O)n1 879649388 PPOWLVDHORDDDX-ZJUUUORDSA-N 277.324 2.333 10 20 CECD COC(=O)CC[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 874528009 HGJLFRXDSFMFIL-JTQLQIEISA-N 297.376 2.259 10 20 CECD O=C1N[C@@H](c2cccc(F)c2O)Nc2ccccc21 778519526 HJKUNDZBCAJTAT-ZDUSSCGKSA-N 258.252 2.385 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CCn1cccc1 773750770 WPINHXWRHJDDRX-LBPRGKRZSA-N 288.347 2.037 10 20 CECD CCC[C@H](O)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776247698 VUBZRVDIDKYBES-DOMZBBRYSA-N 293.411 2.274 10 20 CECD FC(F)Oc1ccc2c(c1)CCCN2Cn1cnnc1 776763314 QVZJGDNVEXIXSJ-UHFFFAOYSA-N 280.278 2.290 10 20 CECD COc1ccc(CNC[C@@H]2CCCN2C(C)=O)cc1C 1044891063 HSOUCFARZCLWDL-HNNXBMFYSA-N 276.380 2.104 10 20 CECD CCOc1ccc(CN[C@@H]2C[C@@H](OCC)[C@H]2OC)c(O)c1 775979193 RQKSQTJWRXBGJA-BMFZPTHFSA-N 295.379 2.073 10 20 CECD CN1CCN(c2ccc(CN(C)CC(F)F)cc2)CC1 775661726 AECAOXSNGHWKRA-UHFFFAOYSA-N 283.366 2.135 10 20 CECD Cc1nnc(NCc2ccc3c(c2)CCCN3C)nc1C 775459805 WPWIUACIDFENIG-UHFFFAOYSA-N 283.379 2.483 10 20 CECD Cc1cc(N(C)C)ccc1CN1C(=O)N[C@H](C(C)C)C1=O 777655543 KTWPJMRAODVKJC-CQSZACIVSA-N 289.379 2.137 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(F)cc(F)c2O)C1 896956035 NUDYKBLGIWZGLU-VIFPVBQESA-N 285.290 2.055 10 20 CECD COc1cc(C)cc(CN2CCC[C@@](C)(O)CC2)c1O 794672454 MMLWLFQPYKIZTA-MRXNPFEDSA-N 279.380 2.446 10 20 CECD C[C@H](NC(=O)C1=CCOCC1)c1ccc(N(C)C)cc1 793856444 QFMOSIQNATYSFS-LBPRGKRZSA-N 274.364 2.277 10 20 CECD C[C@H](CCC(=O)O)NCc1ccc2c(c1)CCCO2 1335615167 HXUKWKGXSXWOSG-LLVKDONJSA-N 263.337 2.355 10 20 CECD CCOC(=O)c1c[nH]ccc1=NCc1ccc(N(C)C)cc1 1320589639 OMXXPEULHXUHAX-UHFFFAOYSA-N 299.374 2.358 10 20 CECD CCC[C@@H](O)CNCc1c(O)cccc1Br 706875333 VKFPIMKIACOROG-SECBINFHSA-N 288.185 2.405 10 20 CECD COc1ccc(CNCc2cc(C)ncn2)cc1C 756990316 KQQCAZBOGSQTQK-UHFFFAOYSA-N 257.337 2.392 10 20 CECD Nc1ccc(CC(=O)N2CCc3ccsc3C2)cc1 712254383 HTQBEALEDGQGSX-UHFFFAOYSA-N 272.373 2.458 10 20 CECD CCN(Cc1cc(F)cc(C(C)=O)c1O)CC(C)(C)O 92970689 LGHJQISMNODLNH-UHFFFAOYSA-N 283.343 2.327 10 20 CECD Cc1nc([C@H](C)NCc2cc(F)cc(F)c2O)no1 1332707756 MQVCDVHMTZKDLW-LURJTMIESA-N 269.251 2.213 10 20 CECD Cc1cc(CN2CC[C@](O)(C3CC3)C2)ccc1N(C)C 1330334285 MDGZGWDHGZIZNB-QGZVFWFLSA-N 274.408 2.408 10 20 CECD Cn1c(-c2sccc2O)nnc1N1C[C@@H]2[C@@H](C1)C2(C)C 1262854153 AFEWJEPVTUNZMX-RKDXNWHRSA-N 290.392 2.341 10 20 CECD C[C@@H](NC(=O)[C@@H](O)c1ccccn1)c1ccc(N(C)C)cc1 1346993442 QBJDJOFJXVCLCU-WBMJQRKESA-N 299.374 2.058 10 20 CECD Cc1cccc(O)c1CNc1cccc(CC(=O)O)n1 1600543493 ZFEMARBPPYLQGR-UHFFFAOYSA-N 272.304 2.335 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H]2CC[C@]21CN 1579616643 CQEBHQWCYSVUHK-WBVHZDCISA-N 273.424 2.374 10 20 CECD CN(C(=O)NCc1ccc(N2CC=CC2)cc1)C1CC1 155719297 GPBVZXQODDXQSU-UHFFFAOYSA-N 271.364 2.367 10 20 CECD COc1ccnc(CN(C)c2ccc(N)cc2)c1OC 232196967 LYPGCDPACCBTQJ-UHFFFAOYSA-N 273.336 2.317 10 20 CECD COc1ccc(S(=O)(=O)Nc2ccc(O)cc2F)cc1 33859183 GDLPOFPSBMVDSX-UHFFFAOYSA-N 297.307 2.341 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCCNC 37807422 TZLUFSRJSWHTSK-UHFFFAOYSA-N 277.412 2.101 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CC12CCOCC2 377951728 UEPOXECRRLXVDY-CYBMUJFWSA-N 275.348 2.167 10 20 CECD OCCN(Cc1ccccc1)Cc1ccccc1O 819187 ARORWUIGDPBDTP-UHFFFAOYSA-N 257.333 2.387 10 20 CECD Cc1ncsc1CNC(=O)N(C)Cc1ccccc1O 105256352 ZNXYBADRXIERJU-UHFFFAOYSA-N 291.376 2.499 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cc(C)[nH]n2)cc1 57127044 BWJOPYNCRQMBDP-UHFFFAOYSA-N 286.379 2.494 10 20 CECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)[C@H]1CCCO1 20208537 IEBBKHYDBSJTRF-RHSMWYFYSA-N 290.407 2.180 10 20 CECD COc1ccc(O)c([C@H]2NC(=O)c3ccccc3N2C)c1 69055633 SBIHHLINPIPEFL-HNNXBMFYSA-N 284.315 2.279 10 20 CECD COc1ccc(N(C)CC(=O)Nc2cc(C)no2)cc1F 121789520 SSNKWDNEENMUSM-UHFFFAOYSA-N 293.298 2.206 10 20 CECD Cc1ccc(C(=O)NCCCOC2CCCC2)c(O)c1O 182256107 XHAZHHFKYIOOHV-UHFFFAOYSA-N 293.363 2.485 10 20 CECD Cc1cnccc1CNC(=O)/C=C/c1ccc(O)c(O)c1 187438965 BJQNISWSXAWOOE-HWKANZROSA-N 284.315 2.131 10 20 CECD CN(Cc1cc(F)ccc1O)CC1(O)CCCC1 180172721 OKRRPDHDAQXBGN-UHFFFAOYSA-N 253.317 2.268 10 20 CECD CSC1(CNCc2cc([N+](=O)[O-])ccc2O)CC1 193653616 CSDKHVNINQUOMW-UHFFFAOYSA-N 268.338 2.286 10 20 CECD CSC1(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CC1 191007788 YEXSHKAROZGSHS-VIFPVBQESA-N 281.377 2.041 10 20 CECD CCOc1cccc(CN[C@@H](C)C[C@H](C)O)c1O 228067377 FRMGSPSYPOQACK-QWRGUYRKSA-N 253.342 2.040 10 20 CECD Cn1nccc1CCNCc1cc(Cl)ccc1O 231033257 QDQYSGMYGYGSTA-UHFFFAOYSA-N 265.744 2.111 10 20 CECD C[C@@H](NCc1nnc2n1CCC2)c1ccc(F)c(F)c1O 277001777 ZHYXHIVFHXKJBE-MRVPVSSYSA-N 294.305 2.059 10 20 CECD COCC[C@H]1COCCN1Cc1cc(C)c(C)cc1O 365804671 RAARIEUUUWUTDJ-HNNXBMFYSA-N 279.380 2.246 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC(C)(F)F 277380540 QKBPJKLINWZFMM-QMMMGPOBSA-N 273.279 2.190 10 20 CECD CN1CCC(C)(CNCc2cc([N+](=O)[O-])ccc2O)CC1 272499721 GMLQQLDLIDVDPJ-UHFFFAOYSA-N 293.367 2.122 10 20 CECD C[C@H]1C(=O)CC[C@@H]1CC(=O)N(C)Cc1ccccc1O 279726444 CGFLBMZVFQPNRH-VXGBXAGGSA-N 275.348 2.356 10 20 CECD CC[C@H](N[C@@H](C)C(=O)NCCF)c1ccc(F)cc1O 287333286 GBKDTULKGSIIMW-CABZTGNLSA-N 286.322 2.046 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@](C)(CN)C2)c1O 380339570 YENFRCJTHWFYQU-OAHLLOKOSA-N 296.798 2.419 10 20 CECD CC(=O)N1CCC[C@H](CN[C@H](C)c2ccc(F)cc2O)C1 281170814 PXFHMKAIQSMHIA-DGCLKSJQSA-N 294.370 2.440 10 20 CECD C[C@@H]1CC(CCNC(=O)c2cccc(O)c2O)C[C@@H](C)O1 802196938 BOCCQQBIJSGUPN-GHMZBOCLSA-N 293.363 2.421 10 20 CECD Oc1c(Cl)cccc1CN1CCOCC12CC2 802658722 PSWRJWLYSXXWQX-UHFFFAOYSA-N 253.729 2.410 10 20 CECD COc1cc(Cl)cc(CNCc2nonc2C)c1O 809745259 PJYWGYNRIONFPD-UHFFFAOYSA-N 283.715 2.035 10 20 CECD C[C@H](N[C@@H]1CCN[C@H](C)C1)c1cc([N+](=O)[O-])ccc1O 817972633 YVPDWSDZUXVXDP-OUAUKWLOSA-N 279.340 2.092 10 20 CECD CCN(C)c1ccc(CN2C[C@H](O)C(C)(C)C2)cc1 815102967 NCAWHZJRHFCTIS-HNNXBMFYSA-N 262.397 2.345 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@](C)(O)c2ccccc2)cc1 817514265 XDLRICYDQNAWBR-SFHVURJKSA-N 298.386 2.277 10 20 CECD CC(C)NC(=O)CN(C)Cc1cc(Cl)c(F)cc1O 816482731 QKRNMMVKINZXLM-UHFFFAOYSA-N 288.750 2.141 10 20 CECD CC[C@H](N)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 817978833 FPKDJJPKDNVBRJ-ATZCPNFKSA-N 252.333 2.407 10 20 CECD CCN(CC[C@H](C)O)c1ccc(OC)c(OC)c1 828162515 IBVQIDPDANBBQV-NSHDSACASA-N 253.342 2.301 10 20 CECD COc1cc(O)c(CN2CC[C@H](OC)[C@@H](C)C2)cc1OC 824815317 LRHBUMJNLOWLKT-FZMZJTMJSA-N 295.379 2.266 10 20 CECD COc1ccc(CNC2(CC(=O)O)CCC2)cc1C 901706236 CUOTYRARQXGTBP-UHFFFAOYSA-N 263.337 2.491 10 20 CECD CNC(=O)C[C@H](C)N[C@@H](C)c1cc(Cl)ccc1O 834900101 MDYKYEVSJSDNQG-IUCAKERBSA-N 270.760 2.221 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2=COCC2)cc1 734122464 GGRLYIUWHOVAAJ-UHFFFAOYSA-N 274.364 2.453 10 20 CECD CC[C@@H](SC)C(=O)NCCc1ccc(N)cc1 844164950 VLWWFFJQMROLND-GFCCVEGCSA-N 252.383 2.069 10 20 CECD COc1cccc(CNCCCCCCN)c1O 843127036 MEWGVOACVSAUEE-UHFFFAOYSA-N 252.358 2.010 10 20 CECD COC/C(C)=C\C(=O)N[C@H](C)c1cc(OC)ccc1O 845834632 VLFAUNXNIRUWED-ZJRUKIMVSA-N 279.336 2.171 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@H]1CCCCN1 841032918 KAKAVERJOCRUOY-LLVKDONJSA-N 272.751 2.416 10 20 CECD O=C(NCCOc1ccccc1)NCc1ccccc1O 748462249 DBCZDNULKGTZGG-UHFFFAOYSA-N 286.331 2.270 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NC[C@H](N)CC 842009112 XKRBGMRFHIQFDQ-CQSZACIVSA-N 293.411 2.441 10 20 CECD CCOC[C@H](NC(=O)NCCc1ccc(N)cc1)C(C)C 841886985 XHDUBQXBQSHSMK-HNNXBMFYSA-N 293.411 2.172 10 20 CECD c1cc2c(cc1CN[C@H]1CCc3n[nH]cc3C1)CCCO2 921760208 GAIUOVHSERLMBA-HNNXBMFYSA-N 283.375 2.382 10 20 CECD COc1cccc([C@H](C)NCCN(C)CC(F)F)c1O 858596434 HDMBFHJOHFTJCS-JTQLQIEISA-N 288.338 2.248 10 20 CECD CN1CCN(c2ccc(CNCC3CC=CC3)cc2)CC1 858220686 JSAKQXNXFAWMFS-UHFFFAOYSA-N 285.435 2.494 10 20 CECD COC[C@H](OC)C(=O)Oc1ccc2c(c1)c(C)c(C)n2C 851091987 GKULYCWFYJWUQB-HNNXBMFYSA-N 291.347 2.362 10 20 CECD COc1cc(CNC[C@@H]2CCN2C)c(O)c(C(C)(C)C)c1 922574702 QAPZDBAXJCNTRF-ZDUSSCGKSA-N 292.423 2.492 10 20 CECD C[C@@H](N[C@@H]1C=C[C@H](CO)C1)c1cc(F)cc(F)c1O 756662188 XSORIFYIGLAILM-WCABBAIRSA-N 269.291 2.258 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccc(O)c(F)c1 857466807 HXOYWMZIBNNDFE-UHFFFAOYSA-N 289.306 2.438 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)OCCF)c1 859007329 ZXBMVGXHPXLWKM-MRVPVSSYSA-N 257.261 2.158 10 20 CECD CO[C@H]1CN(Cc2c(O)ccc(Cl)c2F)C[C@H]1OC 754153940 KQHCTYCGIWZEBL-TXEJJXNPSA-N 289.734 2.030 10 20 CECD CCOC(=O)/C=C/CN(C)c1ccc(OC)cc1OC 930076192 DCQVOKSDVCTSFF-VOTSOKGWSA-N 279.336 2.259 10 20 CECD COc1cccc(O)c1CN(C)Cc1cccn1C 769468656 NUMAHSVTHQEGOO-UHFFFAOYSA-N 260.337 2.371 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCCC(=O)NC)cc1 765406329 VAUYJGJFSSKINE-CYBMUJFWSA-N 277.412 2.320 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1[C@H]2Cc3ccccc3[C@H]21 860243618 RQZHFXDVUAIDBS-IAOVAPTHSA-N 295.338 2.300 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2ccccc2O)CCC1=O 764071140 TZCKMWNZYQXVLD-GHMZBOCLSA-N 261.321 2.014 10 20 CECD Cc1cccc(CN(C)CCCNC(=O)C2CCC2)c1O 763626845 PFRSZPNWSFZCDZ-UHFFFAOYSA-N 290.407 2.439 10 20 CECD CC[C@@]1(O)CCN(Cc2c(O)cccc2Cl)C1 779219350 NZDGWSZLIXNQRR-CYBMUJFWSA-N 255.745 2.392 10 20 CECD COCC1(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1 773018410 LSJBQGNIDQEYHH-LBPRGKRZSA-N 276.380 2.356 10 20 CECD CCCOc1ccc(CNCc2ncn(C)n2)cc1C 873099061 SRDNLXQOADLEBJ-UHFFFAOYSA-N 274.368 2.202 10 20 CECD CN1CCN(c2ccc(CNCc3ccn(C)c3)cc2)CC1 771844837 WVCLKLOIJQQUJG-UHFFFAOYSA-N 298.434 2.067 10 20 CECD CC[C@H](NC[C@@](C)(O)COC)c1cc(Cl)ccc1O 775504283 XHFFVYLNBHNNHP-GXTWGEPZSA-N 287.787 2.484 10 20 CECD COC(=O)CC1(NCc2cc(C)ccc2O)CCC1 777441111 OUUDYBZBUBANCA-UHFFFAOYSA-N 263.337 2.276 10 20 CECD CC[C@H](C)CC(=O)OCC(=O)c1ccc(O)c(O)c1 784927227 ZSLSJOXGUHVESW-VIFPVBQESA-N 266.293 2.260 10 20 CECD CN(Cc1cc(F)cc(F)c1O)[C@@H]1CCCC[C@H]1O 895439029 SYZDDLDZPWBWMS-CHWSQXEVSA-N 271.307 2.406 10 20 CECD CCc1ncsc1C(=O)NCc1ccc(OC)cc1O 794378594 VHZFXRMJFWIJSI-UHFFFAOYSA-N 292.360 2.350 10 20 CECD O=C(O)c1coc(CNCc2ccc3c(c2)CCO3)c1 276925646 ATCOJDDTEKMJEH-UHFFFAOYSA-N 273.288 2.203 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC/C=C/C1CC1 1324371711 OVTXKPFBUCFHGR-NLYMIESDSA-N 259.305 2.193 10 20 CECD C[C@]1(CN)CCN(Cc2ccc(N3CCCC3)cc2)C1 1326201946 MMKMWOXUCMPYQF-QGZVFWFLSA-N 273.424 2.458 10 20 CECD CCOC(=O)[C@@H](NCc1cc(Cl)ccc1O)C1CC1 1338881297 KPCUQVXFIAUHTB-ZDUSSCGKSA-N 283.755 2.477 10 20 CECD Cc1ccc(CN(C)C(=O)NCc2ccc(N)cc2)nc1 1335736974 IZBIYLDFDNHYJE-UHFFFAOYSA-N 284.363 2.314 10 20 CECD CCCC[C@@H](COC)NC(=O)NCc1ccc(N)cc1 1346634795 ZMROWAIDUKXJBG-AWEZNQCLSA-N 279.384 2.273 10 20 CECD CN(C)c1ccc(CNC2CC(CC(=O)O)C2)cc1 1353952858 UURBAHCBYXJLLV-UHFFFAOYSA-N 262.353 2.096 10 20 CECD CN1CCCc2cc(CN[C@H]3CC[C@@H](C(=O)O)C3)ccc21 1606230088 PWGGUBGKEJPCJK-CABCVRRESA-N 288.391 2.412 10 20 CECD Cc1[nH]c(CN2Cc3cccc(O)c3C2)cc1C(=O)O 1599964604 OZXDHROFMGJEIM-UHFFFAOYSA-N 272.304 2.243 10 20 CECD C[C@H](N[C@H]1CCN(C)[C@H](C)C1)c1cc(C(=O)O)ccc1O 1593220069 QCFZBWAAXZRYIU-MDZLAQPJSA-N 292.379 2.224 10 20 CECD CCN1CCc2cc(CN[C@@H](C(=O)O)C3CC3)ccc21 1776884710 MCQZVWQNUWGTRY-OAHLLOKOSA-N 274.364 2.022 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1cccnc1 152978143 JHGJTPCVNXLWTN-JTQLQIEISA-N 287.319 2.246 10 20 CECD Oc1ccccc1CN1CCn2c(nnc2C(F)(F)F)C1 156044291 KMJQQNNVPMDZTC-UHFFFAOYSA-N 298.268 2.018 10 20 CECD COc1cccc(O)c1CN(C)C1CCC(N)CC1 843055644 JQLYLLWASPKBAM-UHFFFAOYSA-N 264.369 2.103 10 20 CECD CCC[C@H]1CNCCN1Cc1ccc(N(C)C)cc1 107092182 ZADFMKOYODUUMG-INIZCTEOSA-N 261.413 2.327 10 20 CECD Oc1ccc(F)cc1CN1CCC([C@@H]2CCNC2)CC1 843126770 MZJBFRNTKLUUSX-CYBMUJFWSA-N 278.371 2.353 10 20 CECD COC(=O)N1CCC(NCc2c(O)cccc2Cl)CC1 113327823 KUHQIXFTXMRMLZ-UHFFFAOYSA-N 298.770 2.366 10 20 CECD CNC(=O)[C@@]1(C)CCN(Cc2cccc(Cl)c2O)C1 228098960 CMYDAXHWVPVXKV-AWEZNQCLSA-N 282.771 2.004 10 20 CECD CC(=O)c1cc(F)cc(CN(C)[C@@H](C)C(C)(C)O)c1O 295047434 AVWXBGNWNBSFQK-JTQLQIEISA-N 283.343 2.325 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)c1cn(C)cn1 710115705 HTPDKMYKNQTWDW-NSHDSACASA-N 257.337 2.206 10 20 CECD OC[C@H](C[C@@H]1CCCO1)NCc1c(O)cccc1Cl 886226834 SCLWMXXUDORGGU-QWRGUYRKSA-N 285.771 2.065 10 20 CECD Oc1cc2c(cc1CN[C@H]1CCC[C@@H]3C[C@H]13)OCO2 839186322 HPNHETPASCCCKH-USWWRNFRSA-N 261.321 2.399 10 20 CECD Cc1cc(C(=O)NCc2ccc(N3CCCC3)cc2)[nH]n1 54775704 OTFBVDHAJKHWMX-UHFFFAOYSA-N 284.363 2.248 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cocn1 104880202 YDLQJDBBMQNCCL-UHFFFAOYSA-N 260.293 2.433 10 20 CECD COC[C@@H](C)CNC(=O)N(C)Cc1ccc(N(C)C)cc1 171595716 LOWIVAQDFCPUNN-ZDUSSCGKSA-N 293.411 2.177 10 20 CECD CCc1nnc2ccc(N(C)Cc3ccccc3O)nn12 301958027 AUFYXKSUJSGXRG-UHFFFAOYSA-N 283.335 2.029 10 20 CECD COc1ccc(N(C)CCOCC(F)F)c(OC)c1 189746117 LUNOVSIZWOWUEE-UHFFFAOYSA-N 275.295 2.422 10 20 CECD C[C@@H](NCCCC(=O)N(C)C)c1ccc(F)c(F)c1O 187672418 ZYVFZLDZFVDHQH-SECBINFHSA-N 286.322 2.189 10 20 CECD CC[C@@H](COC)NC(=O)N(C)Cc1ccc(N(C)C)cc1 129318671 MUZJTSXSYQTWFV-AWEZNQCLSA-N 293.411 2.319 10 20 CECD CCOc1cccc(CN2CCC(C)(CO)CC2)c1O 184071240 DXYPJULFZDUHDG-UHFFFAOYSA-N 279.380 2.385 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CC[C@H](O)C2)c1 189341995 SXURMZXJZGQVJH-WOPDTQHZSA-N 265.353 2.212 10 20 CECD CC1CCN(CC(=O)N(C)Cc2ccccc2O)CC1 136180008 VPOQKQACWBRPAL-UHFFFAOYSA-N 276.380 2.083 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@]1(C)CCCO1 133343494 FTYMSYWSCYPXOD-HNNXBMFYSA-N 278.352 2.103 10 20 CECD CCOCc1cc(CNCCCCO)ccc1OC 193249179 NHYSJZULCBKDDN-UHFFFAOYSA-N 267.369 2.094 10 20 CECD COCCC[C@H](C)C(=O)NCc1ccccc1O 272439792 ZWGVVSICRSNSKE-NSHDSACASA-N 251.326 2.071 10 20 CECD Cc1cc(O)c(CN2CCO[C@@]3(CCO[C@@H]3C)C2)cc1C 377272318 BLQAYBTWSHZDKF-PBHICJAKSA-N 291.391 2.389 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@]3(CCOC3)C2)c1O 280137712 CTLVFXDTCDKNQV-XJKSGUPXSA-N 277.364 2.080 10 20 CECD COc1cc(N(C)C[C@H](C)OC)c([N+](=O)[O-])cc1OC 286259310 DXNDOAFIHNRLAE-VIFPVBQESA-N 284.312 2.083 10 20 CECD CN(C)c1ccc(CNc2ccc(CCO)nc2)cc1 806670168 IYSWEEYAKBQWKS-UHFFFAOYSA-N 271.364 2.295 10 20 CECD CC(=O)C(=O)COC(=O)c1c(Cl)cccc1Cl 808488093 ATFWZJRTMGGYGX-UHFFFAOYSA-N 275.087 2.308 10 20 CECD O=C(Nc1ccc2c(=O)cc[nH]c2c1)c1cccc(O)c1O 807367275 OWDJXOHUOXMASH-UHFFFAOYSA-N 296.282 2.192 10 20 CECD C[C@@H]1C[C@@H](NCCc2ccc(N)cc2)c2nccn21 817957796 PGFAYDPOPIXJAG-BXUZGUMPSA-N 256.353 2.303 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCc1ncccn1 812449124 KNVUTEJHXUOXIK-UHFFFAOYSA-N 298.390 2.134 10 20 CECD Cc1c(C)n(C)c2ccc(OC(=O)c3nnn(C)c3C)cc12 817762215 UFSHALYZQOWNTB-UHFFFAOYSA-N 298.346 2.451 10 20 CECD CCN(Cc1cccc(Br)c1O)[C@H](C)CO 814169010 BAOGWINIAHCJJE-SECBINFHSA-N 288.185 2.357 10 20 CECD COC[C@@H](C)CNCc1ccc(N2CCC(O)CC2)cc1 827662765 USNQEHUKHYESJS-AWEZNQCLSA-N 292.423 2.020 10 20 CECD CCO[C@@H]1CCC[C@H]1NCc1cc(OC)c(OC)cc1O 825284368 LWLCTIQUWUBBQB-TZMCWYRMSA-N 295.379 2.457 10 20 CECD Oc1cccc2c1[C@@H](N[C@@H]1CCc3n[nH]cc3C1)CC2 834680702 GFKZBGWIPRITTR-OCCSQVGLSA-N 269.348 2.250 10 20 CECD CCOc1ccc(CNc2cc(C)cn(C)c2=O)c(O)c1 902255207 HPHRIGCHRPUCPY-UHFFFAOYSA-N 288.347 2.410 10 20 CECD CCN(CC(=O)O)Cc1cc(C(C)(C)C)cc(O)c1O 737074271 DPAFXMKIPGANNY-UHFFFAOYSA-N 281.352 2.302 10 20 CECD CCCNC(=O)NC(=O)CSc1ncc(Cl)s1 849998284 MELSYWIQZLDDGO-UHFFFAOYSA-N 293.801 2.124 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C(C)(C)F 156970651 HWZYYNNLJJUARV-UHFFFAOYSA-N 252.333 2.425 10 20 CECD CN(C)c1ccc(/C=C\CN2CCC[C@@H]2C(=O)O)cc1 840995599 XTFHROFFGGBTIW-UYWPIULCSA-N 274.364 2.315 10 20 CECD C[C@@H](NCc1cn[nH]c1)c1ccc(N2CCOCC2)cc1 749915594 MZASWDACBZIZMY-CYBMUJFWSA-N 286.379 2.097 10 20 CECD NCc1ccc2c(c1)CCCN2CCOC[C@@H]1CCCO1 843350704 SVEIWKLAKBCRRC-INIZCTEOSA-N 290.407 2.094 10 20 CECD O=C(Cc1ccc2c(c1)CCC2)NCc1ccc(O)cc1O 910957109 JGLYBDCQWXOFJN-UHFFFAOYSA-N 297.354 2.445 10 20 CECD CC(C)CN(CC(C)C)C(=O)C(=O)Nc1ccc(N)cc1 841009701 GYFOMPBBEDTIAW-UHFFFAOYSA-N 291.395 2.348 10 20 CECD CC1(C)CCCC[C@@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841069061 MECUOZWFOADGHZ-ZDUSSCGKSA-N 289.379 2.292 10 20 CECD Cc1ccc(C(=O)N[C@H]2CS[C@@H](C)C2)c(O)c1O 840511268 XKDYDZZQBWSQOO-DTWKUNHWSA-N 267.350 2.030 10 20 CECD c1cc(N2CCCC2)ccc1CN[C@@H]1[C@@H]2C[C@H]3[C@H](CN[C@H]31)C2 925542006 FOJXWRICAVDVLP-WAARBJQMSA-N 297.446 2.373 10 20 CECD CCN(C(=O)/C=C\c1cnccc1C)c1cnn(C)c1 848343716 OGLQCDRHGRDXER-WAYWQWQTSA-N 270.336 2.190 10 20 CECD C[C@@H]1CN(CCN[C@H](C)c2ccc(Cl)cc2O)CCO1 841748369 XBISIOMNDISBJQ-VXGBXAGGSA-N 298.814 2.417 10 20 CECD Cc1cc(CC(=O)N[C@H](C)c2ccc(N(C)C)cc2)on1 845957637 QNCWHKYJQDPFLY-GFCCVEGCSA-N 287.363 2.469 10 20 CECD CNC[C@H](C)NCc1cc(Br)cc(C)c1O 853249390 QNYMZQXOWFEHCO-VIFPVBQESA-N 287.201 2.161 10 20 CECD COc1ccc(N2CCC(N[C@@H]3C[C@]3(C)OC)CC2)cc1 850410905 YWNPXQDZXOJZBK-SJORKVTESA-N 290.407 2.431 10 20 CECD Cc1ccc([C@@H](C)NCc2ccnc(N(C)C)n2)c(O)c1 756792117 YLESSNPYTADBNZ-GFCCVEGCSA-N 286.379 2.407 10 20 CECD CCn1cnnc1CCN[C@H](C)c1ccc(C)cc1O 756733303 OLWGVLRBQIUQAB-GFCCVEGCSA-N 274.368 2.205 10 20 CECD CN(C)c1cc(F)c(CNC[C@H]2CCCO2)cc1F 858087144 UNBMEVJYFYGHOO-LLVKDONJSA-N 270.323 2.299 10 20 CECD CC(C)(C)N1CC[C@H](NCc2cc3c(cc2O)OCO3)C1 850350262 ABTBNUJSDSNPNO-LBPRGKRZSA-N 292.379 2.083 10 20 CECD O=C(C=C1CCCC1)NCCc1ccc(O)c(O)c1 762261530 OKMFXCFRQNXWOH-UHFFFAOYSA-N 261.321 2.257 10 20 CECD CCc1cc(N[C@@H](C)Cc2ccc(O)c(O)c2)ncn1 762800631 VAPCGKMDBUFHPD-JTQLQIEISA-N 273.336 2.493 10 20 CECD CN(C)c1cc(F)c(CN(CCO)CC(F)F)cc1F 862351934 WFKKRPXCCQNAOQ-UHFFFAOYSA-N 294.292 2.090 10 20 CECD C[C@@H]1OCC[C@H]1COC(=O)/C=C\c1ccc(O)c(O)c1 869441987 ABGNNZQVVKDFQO-CVEGFPIKSA-N 278.304 2.079 10 20 CECD Cc1ccc(CN2CCCC[C@H]2CS(C)(=O)=O)c(O)c1 877568639 TVQFBVOIMJBHBP-AWEZNQCLSA-N 297.420 2.100 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1C[C@H]2CC[C@H]1O2 1117507952 ZKDDZVGGUKWYAX-BRDIYROLSA-N 293.710 2.382 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H](C)n2cccc2)c1 1118909810 AKRKXEZMESEGDB-LBPRGKRZSA-N 258.321 2.380 10 20 CECD Cn1nc(CNC(=O)c2cc(O)cs2)c2ccccc21 760449107 AIBZGSUYXWYDCK-UHFFFAOYSA-N 287.344 2.270 10 20 CECD COCCOC1CCN(Cc2ccc(C)cc2O)CC1 876724880 BFTNFFXVKVEIEV-UHFFFAOYSA-N 279.380 2.328 10 20 CECD CCCOC(=O)[C@@H](C)N[C@H](C)c1ccccc1O 879648363 LNTDRKCHWDWMMM-GHMZBOCLSA-N 251.326 2.385 10 20 CECD COC(=O)C(C)(C)N(C)Cc1cccc(C)c1O 775674636 HBFABYZJUNNGGI-UHFFFAOYSA-N 251.326 2.084 10 20 CECD CCN(C)c1ccc(CN2CCC[C@H](CO)C2)cc1 773734252 NTRNAJZHAQJOEL-HNNXBMFYSA-N 262.397 2.347 10 20 CECD C[C@@H]1CC[C@@H](NC(=O)/C=C/c2ccc(O)c(O)c2)C1 781617092 ACSMKLQXRWAKLX-UHLPNAGUSA-N 261.321 2.416 10 20 CECD COC(=O)C[C@H](NCc1cc(OC)ccc1O)C(C)(C)C 897889627 WCHBZPQDHCTBDZ-AWEZNQCLSA-N 295.379 2.468 10 20 CECD CCN(CC)C(=O)CNCc1c(O)ccc(Cl)c1F 790956166 PDMXTZCUXKCNNB-UHFFFAOYSA-N 288.750 2.143 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5C[C@H]42 793683785 YIADGTBJDVSAHG-KDZPWCFYSA-N 295.382 2.402 10 20 CECD CO[C@H]1CN(Cc2cc3c(cc2O)CCCC3)C[C@H]1OC 792712950 GHLBYVNPFKCUJX-CALCHBBNSA-N 291.391 2.117 10 20 CECD O=C(OC[C@@H]1CC2(CCC2)C(=O)O1)c1cc(O)cs1 791383795 ZDLSUPHQQLYBFX-VIFPVBQESA-N 282.317 2.096 10 20 CECD CCN[C@H](C)CNCc1ccc(N2CCCC2)cc1 1325274730 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C[C@@H](NCc1cccnc1)c1cc(C(=O)O)ccc1O 1593305643 ZHLTUJDWJJBIGB-SNVBAGLBSA-N 272.304 2.336 10 20 CECD CCN1CCCc2cc(CNCCC(=O)O)ccc21 1776875452 CWXLIZCEJPOZLA-UHFFFAOYSA-N 262.353 2.023 10 20 CECD CCN(C)c1ccc(Cn2cc([N+](=O)[O-])ccc2=O)cc1 153646745 NTAPIFXDLFGAFA-UHFFFAOYSA-N 287.319 2.261 10 20 CECD O=C(NCCCF)NCCCSc1nccs1 154487018 SQAWONQDFIZNJK-UHFFFAOYSA-N 277.390 2.284 10 20 CECD CC(C)(CCNCc1ccc2c(c1)CCO2)C(=O)O 258812701 FKTJOVDMAKQEMG-UHFFFAOYSA-N 263.337 2.212 10 20 CECD c1cc2c(cc1CNCCCNC1CC1)CCCO2 228410785 XKENGNQDMZXXOO-UHFFFAOYSA-N 260.381 2.243 10 20 CECD COc1ccc(CNCC2([S@@](C)=O)CCC2)cc1C 280626428 LOZAGSUSPPDLAE-LJQANCHMSA-N 281.421 2.394 10 20 CECD C[C@@H](CO)N[C@@H](C)c1ccc(N2CCOCC2)cc1Cl 127544228 LOSSNBHOFXNTEN-RYUDHWBXSA-N 298.814 2.208 10 20 CECD C[C@@H]1SCCN(C(=O)c2cccc(O)c2O)[C@@H]1C 126564489 ZDEPKSJRAPYXFR-BDAKNGLRSA-N 267.350 2.064 10 20 CECD C[C@H](NCCCN1CCC(O)CC1)c1ccc(F)cc1O 185116052 FHNKEJXAULLFCB-LBPRGKRZSA-N 296.386 2.029 10 20 CECD Cn1c(-c2ccccc2)cnc1SCC(=O)N1CCC1 74233121 PBAXTMLXORZHSB-UHFFFAOYSA-N 287.388 2.412 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1cccc(C)c1O 180418853 GGNUQQWRSBZQKV-ZDUSSCGKSA-N 263.337 2.228 10 20 CECD CCN(C[C@@H]1CCCO1)C(=O)/C=C/c1ccc(O)c(O)c1 180969511 VTIJJNWYJVIFCJ-CFNZNRNTSA-N 291.347 2.139 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccnc(F)c1 41039908 JROXFDUWAJVIBD-UHFFFAOYSA-N 260.268 2.199 10 20 CECD CCOCc1cc(CNC[C@@H](C)OC)ccc1OC 191138133 WZTKACKIPXAYFH-GFCCVEGCSA-N 267.369 2.356 10 20 CECD CCOC(=O)c1cnc(Sc2ncc[nH]2)s1 380996177 MREKELUUVZCZAE-UHFFFAOYSA-N 255.324 2.194 10 20 CECD O=C(N[C@@H]1CCOC2(CCCC2)C1)c1cccc(O)c1O 193138732 BVACJAPEVAPUOI-LLVKDONJSA-N 291.347 2.319 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2C[C@H]3CC[C@H]2O3)cc1F 265029009 BCXSRNKOFWRBPM-TYNCELHUSA-N 292.354 2.075 10 20 CECD CC[C@H](NCCc1n[nH]c(C)n1)c1ccc(C)cc1O 280251945 WSFDTZQFXVAIQU-ZDUSSCGKSA-N 274.368 2.411 10 20 CECD Oc1ccccc1CN1CCOC2(CCOCC2)CC1 375078777 KSRFGZDDWOLUFT-UHFFFAOYSA-N 277.364 2.164 10 20 CECD COc1ccc(CNC(=O)c2occ3c2CCC3)c(O)c1 803292400 OLPOSYYLQLEELW-UHFFFAOYSA-N 287.315 2.413 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](S(C)(=O)=O)CC2)c1 800534012 IUJSGMNKCHTQSD-AWEZNQCLSA-N 297.420 2.100 10 20 CECD CNC(=O)CCN(C)Cc1ccc2ccccc2c1O 816502670 LBJWPNCERHZWJC-UHFFFAOYSA-N 272.348 2.113 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H]3CCO[C@@H]3C)C2)cc1 818221456 MUFAEKODGHTQQA-CKEIUWERSA-N 290.407 2.289 10 20 CECD Nc1ccc(CC(=O)NCC2Cc3ccccc3C2)cc1 829882752 AJTSLWHUHAQMRT-UHFFFAOYSA-N 280.371 2.343 10 20 CECD Cc1cc(O)c(CN2CCO[C@@H](C(=O)O)C2)cc1C(C)C 738239683 LFLGYUIASDIPRM-OAHLLOKOSA-N 293.363 2.109 10 20 CECD CC1(CNCc2ccc3c(c2)CCCO3)CCNCC1 904356274 UXWGUYBIEDUWTG-UHFFFAOYSA-N 274.408 2.491 10 20 CECD O=C(O)[C@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 739582658 HHSKTPIXUMLUSD-ZDUSSCGKSA-N 275.348 2.178 10 20 CECD O=C1CC[C@@H]2[C@H]1[C@H]2C(=O)NCc1ccc(N2CCCC2)cc1 906110769 HCPCCXGKIPCXRI-OIISXLGYSA-N 298.386 2.128 10 20 CECD CCn1ccnc1[C@H](C)NC(=O)c1cc(O)cs1 839785838 LAJDBDOXVDZLPV-QMMMGPOBSA-N 265.338 2.161 10 20 CECD CCO[C@H]1CCN(C(=O)NCc2ccc(N(C)C)cc2)C1 913926983 ROBYXBHPDUVERB-HNNXBMFYSA-N 291.395 2.073 10 20 CECD CCOc1cccc(CN2CC(OC(F)F)C2)c1O 839145383 SFKCBRKIPNSQDJ-UHFFFAOYSA-N 273.279 2.214 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](CN)C[C@@H]1C 843057845 MMGDHFYZDQVZOU-KBPBESRZSA-N 261.413 2.230 10 20 CECD CCCN(Cc1cc(OC)ccc1O)[C@@H]1CCN(C)C1 843422819 SUUVEEJIRUKAIN-CQSZACIVSA-N 278.396 2.317 10 20 CECD CCOCCCN[C@H](C)c1cccc(OC)c1O 846136607 IDRVYQJIJGHPJH-LLVKDONJSA-N 253.342 2.478 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2COCCO2)cc1F 740004728 UIJXSGRZEULUOW-CQSZACIVSA-N 296.386 2.177 10 20 CECD COc1cc(Cl)cc(CN(C)Cc2nc(C)no2)c1O 848928330 YKRJRWQURCJMAH-UHFFFAOYSA-N 297.742 2.378 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)Cc2ccccn2)c(O)c1O 848311090 IZPUNDYPPJIBII-NSHDSACASA-N 286.331 2.162 10 20 CECD CCC(CC)(CO)C(=O)N[C@H](C)c1cc(OC)ccc1O 847588656 AKYCTLJZXKCEHM-LLVKDONJSA-N 295.379 2.377 10 20 CECD CCOC(=O)C1(CNCc2ccc(N(C)C)cc2C)CC1 840939584 ZKKGNOMOUFUXKD-UHFFFAOYSA-N 290.407 2.494 10 20 CECD CC(C)(C)N1CC[C@@H](NC(=O)c2cc(O)cs2)C1 855286721 WJODBGOKNOIVLZ-SECBINFHSA-N 268.382 2.056 10 20 CECD COc1ccc(CN(C)Cc2c(O)cccc2OC)cn1 757918205 XUQFOWLOIUTZCF-UHFFFAOYSA-N 288.347 2.436 10 20 CECD CC[C@@H](NCCCS(C)(=O)=O)c1ccc(N(C)C)cc1 765754758 QXLCWHWGSLKAPP-OAHLLOKOSA-N 298.452 2.228 10 20 CECD CC[C@]1(O)CCCN(Cc2cc(OC)c(OC)cc2O)C1 877691728 UPRQJTKVCOJRJI-INIZCTEOSA-N 295.379 2.146 10 20 CECD O=C1NC(=S)S/C1=C\c1ccc([N+](=O)[O-])cc1F 777869043 DXMCXIFOQHQFPM-BAQGIRSFSA-N 284.293 2.223 10 20 CECD C[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CCC1 779541810 KJOCRSQBMYDXCZ-QEHWCHDUSA-N 261.321 2.416 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCOCCN(C)C)cc1 774381356 MKILZDSQGOQATD-OAHLLOKOSA-N 293.455 2.372 10 20 CECD COc1ccc(F)cc1CC(=O)NCc1ccccc1O 775880375 OMTZGAOFOZXCFC-UHFFFAOYSA-N 289.306 2.399 10 20 CECD CC(=O)N1CCC[C@H](CNCc2cc(F)cc(F)c2O)C1 883107508 ASHQJGHTLDZOEQ-LLVKDONJSA-N 298.333 2.019 10 20 CECD CC(C)C[C@@H]1C(=O)NCCN1Cc1c(O)cccc1Cl 783727733 FKKSYNLLGIEJCA-CYBMUJFWSA-N 296.798 2.392 10 20 CECD COc1ccc(CNC(=O)c2ccnc(Cl)c2)c(O)c1 794387122 FLGLRSFSRVUHMA-UHFFFAOYSA-N 292.722 2.379 10 20 CECD CCn1ccc(CN(C)C(=O)c2ccc(C)c(O)c2O)c1 791000396 UJPYRLAXSZBZOF-UHFFFAOYSA-N 288.347 2.500 10 20 CECD COCCN(C(=O)c1cccc(O)c1O)[C@H]1CC[C@H](C)C1 791772882 FDSPFGCCHJIJBF-RYUDHWBXSA-N 293.363 2.375 10 20 CECD COC(=O)CCCC(=O)Nc1c(Cl)ccc2nonc12 1323420832 ZAIBBEBWPYYMRO-UHFFFAOYSA-N 297.698 2.158 10 20 CECD CN1CCC[C@H](CN(C)Cc2cc(F)cc(F)c2O)C1 708412588 JPJSXFCWGOCLDL-NSHDSACASA-N 284.350 2.444 10 20 CECD COc1cccc(O)c1CNCCc1cccc(C)n1 793203274 WFLXDRRMWMRDOC-UHFFFAOYSA-N 272.348 2.437 10 20 CECD Cc1c(CNCc2cc(F)c(N(C)C)cc2F)cnn1C 1351331647 YYGCWXZLVFBYEZ-UHFFFAOYSA-N 294.349 2.363 10 20 CECD CC(C)C[C@H](CNC(=O)c1cc(O)cs1)CC(=O)O 1588894623 PYMFKJHZJJCEQD-VIFPVBQESA-N 285.365 2.321 10 20 CECD CN(Cc1ccncc1F)c1ccc(OCC(=O)O)cc1 1598531546 WDVCKTLPJGNKRO-UHFFFAOYSA-N 290.294 2.321 10 20 CECD CCCC[C@H](NCc1cc(OC)c(OC)cc1O)C(=O)O 1595637977 ALZTZSVKGODSKU-NSHDSACASA-N 297.351 2.142 10 20 CECD CC(C)(C)C[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776245751 NQLDQVYKWIDUMY-NSHDSACASA-N 296.323 2.279 10 20 CECD COc1cccc(NC(=O)c2cccc(O)c2O)c1 126233504 WVZWUJAHVXDCNU-UHFFFAOYSA-N 259.261 2.359 10 20 CECD CC[C@@H]1CN(Cc2cccc(OC)c2O)[C@@H](C)CO1 403841967 STRMGJFQZCWEBI-WCQYABFASA-N 265.353 2.400 10 20 CECD C[C@@H]1CCCN(Cc2cc(F)ccc2O)[C@@H]1CCN 404516891 SXKKIGBRJHYPRT-BXUZGUMPSA-N 266.360 2.481 10 20 CECD COc1ccc(O)c(CN[C@@H](C)CN(C)C(C)C)c1 388298995 ZZIBNNOENVBKHF-LBPRGKRZSA-N 266.385 2.219 10 20 CECD Oc1cccc2c1[C@@H](NCC1CC3(C1)OCCO3)CC2 927000560 PWTWHSOARSHQSE-ZDUSSCGKSA-N 275.348 2.122 10 20 CECD O=C(CCc1ccccc1)NCCc1ccc(O)c(O)c1 1644300 AQTKQQPTLASVMQ-UHFFFAOYSA-N 285.343 2.389 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CC[C@H](N)C2)cc1 178711685 LWBUNWZDHPBQRW-GJZGRUSLSA-N 289.423 2.276 10 20 CECD CCCC[C@H](COC)NC(=O)NCc1ccccc1O 76978758 BGHQCBOXZGRNMX-CYBMUJFWSA-N 280.368 2.397 10 20 CECD C[C@H]1CCSCCN1Cc1cc2c(cc1O)OCO2 189912497 VVNHOSCDHRQQRX-JTQLQIEISA-N 281.377 2.448 10 20 CECD CCOCc1cc(CNCC2(CO)CCC2)ccc1OC 184378417 MRHXJUIHCQMWKI-UHFFFAOYSA-N 293.407 2.484 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N(C3CC3)C2)c1 186088350 DJRSHICQWRIMAP-NWDGAFQWSA-N 274.364 2.115 10 20 CECD C[C@](O)(CNCc1cc(Cl)ccc1O)C1CC1 383541103 UIGVDAXCGJQKLQ-ZDUSSCGKSA-N 255.745 2.296 10 20 CECD CSc1ccccc1C(=O)N1CC[S@](=O)[C@H](C)[C@H]1C 265493011 ILSLUNIBBRVORK-BFKGZMGPSA-N 297.445 2.390 10 20 CECD COc1cccc(CNC[C@](C)(O)c2cccs2)c1O 265780943 OKAVDXNTDUJBRB-HNNXBMFYSA-N 293.388 2.460 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H]2C[C@@H](C)O)c1O 269865268 XAEDWTJQQPEQQD-YGRLFVJLSA-N 295.354 2.469 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NOC1CCCC1 272720402 ZHPRRPVOVOZTDE-SOFGYWHQSA-N 263.293 2.101 10 20 CECD CCN(CC)S(=O)(=O)Nc1cc(Cl)c(O)cc1F 288300257 SKRRRZJFQHQTPO-UHFFFAOYSA-N 296.751 2.183 10 20 CECD Cc1cc(O)c(CN[C@@H](C)C(=O)N2CCCC2)cc1C 281390629 OYVGEUCVJJCSHN-ZDUSSCGKSA-N 276.380 2.110 10 20 CECD CCOc1ccc(O)c(CNCc2nc(C3CC3)n[nH]2)c1 294812981 OBSYNTUDMKWDEP-UHFFFAOYSA-N 288.351 2.076 10 20 CECD COCC(C)(C)CNCc1ccc([N+](=O)[O-])c(OC)c1O 292837641 RVMCJSSUOFAVTE-UHFFFAOYSA-N 298.339 2.071 10 20 CECD CCOCC(C)(C)NC(=O)/C=C/c1ccc(O)c(O)c1 293983172 VTQDMLXJEQUSFY-SOFGYWHQSA-N 279.336 2.042 10 20 CECD C[C@H](N[C@@H]1CCC[C@H](N)C1)c1cc([N+](=O)[O-])ccc1O 817969900 HWOLFWQFFVUMIG-GARJFASQSA-N 279.340 2.221 10 20 CECD CCCN1C[C@@H](CN[C@@H]2CCc3cccc(O)c32)CC1=O 817589905 RELKNDQVEJPLDC-TZMCWYRMSA-N 288.391 2.228 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)cc1 817977090 AVEBVDBYBXQOHH-FWYOQMDTSA-N 259.397 2.011 10 20 CECD COCCN(C)c1nc(-c2ccc(O)c(O)c2)cs1 823208463 IYRLFCPFSRAVHA-UHFFFAOYSA-N 280.349 2.304 10 20 CECD Oc1cc(Br)ccc1CN1CC2(CCOC2)C1 826024351 ZQXNUKWGLYTHKS-UHFFFAOYSA-N 298.180 2.377 10 20 CECD CCCCC[C@@H](O)C(=O)NCc1ccc(N(C)C)cc1 822226744 FUPVFVXNPMXLQO-OAHLLOKOSA-N 278.396 2.310 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NC(CF)CF)c1 836529868 NPOSDYWYXZJNGQ-MRVPVSSYSA-N 288.294 2.069 10 20 CECD CCN1CCC[C@H](N[C@H](C)c2c(O)cccc2F)C1=O 903387764 IYSCTAKRGLRAMC-PWSUYJOCSA-N 280.343 2.193 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(C)n(C)n1 734406498 WPSXOCJSEYDCMO-UHFFFAOYSA-N 286.379 2.033 10 20 CECD Nc1ccc(CCNC(=O)[C@H]2CCCc3cccnc32)cc1 832659238 WAVIZXREIICVJX-INIZCTEOSA-N 295.386 2.443 10 20 CECD CC(C)(C)N1CCCN(C(=O)c2cc(O)cs2)CC1 732279502 RIXNLFRKVSSQCM-UHFFFAOYSA-N 282.409 2.400 10 20 CECD Oc1cc2c(cc1CNCC[C@@H]1C[C@H]3CC[C@H]1O3)OCO2 839163573 ILBLYDNXZKYMRK-MPKXVKKWSA-N 291.347 2.168 10 20 CECD CC(C)N1CCC[C@H](OC(=O)c2cc(O)cs2)C1=O 748191690 SOYLFRQGXNRNMV-JTQLQIEISA-N 283.349 2.010 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@H](C)c1cc(F)cc(F)c1O 840892044 XKRAPBNOOYUUOR-BDAKNGLRSA-N 286.322 2.234 10 20 CECD CCOc1ccc(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)c(O)c1 843059724 RBAODYCQKLEMRJ-APHBMKBZSA-N 290.407 2.350 10 20 CECD C[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)[C@H](C)[C@H]1C 842273258 DCEFFBGMVAGNAV-HRDYMLBCSA-N 267.300 2.353 10 20 CECD CNC(=S)N[C@H](C)Cc1ccc(N(C)C)cc1C 840870911 VXVCYEONVOMPTC-LLVKDONJSA-N 265.426 2.086 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1cc(Cl)c(F)cc1O 840837252 HREWUTNQSMPQNE-NSHDSACASA-N 286.734 2.414 10 20 CECD CN1CCCC[C@@H](CNCc2cc([N+](=O)[O-])ccc2O)C1 858245366 RIIQMRSMCRMXIS-LBPRGKRZSA-N 293.367 2.122 10 20 CECD CC(C)(F)CCNCc1cc2c(cc1O)OCO2 698342758 PKKATZYYZKIBOI-UHFFFAOYSA-N 255.289 2.349 10 20 CECD CC1CC(CNC(=O)/C=C\c2ccc(O)c(O)c2)C1 857736715 OQSQBZZYNPLINZ-HYXAFXHYSA-N 261.321 2.273 10 20 CECD CO[C@@H]1CCN(Cc2c(O)ccc3ccncc23)C1 751943504 YNCLVZYSDVOWHP-GFCCVEGCSA-N 258.321 2.161 10 20 CECD C[C@@H](Nc1nccn(C)c1=O)c1ccc(N(C)C)cc1 856742715 UXGIZZUCTLXDFC-LLVKDONJSA-N 272.352 2.019 10 20 CECD CCC[C@H](O)CC(=O)NCc1ccc(N(C)C)c(F)c1 750263963 WIXGLCHFWHEHME-LBPRGKRZSA-N 282.359 2.059 10 20 CECD C[C@@H](C[C@@H]1CCOC1)NC(=O)N(C)Cc1ccccc1O 760192796 ISJQSFZOTDLTGG-STQMWFEESA-N 292.379 2.349 10 20 CECD Cc1ccc(CN2CC[C@@H](N3CCCC3)C2)c(O)c1 876660735 ZLFIXXPFOSSJPR-OAHLLOKOSA-N 260.381 2.371 10 20 CECD Cc1ccc(O)c(CNC(=O)c2c3c(nn2C)CCCC3)c1 862757918 IFORXYDYIWKARC-UHFFFAOYSA-N 299.374 2.243 10 20 CECD O=C(NCc1ccccc1O)c1cc2c(cn1)OCCC2 1116532023 XFZCNRHYZXTGIU-UHFFFAOYSA-N 284.315 2.042 10 20 CECD CN(C)c1ccc(CNC(=O)[C@H]2CC[C@H](N)CC2)cc1F 870875697 HQTRXICQWOBULK-JOCQHMNTSA-N 293.386 2.025 10 20 CECD CNC(=O)CN(Cc1ccccc1)Cc1cccc(C)c1O 877771918 FLZVOUFYYMTDTP-UHFFFAOYSA-N 298.386 2.449 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2c(C)cccc2O)C[C@@H]1C 877666311 FUBHRYRWCJGMJA-LRDDRELGSA-N 277.364 2.332 10 20 CECD Cc1ccc(C(=O)NCc2scnc2C)c(O)c1O 770483249 NIYJXZPUHSLPRK-UHFFFAOYSA-N 278.333 2.101 10 20 CECD O=C(NCCCSc1nccs1)Nc1ncccn1 888686737 BSWYMANPXBCUGB-UHFFFAOYSA-N 295.393 2.237 10 20 CECD CC(C)(C)OC(=O)CCNCc1cc(F)cc(F)c1O 883016970 SSNJMAHKAGZMAV-UHFFFAOYSA-N 287.306 2.492 10 20 CECD COc1ccc(CNCCNC(=O)[C@@H]2CC2(C)C)cc1C 1125807955 TYZLUODSNHHTGK-AWEZNQCLSA-N 290.407 2.256 10 20 CECD COc1cc(C)cc(CN[C@@H](C)c2ccn(C)n2)c1O 894984511 JTJVVSBBLWZBCV-NSHDSACASA-N 275.352 2.294 10 20 CECD C/C=C(/C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891253186 RKASMKXZTJJYEQ-DJXGBFBFSA-N 289.423 2.438 10 20 CECD CC1=NO[C@H](CNCc2cc(Cl)cc(F)c2O)C1 895306933 LDPQULFQBNAARS-JTQLQIEISA-N 272.707 2.439 10 20 CECD CC(C)(C)N1CCCN(C(=O)c2cccc(O)c2O)CC1 790598082 IZNMMGIPXSJGQO-UHFFFAOYSA-N 292.379 2.044 10 20 CECD CC[C@@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(F)cc1O 796849804 WJWJTHNXMOAIQJ-BXKDBHETSA-N 289.372 2.005 10 20 CECD COc1cccc(CNCCCCCCO)c1O 83396283 QLKYYUKYKGTMNX-UHFFFAOYSA-N 253.342 2.043 10 20 CECD c1cc(N2CCCC2)ccc1CNC[C@@H]1CCCNC1 1325321751 ZJICEDSPIHSDQK-MRXNPFEDSA-N 273.424 2.376 10 20 CECD C[C@H](N[C@H](CO)CC1CC1)c1ccc(F)cc1O 756769377 LAZFFTRQHJMEDM-CABZTGNLSA-N 253.317 2.343 10 20 CECD O=C(NCCc1nccn1C(F)F)c1cc(O)cs1 1349978750 NJXAWPOUQSIEGH-UHFFFAOYSA-N 287.291 2.018 10 20 CECD O=C(O)C[C@@H]1CC[C@H](NCc2cc(F)ccc2O)C1 1602112882 PCZGUPFSQOUJSE-SKDRFNHKSA-N 267.300 2.264 10 20 CECD O=C(O)c1cc2ccccc2c(CN2CCO[C@H]3C[C@H]32)c1O 1608866056 URCLPXYJYMWADY-CABCVRRESA-N 299.326 2.217 10 20 CECD O=C(O)[C@@H]1[C@H]2CCC[C@H]2CN1Cc1ccc(F)c(F)c1O 1601756912 KHRSMNKTHOIWAQ-FWDPORAESA-N 297.301 2.356 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(C(=O)O)cc2)cc1 1573997218 NWWIPOCEFYWQKL-UHFFFAOYSA-N 298.342 2.381 10 20 CECD CC[C@@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1C 1589444342 VHKXKXMJOVWRGU-AWEZNQCLSA-N 264.369 2.356 10 20 CECD C[C@@H](NCCC(=O)O)c1cc(Br)ccc1O 1589126988 RSWYLVJADAMDJJ-SSDOTTSWSA-N 288.141 2.280 10 20 CECD COc1cc(C)cc(CN(C)C[C@H]2CCOC2)c1O 164460010 WJDOVQPINLFFQF-GFCCVEGCSA-N 265.353 2.178 10 20 CECD Cc1cc(C(=O)NCCc2ccc(O)c(O)c2)c(C)o1 59064087 ZJHWBFYNGOYGDN-UHFFFAOYSA-N 275.304 2.280 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCS[C@@H]2C)c1 310528698 YQQRPEAOPOZIPA-BXKDBHETSA-N 253.367 2.384 10 20 CECD CO[C@@H]1CC[C@H](NCc2cc(F)cc(F)c2O)C1 708436486 MWZJMOIHKUSVCT-WDEREUQCSA-N 257.280 2.328 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NC(=O)Nc1ccc(N)cc1 388267481 FTLNCUPGMQUNHJ-RNCFNFMXSA-N 263.341 2.204 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ncc(C)s2)c1 172019633 CDLRJWLOWZHBHD-UHFFFAOYSA-N 293.348 2.487 10 20 CECD CN[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 128321330 IYWLRWRXAJPHRV-JTQLQIEISA-N 254.761 2.229 10 20 CECD CCOc1cccc(CN2CC[C@H](C(=O)O)[C@H](C)C2)c1O 313741020 CABODUFKWLMYNB-YPMHNXCESA-N 293.363 2.334 10 20 CECD C[C@H]1CC[C@H](CCC(=O)NCCc2ccc(O)c(O)c2)O1 122190104 JWIIVBXOXQORSD-WCQYABFASA-N 293.363 2.104 10 20 CECD CCC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 78345636 AUURGWOWBGTUPK-ZDUSSCGKSA-N 263.337 2.310 10 20 CECD CC(C)N(C(=O)CN(C)c1ccc2c(c1)OCO2)C(C)C 121393169 VWHULWGXCCGVBR-UHFFFAOYSA-N 292.379 2.497 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)NC1CC1 42309450 CXBVHJQAXMLWFZ-UHFFFAOYSA-N 259.353 2.248 10 20 CECD CN(C)C(=O)CN1CCCc2cc(OC(F)F)ccc21 193988584 ZMNDLIHTTBNQRX-UHFFFAOYSA-N 284.306 2.129 10 20 CECD CC[C@@H](NC[C@@H](COC)OC)c1ccccc1O 229574309 LNBYNHKAYCFFPL-WCQYABFASA-N 253.342 2.094 10 20 CECD c1cc(N2CCOCC2)ccc1CNC[C@@H]1CCCCO1 42813875 DMCKXYLZKBONNZ-KRWDZBQOSA-N 290.407 2.182 10 20 CECD Cc1c[nH]cc1C(=O)N1CCOc2cc(N(C)C)ccc21 335725356 AYIVOCXYFTWOFT-UHFFFAOYSA-N 285.347 2.428 10 20 CECD C[C@H](O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 276183716 YHYRPPHCXAVYLV-ZDUSSCGKSA-N 276.380 2.016 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCc2cc(C)no2)c1 273595917 QNUDNXRGQVQUCH-JTQLQIEISA-N 290.319 2.326 10 20 CECD CCN(CCOC)Cc1ccc(N(C)C)c(F)c1 271058501 VNQCICSBUIUPNL-UHFFFAOYSA-N 254.349 2.360 10 20 CECD CC(C)C[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)CCO1 279800888 JSRXZQFCXUNGMN-NEPJUHHUSA-N 293.363 2.421 10 20 CECD Oc1ccccc1CN[C@H]1CCO[C@@H]1c1cccnc1 285265657 ZXBURIVPUVMEAK-GOEBONIOSA-N 270.332 2.407 10 20 CECD CN(C)[C@]1(CN[C@@H]2CCc3cccc(O)c32)CCSC1 297507174 CIXRNGJQIVTLAC-CJNGLKHVSA-N 292.448 2.406 10 20 CECD Cc1cc(O)c(CNC[C@H](O)C(F)(F)F)cc1Cl 825130886 HNNDTXGYMDRNQK-JTQLQIEISA-N 283.677 2.367 10 20 CECD COc1cccc(CN(C(C)C)C2COC2)c1O 824471819 HRKPXBVDIVDTOM-UHFFFAOYSA-N 251.326 2.010 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1cocn1 734529330 JAQVEXDYUVTBPE-UHFFFAOYSA-N 288.351 2.048 10 20 CECD O=S(=O)(CCC1CCCC1)NCc1ccccc1O 830604490 FVHZYQGQDWOITQ-UHFFFAOYSA-N 283.393 2.392 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)Cc2cnccn2)c1O 846142486 ULZPHEDQZBIGAW-VXGBXAGGSA-N 287.363 2.473 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1CCSC1 846475815 KAMWQLDWTFVONZ-QMMMGPOBSA-N 271.769 2.415 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@]2(CCCN2)C1 841105464 PALZZXVJDFNHIU-CQSZACIVSA-N 266.772 2.374 10 20 CECD CCc1cccc(CN(C)[C@H]2CC(C)(C)OC2=O)c1O 848914040 HDPQEHASYZZVAW-ZDUSSCGKSA-N 277.364 2.481 10 20 CECD COc1ccc(N(C)CCC(C)(C)O)cc1OC 749797811 ZGMJNITYKXOAKA-UHFFFAOYSA-N 253.342 2.301 10 20 CECD CCc1cccc(CNC[C@@H]2CCCN(C(C)=O)C2)c1O 848908546 XCERSLHXAUPQRT-AWEZNQCLSA-N 290.407 2.303 10 20 CECD COc1ccc(O)c(CN[C@H]2c3ccccc3C[C@@H]2O)c1 848925883 HVDNNCHHAIMNFD-IRXDYDNUSA-N 285.343 2.149 10 20 CECD C[C@H](C[C@@H](O)c1ccco1)NC(=O)Nc1ccc(N)cc1 841299149 GLAMLYIVMDBKGD-ZWNOBZJWSA-N 289.335 2.496 10 20 CECD C[C@H]1COC[C@@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 922640485 FAZSVLKCNAAAOJ-XVKPBYJWSA-N 286.715 2.078 10 20 CECD C[C@@H](C(=O)NCCc1ccc(N)cc1)c1ccccn1 843342878 QYLIAUNVYWFPOX-GFCCVEGCSA-N 269.348 2.126 10 20 CECD C[C@H](CN1CCCC1=O)NCc1ccc2c(c1)CCCO2 921563589 NPRYLOXFITVVSQ-CYBMUJFWSA-N 288.391 2.112 10 20 CECD O=S1(=O)CC[C@H](CSc2ncc(Cl)s2)C1 850000208 MELGCQNANYNTPT-ZCFIWIBFSA-N 283.827 2.323 10 20 CECD Cc1ccc(O)c(CNC(=O)NOCCC(F)(F)F)c1 858375345 QFTZBDQHZKPHOU-UHFFFAOYSA-N 292.257 2.384 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2C=CCC2)cc1 852511744 LRCMMEIQGBJGCC-ZDUSSCGKSA-N 259.353 2.270 10 20 CECD CO[C@H]1C[C@H](NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 858369449 VGGIGTGJLCUKRR-WHOFXGATSA-N 291.395 2.290 10 20 CECD COc1ccc(N(C)CCCN2CCCC2=O)c(OC)c1 752126046 OGAMCHZJKCBADN-UHFFFAOYSA-N 292.379 2.153 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnn(C(C)C)c2)c1 862757558 YLFPNPKFOXCGGV-UHFFFAOYSA-N 273.336 2.408 10 20 CECD CCN(CCNC(=O)N[C@H](C)c1ccccc1O)C1CC1 868218825 LYMUYWCNQYDPND-GFCCVEGCSA-N 291.395 2.237 10 20 CECD CC(=O)CC1(C(=O)NCc2cc(C)ccc2O)CCC1 862757505 WRBOQFDCDRZSDW-UHFFFAOYSA-N 275.348 2.466 10 20 CECD CCOC(=O)C1CCN(Cc2ccc(C)cc2O)CC1 876525956 NTAWZVXTWFDYRG-UHFFFAOYSA-N 277.364 2.476 10 20 CECD C[C@H](CCn1cccn1)NCc1ccc2c(c1)CCO2 779399139 HJIMGHFOYNCJRZ-CYBMUJFWSA-N 271.364 2.386 10 20 CECD CC(=O)C1=NN(c2cccc3c2CCCC3)C(=O)C1 871949289 VVVWEYGDYXMFCQ-UHFFFAOYSA-N 256.305 2.247 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H]1[C@@H]2CNC[C@@H]21 1118122296 STWSSBJNESLAFU-ZOUHWKOYSA-N 258.365 2.056 10 20 CECD CCCN(C(=O)/C=C\c1cnc(OC)nc1)c1cccnc1 775867064 IIBJYYXJDDVKBF-SREVYHEPSA-N 298.346 2.337 10 20 CECD CCC(=O)N1CCC[C@H]1CNCc1ccc(OC)c(C)c1 1044886863 BAKFCNJCSWAAQO-HNNXBMFYSA-N 290.407 2.494 10 20 CECD Cc1cccc(CN(C)C(=O)/C=C/c2ccc(O)c(O)c2)n1 779520769 RMSJXUGCUVYGHR-VQHVLOKHSA-N 298.342 2.473 10 20 CECD CCN(C)c1ccc(CN(C)CCCC(=O)NC)cc1 773791378 KPMHZGSZCTWHCJ-UHFFFAOYSA-N 277.412 2.101 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1cc(F)cc(F)c1O 788986093 ZOBMPRPBXZSUSL-DTWKUNHWSA-N 286.322 2.188 10 20 CECD CC(C)(C)c1cc(O)c(O)c(CN2CCO[C@@H]3C[C@H]32)c1 793620169 NPGXJTQUTJCLDV-TZMCWYRMSA-N 277.364 2.368 10 20 CECD COc1ccc(CN[C@@H](C)CCn2cccn2)c(O)c1 793388513 PFAMTCCWAAMACP-LBPRGKRZSA-N 275.352 2.166 10 20 CECD CCCN(CCC(=O)NCC)Cc1ccccc1O 75829148 LAIUIDMYFLKNIX-UHFFFAOYSA-N 264.369 2.130 10 20 CECD Oc1cccc(Br)c1CN[C@@H]1CCOC1 706834358 ZRPQAGUESAFIJX-MRVPVSSYSA-N 272.142 2.033 10 20 CECD CCc1cccc(CNC[C@H](C)CCCO)c1O 691523006 NOXAHXMDQQJOGU-GFCCVEGCSA-N 251.370 2.453 10 20 CECD CCOC(=O)CN(Cc1ccc(N)cc1)CC(C)C 1336285010 GGRLDPRAKOBDAB-UHFFFAOYSA-N 264.369 2.290 10 20 CECD CN(Cc1cccc(Cl)c1O)Cc1nnc2n1CCC2 775645733 PUMIIDUCPSECCD-UHFFFAOYSA-N 292.770 2.215 10 20 CECD CN(C)c1ccc(CN[C@H]2CCn3ccnc3C2)cc1 778189103 NEASZYWTJNFZFM-AWEZNQCLSA-N 270.380 2.054 10 20 CECD COc1cccc(O)c1CNCC1(C)CCN(C)CC1 779986445 NVPWQYDNTLYJCZ-UHFFFAOYSA-N 278.396 2.222 10 20 CECD CCN(Cc1cnn(C)c1)Cc1cc(F)cc(F)c1O 1262109590 YECGPPFOKORYKJ-UHFFFAOYSA-N 281.306 2.426 10 20 CECD Nc1ccc(CN2CCNC(=O)C[C@H]2c2ccccc2)cc1 1352789217 UVUNQCKAHYCNPP-KRWDZBQOSA-N 295.386 2.332 10 20 CECD CC(C)c1ccc(O)c(CN2CCCO[C@H](CN)C2)c1 1575858795 PGORJOLMRICKQK-OAHLLOKOSA-N 278.396 2.065 10 20 CECD Cc1cc(O)c(CNCCCC(=O)O)cc1Cl 1574343119 DJLHPANBPHFQKU-UHFFFAOYSA-N 257.717 2.308 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2CNCC2(C)C)cc1F 1578423030 NJYCWVUYCABCDS-CQSZACIVSA-N 283.366 2.118 10 20 CECD O=C(O)[C@H]1CCCC[C@H]1NCc1cc(F)cc(F)c1O 1777660350 MDRPWFJWGYDGGA-CMPLNLGQSA-N 285.290 2.403 10 20 CECD O=C1NC(=S)S/C1=C\c1cccc(-n2cccn2)c1 155137285 PHFZUBRZJLRVSC-FLIBITNWSA-N 287.369 2.361 10 20 CECD C[C@@H](NCC[C@H](O)C1CC1)c1ccc(F)cc1O 903406596 JZMIYCNIWHVLJF-RNCFNFMXSA-N 253.317 2.343 10 20 CECD CCOC(=O)CC(=O)[C@H](C)Sc1nccs1 315166729 HIWTYYLAPPESQD-ZETCQYMHSA-N 259.352 2.146 10 20 CECD C[C@H](NC[C@H](O)C1CCC1)c1cc(F)ccc1O 315953920 IZGOWLHRVLUAML-XPTSAGLGSA-N 253.317 2.343 10 20 CECD CCOc1cccc(CN2CC[C@@](C)(C(=O)O)C2)c1O 86780041 LEMBUVXKFDCMCG-OAHLLOKOSA-N 279.336 2.088 10 20 CECD CON1CCC(N[C@@H](C)c2ccc(F)cc2O)CC1 692105911 BOGCHPHCTITRKU-JTQLQIEISA-N 268.332 2.208 10 20 CECD CCCn1cc(CNCc2ccc(N(C)C)cc2)nn1 714458217 JRSYRQOXVWUOGC-UHFFFAOYSA-N 273.384 2.044 10 20 CECD CN(C)C1(CNCc2cc(Cl)ccc2O)CC1 397892888 PMIXOOUEGOYSJQ-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CCN(C)C(=O)NCc1ccc2c(c1)CCCN2C 102010961 NQNBOBSZZPYQGJ-UHFFFAOYSA-N 261.369 2.230 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnn(C)c1 53661908 BULHNLLHMXVBLU-UHFFFAOYSA-N 286.379 2.148 10 20 CECD O=C1CN(Cc2ccccc2)[C@H](c2cc(F)ccc2O)N1 112368775 GXDLEEWGZALOMT-MRXNPFEDSA-N 286.306 2.162 10 20 CECD CN(C)c1ccc(CNc2ncnc3nc(N)ccc23)cc1 301766282 HNVPTMYEFIVQKI-UHFFFAOYSA-N 294.362 2.285 10 20 CECD CCOc1cc(N(C)Cc2ccccc2O)ncn1 128566696 JRHXSAFZTCYXIU-UHFFFAOYSA-N 259.309 2.217 10 20 CECD CC[C@@](C)(CCO)NCc1cc(OC)ccc1O 182626657 JIBQKDDLWAFUHV-AWEZNQCLSA-N 253.342 2.042 10 20 CECD CC(C)OCCNC(=O)NCc1ccc(N(C)C)c(F)c1 184132959 AHYZYBZISBVJEL-UHFFFAOYSA-N 297.374 2.116 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc3occc3[nH]2)c1 133456391 PCOJMYSZYWOMDI-UHFFFAOYSA-N 286.287 2.405 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCc1ccccn1 42964145 JEDSRSADQIPEMM-UHFFFAOYSA-N 285.347 2.171 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1ncccc1F 132118769 ATERALNRMHZIKU-UHFFFAOYSA-N 289.310 2.268 10 20 CECD CCOc1cccc(CN2CCOC[C@H]2C)c1O 132177274 WESUWHDQBCNBMV-LLVKDONJSA-N 251.326 2.012 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccoc2)cc1 43862422 PBBLKCCBRGYRQE-UHFFFAOYSA-N 273.336 2.345 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2CC(=O)O)cc1 86790771 ZPRZYEJCTYRDCB-AWEZNQCLSA-N 262.353 2.192 10 20 CECD CN(C)c1ccc(CN2CC[C@@](O)(C3CC3)C2)cc1 365853013 BUAGJUGAUALBOB-INIZCTEOSA-N 260.381 2.099 10 20 CECD CC(=O)C(=O)CSc1nc(-c2ccc(C)cc2)n[nH]1 808014264 HCJNJVGZQVWHHE-UHFFFAOYSA-N 275.333 2.030 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CSC(F)F 295625861 ATSKBRVXMVZJMH-ZETCQYMHSA-N 291.319 2.101 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](CC)N(C)C 298569226 KHGCSICNVGPMBS-AWEZNQCLSA-N 278.396 2.471 10 20 CECD C[C@@H]1CN(C2CC2)C[C@@H]1N[C@@H]1CCc2cccc(O)c21 297820722 RJVSAKZQPUDJRQ-DFBGVHRSSA-N 272.392 2.452 10 20 CECD C[C@@]1(CN[C@@H]2CCc3cccc(O)c32)CCCNC1 817966444 NZWKBZQDYSCCAP-CZUORRHYSA-N 260.381 2.359 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCN2C)[C@@H]1CCCN1 817900615 OPWNDVQHCHIXFA-BBRMVZONSA-N 273.424 2.299 10 20 CECD C[C@@H]1C[C@H](N[C@H](C)c2ccc(F)cc2O)CCN1 817971899 QZHGFDAELJUULV-CKYFFXLPSA-N 252.333 2.322 10 20 CECD Cc1cc(CN2CC[C@@H](O)[C@@H](C)C2)ccc1N(C)C 815096663 UIZKBPIGNZDNQQ-XJKSGUPXSA-N 262.397 2.264 10 20 CECD CCn1nnc(C)c1CNCc1ccc(N(C)C)c(F)c1 823736435 BMTCXSVGUHCGFN-UHFFFAOYSA-N 291.374 2.101 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)CC(=O)O 829497132 WWYHRARGHYWDOZ-NSHDSACASA-N 279.336 2.242 10 20 CECD CC(C)n1ccc(CC(=O)Nc2ccc(N)cc2)n1 832244089 KBPZUZDCSHGICP-UHFFFAOYSA-N 258.325 2.227 10 20 CECD COC(=O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1ccccc1O)C2 839172872 RLWGFJSCOWGXQC-MRVWCRGKSA-N 275.348 2.166 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1cccnc1 588432761 VNFFLQLFPIEYIZ-HWPRWLFBSA-N 298.342 2.253 10 20 CECD C[C@@H]1CC(C)(C)CN1Cc1cc2c(cc1O)OC[C@@H]2O 840179327 ALEDMKATFAEJNE-YGRLFVJLSA-N 277.364 2.438 10 20 CECD COc1cccc([C@@H](C)NCCn2ccnc2C)c1O 846141748 NHWUIQQNXSLPHZ-LLVKDONJSA-N 275.352 2.257 10 20 CECD COc1ccc(O)c(CNC(=O)c2cnccc2C)c1 743411275 ZUFALSYNDRINKO-UHFFFAOYSA-N 272.304 2.034 10 20 CECD C[C@H]1C[C@@H](NCc2c(O)cccc2Cl)CCN1 841061606 LNLHBYBOGBKJGO-UWVGGRQHSA-N 254.761 2.276 10 20 CECD COCC[C@H](C)N(C)CCN(C)c1ccc(OC)cc1 844400655 FOYVIKHIXMMXCF-AWEZNQCLSA-N 280.412 2.488 10 20 CECD COC[C@@H](C)NC(=S)NCc1cc(Cl)ccc1O 844583840 HRBOWCYHRXKGBI-MRVPVSSYSA-N 288.800 2.045 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2CCOC[C@H]2C)c1 858451116 NSBNNSYVIMQAEB-OLZOCXBDSA-N 292.379 2.172 10 20 CECD C[C@H](NCC1(CO)CCC1)c1cc([N+](=O)[O-])ccc1O 757655588 FOHVRPJQKBGKPB-JTQLQIEISA-N 280.324 2.114 10 20 CECD CC[C@@H](NC(=O)c1cc(O)cs1)[C@@H]1CCCO1 756809836 RXSKXLCGRLVOOJ-ZJUUUORDSA-N 255.339 2.141 10 20 CECD COC(=O)c1cc(/C=C2\C(=O)Nc3ccc(F)cc32)c[nH]1 751542755 LNCNQOWOQABQDR-WCIBSUBMSA-N 286.262 2.433 10 20 CECD C[C@H]1C[C@@H](NC(=O)N[C@H](C)c2ccccc2O)CCN1C 868374393 RBMHRNRPSHHQQW-XQQFMLRXSA-N 291.395 2.235 10 20 CECD COc1cc(CN2CCC[C@H](N(C)C)C2)c(O)cc1C 768446386 NOFGUVBOHGNCJR-AWEZNQCLSA-N 278.396 2.235 10 20 CECD Nc1ccc(Cc2nc(C3C[C@@H]4CC[C@H](C3)N4)no2)cc1 871792195 QQSAQMCNLKLZLD-QXMXGUDHSA-N 284.363 2.241 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ccc(C(N)=O)cn1 1117476083 JUXILKUXMLXARY-UHFFFAOYSA-N 284.363 2.167 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2CCC[C@H]2CCO)c1 875515514 PYDIRVSXMNMUAH-JSGCOSHPSA-N 292.379 2.051 10 20 CECD Cc1cc(=O)c(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)c[nH]1 773012426 BSZNGMOPRNGOJQ-LBPRGKRZSA-N 299.374 2.240 10 20 CECD C[C@H](NCC1([S@@](C)=O)CC1)c1c(O)cccc1F 886607133 LMAMVCXKQSSUPX-NIVTXAMTSA-N 271.357 2.093 10 20 CECD C[C@@]1(CNC(=O)NCc2ccc(N)cc2)CCCS1 1120659374 IUGHZSQCBNOTCP-AWEZNQCLSA-N 279.409 2.354 10 20 CECD COc1cc(N(C)Cc2cnc[nH]2)cc(OC)c1OC 894429846 PSWWYBYYTKFQNN-UHFFFAOYSA-N 277.324 2.072 10 20 CECD CC[C@H]1CN(Cc2ccc(OC)c(OC)c2O)[C@@H](C)CO1 895147548 MOPHCXTXCVELOV-AAEUAGOBSA-N 295.379 2.409 10 20 CECD CCCN(CC(=O)N(C)C)Cc1c(O)cccc1Cl 133664036 CKBXHNSPTAWMMD-UHFFFAOYSA-N 284.787 2.346 10 20 CECD CC[C@H](C)[C@H](C)C(=O)NCc1cccc(O)c1O 1347542920 SWGCQRNDTVNOTC-UWVGGRQHSA-N 251.326 2.396 10 20 CECD C[C@H]1CCCN1CCN[C@H](C)c1cc(C(=O)O)ccc1O 1609780459 SAAKFPRZSMQSSB-NWDGAFQWSA-N 292.379 2.225 10 20 CECD C[C@@H](CN(C)Cc1cc(Cl)c(F)cc1O)C(=O)O 1604158657 JWSAHAGHSMJICZ-ZETCQYMHSA-N 275.707 2.337 10 20 CECD O=C(O)CC[C@@H]1CCCCN1C(=O)c1cc(O)cs1 1595012310 ZUJVISDSSLRRKB-VIFPVBQESA-N 283.349 2.313 10 20 CECD COc1ccc(N(C)CC(=O)NC2CCCC2)cc1 844353719 XHTKQMZIBSZDJL-UHFFFAOYSA-N 262.353 2.190 10 20 CECD C[C@H]1CCCN(Cc2cc(F)ccc2O)[C@@H]1CN 220222075 WACQIORMFRQBBX-GXFFZTMASA-N 252.333 2.091 10 20 CECD C[S@@](=O)C1(CNCc2c(O)cccc2Cl)CC1 282268481 HMUAJHDZXOBZRD-QGZVFWFLSA-N 273.785 2.046 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@]3(CN)C2)c1 311466474 NHRWDPKUYXVPHM-HOCLYGCPSA-N 260.381 2.261 10 20 CECD C[C@H]1C[C@H](NCc2ccc(N(C)C)cc2)CCN1C 90720995 PCOSUZSMJNLATG-DZGCQCFKSA-N 261.413 2.325 10 20 CECD CC1(C)CN(Cc2ccc(Br)cc2O)C[C@@H]1N 720767593 JNZDOESXRWUKED-LBPRGKRZSA-N 299.212 2.324 10 20 CECD CN(C(=O)[C@@H]1OC[C@@H]2CCC[C@@H]21)c1ccc(N)cc1 884441473 JKUUUGWTZWTMFA-LEWSCRJBSA-N 260.337 2.047 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C1CC=CC1 173187836 XLUKXWKPWPJBGB-UHFFFAOYSA-N 272.348 2.444 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C[C@@H]1CCCCO1 186423339 QMACMSRWQIDCDS-YPMHNXCESA-N 293.363 2.104 10 20 CECD CN(C)c1ccc(CNC(=O)N[C@H]2CCCOCC2)cc1 183069553 DQICXHHWSJAKTD-AWEZNQCLSA-N 291.395 2.121 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CC1CCNCC1 38075700 AOTZONRHHFKZQI-UHFFFAOYSA-N 289.423 2.101 10 20 CECD CCOc1cccc(CN[C@@H](C)C[C@@H](C)O)c1O 228067359 FRMGSPSYPOQACK-WDEREUQCSA-N 253.342 2.040 10 20 CECD COc1ccc(O)c(CN[C@@H](CO)C2CCCC2)c1 290808212 FWSQKRUKFDTUHZ-AWEZNQCLSA-N 265.353 2.042 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CC1(N)CCC1 236731522 RQXQFGQKRKSCPH-UHFFFAOYSA-N 276.380 2.402 10 20 CECD O=C(Cc1cccc(F)c1)NCCc1ccc(O)c(O)c1 98074621 LFNPPDZCMZZMGA-UHFFFAOYSA-N 289.306 2.138 10 20 CECD CC[C@H]1C[C@H](C(=O)NCc2ccccc2O)CCO1 272570370 RVJZUKNOLUSJSC-YPMHNXCESA-N 263.337 2.214 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)[C@H]1CCCCO1 272006229 PDNKSRQXGYXRTB-BXUZGUMPSA-N 278.352 2.149 10 20 CECD COc1cc(O)c(CN[C@H]2CCO[C@H](C)C2)cc1OC 271794265 HQRSXLQFHNRNSX-PWSUYJOCSA-N 281.352 2.067 10 20 CECD COC(=O)COc1ccc(N(C)CCCCCCO)cc1 273082382 LIGWAKZNPCFROC-UHFFFAOYSA-N 295.379 2.227 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H]2CCCCO2)c1 273422120 SLVCIJVRSVKYPT-YPMHNXCESA-N 293.363 2.399 10 20 CECD Oc1ccccc1CN1CCC([C@@H](O)c2ncc[nH]2)CC1 375689466 DYHCQUZVWJALSO-OAHLLOKOSA-N 287.363 2.061 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1cccc(C)c1O 281315656 QTOKFYSFBPLGSD-LBPRGKRZSA-N 265.353 2.474 10 20 CECD CC(C)(C)c1ncc(C(=O)NCc2ccccc2O)cn1 806718384 ZGVPTXCMLIODPB-UHFFFAOYSA-N 285.347 2.410 10 20 CECD C[C@H]1CCN[C@H](C(=O)NCCCSc2nccs2)C1 817940734 KFVHONIOZJEUOA-QWRGUYRKSA-N 299.465 2.130 10 20 CECD CN1CCCc2cc(CNC(=O)CCc3ccon3)ccc21 816910980 YILNBIVNEJIJLN-UHFFFAOYSA-N 299.374 2.306 10 20 CECD COc1ccc(N2CC[C@@H](CNC(=O)C3(C)CC3)C2)cc1 819584742 PQMGKDIHQGOMEB-ZDUSSCGKSA-N 288.391 2.438 10 20 CECD CCCc1[nH]ccc1C(=O)NCCc1ccc(O)c(O)c1 817549134 HXOJVHWBQLDBNL-UHFFFAOYSA-N 288.347 2.351 10 20 CECD CCOc1ccc(CN2C[C@@H](C)[C@](C)(CO)C2)c(O)c1 827699585 JITRWYPCKSVLPW-WBMJQRKESA-N 279.380 2.241 10 20 CECD Oc1ccccc1CNc1ccc(F)cc1-c1nn[nH]n1 826511410 OLMCHQMVPGLMQW-UHFFFAOYSA-N 285.282 2.324 10 20 CECD COc1cc(O)c(CN2CC(CC(F)F)C2)cc1OC 822521212 YFMIKIMVWDWSCB-UHFFFAOYSA-N 287.306 2.496 10 20 CECD CC[C@@H](O)[C@@H](C)C(=O)NCCCSc1nccs1 900684001 VRCQYPJTPOCHSI-NXEZZACHSA-N 288.438 2.149 10 20 CECD CCN1CCCC[C@H]1CNC(=O)c1cc(O)cs1 732293121 CRDUSWMBVLODGI-JTQLQIEISA-N 268.382 2.058 10 20 CECD CC(C)[C@H](N[C@@H]1CCc2cccc(O)c21)c1nncn1C 903066480 VKOVODOKTCWHEX-DOMZBBRYSA-N 286.379 2.495 10 20 CECD C[C@@H](NC(=O)NC1(CCO)CC1)c1ccc(N(C)C)cc1 838558649 GCKZRCNDSKVDNL-GFCCVEGCSA-N 291.395 2.028 10 20 CECD COC(=O)c1cnoc1CN(C)c1ccc(OC)cc1 844355345 NYHJXOCBMXTPEV-UHFFFAOYSA-N 276.292 2.106 10 20 CECD CC[C@H](CN[C@@H](C)c1cccc(OC)c1O)OC 846172898 PIJJUATYLYNYLW-WDEREUQCSA-N 253.342 2.476 10 20 CECD O=C1CC[C@H](C(=O)NCc2cc(Cl)ccc2O)C1 846478068 ZLKUVLRCWIPLIO-QMMMGPOBSA-N 267.712 2.031 10 20 CECD CN[C@H]1CCCN(Cc2cccc(Br)c2O)C1 843048830 ZQQSOJAVSWKCAC-NSHDSACASA-N 299.212 2.339 10 20 CECD Nc1ccc(NC(=O)C(=O)NCCC2=CCCCC2)cc1 841000061 WQQIDSWZCZQDDD-UHFFFAOYSA-N 287.363 2.214 10 20 CECD NC[C@@H]1CCCC[C@@H]1NCc1cccc(F)c1O 841028982 DCDGIVANLNZUNY-GWCFXTLKSA-N 252.333 2.138 10 20 CECD COc1cc(Cl)cc(CNC[C@H](N)C(C)C)c1O 841031006 QQUGATXJRQEIJM-NSHDSACASA-N 272.776 2.127 10 20 CECD C/C=C/C(=O)N[C@@H](C)c1ccc(N2CCOCC2)cc1 920879851 VTYUYHHIASUDEW-OOPCZODUSA-N 274.364 2.277 10 20 CECD CC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)[C@@H](C)CO1 846175301 YITPUCDZYZPBTM-WFASDCNBSA-N 291.395 2.020 10 20 CECD CC(C)[C@@H]1C[C@H](C(=O)NCc2ccc(N)cc2)CCO1 927767752 JLBZUBUVVFNGGY-HIFRSBDPSA-N 276.380 2.336 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2COCCO2)c(O)c1C 756435140 WNKUTFGQWWDSAB-STQMWFEESA-N 265.353 2.075 10 20 CECD C[C@H](NC[C@@]1(C)CCOC1)c1cc([N+](=O)[O-])ccc1O 756575996 SJVIFNCGDIPUCI-IINYFYTJSA-N 280.324 2.378 10 20 CECD C[C@H](NC(=O)N(C)CC(C)(C)N)c1ccc(N(C)C)cc1 851659649 UDORCTHMEZNLJN-LBPRGKRZSA-N 292.427 2.192 10 20 CECD Cc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)c(O)n1 756242486 NCTKXQMHLJVEQD-DAXSKMNVSA-N 286.287 2.159 10 20 CECD Cc1cnc(CCNCc2ccc3c(c2)CCCO3)cn1 922172642 VFDURWFMXKMDIC-UHFFFAOYSA-N 283.375 2.442 10 20 CECD C[C@H]1CCN(Cc2c(O)cccc2Cl)C[C@@H]1CO 857061650 SVEUIABNSKDXOG-WDEREUQCSA-N 269.772 2.496 10 20 CECD O=C(c1cc(O)cs1)N1CCSC[C@H]1C1CC1 854830761 ZVOVKMVXGCJWRK-JTQLQIEISA-N 269.391 2.421 10 20 CECD CN(C)c1ccc(CN(C(=O)CCCCO)C2CC2)cc1 864786082 MWANYFAFULKTLW-UHFFFAOYSA-N 290.407 2.406 10 20 CECD C[C@@H](NC(=S)NC1CCC1)c1ccccc1O 865269303 HWBGVOIXJTVBSA-SECBINFHSA-N 250.367 2.470 10 20 CECD COC(=O)/C=C(/C)CN(C)c1ccc(OC)cc1OC 930076958 NDFXYKXJEPTUTF-FLIBITNWSA-N 279.336 2.259 10 20 CECD CCOc1cccc(CN(C)CC2(O)CCC2)c1O 761219370 OYRJSBASRMZMEN-UHFFFAOYSA-N 265.353 2.138 10 20 CECD Cc1cccc(CN(C)CC(=O)NCc2ccco2)c1O 775647289 UIAISFYVIQTUCK-UHFFFAOYSA-N 288.347 2.042 10 20 CECD O=C1N[C@@H](c2ccc(O)c(O)c2)Nc2cc(F)c(F)cc21 877858634 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2.133 10 20 CECD CCOc1cccc(CN[C@](C)(CC)CCO)c1O 230222876 QSEGVBAZWRONSR-OAHLLOKOSA-N 267.369 2.432 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2C[C@H](O)C2(C)C)c1O 128219164 PLNOHVBZBSVPQD-NEPJUHHUSA-N 285.771 2.303 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)cc1 252861333 NLZNUUCMCVIGPL-BHYGNILZSA-N 273.424 2.312 10 20 CECD CO[C@@H]1[C@@H]2C[C@H]3[C@@H](C2)CN(Cc2cc(F)ccc2O)[C@H]31 289777719 RNLBQEWWDFBERV-RLTXXFFMSA-N 277.339 2.387 10 20 CECD OCC1(CNCc2cccc(Cl)c2O)CCC1 183232224 NPRDJPIJAAORLF-UHFFFAOYSA-N 255.745 2.298 10 20 CECD CCc1cccc(CN2CC[C@@H](CN(C)C)C2)c1O 688531847 DICYHVAKACDIKN-ZDUSSCGKSA-N 262.397 2.338 10 20 CECD CNC(=O)CCCN[C@@H]1C[C@@H](C)c2c(C)ccc(O)c21 398351644 JWROKTNPLDPBEZ-VXGBXAGGSA-N 276.380 2.365 10 20 CECD COc1ccc(O)c(CNC(=O)c2sccc2OC)c1 114541843 OROONWFMEXYQDF-UHFFFAOYSA-N 293.344 2.401 10 20 CECD COc1ccc(O)c(CNC(=O)Nc2ccncc2)c1 114512544 ZACCUOPYKDGGQI-UHFFFAOYSA-N 273.292 2.118 10 20 CECD CCNC(=O)C(C)(C)CN[C@H](C)c1ccc(F)cc1O 186354005 NMRZSKSMEXBGSG-SNVBAGLBSA-N 282.359 2.344 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CCO)CSC)c1 185530365 BIRAITGTEBUKGF-GHMZBOCLSA-N 285.409 2.165 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1cncs1 188401434 VSDYWMJCNSNTPI-UHFFFAOYSA-N 262.334 2.050 10 20 CECD COc1ccccc1CCNC(=O)c1cccc(O)c1O 186728430 UIGGBRIFELNFKL-UHFFFAOYSA-N 287.315 2.079 10 20 CECD COc1cccc(CN2CCc3ccccc3[C@@H]2CO)c1O 93455542 FHAHNBNRNVYECZ-INIZCTEOSA-N 299.370 2.493 10 20 CECD NC(=O)COC(=O)c1ccccc1N=Nc1ccc(O)cc1 252457239 QFNRHDSDIKNABX-UHFFFAOYSA-N 299.286 2.450 10 20 CECD C[C@H](Cn1ccnc1)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273363758 DNZCJGQNOGYLKJ-GHMZBOCLSA-N 290.323 2.236 10 20 CECD Cc1ccc(C(=O)NCC2(CCO)CCCC2)c(O)c1O 272713980 FPXLZMKBCFJGMD-UHFFFAOYSA-N 293.363 2.079 10 20 CECD Cc1ccc([C@@H](C)NCCCN2CCOCC2)c(O)c1C 273431175 VSPOLYJWTXYKER-OAHLLOKOSA-N 292.423 2.382 10 20 CECD Cc1ccc([C@@H](C)NCCNC(=O)C(C)C)c(O)c1C 273413707 QFIJUNHLYLJSPC-CYBMUJFWSA-N 278.396 2.432 10 20 CECD COc1cc(O)c(CN2CCC[C@H](OC)CC2)cc1OC 377242723 HVLUKYKDCAJXAE-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD CC[C@H](N[C@@H](C)C(=O)N(C)CC)c1ccc(F)cc1O 287532184 OYOZGIUTTAKNAY-GWCFXTLKSA-N 282.359 2.439 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C1(C(F)(F)F)CCC1 296671011 ZKYCEZMMLACDJD-UHFFFAOYSA-N 289.253 2.447 10 20 CECD C[C@H]1CN(Cc2cc(-c3ccccc3)ccc2O)CC(=O)N1 294972634 JCEGTORNQQGRAD-ZDUSSCGKSA-N 296.370 2.380 10 20 CECD CN(C)c1ccc(CNC(=O)CC2CC2)cc1F 299329468 LWAARKNSXCFUNB-UHFFFAOYSA-N 250.317 2.308 10 20 CECD COc1ncccc1COC(=O)c1ccc(C)c(O)c1O 801252680 ZIFZIOMSIMTNQD-UHFFFAOYSA-N 289.287 2.167 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)[C@@H]1CCCO1 807838936 UAXQWTBAJMGHGH-JTQLQIEISA-N 290.146 2.494 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@@H]1CC1(F)F 295391648 TWGXPIIZIPVOQV-JTQLQIEISA-N 282.290 2.133 10 20 CECD C[C@H](NC[C@@H](C)N)c1cc(Br)cc(F)c1O 817971298 CATFFRHOYNMZMH-RQJHMYQMSA-N 291.164 2.292 10 20 CECD C[C@H](NCCc1ccc(N)cc1)c1cc2n(n1)CCC2 817956738 BNRAOWLIBHFUPW-LBPRGKRZSA-N 270.380 2.305 10 20 CECD C[C@H]1CCNC[C@@H]1NCc1ccc2c(c1)CCCN2C 817900432 MTNMALYYXADGKL-BBRMVZONSA-N 273.424 2.157 10 20 CECD COC[C@@](C)(O)CN[C@@H](C)c1c(C)cc(C)cc1O 815579743 UBWLWZMJJGOBNJ-WFASDCNBSA-N 267.369 2.057 10 20 CECD C[C@@H](O)C1(NCc2c(O)ccc(Cl)c2F)CC1 827585419 IKDDMKDXSHHEQA-SSDOTTSWSA-N 259.708 2.188 10 20 CECD CCOC(=O)[C@@H](C)NCc1cc(Cl)c(C)cc1O 825667489 ZBMGJXNNKPOGHV-SECBINFHSA-N 271.744 2.395 10 20 CECD O=C1CC[C@H]2CN(Cc3cccc(Cl)c3O)CC[C@@H]2N1 827133049 QVWZBCKVDCVYCV-GWCFXTLKSA-N 294.782 2.146 10 20 CECD CCc1cccc(C(=O)NCCc2ccc(O)c(O)c2)n1 827084835 DLGMCYRTFFDCJN-UHFFFAOYSA-N 286.331 2.028 10 20 CECD CCc1cccc(CN2CC[C@H]3NC(=O)CC[C@H]3C2)c1O 827134021 ZRPPCKDBSYRAAW-DZGCQCFKSA-N 288.391 2.055 10 20 CECD CC(C)OC(=O)[C@@H]1CCCN1C(=O)c1cc(O)cs1 828238586 HYKLCHZCTVAOKD-JTQLQIEISA-N 283.349 2.010 10 20 CECD COc1ccc2c(c1)CCN2Cc1c[nH]c(C(=O)O)c1 832493721 RBJYJQFCZXONIP-UHFFFAOYSA-N 272.304 2.284 10 20 CECD CC1(C)OCC(N[C@H]2CCc3cccc(O)c32)CO1 834764830 HIHJCOUBNWOWJN-LBPRGKRZSA-N 263.337 2.121 10 20 CECD C[C@@H](O)CN(Cc1cc(Cl)ccc1O)C1CC1 848928836 PBTCRSWFHGNEEV-SECBINFHSA-N 255.745 2.391 10 20 CECD CCc1cnc(COC(=O)c2cc(O)cs2)o1 745001890 DZKWXBIDVBIYGY-UHFFFAOYSA-N 253.279 2.361 10 20 CECD COCCOCCN[C@H](C)c1ccc(Cl)cc1O 841745227 OEZMSHTUHOPLRS-SNVBAGLBSA-N 273.760 2.359 10 20 CECD CCn1ccc(C(=O)N[C@H](C)c2cc(OC)ccc2O)n1 843832186 UKMTWLRVFDWYSN-SNVBAGLBSA-N 289.335 2.108 10 20 CECD CO[C@@H]1CCC[C@H]1NC(=O)NCc1cc(Cl)ccc1O 845235125 FAOWHVJETKDQHV-DGCLKSJQSA-N 298.770 2.412 10 20 CECD COc1ccc(N(C)Cc2oncc2C(=O)O)cc1OC 846242934 WVVIFSDYNAOAIX-UHFFFAOYSA-N 292.291 2.026 10 20 CECD Cc1cc(CN2CC[C@H]3NCC[C@@H]3C2)ccc1N(C)C 923358689 KNZWGMMFQFLJTA-HZPDHXFCSA-N 273.424 2.245 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H](C)C[C@H]2CCOC2)c1 858299171 QHENSZKHGVUNHY-CHWSQXEVSA-N 292.379 2.315 10 20 CECD CC[C@H](C(=O)NCc1cc(C)ccc1O)N(CC)CC 862759547 FWLGZYBNUNQGAB-CQSZACIVSA-N 278.396 2.437 10 20 CECD CCOc1ccc(CN2CCC[C@@H]([C@H](C)O)C2)c(O)c1 768518951 JRIJIKBADOPYFK-QWHCGFSZSA-N 279.380 2.384 10 20 CECD CCCN1C[C@H](CNCc2ccc(C)cc2O)CC1=O 877595110 RRHXVOKDVKZUFU-ZDUSSCGKSA-N 276.380 2.049 10 20 CECD Cc1ccc(CN[C@H](C)C(=O)NC(C)(C)C)c(O)c1 876974070 XKBKATYIDMPEFC-LLVKDONJSA-N 264.369 2.093 10 20 CECD Cc1ccc(CN[C@@H]2CCN3CCC[C@H]3C2)c(O)c1 876940374 SFBCEJXPTXVOBU-CABCVRRESA-N 260.381 2.417 10 20 CECD O=C(O)C[C@@H](CNCc1cc(F)cc(F)c1O)C(F)F 1119550465 USRUPZIEIHNNJF-ZETCQYMHSA-N 295.232 2.116 10 20 CECD CC[C@@H](NCCS(=O)(=O)CC1CC1)c1ccccc1O 775522151 KNJGDWIIFJQDQZ-CQSZACIVSA-N 297.420 2.258 10 20 CECD C[C@@H](NC(=O)CCn1cccn1)c1ccc(N(C)C)cc1 773022272 VIYJZOQUPUUCIH-CYBMUJFWSA-N 286.379 2.217 10 20 CECD C[C@@H](NC(=O)N1C[C@H]2C[C@H]2C1)c1ccc(N(C)C)cc1 888830581 WKOWLBOOLAOWQQ-BNOWGMLFSA-N 273.380 2.475 10 20 CECD COc1ccc(CNC[C@]2(O)CCC[C@@H]2C)c(O)c1OC 894642039 KJYALJKKHLIIHL-MEDUHNTESA-N 295.379 2.050 10 20 CECD COC(=O)CC1(CN[C@@H](C)c2cc(OC)ccc2O)CC1 799315105 YOXNTDOGYCKDQC-NSHDSACASA-N 293.363 2.395 10 20 CECD Nc1ccc(CN2CCC(n3ccnc3)CC2)cc1 1334775276 UXMNSUZTBHMZQR-UHFFFAOYSA-N 256.353 2.302 10 20 CECD COc1ccc(O)c([C@H](C)NCC[C@@H](O)C2CC2)c1 898199002 XXJFTHXEUIDTRS-IINYFYTJSA-N 265.353 2.212 10 20 CECD CCc1nc(C)cc(N2CC=C(CCNC(C)=O)CC2)n1 1089802692 UFUDGOVKQNPTEF-UHFFFAOYSA-N 288.395 2.010 10 20 CECD O=C(NCc1ccccc1O)[C@H]1COc2ccccc21 134789884 VTBBVXWFOZIQDL-ZDUSSCGKSA-N 269.300 2.185 10 20 CECD O=C(N[C@@H]1CCC[C@H](F)C1)c1c(F)ccc(O)c1O 1329565178 WZZSGXZLNMOFGA-JGVFFNPUSA-N 271.263 2.247 10 20 CECD COc1cccc(CN[C@H]2CCC[C@@H]2CCO)c1O 189951056 PJGPTFHBFWIAQV-YPMHNXCESA-N 265.353 2.042 10 20 CECD CC[C@@H]1COCCN1Cc1cc(F)cc(F)c1O 708423185 QDFOPFFKSHKHBH-LLVKDONJSA-N 257.280 2.281 10 20 CECD CC[C@H]1COCCN1Cc1cc(F)cc(F)c1O 708423188 QDFOPFFKSHKHBH-NSHDSACASA-N 257.280 2.281 10 20 CECD Cc1ccc(O)c(CN[C@H](CO)Cc2ccccc2)c1 71409399 LGCZSHHMSIGJMM-INIZCTEOSA-N 271.360 2.394 10 20 CECD Nc1ccc(CNC(=O)NCC2(C3CC3)CC2)cc1 1346406381 STQCJCBBKILQBH-UHFFFAOYSA-N 259.353 2.258 10 20 CECD Cc1nccn1CCSc1ncc(C(=O)O)s1 1600757096 PBXYZNPZVVPAMO-UHFFFAOYSA-N 269.351 2.139 10 20 CECD Cc1ccc(CN2CCC[C@@H](C)[C@@H]2C(=O)O)c(O)c1 1605273096 GPDJDVLXUOGEOC-BXUZGUMPSA-N 263.337 2.386 10 20 CECD C/C(=C/CN[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 1609503417 NRSBNNREVJBDSC-MMRAYRKESA-N 262.353 2.434 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@]2(C)C(=O)O)cc1F 1604083663 URNXSNFLPGJRLQ-OAHLLOKOSA-N 298.333 2.470 10 20 CECD COC(=O)COc1ccccc1CNc1ccc(N)cc1 1578816150 STWJWJMRUIYCKB-UHFFFAOYSA-N 286.331 2.433 10 20 CECD C[C@@H](C(=O)O)N(Cc1cc(F)cc(F)c1O)C1CCC1 1589486854 MWEUCMIVVALNAQ-QMMMGPOBSA-N 285.290 2.498 10 20 CECD CCN(C)c1ccc(CN[C@](CC)(COC)C(=O)O)cc1 1596197176 CTCKMWBQRLGYRA-MRXNPFEDSA-N 294.395 2.112 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@@H]3C[C@H](C(=O)O)C[C@H]32)cc1 1777039934 DVJABGDKIFAMMA-WMHQRMGPSA-N 288.391 2.342 10 20 CECD CN(C)c1ccc(CN2CCC3(CCNC3)CC2)cc1 843126279 HOWWVSJEBWSMTG-UHFFFAOYSA-N 273.424 2.328 10 20 CECD C[C@@](CO)(NCc1ccc2c(c1)CCCO2)C1CC1 921828744 VASKBXUTUBLROX-INIZCTEOSA-N 261.365 2.262 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@H](CO)C2)c1O 50132056 JSYNLUSTSCKCJR-NSHDSACASA-N 297.782 2.453 10 20 CECD COc1ccc(O)c(CNCCC2(OC)CCC2)c1 312035318 OUEVLNLAAQNXFA-UHFFFAOYSA-N 265.353 2.450 10 20 CECD COC[C@@H](NCc1cccc(OC)c1O)c1ccco1 177572957 YRRZIGHKWIRSHZ-GFCCVEGCSA-N 277.320 2.471 10 20 CECD c1ccc(CNCc2ccc(N3CCOCC3)cc2)nc1 20091634 DZRVSZSVPRZREE-UHFFFAOYSA-N 283.375 2.208 10 20 CECD CO[C@]1(C)C[C@@H](NC(=O)c2ccc(C)c(O)c2O)C1(C)C 179531716 ZOJJBYUJMKIKIN-BDJLRTHQSA-N 293.363 2.340 10 20 CECD CCN(CC)C(=O)[C@H](C)N[C@@H](C)c1cc(OC)ccc1O 37126597 FREOPVUQABEYJX-RYUDHWBXSA-N 294.395 2.308 10 20 CECD CN(Cc1ccsc1)C(=O)c1cccc(O)c1O 126255429 PVJFPUVEHBOUAX-UHFFFAOYSA-N 263.318 2.432 10 20 CECD COc1cc(O)c(CN(C)[C@H](CO)C(C)(C)C)cc1OC 180618215 KCAGWZYSMZFMBA-OAHLLOKOSA-N 297.395 2.248 10 20 CECD C[C@@H](NCCSCCCO)c1ccccc1O 183498830 GUOLSBKOTVZZOQ-LLVKDONJSA-N 255.383 2.158 10 20 CECD COCCN(CCOC)Cc1c(O)cccc1Cl 133415767 FHMAMWBGMPSJPK-UHFFFAOYSA-N 273.760 2.140 10 20 CECD C[C@H](NC[C@@H](O)C1CCOCC1)c1ccc(N(C)C)cc1 90055587 AXVMVFLNRDNYIE-SUMWQHHRSA-N 292.423 2.191 10 20 CECD CO[C@@]1(C)C[C@@H](NC(=O)Cc2ccc(N)cc2)C1(C)C 237156689 QPEAZPVFBJYTRP-CJNGLKHVSA-N 276.380 2.131 10 20 CECD O=C(NCc1ccccc1O)c1ncoc1C1CC1 293635877 HGCMKBWXCOYMJI-UHFFFAOYSA-N 258.277 2.188 10 20 CECD CCN(CC)c1ccc(CNC(=O)C(F)F)cc1 278507919 WLPQXGKLIJRDPX-UHFFFAOYSA-N 256.296 2.414 10 20 CECD COc1cc(O)c(CNC[C@@H](OC)C(C)C)cc1OC 271826407 NWDXABYHVQLMSC-OAHLLOKOSA-N 283.368 2.170 10 20 CECD CN(C)c1ccc(CN(C)c2ncc([N+](=O)[O-])cn2)cc1 273598089 IVIUMQVGQRSJIE-UHFFFAOYSA-N 287.323 2.087 10 20 CECD Oc1ccccc1CNC[C@@H]1COC2(CCCC2)O1 271422682 MPEUAANETYRBOL-CYBMUJFWSA-N 263.337 2.168 10 20 CECD CCN(CC)S(=O)(=O)Nc1cc(C)c(O)c(C)c1C 274853542 YHPORHQTEMCSMS-UHFFFAOYSA-N 286.397 2.316 10 20 CECD CCCCN(Cc1ccccc1O)[C@@H](C)C(=O)N(C)C 282348719 CKEOJFJJSOAJQS-ZDUSSCGKSA-N 278.396 2.471 10 20 CECD CCCN(CC(=O)NC)Cc1ccc(N(C)C)c(C)c1 293379612 GELYZEDQJGJRGH-UHFFFAOYSA-N 277.412 2.019 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCC2(C)C)c(O)c1 806021173 FGKSZKUIAYVOGF-CYBMUJFWSA-N 278.352 2.389 10 20 CECD Cc1cccc(CN2CCC(F)(F)[C@H](CO)C2)c1O 291305050 QZSNOUMAVOTZNC-LBPRGKRZSA-N 271.307 2.150 10 20 CECD CCC(C)(C)C(=O)COC(=O)c1cccc(O)c1O 811188859 APCHCXZFNGQZKI-UHFFFAOYSA-N 266.293 2.260 10 20 CECD C[C@@H]1C[C@@H](N[C@H]2CCCNC2)c2c(O)ccc(F)c21 817942165 XMPJMWMKSLIYNG-JFGNBEQYSA-N 264.344 2.421 10 20 CECD COc1cccc(CN[C@H](C)c2ccnc(O)c2)c1O 815148550 ZFZCQGBETMZISG-SNVBAGLBSA-N 274.320 2.352 10 20 CECD COc1cc(CN(C)CCO)c(O)c(C(C)(C)C)c1 824484712 RHUXWOGSFSNWRW-UHFFFAOYSA-N 267.369 2.122 10 20 CECD Cc1cc(O)c(CN[C@H]2CCN(C)C2)cc1Cl 825247909 ZNVPHNMOOLPVGT-NSHDSACASA-N 254.761 2.148 10 20 CECD C[C@H](Cc1cnn(C)c1)C(=O)N[C@H](C)c1ccccc1O 827952401 QZGJZOCZCIZNKH-VXGBXAGGSA-N 287.363 2.182 10 20 CECD CC(=O)Nc1ccc(CNC(=O)c2cc(O)cs2)cc1 732265872 JMRWVCAWDRCGNI-UHFFFAOYSA-N 290.344 2.342 10 20 CECD O=C(Nc1nnc(C2CC2)s1)c1cc(O)cs1 731867800 WDSSCCCJECGHSI-UHFFFAOYSA-N 267.335 2.435 10 20 CECD C[C@@]1(C(=O)O)CCN(Cc2cc(Cl)cc(F)c2O)C1 833554507 VTVJNSHCOACXML-CYBMUJFWSA-N 287.718 2.481 10 20 CECD CCC[C@H](C)NC(=O)[C@@H](C)OC(=O)c1cc(O)cs1 732352691 CDVIXKYXDPQIRC-DTWKUNHWSA-N 285.365 2.304 10 20 CECD C[C@@H](N[C@@H]1CCc2cccc(O)c21)c1nnnn1C1CC1 834784032 QYUNUTKEIHIAEN-BXKDBHETSA-N 285.351 2.052 10 20 CECD COc1ccc(CN[C@H](C)[C@@H](O)C(F)(F)F)cc1C 865712240 YKZVYGXPLAGWPT-BXKDBHETSA-N 277.286 2.405 10 20 CECD CCN(C(=O)/C=C/c1cnn(C)c1)c1ccccc1OC 914519205 JRLPDDRWGRSGPB-MDZDMXLPSA-N 285.347 2.495 10 20 CECD CO[C@H](C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 749562769 NJTVDAVWLDTFIO-GFCCVEGCSA-N 264.369 2.136 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CC[C@@H](CN)C2)c1O 841083243 ABBGIZPKCOAIOV-BXKDBHETSA-N 284.787 2.271 10 20 CECD CC1(NC(=S)NCc2ccccc2O)CCC1 840723940 HBRRCRRFUNAWDJ-UHFFFAOYSA-N 250.367 2.299 10 20 CECD Cc1cc(C)c([C@@H](C)N[C@H](CO)CCF)c(O)c1 846208406 JOWLDIACHJMNJH-NEPJUHHUSA-N 255.333 2.380 10 20 CECD COC/C(C)=C\C(=O)NCc1ccc(N(C)C)c(F)c1 844358426 WVWWNTKYWXGNLJ-XFFZJAGNSA-N 280.343 2.101 10 20 CECD C[C@@H](Cc1ccncc1)NC(=O)c1cc(O)cs1 749543279 DNMSUCCBRPKFNG-VIFPVBQESA-N 262.334 2.210 10 20 CECD C[C@@H](NCc1cc(F)ccc1O)[C@@H]1CCCNC1 841033271 MIKXXSAMAMJVGQ-GHMZBOCLSA-N 252.333 2.009 10 20 CECD CCc1cccc(CN2CCC(F)(F)[C@H](CO)C2)c1O 848913213 RGJIPCCZQQGIBC-ZDUSSCGKSA-N 285.334 2.404 10 20 CECD CN[C@@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 848427434 MSKCSLHJNSSFJA-ZDUSSCGKSA-N 277.412 2.098 10 20 CECD NC[C@H]1CC[C@H](CNCc2ccc3c(c2)CCO3)CC1 841081242 ZFGFTNSXWDVVHJ-HDJSIYSDSA-N 274.408 2.476 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)Cc2cnccn2)c1O 846142484 ULZPHEDQZBIGAW-NWDGAFQWSA-N 287.363 2.473 10 20 CECD CCOc1cccc(CNCC2(C(=O)O)CCC2)c1O 854244962 YRKQHBVFZMQHGX-UHFFFAOYSA-N 279.336 2.135 10 20 CECD Cc1ccc(CN2CC[C@H](C(=O)N3CCCC3)C2)c(O)c1 877529381 AZFMKFAITSWOBW-HNNXBMFYSA-N 288.391 2.145 10 20 CECD COC[C@@H](C)NCc1ccc(OC)c(Cn2cccn2)c1 873006652 NWASTYVUDRHFBD-CYBMUJFWSA-N 289.379 2.065 10 20 CECD CCOc1ccc(N(C)C[C@@H](O)CSC)cc1 778091278 XHZOFCZILOAJRR-GFCCVEGCSA-N 255.383 2.245 10 20 CECD C/C=C(\C)C(=O)NCCNCc1ccc(OC)c(C)c1 1125448988 CSUQAPVFFMWRTG-LFYBBSHMSA-N 276.380 2.176 10 20 CECD COc1cccc([C@H](C)N[C@@H](CCO)C(F)(F)F)c1O 886803702 MFFQJJNFKSHLPG-KWQFWETISA-N 293.285 2.365 10 20 CECD C[C@@H](NC(=O)N(C)Cc1ccccc1O)[C@@H]1CCCOC1 780858791 ARQULESNPIGTNZ-TZMCWYRMSA-N 292.379 2.349 10 20 CECD CCOc1ccc(CN2CCC[C@]2(C)CO)c(O)c1 789557788 MVOQNKRKIJECQY-OAHLLOKOSA-N 265.353 2.138 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](C)[C@@H](CO)C2)c1O 895375473 BRHUKEBJDQDNLB-TZMCWYRMSA-N 279.380 2.160 10 20 CECD COc1ccc(CNC(=O)c2ccccc2)c(O)c1 794388984 FLLLNPUGAAYOJO-UHFFFAOYSA-N 257.289 2.331 10 20 CECD CCO[C@H]1CCCN(Cc2cc(OC)ccc2O)C1 133650241 CWORGWWPTNVVJW-AWEZNQCLSA-N 265.353 2.402 10 20 CECD COc1cc(Cl)cc(CNCCC(C)(C)O)c1O 274979045 XGZBVSGETDFEAP-UHFFFAOYSA-N 273.760 2.305 10 20 CECD C[C@@H](CCO)NCc1c(O)cccc1Br 706846448 ITYLADOTDFWPJP-QMMMGPOBSA-N 274.158 2.015 10 20 CECD COc1cccc(O)c1CN[C@H]1CCCSC1 749111212 YKVAQWLTWQAPEV-JTQLQIEISA-N 253.367 2.386 10 20 CECD Nc1ccc(CN2C[C@@H](N)[C@H](c3cccc(F)c3)C2)cc1 1335288888 JJGCUOOSKPCPPH-DLBZAZTESA-N 285.366 2.335 10 20 CECD Cc1ccc(O)c(CN(C)C[C@H]2CCCN(C)C2)c1 92253844 ZNENIVZODXOCIT-AWEZNQCLSA-N 262.397 2.474 10 20 CECD C[C@H](N[C@@H]1CCn2ccnc2C1)c1ccccc1O 779060675 HXZMTXTWBQHKPI-NWDGAFQWSA-N 257.337 2.254 10 20 CECD Nc1ccc(CNC(=O)N[C@H]2CCC[C@H](F)C2)cc1 1335568215 JIZNFDNYAGQDCW-AAEUAGOBSA-N 265.332 2.349 10 20 CECD Cc1oncc1CN(C)c1ccc(OCC(=O)O)cc1 1600863610 PQCQOHLXRHCGTQ-UHFFFAOYSA-N 276.292 2.083 10 20 CECD O=C(O)[C@H]1CCCCCN1Cc1ccc(F)c(F)c1O 1608629483 UKEHLYALRBRGMD-LLVKDONJSA-N 285.290 2.500 10 20 CECD N[C@H]1CC=C(C(=O)N2CCCc3c(F)cc(F)cc32)C1 1580171800 XDRGWIKBNHIYLI-NSHDSACASA-N 278.302 2.292 10 20 CECD CC[C@@H](NC1CCC1)c1cccc(-c2nn[nH]n2)c1O 1590465571 IXPKFZLGNGECAR-GFCCVEGCSA-N 273.340 2.166 10 20 CECD CCN(C)c1ccc(CN2CCC=C(C(=O)O)C2)cc1 1776855913 LTKUVLGBGLOBCN-UHFFFAOYSA-N 274.364 2.359 10 20 CECD COCC(C)(C)C(=O)N(C)Cc1ccc(N(C)C)cc1 160732107 PWQFLVJYIZHIOR-UHFFFAOYSA-N 278.396 2.384 10 20 CECD COc1ccc(O)c([C@H](C)NCC(C)(C)OC)c1 168823533 BJFLWLVMAINITG-JTQLQIEISA-N 253.342 2.476 10 20 CECD COc1cccc(CNC(=O)c2cc3occc3[nH]2)c1O 153999916 FIHCBSHFZFFMIG-UHFFFAOYSA-N 286.287 2.405 10 20 CECD COC(=O)c1occc1CNCc1ccccc1O 164475936 FIKCUOBYDMEGLO-UHFFFAOYSA-N 261.277 2.062 10 20 CECD Cn1cncc1CNCc1cccc(Br)c1O 278424329 RZSSXZKECHQOIL-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CCN(C)C2)cc1 49084091 XQPOWHJZNAZKFX-OAHLLOKOSA-N 261.413 2.327 10 20 CECD Cc1ccc([C@@H](C)NC[C@]2(O)CCSC2)c(O)c1 185639080 WKHGAAJWXDBJEL-BXUZGUMPSA-N 267.394 2.219 10 20 CECD CCc1cccc(CNCCN2CC=CCC2)c1O 691448657 BJECFMOAWSELEA-UHFFFAOYSA-N 260.381 2.306 10 20 CECD CSC[C@@H](C)C(=O)N1CCOc2cc(N(C)C)ccc21 173190700 FUGXNSOBSKDWEP-LLVKDONJSA-N 294.420 2.477 10 20 CECD C[C@@H](CNC(=O)NCc1ccc(N)cc1)c1ccncc1 1353368511 YNLUOTWZPHNYCV-LBPRGKRZSA-N 284.363 2.267 10 20 CECD Cc1c(/C=C/C(=O)N2CCCc3cccc(O)c32)cnn1C 182918169 AOXPXQBXSAMSSB-CMDGGOBGSA-N 297.358 2.427 10 20 CECD Oc1c(Cl)cccc1CNCCOCC(F)F 189004697 GLNYDUWIUJLWTC-UHFFFAOYSA-N 265.687 2.417 10 20 CECD Cc1cnc(C(=O)N(C)Cc2ccc(N(C)C)cc2)cn1 45580103 SVXLDAKNKXTHPF-UHFFFAOYSA-N 284.363 2.123 10 20 CECD CC(C)C(=O)NCc1ccc(N2CCC(O)CC2)c(F)c1 47293765 IDRNXENCVJZYBR-UHFFFAOYSA-N 294.370 2.059 10 20 CECD CCN1CCC(CCNC(=O)Cc2ccc(N)cc2)CC1 236851535 HDFXDYCONIIRBZ-UHFFFAOYSA-N 289.423 2.050 10 20 CECD Cc1ccccc1[C@@H]1C(=O)NCCN1Cc1ccccc1O 368119971 LSZXIHBBJNXBAY-QGZVFWFLSA-N 296.370 2.374 10 20 CECD C[C@@H](NC1CCOCC1)c1cc([N+](=O)[O-])ccc1O 273390359 KOOPBSZQFNBHOY-SECBINFHSA-N 266.297 2.130 10 20 CECD CN1CCCN(C(=O)/C=C/c2c[nH]cn2)c2ccccc21 283944708 KXTHLNVPUSXERD-BQYQJAHWSA-N 282.347 2.296 10 20 CECD CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NCc1ccccc1O 285451890 JBCBZYUOXCZDBR-IUODEOHRSA-N 276.380 2.175 10 20 CECD CC(F)(F)C(=O)NCc1ccc(N2CC=CC2)cc1 289069635 BJKJCGFIAIBTCV-UHFFFAOYSA-N 266.291 2.334 10 20 CECD CCCCN(Cc1cnn(C)n1)Cc1ccccc1O 289488669 YTYDZQFSUFPDRK-UHFFFAOYSA-N 274.368 2.323 10 20 CECD COCC[C@@H](CO)N[C@H](C)c1cc2c(cc1O)CCCC2 281719266 UMIBUXRSBGOTPD-DOMZBBRYSA-N 293.407 2.319 10 20 CECD CC(C)c1nnc(CN[C@H]2CCc3cccc(O)c32)[nH]1 296595192 VFIVVLBHYTXKAF-NSHDSACASA-N 272.352 2.411 10 20 CECD Cc1cc(C)c([C@H](C)N[C@H]2CC(=O)N(C3CC3)C2)c(O)c1 294804145 PEKPETZJTQNDLP-STQMWFEESA-N 288.391 2.423 10 20 CECD C[C@H]1C[C@@H](NCCN(C)C)c2c(O)ccc(F)c21 806171460 JMXXIMDYWSHNHI-GXSJLCMTSA-N 252.333 2.231 10 20 CECD O=C(NCCCCCN1CCCC1)c1cccc(O)c1O 294024008 WBMRIHIMWMBBER-UHFFFAOYSA-N 292.379 2.094 10 20 CECD O=C1CN(Cc2ccc3ccccc3c2O)CN1C1CC1 816594932 SZOYEMWUMPSBCH-UHFFFAOYSA-N 282.343 2.310 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1ccc(N(C)C)c(C)c1 815094461 BURGVDIUFJMTON-RDJZCZTQSA-N 292.423 2.345 10 20 CECD CN1CCCC[C@H]1C(=O)NCc1cc(Cl)ccc1O 824212966 DUIZHHJUSYAGCY-LBPRGKRZSA-N 282.771 2.146 10 20 CECD CCN(CCC(=O)O)Cc1cc2c(cc1O)CCC2 737095997 HDAORAPWZQSANH-UHFFFAOYSA-N 263.337 2.178 10 20 CECD CC[C@@H](C)C[C@@H](NCc1ccccc1O)C(=O)O 901679365 CXQDNRJPUIKJGB-ZYHUDNBSSA-N 251.326 2.371 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1cccc(O)c1 588406522 QBQNRHQASYOTQX-ALCCZGGFSA-N 285.299 2.133 10 20 CECD COc1cc(Cl)cc(CN2CC(C)(OC)C2)c1O 839101167 KJAKVBGHDXXDFG-UHFFFAOYSA-N 271.744 2.275 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@H](C2CC2)[C@H]1C1CC1 836884446 FWGULYOLKMTTJQ-TZMCWYRMSA-N 273.332 2.358 10 20 CECD COc1ccc(N(C)CCN(C)c2nnc(C)s2)cc1 845671489 BPZMTDWWAFCXSX-UHFFFAOYSA-N 292.408 2.428 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCCC[C@H]2F)c1O 840440907 IXHFICVDWDRMNU-VXGBXAGGSA-N 296.342 2.481 10 20 CECD CC[C@H](C)[C@H](C)C(=O)NCc1ccc(O)cc1O 910948815 AXFBHRDVILEVEM-UWVGGRQHSA-N 251.326 2.396 10 20 CECD C[C@@H]1CCSCCN1C(=O)NCCc1ccc(N)cc1 841959942 SOMPWOXTKATLDN-GFCCVEGCSA-N 293.436 2.348 10 20 CECD O=C(O)c1cnc(NCc2ccc(N3CCCC3)cc2)nc1 844207397 DCYUKJFIOTYUGZ-UHFFFAOYSA-N 298.346 2.387 10 20 CECD CCCN(C(=O)c1cc(O)cs1)[C@@H]1CCN(C)C1 844146950 TVGRNMDNCZEJOZ-SNVBAGLBSA-N 268.382 2.010 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)NC1CC1 840237294 FAYPNTMIZUQIBD-GFCCVEGCSA-N 275.396 2.454 10 20 CECD CCC[C@](C)(O)C(=O)NCc1cc(Cl)ccc1O 846474861 CMSDDGAWHCVNNO-ZDUSSCGKSA-N 271.744 2.213 10 20 CECD Cc1cc(Br)c(O)c(CN2CCC(N)CC2)c1 843047253 IGBMWFUCWIRYBF-UHFFFAOYSA-N 299.212 2.386 10 20 CECD CCN1CCN(Cc2cc(C(C)C)c(C)cc2O)CC1=O 758277192 SNLIXNLHXWXOAT-UHFFFAOYSA-N 290.407 2.488 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1ccc(F)cc1O 756734261 VJOIPLWAQNQHPR-MNOVXSKESA-N 271.332 2.233 10 20 CECD CCOCC(=O)CSc1ncc(Cl)s1 850000546 YTRBQLNGWYSKAF-UHFFFAOYSA-N 251.760 2.494 10 20 CECD O=C(c1cc(O)cs1)N1C[C@@H](CO)Cc2ccccc21 854577988 LXZJNZQALSZUNY-JTQLQIEISA-N 289.356 2.265 10 20 CECD CCC[C@@H](CNC(=O)c1c(F)ccc(O)c1O)OCC 863935940 YDIQYCUOCWCLAD-VIFPVBQESA-N 285.315 2.172 10 20 CECD O=C(NCc1ccn2ccnc2c1)NCc1ccccc1O 762271683 KZZDATDWKXKTMC-UHFFFAOYSA-N 296.330 2.039 10 20 CECD Cc1nc(CN2CCOc3cc(N(C)C)ccc32)[nH]c1C 862325340 DQHCUQQRPBCJES-UHFFFAOYSA-N 286.379 2.492 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C(C)(C)COC 935948411 MDERQJVCQMNNMY-UHFFFAOYSA-N 286.368 2.167 10 20 CECD CC1(F)CCN(C(=O)Cc2ccc(N)cc2)CC1 877203674 OQRXMQBGKHYAIO-UHFFFAOYSA-N 250.317 2.162 10 20 CECD CC(=O)NCCc1noc(-c2ccc(-n3cccc3)cc2)n1 762246196 PJVWUUZBDGPSGG-UHFFFAOYSA-N 296.330 2.206 10 20 CECD COc1ccc2c(c1)CCCN2CN1C(=O)[C@H]2C=C[C@H]1C2 766342708 ZMVRHRHPGRKLML-KBPBESRZSA-N 284.359 2.192 10 20 CECD CCC1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768443097 OVGUVATZLFBQCT-OAHLLOKOSA-N 277.364 2.440 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2cc(OC)ccc2O)C[C@@H]1C 877666222 BHUXMVUYCCAKCX-ZBEGNZNMSA-N 293.363 2.032 10 20 CECD Nc1ccc(OCc2cn(CC[C@H]3CCCO3)nn2)cc1 881329124 PNRMIVGXYVGJDR-CQSZACIVSA-N 288.351 2.008 10 20 CECD C[C@@H](CCO)CNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776248398 ZMACGGOBHFAQPF-QWHCGFSZSA-N 293.411 2.131 10 20 CECD COc1ccc(CN[C@H]2CC2(C)C)c(O)c1OC 894902540 ZSRYKDRGKFXJHV-NSHDSACASA-N 251.326 2.298 10 20 CECD Cc1ncccc1CCNCc1cc([N+](=O)[O-])ccc1O 898257097 NTBQYWWNJWVICH-UHFFFAOYSA-N 287.319 2.336 10 20 CECD COc1ccc(CNC[C@@H]2C[C@H](C)O[C@H]2C)c(O)c1OC 894909238 COLFSYFEVYAPOW-GVXVVHGQSA-N 295.379 2.313 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C2OCCO2)C1 896380156 HHJASCOFHGPRMU-HNNXBMFYSA-N 290.407 2.256 10 20 CECD C[C@H](NC(=O)NCCF)c1ccc(N(C)C)cc1 798074775 FHTIZIAIMZPKSF-JTQLQIEISA-N 253.321 2.082 10 20 CECD Oc1cc2c(cc1CNC[C@H]1C[C@H]3C=C[C@H]1C3)OCO2 1335133302 GZIJIGLODKIBOW-SDDRHHMPSA-N 273.332 2.423 10 20 CECD Cc1cc(Br)cc([C@@H](C)NC[C@@H](C)O)c1O 186902139 BNXUBZPGRKLIAA-RKDXNWHRSA-N 288.185 2.495 10 20 CECD CCOc1cccc(CN2CCN(CC)[C@H](C)C2)c1O 250267051 KQCHLBVILDWKEN-CYBMUJFWSA-N 278.396 2.317 10 20 CECD CCn1[nH]cnc1=N[C@@H](C)Cc1ccc(N(C)C)cc1C 1336665262 KIJJOVGLBUBZBR-ZDUSSCGKSA-N 287.411 2.137 10 20 CECD C[C@H](N[C@@H]1COC[C@H]1C1CC1)c1cc(C(=O)O)ccc1O 1604331126 ZOAJIIKXOZCYPW-QCZZGDTMSA-N 291.347 2.166 10 20 CECD C/C=C\C[C@H](CO)N[C@@H](C)c1cc(C(=O)O)ccc1O 1604851107 JTZXLKYSFJEGOY-OIFMLDNNSA-N 279.336 2.068 10 20 CECD CC(C)(F)C(=O)NCCCSc1nccs1 156803360 VUTRPVVVMZJBBG-UHFFFAOYSA-N 262.375 2.490 10 20 CECD Oc1ccc(CCNc2nnc(C(F)F)o2)cc1O 814363464 MMWUBNUUNCOYSY-UHFFFAOYSA-N 271.223 2.073 10 20 CECD CCc1cccc(CN2C[C@@H](C)N(C)C[C@H]2C)c1O 848904454 UKNUPKZUYFBHRO-CHWSQXEVSA-N 262.397 2.479 10 20 CECD CCOc1cccc(CN2CCC([C@H](C)N)CC2)c1O 110643912 FYTDQKFMJGGSRS-LBPRGKRZSA-N 278.396 2.350 10 20 CECD CN[C@H]1CCCN(Cc2cc(Br)ccc2O)C1 219858432 VISCUPNSBDYTKV-LBPRGKRZSA-N 299.212 2.339 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC(=O)NCC(C)C)c1 228693870 JUZGMLBZSCCATB-GFCCVEGCSA-N 264.369 2.123 10 20 CECD COc1cc(Cl)cc(CN2C[C@H](CN)C[C@H]2C)c1O 252879644 YXTZWIZYEUZUPF-ZJUUUORDSA-N 284.787 2.223 10 20 CECD C[C@H](NCCc1ccnn1C)c1cc(F)ccc1O 184025829 CPFWTJQGOKEODJ-JTQLQIEISA-N 263.316 2.158 10 20 CECD COc1ccc(O)c([C@@H](C)NC2CCN(OC)CC2)c1 692122494 BBELKQFYTLGYOF-LLVKDONJSA-N 280.368 2.077 10 20 CECD C[C@@H](OCC1CC1)C(=O)NCc1ccc(N(C)C)c(F)c1 58734269 SSKZTOSXOURIOK-LLVKDONJSA-N 294.370 2.323 10 20 CECD OCCCN1CCCc2cc(OC(F)F)ccc21 69003619 KXAMDOKJMXYUBP-UHFFFAOYSA-N 257.280 2.423 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(F)cc1O)CC2 185317510 URHQJFJUSGPJAL-SKDRFNHKSA-N 290.342 2.097 10 20 CECD CN(CCOC[C@@H]1CCCO1)Cc1ccccc1O 152295214 VCHBNCWTOQTHPG-AWEZNQCLSA-N 265.353 2.020 10 20 CECD COC[C@H](O)CNCc1cc(C)n(-c2ccccc2)c1C 71263820 FTTNODWOTYFZCO-QGZVFWFLSA-N 288.391 2.191 10 20 CECD COc1ccc(O)c(CN(C)[C@H](C)C(=O)OC(C)C)c1 180557495 JDUHFADQGBVSNY-LLVKDONJSA-N 281.352 2.173 10 20 CECD C[C@H]1CN(Cc2cc(Br)ccc2O)C[C@H](C)N1 212466804 QDWNCWOOKKQAAM-UWVGGRQHSA-N 299.212 2.337 10 20 CECD COc1cccc(CNCC2(SC)CC2)c1O 193654912 SMWORKUSZSJTPE-UHFFFAOYSA-N 253.367 2.386 10 20 CECD COc1ccc(N2CCN(C(=O)C=C(C)C)CC2)cc1F 84815175 WEDNZQNLUIMUSO-UHFFFAOYSA-N 292.354 2.449 10 20 CECD CC[C@H](C)[C@H](N)C(=O)NCc1ccc(N2CCCC2)cc1 195171620 IZYLWUQWHLELGN-BBRMVZONSA-N 289.423 2.276 10 20 CECD COc1ccc2c(c1)CCCCN2CC(=O)NC(C)C 270908896 SLTNPJGCGHVTHH-UHFFFAOYSA-N 276.380 2.363 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC1CC(F)(F)C1 277593191 PIWYUCQGYOGKAE-DUXPYHPUSA-N 269.247 2.025 10 20 CECD CC[C@H](N[C@H]1CCN(CCOC)C1)c1ccc(C)cc1O 279973792 DDTHQZBRRHJPMY-HOCLYGCPSA-N 292.423 2.462 10 20 CECD C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cc(O)cs1 807694567 MUTWFBFRGYSXIJ-WDEREUQCSA-N 280.393 2.153 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CSC[C@@H]2C)c1O 809703794 UFKGBBYKANAWSB-WCBMZHEXSA-N 298.364 2.150 10 20 CECD Cc1cc(C(=O)NCCO)c(C)n1-c1cccc(Cl)c1 299149173 KLNBATFNUWRWLA-UHFFFAOYSA-N 292.766 2.470 10 20 CECD CC(=O)C(=O)COC(=O)CCSc1ccc(C)cc1 808486432 QUYIXOCHKPDZTI-UHFFFAOYSA-N 280.345 2.179 10 20 CECD CC[C@H](N[C@H]1COC[C@@H]1OC)c1ccc(C)cc1O 290117169 JACBOJSUWBZUGS-YDHLFZDLSA-N 265.353 2.155 10 20 CECD C[C@@H](O)CNc1ccccc1OC[C@@H]1CCCCO1 819426988 QKYCAPBQMDAOOQ-OLZOCXBDSA-N 265.353 2.427 10 20 CECD COc1cccc(O)c1CN(C)Cc1nncn1C(C)C 814179067 OVNZOESUCZCCTI-UHFFFAOYSA-N 290.367 2.205 10 20 CECD COCC1(NCc2cc(Cl)ccc2O)CCOCC1 814302308 RYZNISZHDSKQEB-UHFFFAOYSA-N 285.771 2.331 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C(=O)N(C)C)C2)cc1Cl 826122204 YVPSYJOSHUBVRD-LLVKDONJSA-N 296.798 2.264 10 20 CECD Cc1cc(O)c(CN(C)C[C@@H]2COCCO2)cc1Cl 827139805 FMDPJSWQOQLBDN-GFCCVEGCSA-N 285.771 2.201 10 20 CECD CCNC(=O)CN(CC)Cc1cc(Cl)c(C)cc1O 824529083 HFAIEKKZTRHNQN-UHFFFAOYSA-N 284.787 2.312 10 20 CECD CC[C@@H](NC(=O)c1c(F)ccc(O)c1O)C(F)F 833200254 ABEFOZVQXNPXBB-ZCFIWIBFSA-N 263.215 2.010 10 20 CECD CN(CCNC(=O)c1cc(O)cs1)Cc1ccccc1 731870317 MESMDRXOBSPAJY-UHFFFAOYSA-N 290.388 2.316 10 20 CECD C[C@H]1C[C@@H](N)CCN1Cc1cccc(Br)c1O 846698337 FULPRVFFAUMJLL-ONGXEEELSA-N 299.212 2.466 10 20 CECD CN(C)c1ccc([C@H](N)CNC2CCSCC2)cc1 841044592 DMUFHMZFVLEVOJ-OAHLLOKOSA-N 279.453 2.238 10 20 CECD COc1ccc(N(C)CCN(C)Cc2ccon2)cc1 844402486 ZLMVBBLWUYZOLT-UHFFFAOYSA-N 275.352 2.251 10 20 CECD CCCN(Cc1cc2c(cc1O)OCO2)[C@@H]1CCN(C)C1 843421362 CIOKYGKXMNBZMJ-CYBMUJFWSA-N 292.379 2.037 10 20 CECD CNCc1ccccc1NCc1cc2c(cc1O)OCO2 841042984 NFPPYEPUHGXMOF-UHFFFAOYSA-N 286.331 2.452 10 20 CECD C[C@H]1C[C@H](CN(C)c2ccc3c(c2)OCO3)CCN1 841012030 WTDOSXYOOSPKES-NWDGAFQWSA-N 262.353 2.240 10 20 CECD CC[C@@](C)(OC)C(=O)NCc1cc(Cl)ccc1O 846472977 HHTDYFLSKZWZCF-CYBMUJFWSA-N 271.744 2.477 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CCCC[C@@H]1CN 841950653 VEGZINYDABREPN-OCCSQVGLSA-N 291.395 2.051 10 20 CECD Cc1cc(O)c(CN[C@H]2CCN(CC(F)F)C2)cc1C 841894873 ZCPYTUIPSUAGLE-ZDUSSCGKSA-N 284.350 2.438 10 20 CECD C[C@H]1C[C@H](C)CC[C@@H]1NC(=O)C(=O)Nc1ccc(N)cc1 841038311 UQMTXVHGHNVUIA-SUNKGSAMSA-N 289.379 2.148 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CCC[C@]3(C(=O)O)C2)cc1 846282765 DJUNMXXNKXNCOM-PBHICJAKSA-N 288.391 2.439 10 20 CECD CC(=O)[C@H]1CCCCN1C(=O)/C=C/c1ccc(O)c(O)c1 854724852 BGPQFECNNSATON-STMXVASLSA-N 289.331 2.081 10 20 CECD C[C@H](NCC(=O)NC1CCCC1)c1cc(F)cc(F)c1O 756705571 LFOQMRXRGAXYFR-VIFPVBQESA-N 298.333 2.380 10 20 CECD CC(C)CNC(=O)CCCN(C)Cc1ccccc1O 851840846 JPBFHPYBGCILKZ-UHFFFAOYSA-N 278.396 2.376 10 20 CECD COc1ccc(O)c([C@H](C)NCCOC[C@H]2CCOC2)c1 756565809 YTBTVPNPRKDUOP-STQMWFEESA-N 295.379 2.105 10 20 CECD C[C@H](NC[C@H](O)COCC1CC1)c1cc(Cl)ccc1O 756510452 IJYAJHXYSVULSO-GWCFXTLKSA-N 299.798 2.484 10 20 CECD COc1cc(CNCc2ccc(C)cc2O)ccn1 877015482 RFQXRWKPNWWNJQ-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COCC(C)(C)NCc1ccc(N2CCC(O)CC2)cc1 877003654 XSEVCIJDINEBGB-UHFFFAOYSA-N 292.423 2.162 10 20 CECD CC1(C)CN(Cc2ccc(N3CCOCC3)cc2)C1 877717677 PBEOIMYZVJCKAI-UHFFFAOYSA-N 260.381 2.365 10 20 CECD COc1cccc(CNc2ccc3c(c2)C(=O)NCC3)c1O 770578799 KOFNBYNYTVQNPR-UHFFFAOYSA-N 298.342 2.299 10 20 CECD CCCNC(=O)CN(CCC)Cc1ccc(C)cc1O 876624754 JGKXEXNLYINSQJ-UHFFFAOYSA-N 278.396 2.439 10 20 CECD Cc1ncc(CN(C)C(=O)NCc2ccc(N)cc2)s1 1120592444 XLKHHKIXODKNFZ-UHFFFAOYSA-N 290.392 2.375 10 20 CECD C[C@@H](NC(=O)C[C@H]1CCOC1)c1ccc(N(C)C)cc1 773010408 PJRVEWRIDFTWKR-CHWSQXEVSA-N 276.380 2.356 10 20 CECD C[C@@H](NCCCn1cccn1)c1c(O)cccc1F 886498624 JHNCZSVQCJKITK-LLVKDONJSA-N 263.316 2.469 10 20 CECD CCO[C@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779481782 OJXKWWJWLFWLFW-WOLRVDTOSA-N 291.347 2.139 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccc3c(c2)CCCO3)[C@H]1OC 893593820 PEZUENGGCMLEKV-USXIJHARSA-N 291.391 2.294 10 20 CECD C[C@@]1(O)CCCN(Cc2cc(F)cc(F)c2O)C1 894044659 WJRXVKSIILZZCJ-CYBMUJFWSA-N 257.280 2.017 10 20 CECD C[C@@H](NCC1([S@](C)=O)CC1)c1cc(F)cc(F)c1O 799727417 JNQALMCEKXEURQ-YLVJLNSGSA-N 289.347 2.232 10 20 CECD CCc1ccnc(C(=O)NCc2ccc(OC)cc2O)c1 794376757 BBOWRNQQTKOWET-UHFFFAOYSA-N 286.331 2.288 10 20 CECD CCN(CC)C(=O)CN[C@H](C)c1ccc(N(C)C)cc1 135127542 JCUYZZLMGUIEQJ-CYBMUJFWSA-N 277.412 2.272 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)C(=O)NC(C)(C)C 135719319 XDACWZXBIDJVTG-MNOVXSKESA-N 264.369 2.346 10 20 CECD CCN(C)c1ccc(CN2CCC[C@H](CC(N)=O)C2)cc1 1320858357 GOSTXLWDSAVDGR-OAHLLOKOSA-N 289.423 2.230 10 20 CECD CCc1cccc(CN(C)[C@H](C)C[S@](C)=O)c1O 709309432 UXZMZKNDDCWIPR-ZMZPIMSZSA-N 269.410 2.153 10 20 CECD CCC[C@@](C)(CO)NCc1ccc(OC)c(OC)c1O 1334955839 ITSONTLOQKFBNA-HNNXBMFYSA-N 283.368 2.050 10 20 CECD Cc1ccc([C@@H](C)NCCNC(=O)C(C)C)c(O)c1 20125458 QQHRQUHIPXSMOT-GFCCVEGCSA-N 264.369 2.123 10 20 CECD COc1ccc(O)c(CNCc2cn(C)nc2C2CC2)c1 1355254712 OSGZXSFDRADSJO-UHFFFAOYSA-N 287.363 2.302 10 20 CECD O=C(O)c1ccc(CC(=O)N2Cc3cccc(O)c3C2)cc1 1608880226 XKMQEQVHYLFRCT-UHFFFAOYSA-N 297.310 2.175 10 20 CECD COc1cc(CN2C[C@H](C)[C@@](C)(C(=O)O)C2)c(O)cc1C 1599408554 IXOKNPZHCBAPMY-ZBEGNZNMSA-N 293.363 2.252 10 20 CECD CN(Cc1ccccc1O)[C@H](C(=O)O)c1cccnc1 1598530363 BWURAENFJZVLCQ-AWEZNQCLSA-N 272.304 2.045 10 20 CECD CCN1CCc2cc(CNC3CC(C)(C(=O)O)C3)ccc21 1776877520 PGEOKWJLEJCSLD-UHFFFAOYSA-N 288.391 2.412 10 20 CECD CCN1CCc2cc(CNc3ccc(C(=O)O)nn3)ccc21 1776878027 PJVVLPPEMBSMGQ-UHFFFAOYSA-N 298.346 2.169 10 20 CECD CCCC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 262705819 MWZHFGVHTFWDME-CYBMUJFWSA-N 263.337 2.355 10 20 CECD COC1(CC(=O)N(C)Cc2ccccc2O)CCC1 276584153 BFKSXRVKAMWMFP-UHFFFAOYSA-N 263.337 2.310 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cnc(C)n2C)c1 689239889 PBCWMBIJNVTWSO-SNVBAGLBSA-N 275.352 2.294 10 20 CECD COc1ccc(O)c(CN(C[C@@H](C)C(=O)O)C2CC2)c1 833733909 VJCOINFUTBBGBW-SNVBAGLBSA-N 279.336 2.086 10 20 CECD Cc1noc(CCCC(=O)N(C)Cc2ccccc2O)n1 53916226 FNLDXWBGKPHUCL-UHFFFAOYSA-N 289.335 2.065 10 20 CECD COc1ccc(N2CCN(CCNCC(C)C)CC2)cc1 52418131 KQTGCHXWQSYODP-UHFFFAOYSA-N 291.439 2.063 10 20 CECD OCCCSCCNCc1c(O)cccc1Cl 113338242 LYQGMPQPUIJUES-UHFFFAOYSA-N 275.801 2.251 10 20 CECD C[C@@H]1C[C@@H]1C(=O)N(C)Cc1ccc(N2CCOCC2)cc1 68535645 WSXIYTFXKGMCEZ-CJNGLKHVSA-N 288.391 2.138 10 20 CECD C[C@@H](NC1CC1)c1ccc(N2CCOCC2)c(F)c1 20551012 MRIVQKDYLQCSLL-LLVKDONJSA-N 264.344 2.475 10 20 CECD CNC(=O)c1ccc(OC)c(NCc2ccccc2O)c1 118941302 ONVDMPMINRQAMS-UHFFFAOYSA-N 286.331 2.373 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CC[C@H](O)CC1 252700976 BTMQTWASQSKEFP-MGCOHNPYSA-N 255.745 2.439 10 20 CECD CCOC(=O)CN(CC)Cc1cccc(C)c1O 179829579 OPJZMQAEPALNJD-UHFFFAOYSA-N 251.326 2.086 10 20 CECD CSCCNC(=O)NCc1ccc(N2CC=CC2)cc1 125036931 YUXLIMKVADETBF-UHFFFAOYSA-N 291.420 2.225 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 126797459 XRVWDFNPFVPVKY-ZJUUUORDSA-N 254.761 2.215 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(C#N)c(O)c1 188323302 ZBRWGLFEYYIXQW-UHFFFAOYSA-N 282.299 2.242 10 20 CECD CCC1(CNC(=O)/C=C/c2ccc(O)c(O)c2)CC1 181166909 SKUGYRYFQWTYNR-GQCTYLIASA-N 261.321 2.417 10 20 CECD C[C@H]1C[C@H](CNC(=O)/C=C/c2ccc(O)c(O)c2)CCO1 272356707 AZOVWRSMHOHHQX-OLEFQQMKSA-N 291.347 2.042 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)N(C)C)c1ccc(F)cc1O 287560284 QDSDKYYMXKHBQV-JOYOIKCWSA-N 268.332 2.049 10 20 CECD CNC(=O)CC[C@@H]1CCCCN1Cc1cc(F)ccc1O 289203852 BOAWTQJZWVJNOU-AWEZNQCLSA-N 294.370 2.412 10 20 CECD CC(=O)N1CCC[C@H](CN[C@H]2CCc3cccc(O)c32)C1 296401110 KIDZLIZYCMALMO-HIFRSBDPSA-N 288.391 2.228 10 20 CECD CN(CCN(C)C1CC1)Cc1ccc(N(C)C)c(F)c1 290585574 UYELDGCYQIUNLF-UHFFFAOYSA-N 279.403 2.418 10 20 CECD Cc1cccc(CN[C@H](C2CC2)[C@@]2(CO)CCCO2)c1O 816667178 FQOONMXMEVGLQZ-SJORKVTESA-N 291.391 2.110 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)C(OC)OC 822757258 UVKUJVISVAREMV-UHFFFAOYSA-N 281.352 2.140 10 20 CECD CCCNC(=O)CCNCc1cc(Cl)c(C)cc1O 825131558 PQJBOEVQDVXMQT-UHFFFAOYSA-N 284.787 2.360 10 20 CECD CC[C@@H]1CN(C)CCN1Cc1cc(F)cc(C(C)=O)c1O 821338235 YZECCNLEHVHZTE-CQSZACIVSA-N 294.370 2.260 10 20 CECD CCOc1ccc(CNC[C@@H](C)CCCO)c(O)c1 824603400 RIIXIVGKWWZXQG-LBPRGKRZSA-N 267.369 2.289 10 20 CECD C[C@@H](NC(=O)c1cc(C=O)cn1C)c1ccc(N(C)C)cc1 829818518 XZRLJODPEWIIHV-GFCCVEGCSA-N 299.374 2.395 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)/C=C/[C@H]1CCOC1 822265522 REDTUXPXSPBVST-PPYMECGQSA-N 288.391 2.304 10 20 CECD COC(=O)c1ccc(O)c([C@@H]2NC(=O)c3ccccc3N2)c1 726796841 KEMCYAGQCXOTOW-AWEZNQCLSA-N 298.298 2.033 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC(C(=O)O)CC1 901480801 PEBQHVKZIJYOCK-UHFFFAOYSA-N 276.380 2.358 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@@H]1C(=O)O 833629710 LOOUTVMDJPUMCX-XVKPBYJWSA-N 287.718 2.337 10 20 CECD C[C@@H](CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1)C1CC1 832281584 UNXOVSDFYAYCNB-BLLLJJGKSA-N 289.423 2.305 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N[C@@H](C)C(=O)O)cc1 740120323 ZMRYSJUVJLQPBG-LBPRGKRZSA-N 286.331 2.297 10 20 CECD Oc1ccccc1CNC[C@@H]1NCCc2ccccc21 841069318 UGEGKEDAZKGIAH-INIZCTEOSA-N 268.360 2.369 10 20 CECD CC(=O)c1cc(Cl)cc(CN2[C@@H](C)CNC[C@H]2C)c1O 843369472 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CCN(C)c1ccc(Cn2cc([C@@H](N)C(C)C)nn2)cc1 881313922 WFPZCBKAZPVICN-INIZCTEOSA-N 287.411 2.438 10 20 CECD COc1ccc(N2CCC(N[C@H](C)C[C@H](C)O)CC2)cc1 783535214 LKXNXNMRCKKNME-KGLIPLIRSA-N 292.423 2.413 10 20 CECD CC(=O)N1CCC(CN[C@H](C)c2c(O)cccc2F)CC1 886524756 QFWUNWAFSAAIHK-LLVKDONJSA-N 294.370 2.440 10 20 CECD C[C@@H](C[C@@H](C)O)NCc1ccc(N(C)C)c(F)c1 782981114 XXUBWTOMXYGDPR-WDEREUQCSA-N 254.349 2.141 10 20 CECD Cc1nnc(NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)o1 897520939 AZMHVQQDNXCDTP-AWEZNQCLSA-N 289.383 2.159 10 20 CECD CCN(CCO)Cc1cc(Br)cc(F)c1O 893871434 JXCVOLRLIXCECQ-UHFFFAOYSA-N 292.148 2.108 10 20 CECD Cc1ncccc1CCNC(=O)NCc1ccccc1O 892527214 MQQUDJNNTSRVPX-UHFFFAOYSA-N 285.347 2.138 10 20 CECD CN1CCN(c2ccc(CN3CCCC3)cc2F)CC1 1319681888 LRBMDOURPWVWFG-UHFFFAOYSA-N 277.387 2.173 10 20 CECD CC(C)CNC(=S)NCc1ccc(N(C)C)cc1 747754054 VRCCNXJBENWKAM-UHFFFAOYSA-N 265.426 2.373 10 20 CECD CSC[C@@H](O)CNCc1ccc(N2CCCCC2)cc1 1336704904 XRXJIPQWBBVCDX-INIZCTEOSA-N 294.464 2.490 10 20 CECD Nc1ccc(CNC(=O)c2cnn(C3CCC3)c2)cc1 1263303720 GBQRXNSFPTULJB-UHFFFAOYSA-N 270.336 2.120 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@@H]3C[C@@H]3C2)cc1F 1350479961 MLVKIBXOVRLDKI-CHWSQXEVSA-N 291.370 2.443 10 20 CECD C[C@@H](NC1(C2CC2)CC1)c1cccc(-c2nn[nH]n2)c1O 1589953068 YHPKSSSCHULKII-SECBINFHSA-N 285.351 2.166 10 20 CECD CC[C@H](C)[C@H](O)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1594920809 LSFMVZGLOHUIPY-PKFCDNJMSA-N 281.352 2.148 10 20 CECD Oc1cccc2c1[C@@H](N[C@H]1CCn3ccnc3C1)CC2 834773553 GUVVNMXSTVWCBF-STQMWFEESA-N 269.348 2.181 10 20 CECD OC[C@H](CC(F)(F)F)NCc1cc(F)cc(F)c1O 708422597 YSEVHOCMQYIYFI-QMMMGPOBSA-N 285.212 2.073 10 20 CECD COCC(COC)N[C@@H](C)c1ccc(N(C)C)cc1 388509846 QKLHJSDKAYPKBC-LBPRGKRZSA-N 266.385 2.065 10 20 CECD COc1ccc(O)c(CN[C@H](C)[C@H]2CCCOC2)c1 389138094 XTIZKLJBCKMPHQ-NEPJUHHUSA-N 265.353 2.306 10 20 CECD CO[C@@]1(C)C[C@H](NC(=O)c2ccc(C)c(O)c2O)C1(C)C 179531823 ZOJJBYUJMKIKIN-ZBEGNZNMSA-N 293.363 2.340 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)[C@H]1CCSC1 125020809 LFHMHVWIAHKVMF-JTQLQIEISA-N 267.350 2.058 10 20 CECD CC(C)[C@H](O)CN[C@H](C)c1ccc(F)c(F)c1O 187722827 NFCOUHCNHADLGC-LDYMZIIASA-N 259.296 2.338 10 20 CECD COC(=O)COc1ccc(N(C)C[C@@H]2CC[C@@H](C)O2)cc1 191085905 AXKCNBTVTSHWEO-DOMZBBRYSA-N 293.363 2.242 10 20 CECD C[C@@H](NCCc1ccnn1C)c1ccc(N(C)C)cc1 184018559 YMBIWUVRVSAOCD-CYBMUJFWSA-N 272.396 2.379 10 20 CECD Oc1cc2c(cc1CNC1(C3CC3)CCOCC1)OCO2 363793964 AUKKVPAHOARGHM-UHFFFAOYSA-N 291.347 2.170 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2C[C@H]3[C@@H](C2)C3(C)C)c1O 278207391 JSIMOFRKTYIEDD-PHIMTYICSA-N 292.335 2.397 10 20 CECD Oc1ccccc1CN1CCC(c2cn[nH]c2)CC1 360013327 FURSRRCYQKJQAT-UHFFFAOYSA-N 257.337 2.495 10 20 CECD CN1CCCc2cc(CNC(=O)CCc3ncc[nH]3)ccc21 279150320 HEVQKGVILYXTRY-UHFFFAOYSA-N 298.390 2.041 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)c1 273520444 UAZZDMWTMZWWFD-CHWSQXEVSA-N 276.380 2.361 10 20 CECD CC[C@H]1CN(Cc2cccc(C)c2O)C[C@H](C)S1(=O)=O 289970757 ZCFVQSUQLXCDHS-JSGCOSHPSA-N 297.420 2.098 10 20 CECD CCCNC(=O)CN[C@@H](CC)c1ccc(F)cc1O 285492319 CDVWANTURVIDDE-LBPRGKRZSA-N 268.332 2.098 10 20 CECD COCC[C@@](C)(O)CN[C@@H](C)c1cc(C)ccc1O 185467086 RMQAWVNUUXPQNI-SWLSCSKDSA-N 267.369 2.139 10 20 CECD CC[C@@H](NCCCNC(C)=O)c1ccc(F)cc1O 285767122 SOADNMBXEZXROH-CYBMUJFWSA-N 268.332 2.098 10 20 CECD CS[C@H]1CCN(Cc2cc3c(cc2O)OCO3)C1 295086259 QZOVSRIRRKULCW-JTQLQIEISA-N 267.350 2.058 10 20 CECD CO[C@H]1CCN(C(=O)c2c(F)ccc(O)c2O)CC1(C)C 296220698 VFFCBBVQWYWQFN-NSHDSACASA-N 297.326 2.124 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@H]2CSC[C@@H]2C)c1O 809703796 UFKGBBYKANAWSB-WPRPVWTQSA-N 298.364 2.150 10 20 CECD CCOc1cccc(CN(C2CC2)C2COC2)c1O 296079770 QMFUEDIBZFINNK-UHFFFAOYSA-N 263.337 2.154 10 20 CECD O=C1OCc2c(NCc3cc4c(cc3O)OCO4)cccc21 809791770 WQTWERFMFOKXON-UHFFFAOYSA-N 299.282 2.403 10 20 CECD COc1cccc(CNC(=O)c2ccc(C)c(C)n2)c1O 298370524 NOFUPMAZQNCIMU-UHFFFAOYSA-N 286.331 2.343 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H](O)C2CCOCC2)c(O)c1 294838145 RPPYVHGYCOUOIA-CJNGLKHVSA-N 293.407 2.447 10 20 CECD CC(C)OCC[C@@H](O)CNCc1ccc(N(C)C)c(F)c1 818984875 IPKMDWOWIXOEPM-CQSZACIVSA-N 298.402 2.157 10 20 CECD COc1cccc(CNC(=O)c2ncccc2Cl)c1O 815834482 LBDKJAUBJIWYQG-UHFFFAOYSA-N 292.722 2.379 10 20 CECD CC[C@H](O)CNC1CCN(c2ccc(OC)cc2)CC1 813790997 MTPLBZIPVWFGDR-HNNXBMFYSA-N 278.396 2.025 10 20 CECD C[C@@H](NC(=O)C[C@](C)(O)C1CC1)c1ccccc1O 827941644 UQLOCGDCHWEGRN-BMIGLBTASA-N 263.337 2.121 10 20 CECD Cc1cnc(CNC(=O)/C=C\c2ccc(O)c(O)c2)s1 588406618 PGXIPGOXBSALSQ-HYXAFXHYSA-N 290.344 2.192 10 20 CECD CCC(CC)(CO)CNC(=O)/C=C\c1ccc(O)c(O)c1 588408625 QCHQVONNODWVQE-VURMDHGXSA-N 293.363 2.026 10 20 CECD COc1cc(CN2CC[C@@H](O)C2)c(O)c(C(C)(C)C)c1 824549015 VELOZVSQRNVHTR-GFCCVEGCSA-N 279.380 2.265 10 20 CECD CCc1cccc(CN(C)Cc2nnc(C)o2)c1O 827039502 WXSBEACEYOURFW-UHFFFAOYSA-N 261.325 2.278 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H](C)C(=O)O 901447880 JWLAIBZGHPSNFA-ZJUUUORDSA-N 268.332 2.091 10 20 CECD COC(=O)c1ccc(CNCc2ccc(OC)cc2O)o1 734160278 SYFCCTANJOUWPI-UHFFFAOYSA-N 291.303 2.070 10 20 CECD CC[C@@H](NC(=O)NCc1ccc(N(C)C)cc1C)[C@H](C)O 838480650 ZIRKTMGOMCZYKR-SWLSCSKDSA-N 293.411 2.020 10 20 CECD C[C@@H]1C[C@H](CNCc2cc([N+](=O)[O-])ccc2O)[C@@H](C)O1 840964656 UHUGBQMMZMBYDT-GMTAPVOTSA-N 280.324 2.204 10 20 CECD COc1cncc(/C=C2/SC(=S)N(C3CC3)C2=O)c1 849173047 BDDIYQDPEIBTPX-VZUCSPMQSA-N 292.385 2.454 10 20 CECD C[C@@H](CCO)N(C)Cc1cc(Cl)cc(F)c1O 846112660 WHQIZLTYCPMQPG-QMMMGPOBSA-N 261.724 2.387 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CC[C@@H]2NCC[C@H]2C1 843127096 OKBQKYXXIDNHAB-ZANVPECISA-N 284.762 2.369 10 20 CECD Cc1cc(O)c(CN(CC(=O)O)C2CCC2)cc1C 848640405 REVCZOCADQBJMX-UHFFFAOYSA-N 263.337 2.448 10 20 CECD COc1cccc([C@@H](C)NCCc2ccnn2C)c1O 846161715 BNISUCXSGWIZHY-LLVKDONJSA-N 275.352 2.028 10 20 CECD CCN(CC(=O)OC)Cc1ccc(N(C)C)cc1C 840914394 SHSRDSIYGZQYBU-UHFFFAOYSA-N 264.369 2.056 10 20 CECD Nc1ccc(CC(=O)NC[C@H]2COc3ccccc3C2)cc1 746403913 UOJATDSOINJHGH-AWEZNQCLSA-N 296.370 2.179 10 20 CECD COC[C@](C)(O)CN[C@@H](C)c1ccc(Cl)cc1O 841762704 JSMFFSQWGMNZGK-TVQRCGJNSA-N 273.760 2.094 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)Cc2cnccn2)c1 756493450 FBIBUSJDCNPMLP-VXGBXAGGSA-N 287.363 2.473 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCc2n[nH]cc2C1 857878017 RVOPRNCHUVQSEF-UHFFFAOYSA-N 270.380 2.342 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@]3(N)C2)cc1 857230144 ODJANBKOLXDTOA-HOCLYGCPSA-N 259.397 2.066 10 20 CECD C[C@@H]1OCC[C@@H]1COC(=O)/C=C/c1ccc(O)c(O)c1 869441990 ABGNNZQVVKDFQO-ZIAVJRNFSA-N 278.304 2.079 10 20 CECD O=Cc1ccc(OCCC(=O)NCc2ccccc2O)cc1 769362265 GDCVEVZMLCIFOL-UHFFFAOYSA-N 299.326 2.290 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cn3c(n2)CCCC3)c1 862755869 LUIVWPCSIMIVJI-UHFFFAOYSA-N 285.347 2.163 10 20 CECD CC[C@H](CNCc1ccc(N2CCCC2)cc1)C(=O)O 1119544410 ASBYWHQYSIJKCW-CQSZACIVSA-N 276.380 2.487 10 20 CECD Cc1ccc(CN[C@H]2CCN(CC3CC3)C2)c(O)c1 877024965 UVGYTFJSSHOBKG-HNNXBMFYSA-N 260.381 2.275 10 20 CECD CC[C@H]1CO[C@H](CC)CN1C(=O)NCc1ccc(N)cc1 1120677074 IKDQDAAESXDAFK-LSDHHAIUSA-N 291.395 2.368 10 20 CECD COc1cc(N2C[C@@H]3C[C@H]3C2)c([N+](=O)[O-])cc1OC 884589527 CPIHHNBCWBSXQM-IUCAKERBSA-N 264.281 2.068 10 20 CECD COC(=O)[C@H](CC(F)F)NCc1cc(Cl)ccc1O 789578654 DAVQYYFAEWXULT-VIFPVBQESA-N 293.697 2.332 10 20 CECD CC[C@@H](C)[C@H](OC)C(=O)NCc1ccc(OC)cc1O 794382493 XUVBZMQMLNTWEZ-YGRLFVJLSA-N 281.352 2.078 10 20 CECD Cn1ncc2c1CCCN(Cc1cc(F)cc(F)c1O)C2 894988403 ZYMZFUNZSCYTCV-UHFFFAOYSA-N 293.317 2.352 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CC[C@@H](C)C2)c(O)c1 793066088 KNIMNXRUEYWWTO-PWSUYJOCSA-N 278.352 2.389 10 20 CECD CC[C@@H](NC[C@H](O)COCC1CC1)c1ccc(F)cc1O 796737486 VZTZYSARQMENBA-DZGCQCFKSA-N 297.370 2.360 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1C/C=C/C1CC1 1325843822 JFSJOTPTGLZIQT-ONEGZZNKSA-N 286.331 2.123 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1cc(C)ccc1O 186029799 ZMOCEMRNESHUQO-RYUDHWBXSA-N 285.409 2.174 10 20 CECD Cc1nocc1CNCc1cc(F)cc(F)c1O 708481333 CFFDJENYGLOXKQ-UHFFFAOYSA-N 254.236 2.257 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H]2CCCCS2(=O)=O)c1 694591015 QLWZERXJCDYRFJ-OLZOCXBDSA-N 297.420 2.319 10 20 CECD CCCN(Cc1ccccc1O)c1nnnn1C(C)C 1334447929 JRCARISOAKQDHK-UHFFFAOYSA-N 275.356 2.376 10 20 CECD O=C(CC1CCCC1)NCCc1ccc(O)c(O)c1 98074486 OJAQDSPDSRKPBJ-UHFFFAOYSA-N 263.337 2.337 10 20 CECD C[C@@H](C(=O)O)C1(NCc2ccc(N(C)C)cc2)CC1 1261503527 CVZDZJMTBGDFBE-NSHDSACASA-N 262.353 2.096 10 20 CECD CCN1CCc2cc(CN[C@](C)(C(=O)O)C3CC3)ccc21 1776884793 XQSXTJJQLUYHOG-KRWDZBQOSA-N 288.391 2.412 10 20 CECD CC[C@H](NCCc1cncn1C)c1ccccc1O 401720325 IVWGJJCVQOFUGO-AWEZNQCLSA-N 259.353 2.409 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@@H]2NCC[C@H]2C1 311210128 KZKNJEBSCHJXAB-GWCFXTLKSA-N 266.772 2.229 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@H]2NCC[C@@H]2C1 381332412 BTZNKBSPVGNBTI-ZWNOBZJWSA-N 266.772 2.229 10 20 CECD C[C@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)C[C@@H](C)O1 694775848 WPJKZZYGNIKBCZ-DDFAGTSDSA-N 263.341 2.346 10 20 CECD Cc1nc([C@H](C)NCc2cccc(Cl)c2O)n[nH]1 392460658 KVPXJKGKLDMBEB-ZETCQYMHSA-N 266.732 2.323 10 20 CECD C[C@H](CN)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 54344781 JKDHWFABQWBXFW-CQSZACIVSA-N 289.423 2.230 10 20 CECD C[C@@H](CCCO)N[C@H](C)c1ccc(F)c(F)c1O 187755847 JMFKMDVSEZACOI-DTWKUNHWSA-N 259.296 2.482 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@H]1CCCCO1 178820902 ASGGPQAZOSRZCO-MRXNPFEDSA-N 288.391 2.472 10 20 CECD Cc1[nH]ccc1C(=O)NCc1ccc(N(C)C)c(F)c1 175940881 RSBXUGBCGZZNOX-UHFFFAOYSA-N 275.327 2.458 10 20 CECD CN(Cc1cccc(Cl)c1O)[C@H]1CCCCNC1=O 367725073 RCDGQFZHILSYSC-LBPRGKRZSA-N 282.771 2.146 10 20 CECD C[C@H](NC(=O)c1cccc(O)c1O)c1nc2ccccc2[nH]1 184774607 STLPDRHBHQPBMV-VIFPVBQESA-N 297.314 2.465 10 20 CECD C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@H](C)CO1 193104395 AMWKXVAJTABMIR-CHWSQXEVSA-N 291.395 2.071 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)NCC(C)C)c1 135727415 SPCHUVYPIXIMSN-NEPJUHHUSA-N 294.395 2.212 10 20 CECD CCCNC(=O)[C@@H]1CCCN(Cc2cc(C)ccc2O)C1 92734324 DHPSPWJHKQEEEW-CQSZACIVSA-N 290.407 2.439 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](Cn3ccnn3)C2)cc1 92069549 HNMPVMDCAKGFMG-MRXNPFEDSA-N 299.422 2.256 10 20 CECD C[C@H](NC[C@H]1CN2CCC[C@@H]2CO1)c1ccc(F)cc1O 91662230 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817962068 HPPMSTZLJVTGLU-WCQYABFASA-N 294.395 2.347 10 20 CECD COc1ccc(CNC(=O)[C@@H]2CCCSC2)c(O)c1 811485157 XMALRGLCUZJIEJ-LLVKDONJSA-N 281.377 2.160 10 20 CECD CCn1nc(C)c(CSc2ncc(C(=O)OC)s2)n1 829677586 DOLRMASQNYLRRT-UHFFFAOYSA-N 298.393 2.142 10 20 CECD CO[C@@]1(C)C[C@H](NC(=O)c2cc(O)cs2)C1(C)C 829414581 CYVLMEWVJCZMCF-GWCFXTLKSA-N 269.366 2.387 10 20 CECD COc1ccc(N(C)CC[S@](C)=O)cc1Cl 828040508 IFSQMWGLHUXKJN-INIZCTEOSA-N 261.774 2.163 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)/C=C\[C@@H]2CCOC2)c1 827303200 CBCBSDWJRTZIOD-VCUMLDNESA-N 291.347 2.171 10 20 CECD CCOc1cccc(CN2CC(OCC)C2)c1O 839133010 UFWQWVSLJZOFJM-UHFFFAOYSA-N 251.326 2.012 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCC[C@H]1CCOC1 837063873 FEBJKXPOCFRBOQ-BPJJOFIESA-N 291.347 2.044 10 20 CECD O=C(NCc1ccc(O)cc1O)c1occ2c1CCC2 910947011 ZCMBRLPXLYZNAU-UHFFFAOYSA-N 273.288 2.110 10 20 CECD CCCN1CCC[C@H](C(=O)NCc2cc(C)ccc2O)C1 912999967 AXFFNRBMBMWCJB-AWEZNQCLSA-N 290.407 2.439 10 20 CECD COc1ccc(CN[C@H]2CCN(CC(F)F)C2)cc1C 841893232 BXDLIMTZVOKVDA-ZDUSSCGKSA-N 284.350 2.433 10 20 CECD CCOC(=O)N1CC[C@H](NCc2cccc(CC)c2O)C1 848903155 NONVRGRCDABQDB-AWEZNQCLSA-N 292.379 2.275 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1cc(Cl)ccc1O 843065897 RBMKRHMZANRRLO-AOOOYVTPSA-N 254.761 2.228 10 20 CECD Cc1cc(N(C)C)ccc1CNCC(=O)NC1CCCC1 840932914 WDVCWEVDPMLPPQ-UHFFFAOYSA-N 289.423 2.209 10 20 CECD CCN1C[C@H](CN[C@@H](C)c2cc(C)ccc2O)CC1=O 846210274 WVSPHYLSLOHCCI-STQMWFEESA-N 276.380 2.220 10 20 CECD CC(C)CONC(=O)NCc1cc(Cl)ccc1O 845069981 QKLCANICQVKTLO-UHFFFAOYSA-N 272.732 2.432 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)CC[C@H]1N 843052217 PLMIXPLVQROOPZ-QPUJVOFHSA-N 272.751 2.354 10 20 CECD CN(CCOCC1CC1)c1ccc(OCC(=O)O)cc1 846279578 GSFQIRWDNKKXCY-UHFFFAOYSA-N 279.336 2.013 10 20 CECD CC(C)CC(=O)COC(=O)/C=C\c1ccc(O)c(O)c1 759597338 RCJPSAZKCMNQJW-XQRVVYSFSA-N 278.304 2.269 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H](C)C(=O)N(C)OC)cc1 858586217 GZXYKJPDAQGPLM-QWHCGFSZSA-N 293.411 2.202 10 20 CECD Cn1cnc(C(=O)NCc2ccc(N3CCCCC3)cc2)c1 758785616 LIBMUWLPVVLDGF-UHFFFAOYSA-N 298.390 2.340 10 20 CECD CSCCN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756351441 LBHGHTFTBDQZEZ-MRVPVSSYSA-N 256.327 2.314 10 20 CECD CC[C@](C)(O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 935463623 KIBGIEPUMBTCHC-NHYWBVRUSA-N 264.369 2.091 10 20 CECD CCCCOC(=O)[C@H](C)N(C)c1ccc(N)cc1 863558226 ANIBOCMJTLCJQY-NSHDSACASA-N 250.342 2.437 10 20 CECD Oc1cc2c(cc1CNCc1ccc3c(c1)COC3)OCO2 769927653 HPAVWWGJRGGVJS-UHFFFAOYSA-N 299.326 2.441 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H](N(C)C)CC1 763617967 YGXSCDJBBBUDAB-CYBMUJFWSA-N 278.396 2.317 10 20 CECD Oc1ccc(Cl)cc1CN1CCc2c[nH]nc2C1 769468812 OPQIJKSMRFQQOY-UHFFFAOYSA-N 263.728 2.327 10 20 CECD CN1CCCc2cc(CNC(=O)C3CSC3)ccc21 865053599 JPBBCNHQRMEYTD-UHFFFAOYSA-N 276.405 2.048 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1NCc1cc(C)c(C)cc1O 765796071 MLZXRRWJIJIUKC-KGLIPLIRSA-N 276.380 2.013 10 20 CECD COc1ccc(N(C)Cc2ccnn2C)cc1OC 773417887 BHVLZMIKIRSOBT-UHFFFAOYSA-N 261.325 2.074 10 20 CECD Cc1cccc(CN2CCCC[C@@H]2C2OCCO2)c1O 775674863 MQYAXHKJNFOCBR-CQSZACIVSA-N 277.364 2.428 10 20 CECD CC(C)c1cc(NS(=O)(=O)C[C@H]2CCCO2)ccc1O 882798741 BKDVFAAKNGRVBQ-GFCCVEGCSA-N 299.392 2.436 10 20 CECD Cc1ccc(O)c(CNCCO[C@H]2CCCCO2)c1 894798749 HWCYIJXKUNLVMK-HNNXBMFYSA-N 265.353 2.333 10 20 CECD COc1ccc(CNC(=O)CC[C@@H]2CC[C@H](C)O2)c(O)c1 794383326 LFSRZQYFNZRGRX-AAEUAGOBSA-N 293.363 2.365 10 20 CECD CCc1cccc(CNCc2c(O)nnc(C)c2C)c1O 1326852379 JKBCIWBDUKAMHD-UHFFFAOYSA-N 287.363 2.357 10 20 CECD C[C@@]1(CNCc2ccc(N3CCCC3)cc2)CCC(=O)N1 1326637538 PYHQFFOJYCVYBL-KRWDZBQOSA-N 287.407 2.045 10 20 CECD O=C(O)[C@@H]1CCCCCN1Cc1cc(F)cc(F)c1O 708091718 XFYSTSYTBNNERO-LBPRGKRZSA-N 285.290 2.500 10 20 CECD Oc1cccc(Br)c1CN1C[C@H]2COC[C@H]2C1 718153883 JWAIUBBRTRAYOZ-AOOOYVTPSA-N 298.180 2.233 10 20 CECD Cc1nnc(CN[C@@H](C)c2ccc(N(C)C)cc2)o1 718865210 DILXZNXISNTXQW-JTQLQIEISA-N 260.341 2.295 10 20 CECD C[C@H](CCCO)NCc1cc(F)c(N(C)C)cc1F 1331517667 FAUZVXXXSVZQEO-SNVBAGLBSA-N 272.339 2.281 10 20 CECD COC(=O)[C@H]1C[C@H](C)CCN1Cc1ccc(N)cc1 1356083703 YIBHSABNMFMOBS-BXUZGUMPSA-N 262.353 2.042 10 20 CECD C[C@@H]1CCC[C@H](OCC(=O)NCc2cccc(O)c2O)C1 1521851626 NTDONHXUNSYHEC-YPMHNXCESA-N 293.363 2.309 10 20 CECD O=C(NCc1ccccc1O)c1ccsc1C(=O)O 1601543841 DPKHPXBHFORMFG-UHFFFAOYSA-N 277.301 2.082 10 20 CECD COC[C@H]1CCCN1Cc1cc(OC)c(C)cc1O 160357982 OCNGPFCOUOJMOA-CYBMUJFWSA-N 265.353 2.320 10 20 CECD CC(C)CCO[C@@H](C)C(=O)NCCc1ccc(O)c(O)c1 156728896 RZJHHNGSRMGLKL-LBPRGKRZSA-N 295.379 2.208 10 20 CECD CCc1cccc(CN(C)[C@H]2CCCCNC2=O)c1O 848884744 JNMPSHTZCWSPRA-AWEZNQCLSA-N 276.380 2.055 10 20 CECD C[C@H](N[C@@H]1CC[C@H]2CNC[C@H]2C1)c1ccccc1O 817987070 PSMWJLOSEOHKEF-IGQOVBAYSA-N 260.381 2.431 10 20 CECD C[C@@H](Cc1cnn(C)c1)N[C@@H](C)c1ccccc1O 834895404 BHQKRNMIWFEYIT-RYUDHWBXSA-N 259.353 2.408 10 20 CECD C[C@@H](NCc1ccn(C)n1)c1ccc(N(C)C)cc1 213186663 WXHMKDWUSXNRLC-GFCCVEGCSA-N 258.369 2.337 10 20 CECD Cc1cc(NS(=O)(=O)N2CCC(C)CC2)ccc1O 148629604 NILZGFHCEJOOBW-UHFFFAOYSA-N 284.381 2.089 10 20 CECD COCCOCCCNCc1ccc(OC)c(C)c1 35052787 AQZHECKTFYMENQ-UHFFFAOYSA-N 267.369 2.146 10 20 CECD COc1cccc(CNCCCc2cn[nH]c2C)c1O 50182475 ACBWSHHKIHCARQ-UHFFFAOYSA-N 275.352 2.155 10 20 CECD CN(C)C1(CNCc2c(O)cccc2Cl)CC1 397885527 MSDBQSQIDPTAMA-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CCOC(=O)[C@@H]1CCCN(Cc2cccc(C)c2O)C1 179843685 RLMPLBHYYMIRQO-CQSZACIVSA-N 277.364 2.476 10 20 CECD Cc1cccc(CN2CCNC(=O)[C@@H]2CC(C)C)c1O 188922700 OEFRNZJXVUTMSC-AWEZNQCLSA-N 276.380 2.047 10 20 CECD C[C@H](NCCN1CCOCC1(C)C)c1ccc(F)cc1O 185333713 WUILJVXYHMMLHG-LBPRGKRZSA-N 296.386 2.293 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@H]2CCCO2)cc1 32246899 QVLHVVLTVJTXBT-OAHLLOKOSA-N 276.380 2.328 10 20 CECD O=C(Cc1ccncc1)NCCCSc1nccs1 182011618 NLPFUBISYFXWJZ-UHFFFAOYSA-N 293.417 2.379 10 20 CECD CSC[C@@H]1CCCN1Cc1cc2c(cc1O)OCO2 130987676 PRLGXGITNRZAOD-NSHDSACASA-N 281.377 2.448 10 20 CECD COCCOC1CCN(Cc2ccc(N(C)C)cc2)CC1 93339278 RAUONHCXDMPJMM-UHFFFAOYSA-N 292.423 2.380 10 20 CECD COC(=O)[C@H](CC(F)(F)F)NCc1cc(C)ccc1O 276451680 JYIIWOBAFABXFS-JTQLQIEISA-N 291.269 2.284 10 20 CECD CC(C)[C@@H](NCc1ccccc1O)c1nncn1C 285517402 OAAGFPCYIWSBFV-CYBMUJFWSA-N 260.341 2.008 10 20 CECD COc1cccc(CNC[C@@H]2CCOC[C@H]2C)c1O 285655822 YRKHMGYFWPYWDV-NEPJUHHUSA-N 265.353 2.163 10 20 CECD Cc1cc(O)c(CN[C@H]2CCO[C@]3(CCOC3)C2)cc1C 374268274 FRTYETOKRYBSBP-DOTOQJQBSA-N 291.391 2.437 10 20 CECD CCOc1ccc(O)c(CNC[C@@]2(O)CCC[C@H]2C)c1 293001626 NBNXEQPXOYDBPE-WBMJQRKESA-N 279.380 2.432 10 20 CECD CC(F)(F)CCNC(=O)c1c(F)ccc(O)c1O 295665441 WMGIBHUAFZMNPX-UHFFFAOYSA-N 263.215 2.012 10 20 CECD CC[C@@H](NC[C@@](C)(O)COC)c1cccc(Cl)c1O 806140726 ZOSPYCBZKMWRLU-TZMCWYRMSA-N 287.787 2.484 10 20 CECD C[C@@H](N[C@H]1CC12CCNCC2)c1cc([N+](=O)[O-])ccc1O 817976666 QOSZZRAIAVOCKI-YGRLFVJLSA-N 291.351 2.093 10 20 CECD CCOC[C@@H](O)CNc1ccccc1OCC1CC1 819450696 GCALTANAYFMSRE-ZDUSSCGKSA-N 265.353 2.285 10 20 CECD Cn1ccnc1[C@H](NCCc1ccc(N)cc1)C1CC1 817958530 WTAMAIQPILAMAX-OAHLLOKOSA-N 270.380 2.286 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](CC(=O)O)C2)c1 820387365 MHDCOKOSTWFGSZ-GFCCVEGCSA-N 293.363 2.478 10 20 CECD CCOc1ccc(N(CC)CC[S@@](C)=O)cc1 828194689 RBOKLJJRTMWPBZ-QGZVFWFLSA-N 255.383 2.290 10 20 CECD CN(CC(=O)N(C)Cc1ccccc1O)CC(C)(C)C 820879000 NCHMWSFSFPWQKI-UHFFFAOYSA-N 278.396 2.329 10 20 CECD CC(C)(C)[C@@H](Cn1ccnc1)NC(=O)c1cc(O)cs1 823310329 BLSTZAGYBRFSPR-GFCCVEGCSA-N 293.392 2.495 10 20 CECD Cc1ncc2c(n1)CCC[C@H]2NC(=O)c1cc(O)cs1 734876864 FBBJZGBGXIHETK-GFCCVEGCSA-N 289.360 2.360 10 20 CECD CC(=O)C(=O)COc1cc(C)ccc1Br 830034640 SCYAZFFZWJEBII-UHFFFAOYSA-N 271.110 2.294 10 20 CECD CC(=O)c1cc(F)cc(CNC2(CC(=O)O)CCC2)c1O 833400207 ADIRVXXAOHYAII-UHFFFAOYSA-N 295.310 2.221 10 20 CECD CC[C@H](N[C@H](C)c1cc(F)cc(F)c1O)[C@H](C)O 834888401 OUJUKAOTNFMWRC-LWINAJNOSA-N 259.296 2.480 10 20 CECD CN(C)c1ccc(/C=C\CN[C@@H]2CCC[C@H]2O)cc1 835082780 XPXXVZQHCKRRLH-KSLSASGISA-N 260.381 2.269 10 20 CECD O=C(CCCC1CCOCC1)NCc1ccc(O)cc1O 910946570 QKSISFFLIZWNBS-UHFFFAOYSA-N 293.363 2.311 10 20 CECD C[C@H](NCCN1CCOC[C@@H]1C)c1ccc(Cl)cc1O 841745741 ACAPMDFTYQNGHX-RYUDHWBXSA-N 298.814 2.417 10 20 CECD COc1cccc([C@@H](C)N[C@H](CO)CC(F)F)c1O 846164126 FPEPPQLHZAGETC-BDAKNGLRSA-N 275.295 2.068 10 20 CECD CCc1cccc(CN[C@]2(CCOC)CCOC2)c1O 848908235 ZIEMTVAUPFMWLW-MRXNPFEDSA-N 279.380 2.240 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CCc3c(nnn3C)C2)c(O)c1 848564421 NDFNKNCBLHAHFJ-RYUDHWBXSA-N 286.379 2.037 10 20 CECD CC[C@H](NC[C@H]1CNC(=O)C1)c1cc(Cl)ccc1O 840833747 PJKRJVYMUUFRQM-CABZTGNLSA-N 282.771 2.222 10 20 CECD C[C@H](N[C@H]1CO[C@H](C)C1)c1cc(F)cc(F)c1O 842928895 KSXGPGLWFDXTHH-KHQFGBGNSA-N 257.280 2.498 10 20 CECD Nc1ccc(NC(=O)C(=O)NCCC2CCCCC2)cc1 841007269 NZFJBFFTNVRUMW-UHFFFAOYSA-N 289.379 2.294 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](N)C[C@@H]2C)c1O 866684007 UIXCNYRFRFXZPS-QPUJVOFHSA-N 282.771 2.170 10 20 CECD COc1cc(CN2CCC(CN(C)C)CC2)c(O)cc1C 768445338 GGFJYQQQNCSRSX-UHFFFAOYSA-N 292.423 2.483 10 20 CECD CCN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CCC1 768448776 WNDDHWWHAZKSFR-AWEZNQCLSA-N 263.337 2.192 10 20 CECD CCN(CC)C(=O)C[C@H](C)NCc1ccc2c(c1)CCO2 765607947 FVVNTXYXUXSSJX-ZDUSSCGKSA-N 290.407 2.358 10 20 CECD CCN(CC[C@H]1CCS(=O)(=O)C1)c1ccc(OC)cc1 760850885 IDDJSYSNNYSLQZ-ZDUSSCGKSA-N 297.420 2.346 10 20 CECD COC(=O)C(C)(C)CCNCc1c(C)cccc1O 877516196 XOKZDLGFMONEHY-UHFFFAOYSA-N 265.353 2.380 10 20 CECD COC(=O)C1CC(NCc2ccc(N(C)C)cc2C)C1 877723537 LLTFOHOETZZGLL-UHFFFAOYSA-N 276.380 2.102 10 20 CECD CN(C(=O)[C@@]1(c2ccccc2)CCNC1)c1ccc(N)cc1 877076107 MBSJUDUHWBYTEW-SFHVURJKSA-N 295.386 2.163 10 20 CECD C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ccc[nH]1 779539540 HCNAUUGFXMEJDM-BXKUYDPTSA-N 272.304 2.317 10 20 CECD COc1cccc(O)c1CN1CC[C@@H]2[C@@H](CCCN2C)C1 770352391 NLDIEIVAAZUKMW-DZGCQCFKSA-N 290.407 2.317 10 20 CECD Nc1ccc(CCNC(=O)c2ccnn2CC2CCC2)cc1 876528697 WHZLSIMEWOSTQM-UHFFFAOYSA-N 298.390 2.238 10 20 CECD Cc1ccc(CNc2cnn(CCN(C)C)c2)c(O)c1 877006054 FYTKYFIALXQABN-UHFFFAOYSA-N 274.368 2.071 10 20 CECD O=C(Nc1nncn1-c1ccccc1)c1cc(O)cs1 776236553 QGPOPNZHDFZVPM-UHFFFAOYSA-N 286.316 2.287 10 20 CECD CS[C@@H](C)CCC(=O)NCCc1ccc(O)c(O)c1 773471452 SOWIWOXZCVNOMO-JTQLQIEISA-N 283.393 2.288 10 20 CECD CCOc1cccc(CN[C@H](CC(C)C)C(=O)O)c1O 43432019 NIJNPCKHIVEKMU-GFCCVEGCSA-N 281.352 2.380 10 20 CECD C[C@H]1CC[C@H](C(=O)OCC(=O)c2ccc(O)c(O)c2)C1 784569032 ZLGJWAKPHCMBJL-ONGXEEELSA-N 278.304 2.260 10 20 CECD NC(=O)[C@@H]1[C@H]2CCC[C@@H]2CN1Cc1c(O)cccc1Cl 787423981 OPKQROCPRMGDAK-BFVZDQMLSA-N 294.782 2.131 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CO[C@H](C)C1 784109587 WCXDUEJZHYBSPZ-OCCSQVGLSA-N 276.380 2.102 10 20 CECD Cc1nc([C@H]2CCN(Cc3cc(C)c(C)cc3O)C2)n[nH]1 895008032 PTDRKZAJVFSMSS-ZDUSSCGKSA-N 286.379 2.425 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCCC[C@H]2O)c1O 894917235 LIHLIEUGQOVSNN-GXTWGEPZSA-N 279.380 2.350 10 20 CECD CC[C@H](C)[C@@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423488 XNSPQZBEFGHCGO-SMDDNHRTSA-N 264.369 2.342 10 20 CECD CCC[C@H](CNC(=O)c1cccc(O)c1O)OCC 705329047 VEYFHLXJENYXER-SNVBAGLBSA-N 267.325 2.033 10 20 CECD C[C@H](NCCN1CCSCC1)c1ccccc1O 223662142 LLLWTTBDIPPFDO-LBPRGKRZSA-N 266.410 2.092 10 20 CECD O=C1CN(Cc2ccccc2O)C(=O)N1[C@H]1C=CCCC1 1345639493 UPYGULHQJUPZMG-ZDUSSCGKSA-N 286.331 2.265 10 20 CECD C[C@@H](NC(=O)NCCC(F)F)c1ccccc1O 1342478101 WSMMEUDZDKGOQY-MRVPVSSYSA-N 258.268 2.408 10 20 CECD O=C(O)[C@H]1CCC[C@@H](C(=O)N2Cc3cccc(O)c3C2)C1 1601800409 WFKOVDZQXQTBIP-MNOVXSKESA-N 289.331 2.125 10 20 CECD CN(C)c1ccc(CNCc2ccoc2C(=O)O)cc1 1598320825 UUINOCLDWOIVEG-UHFFFAOYSA-N 274.320 2.334 10 20 CECD COc1ccc(O)c(CNC(=O)C2=C(C)OCCC2)c1 160303554 XSBAMODGBQUUOF-UHFFFAOYSA-N 277.320 2.101 10 20 CECD O[C@@H]1CCCC[C@H]1NCc1ccc2c(c1)CCCO2 921738840 UYRUQMARJCADHV-HUUCEWRRSA-N 261.365 2.405 10 20 CECD C[C@H](C[S@@](C)=O)N(C)Cc1cc(Cl)ccc1O 130866859 YWYFCIPVQSZHQT-XLFHBGCDSA-N 275.801 2.244 10 20 CECD CCCNC(=O)CCN[C@H](CC)c1ccccc1O 45071808 LXTPHSHXGJGURB-CYBMUJFWSA-N 264.369 2.349 10 20 CECD C[C@@H](C(=O)O)N(Cc1ccc(N(C)C)cc1)C1CC1 738646265 QEBOPXQTTFERIR-NSHDSACASA-N 262.353 2.190 10 20 CECD Cc1noc([C@@H]2CCCN(Cc3ccccc3O)C2)n1 179562715 CKZYPQDZSNANSD-CYBMUJFWSA-N 273.336 2.463 10 20 CECD COC(=O)[C@H](CC(C)C)NCc1ccccc1O 36980433 FHNMRIPJJUJRBT-LBPRGKRZSA-N 251.326 2.070 10 20 CECD Cc1ccc(CCNC(=O)/C=C/c2ccc(O)c(O)c2)cn1 181068068 RPPMISKCFCFDGR-FNORWQNLSA-N 298.342 2.173 10 20 CECD C[C@@H](N[C@@H]1CCc2[nH]ncc2C1)c1cc(F)ccc1O 186115719 SMNYHSQUKUCIBW-BXKDBHETSA-N 275.327 2.463 10 20 CECD Nc1ccc(NC(=O)c2ncoc2[C@@H]2CCCO2)cc1 238017275 WNUUSGNNSIHSPI-NSHDSACASA-N 273.292 2.361 10 20 CECD Cc1cc(C)c(O)c(CN2CCS(=O)(=O)[C@H](C)[C@H]2C)c1 247231210 ZIENYHVJLADXAO-CHWSQXEVSA-N 297.420 2.016 10 20 CECD C[C@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 248333278 FRBRFIUXISJAAR-KBPBESRZSA-N 289.423 2.099 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCCN1C1CCCC1 269701728 PRKADBRGZSDUFO-HNNXBMFYSA-N 288.391 2.415 10 20 CECD OCCN(Cc1cccc(Cl)c1O)C1CCOCC1 275996562 OHBUEAQUQYCRSE-UHFFFAOYSA-N 285.771 2.019 10 20 CECD CCN(CC)c1ccc(CNC(=O)C2(C)COC2)cc1 272749728 LDUBSDBIRXMYOA-UHFFFAOYSA-N 276.380 2.186 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@]2(O)CCO[C@@H]2C)cc1 278932312 XPWCQUZCXOAYEZ-JJRVBVJISA-N 292.423 2.333 10 20 CECD CCOCc1cc(CNCCCCCO)ccc1OC 279839403 CSIFMWCXRAKWHB-UHFFFAOYSA-N 281.396 2.484 10 20 CECD Cc1ccc(O)c(CN2C[C@H](C)O[C@]3(CCO[C@@H]3C)C2)c1 280574176 WCOFVRXRIBNDPG-JJRVBVJISA-N 291.391 2.469 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1C[C@H]1C 808095655 NIOLGXIDXXXYNB-NXEZZACHSA-N 254.326 2.150 10 20 CECD COc1cc(O)c(CNC[C@]2(O)CCC[C@@H]2C)cc1OC 293828757 AMQGYGXFXQGBIQ-MEDUHNTESA-N 295.379 2.050 10 20 CECD CC[C@H](NCc1cnn(CCOC)c1)c1ccccc1O 800494844 JIEVZZVLPTWEJI-HNNXBMFYSA-N 289.379 2.476 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N(C)CCN)c2C)c1 818010652 QKVJQHGPMOZXJK-UHFFFAOYSA-N 285.391 2.433 10 20 CECD COC[C@@]1(CN[C@H](C)c2cc(Cl)ccc2O)CCCN1 817975887 ZFQJCUFJJWNQEJ-ABAIWWIYSA-N 298.814 2.465 10 20 CECD Cc1cc(Br)cc([C@@H](C)N[C@@H]2CCNC2)c1O 817944988 QUYBGIWGOTXVMP-MWLCHTKSSA-N 299.212 2.476 10 20 CECD N[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)C1CCC1 817997775 VYCQYFAPJHNSAO-MRXNPFEDSA-N 288.391 2.015 10 20 CECD COC[C@]1(CN[C@H](C)c2cc(Cl)ccc2O)CCCN1 817975888 ZFQJCUFJJWNQEJ-IAQYHMDHSA-N 298.814 2.465 10 20 CECD COc1ccc(O)c(CN=c2cc[nH]cc2Cl)c1 811806321 QXLRVQUGWJEFJK-UHFFFAOYSA-N 264.712 2.483 10 20 CECD C[C@H](N)CN[C@@H](C)c1ccc(N2CCOCC2)cc1Cl 817970792 FGUSPROIMKEUEN-RYUDHWBXSA-N 297.830 2.174 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1ccnc(CN)c1 828145041 VCRHGWOHROOBSV-UHFFFAOYSA-N 299.374 2.298 10 20 CECD O=C(NCc1ccccc1O)Nc1cnc(C2CC2)nc1 728689851 KIDWYCSONHIUOS-UHFFFAOYSA-N 284.319 2.381 10 20 CECD CN(C)CCCCC(=O)NCc1ccc(N(C)C)cc1 729282416 WOQMCRYNMVWFEK-UHFFFAOYSA-N 277.412 2.101 10 20 CECD COc1ccc2c(c1)CCCN2CC1CCNCC1 823578830 HLVQOKXMSNQZRM-UHFFFAOYSA-N 260.381 2.447 10 20 CECD CN1CCN(c2ccc(CN3CC[C@H]4C[C@H]4C3)cc2)CC1 827507685 YVXCVMHBMJQALA-IRXDYDNUSA-N 285.435 2.280 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CC(C)=NO1 830145645 CSGMFJHADMKDMC-CQSZACIVSA-N 276.336 2.296 10 20 CECD Cc1nn(C)c(C)c1[C@H](C)C(=O)Nc1ccc(N)cc1 832244763 URBOQYUYTIOUNK-VIFPVBQESA-N 272.352 2.361 10 20 CECD Cc1ccc(C(=O)OCc2cc(C(=O)O)co2)c(O)c1O 738547279 SYFHDAROKHJDPW-UHFFFAOYSA-N 292.243 2.054 10 20 CECD Cc1noc(C2CN(Cc3cccc(Cl)c3O)C2)n1 839131593 XABLXUSHNAMCCL-UHFFFAOYSA-N 279.727 2.336 10 20 CECD Cc1ccc(C(=O)NCC[C@H](O)C2CCCC2)c(O)c1O 831381218 CCCMLPDGSGQENQ-ZDUSSCGKSA-N 293.363 2.077 10 20 CECD C[C@]1(NC(=O)c2cc(O)cs2)CCO[C@@H]1C1CC1 832127750 ZHOAXOWUUXNCDY-YPMHNXCESA-N 267.350 2.141 10 20 CECD CCc1cccc(CN(C)Cc2cnccn2)c1O 848883975 WPOJGWUCFANXRE-UHFFFAOYSA-N 257.337 2.377 10 20 CECD CCn1c(C)cc(C(=O)NCc2ccc(O)cc2O)c1C 910951678 LFJDYQWBMVURBQ-UHFFFAOYSA-N 288.347 2.466 10 20 CECD C[C@H]1[C@@H](C)NCCN1Cc1cc(Cl)cc(F)c1O 843056844 AUHINIGQPNBLSY-BDAKNGLRSA-N 272.751 2.367 10 20 CECD CO[C@](C)(C1CC1)[C@@H](C)NC(=O)c1ccc(C)c(O)c1O 840510725 QBRHEOCWILUZMS-HWPZZCPQSA-N 293.363 2.340 10 20 CECD CCc1cccc(CN2CCC(F)(F)[C@@H](CO)C2)c1O 848913212 RGJIPCCZQQGIBC-CYBMUJFWSA-N 285.334 2.404 10 20 CECD C[C@H]1CCC[C@H](NC(=O)C(=O)Nc2ccc(N)cc2)CC1 841114882 JAXQYUYMQHICEA-AAEUAGOBSA-N 289.379 2.292 10 20 CECD Cc1cc(Br)c(O)c(CN2CCNC[C@H]2C)c1 843046879 CYXDRDNLPQYBPJ-SNVBAGLBSA-N 299.212 2.257 10 20 CECD CCO[C@@H](C)C(=O)N(C)CCN(C)c1ccc(OC)cc1 844853126 SRHCXQUIULLAHP-ZDUSSCGKSA-N 294.395 2.015 10 20 CECD CN1CCN(c2ccc(CN[C@@H]3C=CCC3)cc2)CC1 850359108 WQMCTGDKGQVOTD-MRXNPFEDSA-N 271.408 2.247 10 20 CECD CCNC(=O)C1(CNCc2cc(Cl)ccc2O)CCC1 752927889 ABECMAOQVSNQDC-UHFFFAOYSA-N 296.798 2.442 10 20 CECD O=C(COC(=O)c1cccc(O)c1O)Cc1ccccc1 758559260 DBDRJRBOOWMUHE-UHFFFAOYSA-N 286.283 2.066 10 20 CECD Cc1conc1C(=O)NCc1c(O)ccc2c1CCCC2 866771463 TVKTXNMECPQKHA-UHFFFAOYSA-N 286.331 2.497 10 20 CECD CC(C)[C@@H]1CCCN1Cc1cc2c(cc1O)OC[C@@H]2O 768441716 GPDILEMOADUJQJ-ZFWWWQNUSA-N 277.364 2.438 10 20 CECD CC(C)CN(Cc1cc2c(cc1O)OC[C@H]2O)C1CC1 768440048 CRSAUJDXDYEHGC-OAHLLOKOSA-N 277.364 2.438 10 20 CECD CO[C@@H](CC(C)C)C(=O)NCc1cc(C)ccc1O 862755697 WOSZYALHWSHHPU-AWEZNQCLSA-N 265.353 2.378 10 20 CECD CN(C)c1cc(F)c(CNCCC2(O)CCC2)cc1F 1118859537 JWTIZAUUJPVCTF-UHFFFAOYSA-N 284.350 2.426 10 20 CECD Cc1ccc(CN2CCc3ccccc3[C@H]2C(N)=O)c(O)c1 876651239 SJCJCBDQXBUKGL-KRWDZBQOSA-N 296.370 2.285 10 20 CECD COC(=O)N1CCC[C@H](NCc2c(C)cccc2O)C1 876996888 HHRBYYIRVKFDFM-LBPRGKRZSA-N 278.352 2.021 10 20 CECD CCCOc1ccc(CN[C@@H]2COC[C@H]2OC)cc1C 873133898 LCJJUUXLJBCIDG-GDBMZVCRSA-N 279.380 2.287 10 20 CECD Cc1ccc(CNCCCOC[C@H]2CCOC2)c(O)c1 877060480 YOBXUJCCBQCTRZ-CQSZACIVSA-N 279.380 2.233 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCc1ccc(O)cc1 779535098 IBLXQMLNXGJKSB-XBXARRHUSA-N 285.299 2.133 10 20 CECD CC[C@@]1(C)COCCN1C(=O)/C=C\c1ccc(O)c(O)c1 779548119 QAKWYDLDWOEGEE-WRLNGNIRSA-N 291.347 2.139 10 20 CECD O=C(NCc1ccc2c(c1)COC2)NCc1ccccc1O 770033793 SACFMBDFUORXEH-UHFFFAOYSA-N 298.342 2.422 10 20 CECD C[C@H](N[C@H](C)c1c(O)cccc1F)C(=O)N1CCCC1 886605179 LFZIPGZMVZTTRK-MNOVXSKESA-N 280.343 2.193 10 20 CECD CCOc1ccc(CNCC[C@H](C)N(C)C)c(O)c1 895298472 XAGMTFGDRDMQNZ-LBPRGKRZSA-N 266.385 2.221 10 20 CECD COc1ccc(CN[C@@H]2CS[C@H](C)C2)c(O)c1OC 894903142 KGTIZNKTMYGYIF-KOLCDFICSA-N 283.393 2.393 10 20 CECD CCOCCOCCNCc1cc(Cl)c(C)cc1O 897203754 CZQHEPVQTSDCRK-UHFFFAOYSA-N 287.787 2.497 10 20 CECD COc1cc(C)cc(CN[C@@H](CO)C(C)(C)C)c1O 894573662 UYHPYUJJQCCLLE-ZDUSSCGKSA-N 267.369 2.206 10 20 CECD CCOc1ccc(CN(C)Cc2ncc[nH]2)c(O)c1 894583720 KUTOCHZBTYROKM-UHFFFAOYSA-N 261.325 2.146 10 20 CECD Cc1nc([C@@H](C)NCc2ccc3c(c2)CCCO3)n[nH]1 894467484 LZGQFSVCVWCIET-SNVBAGLBSA-N 272.352 2.289 10 20 CECD COCCN(C(=O)c1cccc(O)c1O)[C@H]1CC[C@@H](C)C1 791772880 FDSPFGCCHJIJBF-NEPJUHHUSA-N 293.363 2.375 10 20 CECD COc1ccc(CNC(=O)CCc2ccncc2)c(O)c1 794379880 YVOQPDPDJZSNST-UHFFFAOYSA-N 286.331 2.045 10 20 CECD Oc1ccccc1CNc1cc(N2CCCC2)ncn1 277351576 GJVSHAGXSSZIMT-UHFFFAOYSA-N 270.336 2.395 10 20 CECD C[C@@H]1C[C@H]1C(=O)Nc1c(Cl)ccc2nonc12 1326698590 NVEPNVUTPVMKMX-PHDIDXHHSA-N 251.673 2.471 10 20 CECD O=C(NC[C@@H]1CCC(F)(F)C1)c1cccc(O)c1O 281486202 DNGXWZXDTHYNRF-MRVPVSSYSA-N 271.263 2.263 10 20 CECD C[C@@H](CCCNCc1ccc2c(c1)CCO2)C(=O)O 1324574351 DNHIVPSXQJBVGS-NSHDSACASA-N 263.337 2.212 10 20 CECD CCn1c(Nc2cnn(C)c2)nnc1-c1sccc1O 1339366323 FVXUTWSUVOTVAO-UHFFFAOYSA-N 290.352 2.209 10 20 CECD CCNC(=O)C(C)(C)NCc1cc(Cl)c(C)cc1O 1330808366 LQXGSXLQHWGZPN-UHFFFAOYSA-N 284.787 2.358 10 20 CECD CC(=O)OC[C@@H](C)NCc1ccc(N(C)C)cc1C 1355255232 WGCSONOXKMIZIP-GFCCVEGCSA-N 264.369 2.102 10 20 CECD Cc1cc(CNCc2ccc3c(c2)CCO3)[nH]c1C(=O)O 1600209176 CXEMATGRXYELJK-UHFFFAOYSA-N 286.331 2.246 10 20 CECD CCCN(Cc1ccccc1O)c1cnc(C(=O)O)cn1 1605320335 FQLOQRAPCYNZTF-UHFFFAOYSA-N 287.319 2.297 10 20 CECD Nc1ccc(CNC(=O)c2cc3nccnc3cc2F)cc1 1580445771 VJMIZFNLGJJNOA-UHFFFAOYSA-N 296.305 2.281 10 20 CECD COc1cccc(CNCc2csc(C(=O)O)c2)c1O 1599673033 FWRRYKUXJUHHOJ-UHFFFAOYSA-N 293.344 2.450 10 20 CECD C[C@@H](NC[C@@H]1CCC=CO1)c1cc(C(=O)O)ccc1O 1593251363 DJKVTMPXKJOUKC-PWSUYJOCSA-N 277.320 2.434 10 20 CECD CN(Cc1ccccc1O)[C@@H](C(=O)O)c1cccnc1 1598530364 BWURAENFJZVLCQ-CQSZACIVSA-N 272.304 2.045 10 20 CECD C[C@H](NCCC1(O)CCC1)c1cc(C(=O)O)ccc1O 1593260708 GWKKEKYGIJYZJA-JTQLQIEISA-N 279.336 2.046 10 20 CECD CCN(C)c1ccc(CNCC(F)(F)C(=O)O)c(C)c1 1776856440 XSKHNUNSLDUVPW-UHFFFAOYSA-N 286.322 2.261 10 20 CECD O=C(O)[C@H](CC1CCC1)NCc1cc([N+](=O)[O-])ccc1O 1777572812 XOOJPZKKKCHSKV-LBPRGKRZSA-N 294.307 2.033 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CCCCS1 167554155 JHXKOJIZPVQRPL-GFCCVEGCSA-N 251.351 2.294 10 20 CECD COCCC1(CNCc2cc(OC)ccc2O)CC1 224911303 DJMMSMGFBKHCOB-UHFFFAOYSA-N 265.353 2.307 10 20 CECD CCN(CCCN(C)C)Cc1cccc(OC)c1O 230744767 UBMDVHQUWYYFEV-UHFFFAOYSA-N 266.385 2.174 10 20 CECD COC(=O)N(C)CCN[C@H](C)c1ccc(N(C)C)cc1 689528349 XTJAXKBPCYEYIL-GFCCVEGCSA-N 279.384 2.101 10 20 CECD COc1ccc(N2CCC(NC(=O)C(C)C)CC2)cc1 102382198 XVPPEZPQFUSTTQ-UHFFFAOYSA-N 276.380 2.436 10 20 CECD Cc1ccc(C(=O)NCc2ccsc2)c(O)c1O 177672102 XCUBRLAWNNDLPY-UHFFFAOYSA-N 263.318 2.398 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CC2CCOCC2)c1 117413675 KKWPMDINLGAYPC-NSHDSACASA-N 293.363 2.395 10 20 CECD CCN(CC)c1ccc(CNS(=O)(=O)CC)cc1F 66902836 ZCCCSAXDFBPSRM-UHFFFAOYSA-N 288.388 2.111 10 20 CECD Cc1cc(C(=O)NC[C@H]2CCCO2)c(C)n1-c1ccccn1 60855822 MBCZFADYRRJWLF-CQSZACIVSA-N 299.374 2.398 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc[nH]c2)cc1F 68312809 ULWVDGRFAOAMIL-UHFFFAOYSA-N 261.300 2.150 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)c2nnnn2C2CC2)c1 189132768 DJNDFIKQGKLQBA-QWRGUYRKSA-N 287.367 2.434 10 20 CECD C[C@]1(CN)CCN(Cc2c(O)cccc2Cl)C1 379861045 JXHKPOCLIRJMOU-CYBMUJFWSA-N 254.761 2.216 10 20 CECD Cc1cccc(CN2CCC(C)(C)S(=O)(=O)CC2)c1O 195205406 QNTXPXSYBWNGOR-UHFFFAOYSA-N 297.420 2.100 10 20 CECD Cc1cc(C(=O)NCc2ccc(N3CCCC3)cc2)n(C)n1 193405629 GBIKALBQVCSCOI-UHFFFAOYSA-N 298.390 2.259 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@H](C)C(=O)NC)cc1 93899673 XYFYVMNLLYZCTM-AWEZNQCLSA-N 291.439 2.347 10 20 CECD C[C@@](O)(CN[C@@H]1CCc2cccc(O)c21)C(F)(F)F 296964110 RFYNVYBQGPFQQR-BXKDBHETSA-N 275.270 2.282 10 20 CECD CC(C)O[C@@]1(C)C[C@H]1NCc1cc2c(cc1O)OCO2 527802011 YFIOVXJFYBNCOV-CABCVRRESA-N 279.336 2.167 10 20 CECD O=[N+]([O-])c1ccc(O)c(CN[C@H]2CCOC3(CCC3)C2)c1 268998199 YLOWYHVEPGCBMO-LBPRGKRZSA-N 292.335 2.492 10 20 CECD CC[C@H](C(=O)NCc1ccc2c(c1)CCCN2C)N(C)C 268831572 WPKHNTVBAWAVGU-OAHLLOKOSA-N 289.423 2.025 10 20 CECD COCCN1CC[C@H](N[C@@H](C)c2ccc(C)c(C)c2O)C1 273567924 JYPVYINEVGVRGN-GJZGRUSLSA-N 292.423 2.380 10 20 CECD CCC[C@]1(CO)CCCN1Cc1cc2c(cc1O)OCO2 278797436 XGJSYFLQOUQKRR-MRXNPFEDSA-N 293.363 2.248 10 20 CECD CCN1CCC[C@@H]1CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273382738 IPIVKFSLTBJCGC-DGCLKSJQSA-N 293.367 2.435 10 20 CECD COc1cc(O)c(CNC[C@H]2CCOC[C@H]2C)cc1OC 289236824 DJZGRXNPDOVMEI-VXGBXAGGSA-N 295.379 2.172 10 20 CECD CC[C@H](N[C@@H](CCO)COC)c1cccc(Cl)c1O 287740472 PQLNGJJXAPRRGW-GWCFXTLKSA-N 287.787 2.484 10 20 CECD CCOC(=O)[C@@H](C)[C@H](C)NCc1ccc(N(C)C)cc1 283068944 JXUCXVCVBKRJCT-STQMWFEESA-N 278.396 2.430 10 20 CECD CN(C)c1ccc(CN(C2CC2)C2COC2)cc1F 296177437 XMTRAVIFYMEZRQ-UHFFFAOYSA-N 264.344 2.255 10 20 CECD Cc1cc(CN2CCc3[nH]ncc3C2)ccc1N(C)C 293936159 ZHBVDEJWKRRBKT-UHFFFAOYSA-N 270.380 2.342 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CC1(F)F 294587776 YIJIXRSHNMWGDE-GFCCVEGCSA-N 268.307 2.366 10 20 CECD Cc1nsc(C)c1C(=O)NCc1ccccc1O 815833603 WCTYFKCZJAIMCF-UHFFFAOYSA-N 262.334 2.396 10 20 CECD OC[C@@H]1CN(Cc2cc(Cl)ccc2O)CCC1(F)F 812775023 CLGDLQIVPRKZRR-JTQLQIEISA-N 291.725 2.495 10 20 CECD C[C@H](N[C@H]1CCCNCC1)c1cc(F)cc(F)c1O 817969203 RQDGZVJSTWGYBE-ONGXEEELSA-N 270.323 2.463 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@H]2[C@@H]3CNC[C@@H]32)c1O 817977121 BRRXUFYVPBUSTP-KMLBCRHOSA-N 266.772 2.222 10 20 CECD Cc1cnc(NCc2ccc(N3CCOCC3)cc2)cn1 902207988 DFHLZJHBSNZQAD-UHFFFAOYSA-N 284.363 2.234 10 20 CECD CCNC(=O)c1cccc(NC(=O)c2cc(O)cs2)c1 731867555 WXASQCZKIMTSBT-UHFFFAOYSA-N 290.344 2.456 10 20 CECD CCN(CC)c1ccc(CNC(=O)C[C@H](C)N)cc1F 829038799 PCFJLKZXWSDEDZ-NSHDSACASA-N 281.375 2.025 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 834902846 DJXLJJXOXZSQDA-XIDUGBJDSA-N 295.354 2.473 10 20 CECD COc1cccc([C@H](C)N[C@@H]2COC[C@H]2C)c1O 903393585 PQQDTCRKZLSGNI-JFGNBEQYSA-N 251.326 2.086 10 20 CECD CC(C)[C@H](CO)[C@H](NC(=O)c1cc(O)cs1)C(C)C 834044666 NMWCPMQOUIHDIF-WCQYABFASA-N 285.409 2.473 10 20 CECD CC(C)(CNC(=O)c1cccc(O)c1O)C1(O)CCCC1 837110644 PDIWTJYDRKCVOQ-UHFFFAOYSA-N 293.363 2.159 10 20 CECD Oc1cccc2c1[C@H](NC[C@@H](O)c1ccco1)CC2 834502163 NFZGTMGAVHOWCU-DGCLKSJQSA-N 259.305 2.296 10 20 CECD CN(C[C@H]1CCCOC1)c1ccc(OCC(=O)O)cc1 833693261 RCULPDPYYLWLSS-GFCCVEGCSA-N 279.336 2.013 10 20 CECD CCc1nnc(C(=O)NCc2cc(C)ccc2O)s1 913000653 QFQGZVLLWDMDTO-UHFFFAOYSA-N 277.349 2.045 10 20 CECD CC(C)[C@@H](N)CNCc1cc(Br)ccc1O 841030467 SDKPIIZVTIPLLN-NSHDSACASA-N 287.201 2.228 10 20 CECD O=[N+]([O-])c1cc(CNCCCO)ccc1N1CCCCC1 743503766 SYZIFRUMMXTOKS-UHFFFAOYSA-N 293.367 2.057 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)[C@H](C)SC)cc1 844852703 MZRKEBRCAMKQGT-LBPRGKRZSA-N 296.436 2.341 10 20 CECD CC[C@@H](NCC[C@@]1(O)CCCOC1)c1ccccc1O 846108718 QTYGKMRMFNQUKM-ZBFHGGJFSA-N 279.380 2.365 10 20 CECD CCOc1ccc(CNC[C@H](C(=O)O)C(C)C)c(O)c1 848639357 IPEINWLARSXSDQ-ZDUSSCGKSA-N 281.352 2.237 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H](OC(C)C)C2)c(O)c1O 843921114 CXURJMACFGWVQV-LLVKDONJSA-N 279.336 2.046 10 20 CECD COc1cccc(O)c1CNCC1(CCO)CCCC1 744448387 IZIMUMDZAPVIJO-UHFFFAOYSA-N 279.380 2.433 10 20 CECD CC1(C)CC[C@H](OC(=O)c2cc(O)cs2)C1=O 840228836 UCCIQBWRHGLSPT-QMMMGPOBSA-N 254.307 2.368 10 20 CECD COC(=O)c1cccc(CC(=O)NCc2ccccc2O)c1 759608480 LZFZLLJEWDFAPK-UHFFFAOYSA-N 299.326 2.038 10 20 CECD CN(C)c1cc(F)c(CN[C@@H](CCO)C2CC2)cc1F 858145190 YUTVFHZXNBXVQC-AWEZNQCLSA-N 284.350 2.281 10 20 CECD CCOc1ccc(CNC[C@H](CO)CC2CC2)c(O)c1 850388333 LGNQAVFCSBTWDA-CYBMUJFWSA-N 279.380 2.289 10 20 CECD CON(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 753653028 SKBQCAUPYMDETK-JTQLQIEISA-N 251.330 2.016 10 20 CECD CN(C)c1cc(F)c(CN[C@H]2CCCC[C@@H]2O)cc1F 858136632 WFPZFYKFESQYGI-ZFWWWQNUSA-N 284.350 2.424 10 20 CECD COC(=O)C1(C)CN(Cc2cc(F)c(N(C)C)cc2F)C1 862397355 FUZAZCIYVTWJGV-UHFFFAOYSA-N 298.333 2.026 10 20 CECD COCCOC[C@@H]1CCN(Cc2c(C)cccc2O)C1 876775123 OUGYIXNWJSTLBB-CQSZACIVSA-N 279.380 2.186 10 20 CECD C[C@@H](C[C@H]1CCOC1)NC(=O)N(C)Cc1ccccc1O 760192795 ISJQSFZOTDLTGG-QWHCGFSZSA-N 292.379 2.349 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@H]2O)CC1CCCC1 768439440 HMKJOERLRYLHAO-OAHLLOKOSA-N 277.364 2.440 10 20 CECD COCC1(NC(=O)c2cc(C)n(-c3ccccn3)c2C)CC1 766123185 ZNUDMRDKGQBCPN-UHFFFAOYSA-N 299.374 2.398 10 20 CECD CCO[C@@H](CC(=O)NCc1cccc(OC)c1O)C(C)C 761542160 BUNIKZGWHQPRGM-AWEZNQCLSA-N 295.379 2.468 10 20 CECD CC[C@@H](N[C@@H](C)COCCOC)c1ccccc1O 775527213 PCOVTIFEBZXSBY-GXTWGEPZSA-N 267.369 2.484 10 20 CECD Cc1ccc([C@@H](C)C(=O)NCc2ccc(O)c(O)c2)o1 778929750 MUVKMOWZYUNVEE-SNVBAGLBSA-N 275.304 2.419 10 20 CECD C[C@H](NC[C@@H]1CC[C@@H](O)C1)c1c(O)cccc1F 886598775 JVMSQXNHGICYFD-HBNTYKKESA-N 253.317 2.343 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CC(C)(C)O 279559542 OSDSVFIDLKERFS-UHFFFAOYSA-N 278.396 2.262 10 20 CECD OC[C@]12C[C@H]1CN(Cc1ccc(N3CCCC3)cc1)C2 1320882610 YNWYWXQVTVOZFW-DOTOQJQBSA-N 272.392 2.101 10 20 CECD CC(C)CNCc1ccc(N2CCN(C)CC2)c(F)c1 62734202 XEHQZKBGZLNYND-UHFFFAOYSA-N 279.403 2.323 10 20 CECD CN(Cc1ccccc1O)c1cccnc1[N+](=O)[O-] 760262791 PCZYDHOPULMARJ-UHFFFAOYSA-N 259.265 2.332 10 20 CECD CC[C@@H](NCCN1CCC(CO)CC1)c1ccccc1O 1342930749 FNRIFQJXUKTSLB-MRXNPFEDSA-N 292.423 2.137 10 20 CECD CC1(F)CCN(C(=O)NCc2ccc(N)cc2)CC1 1353531917 OXTNDMOHDYOQRI-UHFFFAOYSA-N 265.332 2.302 10 20 CECD CCc1cccc(CN2CC[C@@H](C)[C@H](C(=O)O)C2)c1O 1603975068 CPOUONYNVDSMDJ-BXUZGUMPSA-N 277.364 2.497 10 20 CECD CCN(CC)CCCNCc1cc(OC)ccc1O 20090582 XURWDTWMBKUFAF-UHFFFAOYSA-N 266.385 2.222 10 20 CECD CSCc1cccnc1C(=O)NCc1ccc(N)cc1 1579382835 MRLUISVMEFDMDV-UHFFFAOYSA-N 287.388 2.457 10 20 CECD N[C@H]1CCC[C@H](NC(=O)NCc2cccc(Cl)c2O)C1 1580176687 QBJFVDJJFZYHBE-QWRGUYRKSA-N 297.786 2.115 10 20 CECD C[C@@H]1CCCCN1CCCNC(=O)Cc1ccc(N)cc1 19271022 LGOXKATXYDDPJD-CQSZACIVSA-N 289.423 2.192 10 20 CECD COc1cccc(CNc2ccc(N(C)C)cn2)c1O 150914183 YSFLHOYZOYSZIV-UHFFFAOYSA-N 273.336 2.474 10 20 CECD COc1ccc(N(C)CC[C@@H]2CCNC2)c(OC)c1 259082083 SUEAWAGTPRURTP-LBPRGKRZSA-N 264.369 2.140 10 20 CECD CCCn1ncnc1CN(C)c1ccc(OC)cc1 844355342 NUACVJRWTDPQQQ-UHFFFAOYSA-N 260.341 2.333 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC(F)(F)CO 231792607 VLDLOIBUXAVEFF-NXEZZACHSA-N 271.307 2.466 10 20 CECD Oc1c(Cl)cccc1CN[C@@H]1C[C@H]2CC[C@@H]1O2 124856394 IMPQQSWJMJJOGU-JLLWLGSASA-N 253.729 2.455 10 20 CECD CCOc1cccc(CN2CCC(CCN)CC2)c1O 70183542 SRQGOHMSFNTJJS-UHFFFAOYSA-N 278.396 2.352 10 20 CECD COc1cccc(CN[C@@H](C)CN(C)C(C)C)c1O 388297183 ZEDHMMROJUYRDH-LBPRGKRZSA-N 266.385 2.219 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC2(CO)CC2)c1 395866970 HLDPHXMHULHVRL-LLVKDONJSA-N 265.353 2.214 10 20 CECD C[C@@H](N1CCN(Cc2ccccc2O)CC1)C(F)(F)F 179585014 DLUHCVIMZTTYMI-LLVKDONJSA-N 288.313 2.461 10 20 CECD Cc1nn(C)cc1C(=O)NCc1ccc2c(c1)CCCN2C 113039645 UVNJVUZCPAFIDC-UHFFFAOYSA-N 298.390 2.041 10 20 CECD CC(C)C(=O)N1CCCN(Cc2cc(F)ccc2O)CC1 179948558 AZXJURLTPMECER-UHFFFAOYSA-N 294.370 2.222 10 20 CECD COc1ccc(O)c([C@@H]2NC(=O)c3ccccc3N2C)c1 69055634 SBIHHLINPIPEFL-OAHLLOKOSA-N 284.315 2.279 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@H](C)c1cc(OC)ccc1O 38013625 YKRZPQFRVKIPIC-VXGBXAGGSA-N 294.395 2.356 10 20 CECD Cc1nnc(NCc2ccc(N3CCOCC3)cc2)s1 77489314 SQYLCSDRGNOZKH-UHFFFAOYSA-N 290.392 2.295 10 20 CECD Cc1cccc(CN2CCC[C@H](C3OCCO3)C2)c1O 180014439 HOBVENBPDNTZPG-AWEZNQCLSA-N 277.364 2.286 10 20 CECD OCC[C@H](NCc1ccc2c(c1)CCO2)c1ccco1 184514973 WMXBLDXYECHVQC-AWEZNQCLSA-N 273.332 2.428 10 20 CECD CCC(CC)C(=O)NCc1cc(OC)ccc1O 81959464 ISOITTAUNNNZHV-UHFFFAOYSA-N 251.326 2.453 10 20 CECD CN1CC[C@@H]2[C@@H](CCCN2Cc2ccccc2O)C1 290565326 SQNQZWXDSZRNDV-DZGCQCFKSA-N 260.381 2.308 10 20 CECD CC(C)(C)n1cc(/C=C2/SC(=S)NC2=O)cn1 193338086 NSUWMMJMOKIACI-XBXARRHUSA-N 267.379 2.127 10 20 CECD COc1cccc(CNC[C@@H](O)c2ccc(C)o2)c1O 265971689 KZSXTAUFZFMORX-GFCCVEGCSA-N 277.320 2.125 10 20 CECD CC[C@H](N[C@@H]1CCN(CCOC)C1)c1ccc(C)cc1O 279973796 DDTHQZBRRHJPMY-ZBFHGGJFSA-N 292.423 2.462 10 20 CECD C[C@@H]1OCC[C@@]12CN(Cc1ccc(N(C)C)cc1)CCO2 280404250 LBLTXDBKEHUNTL-WMLDXEAASA-N 290.407 2.132 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)C[C@H](C)[S@@]1=O 289848968 UVTRLZLKZXIKOM-CJAGKMTESA-N 297.420 2.132 10 20 CECD CCCc1cc(C(=O)NCc2ccccc2O)no1 295058191 KOYBIQQOJAYTLB-UHFFFAOYSA-N 260.293 2.263 10 20 CECD C/C=C\C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 819578378 JPORQRFQOXSUOA-DHCBQETCSA-N 274.364 2.214 10 20 CECD COC[C@]1(CN[C@H](C)c2c(C)cc(C)cc2O)CCCN1 817973682 GIKGBLKNTYJIJU-RHSMWYFYSA-N 292.423 2.428 10 20 CECD Oc1ccccc1CNCc1ncn(-c2ccccc2)n1 815161876 CXSTYWRIFQVYIA-UHFFFAOYSA-N 280.331 2.263 10 20 CECD COC[C@@]1(CN[C@H](C)c2c(C)cc(C)cc2O)CCCN1 817973681 GIKGBLKNTYJIJU-PBHICJAKSA-N 292.423 2.428 10 20 CECD CCN1CCCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O 827930114 BMZVQVKHJXGZCJ-TZMCWYRMSA-N 276.380 2.444 10 20 CECD C[C@H](NC(=O)c1c(F)ccc(O)c1O)C1CCC1 827354479 QCOPTDASWNORLP-ZETCQYMHSA-N 253.273 2.155 10 20 CECD Cc1ncc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)n1C 907491137 AYSCOIIOFNKXEX-NSHDSACASA-N 286.379 2.286 10 20 CECD O=Cc1c[nH]nc1/C=C\c1ccc(N2CCC(O)CC2)cc1 905071610 HAOOTUBLRVFJKQ-UTCJRWHESA-N 297.358 2.354 10 20 CECD Cc1cc(C)c(C(=O)NCc2ccc(O)c(O)c2)c(C)n1 907059522 JHMWLVCIPYBAIW-UHFFFAOYSA-N 286.331 2.348 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@@H]2CCN2C)cc1 903321693 HYTIDNREJRJHIP-CJNGLKHVSA-N 261.413 2.497 10 20 CECD C[C@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 834908147 HGCWGJGBVGRLJR-BLLLJJGKSA-N 275.396 2.072 10 20 CECD C[C@@H](NCC1(CO)CCOCC1)c1ccc(Cl)cc1O 841751598 NXEOMLTZJMNRKD-LLVKDONJSA-N 299.798 2.485 10 20 CECD CCC[C@@H](C)NC(=O)NCc1cccc(OC)c1O 745260805 GJWRZCSWWSJORJ-SNVBAGLBSA-N 266.341 2.389 10 20 CECD C[C@H]1[C@H](C)CCN1C(=O)NCCc1ccc(N)cc1 841959221 WPMOAKBCLGYWQL-NEPJUHHUSA-N 261.369 2.251 10 20 CECD CCO[C@H]1C[C@@H](NC(=O)NCc2cc(Cl)ccc2O)C1 845255702 VWSBGCLLDPRTCR-TXEJJXNPSA-N 298.770 2.412 10 20 CECD CN(C)c1cccc(NC(=O)NCCc2ccc(N)cc2)n1 841183698 PZKRLICGVGVJHS-UHFFFAOYSA-N 299.378 2.094 10 20 CECD CC(=O)NCCN(C)Cc1cc(C(C)C)c(C)cc1O 842633379 QUBMUOXZXXGOEH-UHFFFAOYSA-N 278.396 2.392 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@]2(C)CCOC2)c1 755528593 FNROIIXXKCMOQB-MEBBXXQBSA-N 279.336 2.005 10 20 CECD C[C@H](NC[C@@H](O)COCC1CC1)c1cc(Cl)ccc1O 756510454 IJYAJHXYSVULSO-GXFFZTMASA-N 299.798 2.484 10 20 CECD CCOCCOCCN[C@H](C)c1cc(F)cc(F)c1O 927088306 YTIYDDDDTAUDIA-SNVBAGLBSA-N 289.322 2.374 10 20 CECD CC1(C)C[C@@]1(C)NC(=O)/C=C\c1ccc(O)c(O)c1 856138442 YNXZATBZECJFFF-ZQMJAJRESA-N 261.321 2.416 10 20 CECD CNC[C@H](C)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 854231983 MOPWINSRVOOAAO-QXEWZRGKSA-N 252.333 2.277 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCOC(F)(F)F)c1 858385634 VWYCPGYHSKRIAU-UHFFFAOYSA-N 292.257 2.036 10 20 CECD C[C@@H](N[C@@H]1COC[C@@H]1O)c1ccc(Cl)c(Cl)c1O 866420367 OWWPCNURXXSAJR-DRTBCBBWSA-N 292.162 2.109 10 20 CECD CCN(Cc1cc(F)c(N(C)C)cc1F)[C@@H](C)CO 862378129 PGZZRBQOLZGGAS-JTQLQIEISA-N 272.339 2.234 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCSC1 761840484 BZVOKMQOVJMVMZ-CYBMUJFWSA-N 278.421 2.464 10 20 CECD CCCN(CC(=O)N(C)C)Cc1ccc(OCC)cc1O 769000519 VHQVTQMPJORYCJ-UHFFFAOYSA-N 294.395 2.091 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)c1nc(N)nc(Cl)n1 879648865 CVRBSYPTULZLNZ-SFYZADRCSA-N 293.758 2.225 10 20 CECD O=C(O)CCCCCNC(=O)N1Cc2cccc(O)c2C1 874403887 XSMOMHWLONKIBX-UHFFFAOYSA-N 292.335 2.062 10 20 CECD CC[C@@H](NCCS(C)(=O)=O)c1cc(Cl)ccc1O 775496591 JUAIRPSCFOXECO-LLVKDONJSA-N 291.800 2.131 10 20 CECD CC[C@]1(O)CCCN(Cc2cc(OC)ccc2O)C1 877690554 ALOATJRTRLYHQP-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CN1c2ccccc2C(=O)N[C@@H]1c1cccc(F)c1O 778520098 NXVWDKBMPJRHHG-AWEZNQCLSA-N 272.279 2.410 10 20 CECD CCc1nc(CN2CCCc3cc(OC)ccc32)n[nH]1 771754519 ZOQRHZJDRAIZNC-UHFFFAOYSA-N 272.352 2.329 10 20 CECD CNC(=O)C1CCC(N[C@H](C)c2c(O)cccc2F)CC1 886516648 RQTYNUPCYAJUQJ-VOMCLLRMSA-N 294.370 2.487 10 20 CECD COc1cc(C)cc(CNC[C@]2(C)CCCO2)c1O 894347682 QDHNBUGDHSPCST-HNNXBMFYSA-N 265.353 2.368 10 20 CECD C=CC(=O)N(Cc1ccc(N(C)C)cc1)C[C@@H]1CCCO1 1338389636 MEEVINSEYIRSFX-INIZCTEOSA-N 288.391 2.446 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@H](CO)CC2)cc1 759294262 KNWPPZISFUBDKX-SHTZXODSSA-N 262.397 2.393 10 20 CECD Cc1cnc(CSc2ncc(C(=O)O)s2)o1 1600622325 MDKVISIGAHHAPH-UHFFFAOYSA-N 256.308 2.430 10 20 CECD CCN1CCc2cc(CNC3(C(=O)O)CCC3)ccc21 1776877545 QMFIFRFSUYTFCZ-UHFFFAOYSA-N 274.364 2.166 10 20 CECD C[C@@]1(C(=O)O)CC[C@H](NCc2cc(F)cc(F)c2O)C1 1776501994 XUHVEIDWCZNWIN-IINYFYTJSA-N 285.290 2.403 10 20 CECD CSCCNC(=O)NCCCSc1nccs1 153071170 ZESDUCJBOUOAEW-UHFFFAOYSA-N 291.467 2.288 10 20 CECD COc1ccc(N(C)CCCN2CCCC2=O)cc1 844353290 LGVPNXMZEOMFJJ-UHFFFAOYSA-N 262.353 2.144 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H]2COC(C)(C)O2)c1 230206465 RBGIZOVBYZLWAR-JQWIXIFHSA-N 281.352 2.203 10 20 CECD Cc1ccc([C@H](C)NC[C@]2(O)CCSC2)c(O)c1 185639096 WKHGAAJWXDBJEL-SMDDNHRTSA-N 267.394 2.219 10 20 CECD O=C(O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2O)C1 86773087 YLJQNNIAIQTJNQ-LBPRGKRZSA-N 289.253 2.231 10 20 CECD CC[C@H](C)NC(=O)CCNCc1cc(F)cc(F)c1O 708393396 DASQAXYIHIJJFC-VIFPVBQESA-N 286.322 2.065 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H]2CCCCNC2=O)cc1 177873336 UNBXNIPOCAXVJD-CZUORRHYSA-N 289.423 2.462 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@@H](N)C2)c1O 50149793 UJQQHOBUXXAGQK-GFCCVEGCSA-N 282.771 2.171 10 20 CECD COc1ccc(N2CCN(C(=O)[C@H]3C[C@H]3C)CC2)cc1F 177278463 DBBVAVARPVBFGA-YPMHNXCESA-N 292.354 2.139 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@]1(O)CCO[C@H]1C 300423510 GCXKZVFSGFFWTJ-XREXNNHRSA-N 291.391 2.378 10 20 CECD CC(C)[C@@H](C)NC(=O)CN(C)c1ccc2c(c1)OCO2 121366038 JXJICQPPLBMURY-LLVKDONJSA-N 278.352 2.012 10 20 CECD Oc1ccccc1CNCCn1cc(Br)cn1 285627934 YNTIWTRXLFFETJ-UHFFFAOYSA-N 296.168 2.141 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2CCCOC2)cc1F 193007271 FRUDVKHDHOSIRK-CYBMUJFWSA-N 294.370 2.325 10 20 CECD CCN(CC)c1ccc(CN2C(=O)N[C@@H](C)C2=O)cc1F 272372367 HYARPMXSJJUQFX-JTQLQIEISA-N 293.342 2.112 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCCN[C@@H]3C2)cc1C 271187057 NQLFXZPPBRGBMQ-DZGCQCFKSA-N 260.381 2.193 10 20 CECD Cc1n[nH]c(C)c1[C@@H](C)C(=O)NCc1ccccc1O 273210171 MISWPTAQHRCWKQ-SECBINFHSA-N 273.336 2.152 10 20 CECD CC[C@H](NCc1ccccc1O)[C@H](O)C(F)(F)F 270973777 KHRBLDQIFGBKJI-ONGXEEELSA-N 263.259 2.184 10 20 CECD CC[C@H](CNCc1cc(Cl)cc([N+](=O)[O-])c1O)OC 289795049 LSHSIASFAUEQQT-SNVBAGLBSA-N 288.731 2.468 10 20 CECD C[C@H](NCc1ccc(N2CCCC2)cc1)c1ccc(=O)[nH]n1 285876800 ZFFXVGFZJCPRER-ZDUSSCGKSA-N 298.390 2.221 10 20 CECD CC(=O)C(=O)COC(=O)c1cc2c(s1)CC[C@@H](C)C2 808484978 MFAKJQICZWPSBE-MRVPVSSYSA-N 280.345 2.188 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@H]1[C@@H]1CCCO1 807538433 DMJDUZZUIWKQMW-QWRGUYRKSA-N 267.350 2.237 10 20 CECD C[C@H](N[C@@H]1CCCNC1)c1cc(F)cc(F)c1O 817942492 ZZWDYNHNNAVDCA-WCBMZHEXSA-N 256.296 2.073 10 20 CECD CC(C)[C@H]1C[C@@H](C(=O)NCc2ccc(O)cc2O)CCO1 822971203 AEICIUGWNYSZNL-XHDPSFHLSA-N 293.363 2.165 10 20 CECD COc1ccc(N(C)Cc2cnc(N(C)C)n2C)cc1F 822469596 AQLOVFUNNZFSPY-UHFFFAOYSA-N 292.358 2.270 10 20 CECD CN(Cc1ccc(C(=O)O)[nH]1)Cc1ccccc1O 833696805 UPVNSTXMDDJGIK-UHFFFAOYSA-N 260.293 2.051 10 20 CECD COCCOCCCNCc1ccc(N(C)C)cc1C 840928390 ROESHHQQRXOOGI-UHFFFAOYSA-N 280.412 2.204 10 20 CECD CC[C@H](NCc1cc(Cl)cc(F)c1O)C(=O)O 843040263 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FSXFHWJFKOPUHC-UHFFFAOYSA-N 292.423 2.291 10 20 CECD C[C@@H](NC(=O)NCC(C)(C)CO)c1ccc(N(C)C)cc1 776245986 IVOFMKQPTYQZPC-GFCCVEGCSA-N 293.411 2.131 10 20 CECD Cc1ccccc1[C@@H](CO)NC(=O)c1cc(O)cs1 778514632 JXGHCYJNBHYIIA-GFCCVEGCSA-N 277.345 2.226 10 20 CECD CCc1ccc(CC(=O)N(C)c2ccc(N)cc2)nc1 884441142 AOMXVGBNJLDZKU-UHFFFAOYSA-N 269.348 2.432 10 20 CECD CCc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)no1 888576823 KJYYORKDTFKAJP-UHFFFAOYSA-N 291.326 2.372 10 20 CECD COc1cccc(CN2CC(C)(C)CC[C@@H]2CO)c1O 895926131 WZRMOSXOIVDVCC-CYBMUJFWSA-N 279.380 2.384 10 20 CECD Cc1ccc(C(=O)OCc2ccc(F)cn2)c(O)c1O 787682845 VOLIMHZHXGGQFX-UHFFFAOYSA-N 277.251 2.297 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H](F)C(C)C)c1 784442786 QPJFOWASBQFOSI-GFCCVEGCSA-N 255.289 2.011 10 20 CECD COc1cc(C)cc(CN2CCC[C@H](CO)[C@H]2C)c1O 895014737 MUKNFLUTXUZYGW-CHWSQXEVSA-N 279.380 2.302 10 20 CECD COc1ccc(CNCC[C@H]2CCCCO2)c(O)c1OC 893479547 SULMMIWAPVYVFT-CYBMUJFWSA-N 295.379 2.458 10 20 CECD CC1(C(=O)COC(=O)/C=C\c2ccc(O)c(O)c2)CC1 795562298 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CC(C)NC(=O)[C@@H](C)N[C@H](C)c1cc(F)ccc1O 228943745 YLCIWZVHQKIAKW-NXEZZACHSA-N 268.332 2.095 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCCN2CCOCC2)c1 35628869 IDLOKMCWBDKNIF-CQSZACIVSA-N 278.396 2.074 10 20 CECD CCCNC(=O)CCN[C@@H](CC)c1ccccc1O 45071806 LXTPHSHXGJGURB-ZDUSSCGKSA-N 264.369 2.349 10 20 CECD COc1ccc(O)c(CN2CCCC[C@H]2[C@@H](C)N)c1 63191910 PIVXBQGBGUSJLX-RISCZKNCSA-N 264.369 2.103 10 20 CECD C[C@@H]1NC[C@@H](C)N(Cc2cc(F)ccc2O)[C@H]1C 401202621 ANXPKMXJPOQPJD-VWYCJHECSA-N 252.333 2.102 10 20 CECD OCC(F)(F)CNCc1cc(Cl)cc(Cl)c1O 183873342 VVDUGNVTUVYCCJ-UHFFFAOYSA-N 286.105 2.416 10 20 CECD Cc1cccc(CN2CCN(CCOC(C)C)CC2)c1O 180375160 ABAWFANXFDGVQC-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)cc2)C(C)(C)C1=O 190028727 NQYXLGWZYVLKFN-UHFFFAOYSA-N 289.423 2.195 10 20 CECD CC1CCN(c2ccc(CNC(=O)CCCN)cc2)CC1 236730922 OHHGKFDKOACOTL-UHFFFAOYSA-N 289.423 2.278 10 20 CECD COC[C@H](N[C@H](C)c1ccccc1O)[C@@H]1CCCO1 278659758 FHZYLGQBHUXCRL-ZLDLUXBVSA-N 265.353 2.237 10 20 CECD Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCCCO2)c(O)c1O 272890639 ARECRYSGVTWLHF-PWSUYJOCSA-N 279.336 2.094 10 20 CECD CC1(CNCc2c(O)cccc2Cl)OCCCO1 277129776 CNQGVFCUAMRXIS-UHFFFAOYSA-N 271.744 2.288 10 20 CECD CCNC(=O)c1ccc(N(C)Cc2ccccc2O)nc1 276292881 MCKNFSYNNOCYBU-UHFFFAOYSA-N 285.347 2.173 10 20 CECD Cc1ccc(C(=O)N(CC2CCC2)[C@@H](C)CO)c(O)c1O 280640304 CJNZRUFRAZKJJU-NSHDSACASA-N 293.363 2.029 10 20 CECD CN(C)c1ccc(CN(C(=O)CC(C)(C)O)C2CC2)cc1 280803246 LXOLFWPSQVGVKW-UHFFFAOYSA-N 290.407 2.405 10 20 CECD Oc1c(CNCc2nnc3n2CCC3)ccc2ccccc12 816533679 GQJIYSGSFSRNOB-UHFFFAOYSA-N 294.358 2.373 10 20 CECD C[C@@H](NC(=O)CC1(O)CCCC1)c1ccccc1O 827936746 CBZHYSZECBMKRN-LLVKDONJSA-N 263.337 2.265 10 20 CECD O=C(/C=C\c1cccnc1)N1C[C@H](CO)c2ccccc21 492939956 GXJZXAVJZAMNPS-WBTMPAOCSA-N 280.327 2.218 10 20 CECD CCN1C[C@@H](N[C@H](C)c2c(C)cc(C)cc2O)CC1=O 834892228 UQVITIHEEFPJFF-OLZOCXBDSA-N 276.380 2.280 10 20 CECD CN(C[C@H]1CC1(C)C)C(=O)NCCc1ccc(N)cc1 831104317 ZHJWIQFGXFZJOK-CYBMUJFWSA-N 275.396 2.499 10 20 CECD COc1cccc([C@@H](C)NCc2nc(C3CC3)n[nH]2)c1O 846170601 PHUFXPWECIEKIA-SECBINFHSA-N 288.351 2.247 10 20 CECD CC[C@H](NCC[C@@]1(O)CCCOC1)c1ccccc1O 846108715 QTYGKMRMFNQUKM-HOCLYGCPSA-N 279.380 2.365 10 20 CECD C[C@H](N[C@H](C)[C@H](O)C(F)(F)F)c1ccc(F)cc1O 866463180 KQJQQKOABFKFSC-CVJICSNFSA-N 281.249 2.494 10 20 CECD Nc1ccc(Cc2noc(CC[C@H]3CCOC3)n2)cc1 843159306 ORSUEBIFJMHJEE-LBPRGKRZSA-N 273.336 2.212 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1cc(Cl)cc([N+](=O)[O-])c1O 843066431 XBSWMAQTXZWODT-DTORHVGOSA-N 299.758 2.136 10 20 CECD COc1ccc(N(C)Cc2cnc(N(C)C)nc2)cc1 845998809 QKFLKBWKUUJFIE-UHFFFAOYSA-N 272.352 2.188 10 20 CECD C[C@H](N[C@H](CO)C1CCOCC1)c1ccc(Cl)cc1O 841752064 FOYSZFOEELTGMT-IINYFYTJSA-N 299.798 2.484 10 20 CECD CO[C@H]1C[C@H](NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 858369448 VGGIGTGJLCUKRR-UXIGCNINSA-N 291.395 2.290 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)c(C)nn1 767206382 KKUXBXBNYIXVIA-UHFFFAOYSA-N 298.390 2.432 10 20 CECD CCCN(CCC)Cc1cc2c(cc1O)OC[C@@H]2O 768441408 LGAJKYKJBNCQIQ-AWEZNQCLSA-N 265.353 2.440 10 20 CECD CCc1nnc(CNCc2c(C)cccc2O)s1 877543042 VQPBIQNXJYLFHE-UHFFFAOYSA-N 263.366 2.404 10 20 CECD CCOc1cccc(CN2Cc3cnn(C)c3C2)c1O 877632747 MCPJLXYHTBPYAY-UHFFFAOYSA-N 273.336 2.040 10 20 CECD C[C@@H]1OCC[C@@H]1CN1CCOc2cc(N(C)C)ccc21 878319656 YKUVZFFFDBSWPT-QWHCGFSZSA-N 276.380 2.376 10 20 CECD CC[C@@H](NCCN1CCOC[C@@H]1C)c1ccccc1O 775499174 PJOPINMQSJBBRM-DZGCQCFKSA-N 278.396 2.154 10 20 CECD CO[C@]1(CN[C@@H](C)c2c(C)cc(C)cc2O)CCOC1 788748759 AJRKNGIZHQTDNV-BBRMVZONSA-N 279.380 2.465 10 20 CECD CCC[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)OC 897833831 ZOODDSLDDRYOAG-CQSZACIVSA-N 277.364 2.443 10 20 CECD COc1ccc(CN2CCC(F)CC2)c(O)c1OC 896000691 XZSOCQZHUFGHCP-UHFFFAOYSA-N 269.316 2.343 10 20 CECD COc1ccc(N(C)Cc2cnc3n2CCOC3)cc1F 893465597 RORRQYCFRMOQTG-UHFFFAOYSA-N 291.326 2.197 10 20 CECD COc1ccc(CN(C)C[C@@H]2CCC[C@H]2O)c(O)c1OC 892217601 ZEHPWSPRJDTERJ-WCQYABFASA-N 295.379 2.002 10 20 CECD C[C@@H](O)[C@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894423430 RUECWYGABOLLFU-ZJUUUORDSA-N 271.307 2.263 10 20 CECD COC(=O)[C@@H](NCc1ccc(OC)c(C)c1)C(C)C 37257175 MXYZDESSKHUHBO-AWEZNQCLSA-N 265.353 2.291 10 20 CECD CN1CCC[C@H](CNCc2c(O)cccc2Cl)C1 83552516 WOEPVRYGESIHIS-LLVKDONJSA-N 268.788 2.477 10 20 CECD Cc1nccc(C(=O)Nc2c(Cl)ccc3nonc23)n1 1325346945 ZVGBPCXNSHOSIP-UHFFFAOYSA-N 289.682 2.227 10 20 CECD CC[C@@H](NCc1nnc(C)n1C)c1ccc(F)cc1O 1322447291 XBXRHRBYTPRWDG-GFCCVEGCSA-N 278.331 2.209 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCCCCN 1325681038 HPCQJAAIPHNEFU-UHFFFAOYSA-N 292.427 2.023 10 20 CECD Cn1c(-c2sccc2O)nnc1N1C[C@H]2CCC[C@H]2C1 1339453771 GBYVMBWBAXBBGA-AOOOYVTPSA-N 290.392 2.486 10 20 CECD C[C@H](CC(=O)O)NCc1c(O)cccc1Br 1335467620 ZMXYFFKBJYTTOU-SSDOTTSWSA-N 288.141 2.108 10 20 CECD CCC[C@](C)(NCc1cc(F)c(F)cc1O)C(=O)O 1605199601 YXRATGAHQLEYPD-ZDUSSCGKSA-N 273.279 2.403 10 20 CECD CN(C)c1ccc(OC[C@H]2CCCOC2)cc1C(=O)O 1598328355 JDGDVTLDFHPNEK-NSHDSACASA-N 279.336 2.256 10 20 CECD CCOC(C)(C)CNCc1cccc(OC)c1O 159157376 BUFDLJMTRWMQFY-UHFFFAOYSA-N 253.342 2.306 10 20 CECD Cc1cc(NCc2cc(F)cc(F)c2O)nn1C 708534603 BCHYDZZLSFRCHV-UHFFFAOYSA-N 253.252 2.324 10 20 CECD Cc1ccc(C(=O)N(C)Cc2c(C)noc2C)c(O)c1O 177671198 UOTTVRYTSUVMBT-UHFFFAOYSA-N 290.319 2.283 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@H]2CCOC2)cc1 176564066 JOJIDJSGDGEYOY-AWEZNQCLSA-N 276.380 2.186 10 20 CECD COC[C@H](C)N(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 179368086 WBKQTZAFUPJABD-QMMMGPOBSA-N 288.731 2.421 10 20 CECD CCCCCN(CC(N)=O)Cc1cc(F)ccc1O 180807172 YJDFWXUNEYRLLF-UHFFFAOYSA-N 268.332 2.009 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)[C@@H](C)N2CCOCC2)c1 185375747 XOCRHWQWKABQPJ-RRFJBIMHSA-N 292.423 2.460 10 20 CECD CCNC(=O)C(C)(C)CN[C@H](C)c1cc(F)ccc1O 186354428 JAGYRFXRLKIKFI-SNVBAGLBSA-N 282.359 2.344 10 20 CECD COCCN(CCC(C)(C)O)c1ccc(OC)c(OC)c1 83212419 YDUOHEJTFLOHEN-UHFFFAOYSA-N 297.395 2.318 10 20 CECD O=C(CSc1ncco1)c1ccc(O)c(O)c1 236626771 DRZDWFRTKOVKEA-UHFFFAOYSA-N 251.263 2.061 10 20 CECD Cc1ncccc1/C=C1/SC(=S)N(C)C1=O 255171415 SDJWBKCZLDWEPT-RMKNXTFCSA-N 250.348 2.221 10 20 CECD CC(C)[C@H]1CN(C)CCN1Cc1cc(F)ccc1O 184740078 BXJLZGRUOWPOND-CQSZACIVSA-N 266.360 2.303 10 20 CECD Cc1cc(O)c([C@@H]2NC(=O)CN2CC(C)C)cc1C 266176307 AYANKORXRHDARS-OAHLLOKOSA-N 262.353 2.095 10 20 CECD Cc1ccc([C@@H](C)NCCCOCCO)c(O)c1C 273491297 WQZCEBZEVRKMQH-CYBMUJFWSA-N 267.369 2.059 10 20 CECD COC1(CC(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCC1 276786607 IXUUMPMDWLXFCM-LLVKDONJSA-N 293.363 2.104 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCc2n[nH]c(C)n2)cc1 272598319 TUWWHEZZIOOWIO-GFCCVEGCSA-N 287.411 2.463 10 20 CECD Cc1ccc([C@H](C)NC[C@@]2(O)CCO[C@@H]2C)c(O)c1C 278866547 RODYTVFOEVUZMX-ZENOOKHLSA-N 279.380 2.200 10 20 CECD C[C@H]1CCC[C@@H]1NC(=O)c1c(F)ccc(O)c1O 295392737 YOMYJCJHFVXGIC-CBAPKCEASA-N 253.273 2.155 10 20 CECD C[C@@H]1[C@H](N2CCCC2)CCN1C(=O)c1cc(O)cs1 807776955 JILBXJLCAOGLTH-ZYHUDNBSSA-N 280.393 2.153 10 20 CECD CC[C@H](O)CN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 813885322 SRANUMIRXQFOQA-WCABBAIRSA-N 253.317 2.440 10 20 CECD C[C@H]1C[C@@H](NCCNC2CC2)c2c(O)ccc(F)c21 817951948 BRSSXYRFPFPCGX-JOYOIKCWSA-N 264.344 2.421 10 20 CECD CC(C)[C@H](O)C(=O)NCc1ccc(N2CCCCC2)cc1 813425249 HKVVLLFTCWNCMY-INIZCTEOSA-N 290.407 2.310 10 20 CECD CCN(C)c1ccc(CN2CC[C@@](F)(CO)C2)cc1 815111453 LYGCXNHUCZPHBB-HNNXBMFYSA-N 266.360 2.049 10 20 CECD CC[C@H](NC[C@@H]1CNCCCO1)c1ccc(C)cc1O 817982469 SSIJGZIHVRKEEZ-ZFWWWQNUSA-N 278.396 2.120 10 20 CECD CCN(C)c1ccc(CN2CC[S@@](=O)CC2(C)C)cc1 815098134 BJAFEUWEHQROOF-HXUWFJFHSA-N 294.464 2.486 10 20 CECD C[C@H]1C[C@H](CO)CN(Cc2ccc(N(C)C)cc2)C1 817280914 FEWJYFDGQFSARK-ZFWWWQNUSA-N 262.397 2.203 10 20 CECD CC[C@H](N[C@@H](CN)C1CC1)c1ccc(F)cc1O 817959610 DIXCFWLTUAJYIB-STQMWFEESA-N 252.333 2.309 10 20 CECD CCOCc1cc(CN[C@@H]2CCC[C@@H]2CO)ccc1OC 825182845 CFDMQCJDANDJAX-GDBMZVCRSA-N 293.407 2.482 10 20 CECD C[C@@H](NC(=O)CC[C@@]1(C)CCC(=O)N1)c1ccccc1O 827940350 BLMATAYYSQYRAG-BZNIZROVSA-N 290.363 2.018 10 20 CECD CN1C(=O)C(=Cc2ccc(C3CCC3)cc2)C(=O)N(C)C1=O 834398725 QJEZWAGZCPFESF-UHFFFAOYSA-N 298.342 2.388 10 20 CECD CCOC(=O)CC1CCN(C(=O)c2cc(O)cs2)CC1 732268559 PONSPEVCZBFMAP-UHFFFAOYSA-N 297.376 2.259 10 20 CECD CCOc1ccc(O)c(CN[C@H]2C[C@@H](OCC)C2)c1 839147504 KUMRMEYZEHKOPT-XBXGTLAGSA-N 265.353 2.448 10 20 CECD Nc1ccc(NC(=O)C(=O)NCC2CCCCCC2)cc1 841138084 SGTSUFAAWAHKFN-UHFFFAOYSA-N 289.379 2.294 10 20 CECD C[C@H](O)CNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 743510947 BFYVODTZIYWFHS-LBPRGKRZSA-N 293.367 2.056 10 20 CECD COc1ccc(O)c([C@H](C)NCCC(C)(C)N)c1 925739562 YWCJGIJOYSAJNA-JTQLQIEISA-N 252.358 2.179 10 20 CECD CSCC1(CC(=O)NCc2ccc(O)c(O)c2)CC1 845833552 HKYQQIGHGOBQHG-UHFFFAOYSA-N 281.377 2.247 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@H](C)N1 843048951 BMOWDVSKEBIFDJ-IUCAKERBSA-N 299.758 2.136 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCOCCN2)cc1 854692544 QOZINYZIUJZJPO-UHFFFAOYSA-N 299.374 2.071 10 20 CECD CO[C@@H](C)C(=O)Nc1c(-c2ccccn2)nc2ccccn12 751299484 MMILOZBCZHRSPK-NSHDSACASA-N 296.330 2.370 10 20 CECD COC(=O)[C@H](NCc1ccc(N(C)C)cc1)C(C)C 69610772 FMUWEHPSOPOXRA-CQSZACIVSA-N 264.369 2.040 10 20 CECD Cc1cccc(CN2CC[C@@H](C(=O)O)[C@H](C)C2)c1O 863738376 AFVNTCHWLMXPKR-DGCLKSJQSA-N 263.337 2.243 10 20 CECD C[C@]1(CO)CCCN1Cc1cc(F)cc(F)c1O 1119449454 WQDKINSNVPWFHO-CYBMUJFWSA-N 257.280 2.017 10 20 CECD COC[C@@H](C)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773145556 NOLICTTZHSPRBE-NEPJUHHUSA-N 279.384 2.148 10 20 CECD CC[C@H](NCCc1nncn1CC)c1ccccc1O 775522843 BXFMHOSCYKVATD-ZDUSSCGKSA-N 274.368 2.287 10 20 CECD CCC1(NC(=O)/C=C\c2ccc(O)c(O)c2)CCOCC1 779540967 VDPREEOCMYOHDM-XQRVVYSFSA-N 291.347 2.186 10 20 CECD C[C@@H](NC[C@H]1CC(=O)N(C2CC2)C1)c1c(O)cccc1F 886633281 QUNUFSIJCHQJHT-GHMZBOCLSA-N 292.354 2.193 10 20 CECD C[C@@H](NC(=O)CCC(C)(C)O)c1ccc(N(C)C)cc1 787534157 QASIVHINHZHQSQ-GFCCVEGCSA-N 278.396 2.481 10 20 CECD CCn1ncnc1CN[C@H](C)c1c(C)cc(C)cc1O 788803784 HJZABWWXOYKGPV-GFCCVEGCSA-N 274.368 2.471 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC2(CC1)OCCCO2 894860707 XEJNWYMMRGKVQI-UHFFFAOYSA-N 299.317 2.399 10 20 CECD OCCN(Cc1cc(F)cc(F)c1O)C1CCC1 894532932 KTRQUNZIVGESEA-UHFFFAOYSA-N 257.280 2.017 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)c1 792192391 NSNZZGXENNLVQK-HRBWSGTNSA-N 297.420 2.132 10 20 CECD CO[C@@H](C(=O)N[C@@H](C)c1ccc(N(C)C)cc1)C1CC1 791720369 NDSBGTPUJONCPS-XHDPSFHLSA-N 276.380 2.355 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1CCCNCC1 38086978 AZIHAZXKFGYXTL-UHFFFAOYSA-N 275.179 2.494 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@@H]3C[C@H]3C)CC2)cc1 1322869973 SDSZRQLFGPWMJF-CZUORRHYSA-N 288.391 2.390 10 20 CECD CNC[C@@H](C)CNCc1cccc(Br)c1O 1325320329 PHVZWDDYYKAFAN-SECBINFHSA-N 287.201 2.100 10 20 CECD CCOc1cccc(CN2CCC[C@H](OC)C2)c1O 91772488 JSRWOMYPLMBWJW-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCC(F)F 1263795014 JCKJIWCVQHUWNJ-UHFFFAOYSA-N 258.268 2.189 10 20 CECD CN(C)c1ccc(CN[C@H](CC(C)(F)F)C(=O)O)cc1 1777039536 CGDSZPSUWQXWPA-GFCCVEGCSA-N 286.322 2.341 10 20 CECD COc1cc(C)cc(CN(C)[C@H](C)C(=O)OC(C)C)c1O 164502218 ARWRNIPXFJYIDT-GFCCVEGCSA-N 295.379 2.481 10 20 CECD C(=C/c1ccncn1)\c1ccc(N2CCOCC2)cc1 157337211 BRGWSQRPPDPNTK-DAFODLJHSA-N 267.332 2.484 10 20 CECD CCNC(=O)C(C)(C)NCc1ccc2c(c1)CCCO2 922171025 FCMUXDCPDKDRCY-UHFFFAOYSA-N 276.380 2.016 10 20 CECD COc1ccc(O)c([C@H](C)NCCc2ccn(C)n2)c1 230898152 KEXYDCDAUNAOLL-NSHDSACASA-N 275.352 2.028 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCn2cccn2)c1 126262829 LUTXKFOUKXFRNA-GFCCVEGCSA-N 275.352 2.338 10 20 CECD C[C@@H](C[S@](C)=O)N(C)Cc1cccc(Cl)c1O 131040985 JUQJAQWLMOTIMH-HUTHGQBESA-N 275.801 2.244 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H]2CCCCNC2=O)c1 36977565 HJHIIHJGSTVFPU-AAEUAGOBSA-N 262.353 2.020 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)C[C@@H]1CCCCO1 48835539 WOOKUEPIEOMIOG-LBPRGKRZSA-N 279.336 2.122 10 20 CECD COc1cccc(CN[C@H]2CCS[C@H]2C)c1O 310564141 KXXCQSUUOPJVNN-ONGXEEELSA-N 253.367 2.384 10 20 CECD COc1ccc(O)c(CN2CC(C)(C)[C@@H]3COC[C@@H]32)c1 384819569 LOUNJJSQLCURRH-KGLIPLIRSA-N 277.364 2.258 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(N(C)C)CC2)c1 397972215 IERKBQDJMKYSBF-NSHDSACASA-N 264.369 2.146 10 20 CECD CCCOCC(=O)NCc1ccc2c(c1)CCCN2C 58770356 LLZAHHONLRDWQY-UHFFFAOYSA-N 276.380 2.112 10 20 CECD COc1ccc2c(c1)CCCN2C(=O)/C=C/c1cnn(C)c1 24875941 RDWTUHWOIIYUBH-VMPITWQZSA-N 297.358 2.421 10 20 CECD CC(C)OCCCNC(=O)/C=C/c1ccc(O)c(O)c1 180882963 OPIVGOKQJYDYDE-FNORWQNLSA-N 279.336 2.042 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1cc(C)ccc1O 185619592 MODUNKGOCXOFFG-CYBMUJFWSA-N 263.337 2.228 10 20 CECD C[C@H](Cn1cccn1)NCc1c(O)cccc1Cl 83551844 BROBCFILJVMNCF-SNVBAGLBSA-N 265.744 2.420 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CCC(N)=O)C2)cc1 92659882 GVENZOCDWRQCRX-AWEZNQCLSA-N 289.423 2.230 10 20 CECD CCn1nc(C)c(NC(=O)Cc2ccc(N)cc2)c1C 236977261 JKNAESVWVSUQGE-UHFFFAOYSA-N 272.352 2.283 10 20 CECD CN(CC[C@H]1CCCCN1C)C(=O)Cc1ccc(N)cc1 237076503 XAYDWVKAGBFPOB-MRXNPFEDSA-N 289.423 2.144 10 20 CECD CC(C)CCOCCNC(=O)NCc1ccccc1O 263752260 QEPVDFOGAGZYOV-UHFFFAOYSA-N 280.368 2.254 10 20 CECD COC(=O)C1=C(C)O[C@@H](CN(C)Cc2ccccc2O)C1 272563469 PXOOLEUNJZMEFK-CYBMUJFWSA-N 291.347 2.060 10 20 CECD CCO[C@@H]1C[C@@H](NCc2c(O)cccc2Cl)[C@@H]1OC 273813025 WXHMOZLARJAACE-BNOWGMLFSA-N 285.771 2.328 10 20 CECD C[C@@H](CN[C@H](C)c1ccc(F)c(F)c1O)N(C)C 276969774 UBDMWVIXOLRKBY-DTWKUNHWSA-N 258.312 2.271 10 20 CECD CC[C@H](NCCNC(=O)C(C)C)c1ccc(F)cc1O 285719835 QCLBWNAKALDOSU-ZDUSSCGKSA-N 282.359 2.344 10 20 CECD COc1ccc(O)c(CN2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4OC)c1 289774522 RJILRDVHMCGJOU-RJEFMMBLSA-N 289.375 2.256 10 20 CECD C[C@H]1COCC[C@@H]1CNC(=O)N(C)Cc1ccccc1O 287773266 GRUSOGFTXQEENO-QWHCGFSZSA-N 292.379 2.206 10 20 CECD C[C@H](N[C@H]1CC(=O)N(C)C1)c1ccc2ccccc2c1O 386973547 RDFTXUIWGBPXIL-AAEUAGOBSA-N 284.359 2.427 10 20 CECD C[C@H](CN1C(=O)CN(Cc2ccccc2O)C1=O)C1CC1 819165420 WBZZAKIZTKVHOJ-LLVKDONJSA-N 288.347 2.203 10 20 CECD C[C@H](CNCc1ccc2ccccc2c1O)S(C)(=O)=O 816558563 DHUDHYXXGNXQMW-LLVKDONJSA-N 293.388 2.068 10 20 CECD CCC[C@@H]1C[C@H]1C(=O)NCc1cc(OC)ccc1O 812510033 VFJDLBSCDOVCRG-ZWNOBZJWSA-N 263.337 2.453 10 20 CECD CCOc1cccc(CNCc2nn(CC)nc2C)c1O 818221626 RKAHOPSXPOJTEY-UHFFFAOYSA-N 290.367 2.001 10 20 CECD Cc1cc(CN2CCC3(C2)OCCO3)ccc1N(C)C 815068830 FJGMEPOXFJCCIL-UHFFFAOYSA-N 276.380 2.010 10 20 CECD C[C@@H](N)C[C@@H](C)NCc1ccc(N(C)C)c(F)c1 817901933 ZUUOWWDEFXQYFE-GHMZBOCLSA-N 253.365 2.107 10 20 CECD CCN(CC)c1ccc(CN[C@@H]2CC[C@H]2O)cc1F 818230946 KDHINEBSMACFCL-UKRRQHHQSA-N 266.360 2.285 10 20 CECD Cc1nc(SCC(=O)c2ccc(O)c(O)c2)[nH]c1C 814778794 WOXWRHSGQZGWHU-UHFFFAOYSA-N 278.333 2.413 10 20 CECD CCOCc1cc(CN[C@H](CC)[C@H](C)O)ccc1OC 824921473 MHLUECNHJJYKNO-SWLSCSKDSA-N 281.396 2.481 10 20 CECD CC[C@@H](C)NC(=S)NCc1cc(OC)ccc1O 733907061 SCECBKSSGVGPPW-SECBINFHSA-N 268.382 2.163 10 20 CECD O=C(NCCc1cn2ccccc2n1)c1cc(O)cs1 731867250 PETCFTKDDUZMBM-UHFFFAOYSA-N 287.344 2.074 10 20 CECD CCCCCNC(=O)[C@@H](C)OC(=O)c1cc(O)cs1 732354812 RYIKDSMVJKQHTB-SECBINFHSA-N 285.365 2.305 10 20 CECD CNc1cc(C(=O)NCc2ccccc2O)cc(Cl)n1 731878038 DGVICLQLBBNFKM-UHFFFAOYSA-N 291.738 2.412 10 20 CECD Cc1ccncc1/C=C\C(=O)N1C[C@H](O)Cc2ccccc21 493632923 PXQUASZPCLHUHS-MWWKQMNYSA-N 294.354 2.353 10 20 CECD CC(C)[C@H](C)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832272297 DUZCMNIMNRMUPT-WFASDCNBSA-N 277.412 2.161 10 20 CECD Cc1ccc(CCNC(=O)NCc2ccccc2O)nc1 836683018 CFTRZQLSAFYIGD-UHFFFAOYSA-N 285.347 2.138 10 20 CECD C/C=C\C(=O)NCc1ccc(N2CCSCC2)cc1 737803596 DCSKPLMAFWNPRR-IHWYPQMZSA-N 276.405 2.432 10 20 CECD CC(C)[C@@]1(CO)CCCN(C(=O)c2cc(O)cs2)C1 832907927 CANDTFHCBZDNPL-AWEZNQCLSA-N 283.393 2.324 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NC(=O)N(C)Cc1ccccc1O 838700608 BJMMECNABPDMPN-ABAIWWIYSA-N 292.379 2.347 10 20 CECD CCC[C@]1(CO)CCCN1C(=O)c1cc(O)cs1 834539063 JFZITIKFIHNCJN-CYBMUJFWSA-N 269.366 2.221 10 20 CECD Cc1cc(C(=O)N(C)c2cn[nH]c2)c(C)n1-c1ccccn1 748392794 ASJZWKKOBJGGHB-UHFFFAOYSA-N 295.346 2.489 10 20 CECD C[C@@H]1C[C@H](CN(C)c2ccc3c(c2)OCO3)CCN1 841012034 WTDOSXYOOSPKES-VXGBXAGGSA-N 262.353 2.240 10 20 CECD CCc1cccc(CN2CCC[C@@H](CC(N)=O)C2)c1O 848889027 GAWKMVMEQVPWLD-LBPRGKRZSA-N 276.380 2.042 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1C[C@@H]2C=C[C@H]1CC2 910944199 UFVNNTAHWAJMEL-UHIISALHSA-N 273.332 2.316 10 20 CECD C[C@H](N[C@@H](C)[C@@H](O)C(F)(F)F)c1ccccc1O 866466074 YUYLSYJPFRCTQO-DKCNOQQISA-N 263.259 2.355 10 20 CECD CC1(CCNC(=O)NCCc2ccc(N)cc2)CC1 841891425 PMBXOQNITFBHDN-UHFFFAOYSA-N 261.369 2.301 10 20 CECD Cc1cc(N(C)C)ccc1CNCC(C)(C)N(C)C 840928202 MNEZLKPKDLONNH-UHFFFAOYSA-N 263.429 2.491 10 20 CECD COC(=O)/C=C(/C)CN(C)c1ccc(OC)c(F)c1 929827020 QELBAXURNQLTJU-YFHOEESVSA-N 267.300 2.390 10 20 CECD C[C@@H](C[C@@H]1CCOC1)NC(=O)NCc1ccccc1O 759768566 RTWGCCJRUTUXMV-RYUDHWBXSA-N 278.352 2.007 10 20 CECD C[C@@H]1C[C@H](NC[C@@H]2COCCO2)c2c(O)ccc(F)c21 756433588 DLZMJWYGTUMHDW-FOGDFJRCSA-N 281.327 2.085 10 20 CECD CCn1cc(CN(C)c2ccc(OCC(=O)O)cc2)cn1 851705861 WLKGYLBWXFWWAW-UHFFFAOYSA-N 289.335 2.003 10 20 CECD CC(C)NC(=O)CCNCc1cc(F)c(N(C)C)cc1F 858093625 FQEQUBBUNMTTAN-UHFFFAOYSA-N 299.365 2.035 10 20 CECD COc1ccc(N(C)Cc2cncn2C)cc1OC 751468126 CYRCMDJJMAMRJV-UHFFFAOYSA-N 261.325 2.074 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C)sn2)c1 768083721 YXGQKHVULOMDTE-UHFFFAOYSA-N 278.333 2.096 10 20 CECD Cc1ccc(O)c(CNc2c(C)c(C)nc3ncnn23)c1 1118864131 KURNAUPGKBQHDT-UHFFFAOYSA-N 283.335 2.367 10 20 CECD Cc1ccc(CN(C)[C@H](C)C(=O)NC(C)(C)C)c(O)c1 877424823 QCYNXICKHGBKIN-GFCCVEGCSA-N 278.396 2.436 10 20 CECD CN(CCOC(C)(C)C)C(=O)/C=C\c1ccc(O)c(O)c1 779533859 CGBWMOMMQTUYBS-VURMDHGXSA-N 293.363 2.385 10 20 CECD Cc1ccc(CN2CCO[C@H](C(F)(F)F)C2)c(O)c1 876756222 RANSMCSIDHOAMJ-LBPRGKRZSA-N 275.270 2.464 10 20 CECD Cc1ccc(CN2CCOC[C@@H]2[C@H]2CCCO2)c(O)c1 877516144 BPNDSLXQLVCEHR-GDBMZVCRSA-N 277.364 2.080 10 20 CECD O=C1CN(C2CC2)C(=O)N1CCCSc1nccs1 777649942 IHXVKYUAPIAIIS-UHFFFAOYSA-N 297.405 2.052 10 20 CECD CC[C@@]1(C)CN(Cc2ccc(OC)c(OC)c2O)CCO1 893908254 UTQCXDRCISUILM-INIZCTEOSA-N 295.379 2.410 10 20 CECD CC[C@H](CN1CCCC1)NC(=O)c1ccc(C)c(O)c1O 780944332 LZRXTXTZZBDZPA-GFCCVEGCSA-N 292.379 2.010 10 20 CECD COc1ccc(CNCc2cccc3nccn23)c(O)c1 793387161 AELHHFBTKNKHGL-UHFFFAOYSA-N 283.331 2.338 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC(F)(F)CN 1325724355 WJEKBONAQNDKPE-NXEZZACHSA-N 270.323 2.433 10 20 CECD CN(C)CC(C)(C)NCc1cc(F)cc(F)c1O 708444643 SVWCNXRQYOEAJY-UHFFFAOYSA-N 258.312 2.100 10 20 CECD COc1cc(Cl)cc(CN[C@@H](CO)CC(F)F)c1O 717830158 MTQHXHJIRZMQCU-SECBINFHSA-N 295.713 2.160 10 20 CECD O=C(O)[C@@H]1C=C[C@H](NCc2ccc3c(c2)CCCO3)C1 1336928123 KNBNNUVGOQZGOB-KGLIPLIRSA-N 273.332 2.131 10 20 CECD CCCN(CC)C[C@H](C)NC(=O)NCc1ccc(N)cc1 1262582508 XHTJZHUDZMHEDX-ZDUSSCGKSA-N 292.427 2.188 10 20 CECD CC[C@@H](NCc1c(O)cccc1Br)C(=O)O 1348502007 HPJCTAPIXOCEIX-SECBINFHSA-N 288.141 2.108 10 20 CECD COC[C@H](C)CC(=O)Nc1c(Cl)ccc2nonc12 1342953218 VHYJDPLZYBEDCD-SSDOTTSWSA-N 283.715 2.487 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1CCC[C@H](F)C1 1352669622 JXXLXMMOHXLDSF-ONGXEEELSA-N 267.300 2.242 10 20 CECD CCN(CC)c1ccc(CNc2nncn2C)cc1 162119273 JJPDXZIDEWPHKC-UHFFFAOYSA-N 259.357 2.273 10 20 CECD C[C@H]1CCC[C@H](OCC(=O)NCc2cccc(O)c2O)C1 1521851623 NTDONHXUNSYHEC-AAEUAGOBSA-N 293.363 2.309 10 20 CECD O=C(O)c1cc(CNCc2cc(Cl)ccc2O)on1 1602260050 LTWHFIVRNBLQHR-UHFFFAOYSA-N 282.683 2.022 10 20 CECD COC(=O)c1ccc(CNCc2ccc(N)cc2)c(F)c1 1578868189 VUPIKLSNKQYKOO-UHFFFAOYSA-N 288.322 2.484 10 20 CECD C[C@H](C(=O)O)N(C)Cc1ccc(N2CCCC2)cc1 1599886854 YNFKZIJKVJGQRN-GFCCVEGCSA-N 262.353 2.192 10 20 CECD CC(C)c1ccc(O)c(CN[C@H](C(=O)O)C2CC2)c1 1591973585 BTCSZVVGVFPFHI-AWEZNQCLSA-N 263.337 2.468 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1cccnn1 151920794 CRJVNFPYAKQBSY-UHFFFAOYSA-N 298.346 2.383 10 20 CECD CCOc1ccc(O)c(CN2CCC(C(=O)OC)CC2)c1 159229700 MNMVDRYAGOMBIF-UHFFFAOYSA-N 293.363 2.176 10 20 CECD Cc1cccc(CNCc2cccc(CO)c2)c1O 224794201 SSEMGJXMPAIZRL-UHFFFAOYSA-N 257.333 2.483 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCc1nncn1C 38007587 DNHNQDOVQBAUDG-GHMZBOCLSA-N 272.352 2.167 10 20 CECD Cn1cnc(CNCc2c(O)cccc2Cl)c1 898045679 RWGGYQSLXSPSOI-UHFFFAOYSA-N 251.717 2.069 10 20 CECD CN(Cc1ccccc1O)C[C@@H](O)c1ccc(C#N)cc1 305084438 SMTMGZFLEWPOAT-QGZVFWFLSA-N 282.343 2.429 10 20 CECD Cc1ccnc(NCCc2ccc(O)c(O)c2)c1[N+](=O)[O-] 301585636 OUROLCKECOUUTL-UHFFFAOYSA-N 289.291 2.364 10 20 CECD CC(=O)N1CCN(Cc2cc(C)ccc2O)C(C)(C)C1 184725755 MRMCVEQKZUXHAD-UHFFFAOYSA-N 276.380 2.143 10 20 CECD CCCN(Cc1noc(COC)n1)Cc1ccccc1O 182521419 ABWQBHVNGFLHAS-UHFFFAOYSA-N 291.351 2.334 10 20 CECD CC(=O)Nc1cccc(NC(=O)c2cccc(O)c2O)c1 126215825 TZPFKILHFQVFMJ-UHFFFAOYSA-N 286.287 2.309 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCC(C)(C)OC)c1 75313070 BUYOOILHKPAVCT-JTQLQIEISA-N 296.367 2.186 10 20 CECD CC(=O)N[C@H]1CCCN(c2ccc(OC(F)F)cc2)C1 81203234 OJSPQDRNQDFZHT-NSHDSACASA-N 284.306 2.393 10 20 CECD COC[C@@H]1CN(Cc2cc(C)cc(C)c2O)C[C@@H](C)O1 190214130 PNOUJDFXCMUURG-HIFRSBDPSA-N 279.380 2.245 10 20 CECD CN(Cc1ccccc1O)C(=O)NCc1ccccn1 42880333 KBVUBOVWGIIZLL-UHFFFAOYSA-N 271.320 2.129 10 20 CECD CN(C)c1ccc(CNC(=O)/C=C/C2CCOCC2)cc1 89326550 HLBQMDMYICAZJO-VMPITWQZSA-N 288.391 2.352 10 20 CECD CCO[C@@H]1C[C@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 236882994 JSAZKYOTQKZORY-LSDHHAIUSA-N 290.407 2.473 10 20 CECD Cc1[nH]ccc1C(=O)NCc1ccc(N2CCOCC2)cc1 267363752 OJSNTBCQWURLNB-UHFFFAOYSA-N 299.374 2.090 10 20 CECD C/C=C/C[C@@H](CO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 274598165 GYFXVDHRRRDGQZ-YHROSDCASA-N 280.324 2.278 10 20 CECD COC[C@H](CN[C@H](C)c1ccc(C)c(C)c1O)OC 273392635 DVWMDEMKMATAON-OLZOCXBDSA-N 267.369 2.321 10 20 CECD CCN(C[C@@H]1CCCS(=O)(=O)C1)c1ccc(OC)cc1 284264219 XDGBUZJPLCMFOT-ZDUSSCGKSA-N 297.420 2.346 10 20 CECD COc1ccc(O)c(CN(C)CCCN2CCCC2)c1 281311236 QOHMOZSIJVXVDZ-UHFFFAOYSA-N 278.396 2.319 10 20 CECD C[C@@]1(NCc2cc(Cl)cc(Cl)c2O)CCOC1=O 289421848 BMWCNLMOCDMRJZ-GFCCVEGCSA-N 290.146 2.494 10 20 CECD C[C@@H]1CN(C2CC2)C[C@H]1N[C@H]1CCc2cccc(O)c21 297820716 RJVSAKZQPUDJRQ-BYCMXARLSA-N 272.392 2.452 10 20 CECD CN(C)c1ccc(CNc2cnccc2-n2ccnn2)cc1 808425549 YKAKLTBIJXYLES-UHFFFAOYSA-N 294.362 2.340 10 20 CECD COC(=O)[C@H]1CCCN1Cc1ccc(N(C)C)c(C)c1 292962351 CVJPOFVZCAAKOC-OAHLLOKOSA-N 276.380 2.198 10 20 CECD CC[C@@H](NCc1cc(OC)c(OC)cc1O)C(C)(C)O 293731411 UWGRYJPWUFKTQL-CQSZACIVSA-N 283.368 2.049 10 20 CECD Cc1ccc(O)c(CN2CCC(OC(=O)N(C)C)CC2)c1 816655226 WYQFQRHINBCUHA-UHFFFAOYSA-N 292.379 2.363 10 20 CECD Cc1cc(CN2CCN(C)[C@@H](C)C2)ccc1N(C)C 815078901 JJVDFAWYTNUKPS-AWEZNQCLSA-N 261.413 2.197 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@H]2COCCO2)cc1 827336118 AIHMRCBCNLCMRU-KRWDZBQOSA-N 292.423 2.380 10 20 CECD C[C@@H](NC(=O)c1cnn(CC2CC2)c1)c1ccccc1O 827915920 DTFYABNRSSLSHV-LLVKDONJSA-N 285.347 2.490 10 20 CECD CC[C@@H](NCCCON)c1cc(Cl)ccc1O 902426127 RDECFABIKKPIMB-LLVKDONJSA-N 258.749 2.367 10 20 CECD CCC[C@@H](C)NC(=O)[C@H](C)OC(=O)c1cc(O)cs1 732352690 CDVIXKYXDPQIRC-BDAKNGLRSA-N 285.365 2.304 10 20 CECD CN(C)[C@H](CNC(=O)c1cc(O)cs1)c1ccccc1 731863870 IEFBCYXNVPCZKF-CYBMUJFWSA-N 290.388 2.486 10 20 CECD CC(C)[C@@H]1C[C@@H](C(=O)NCCc2ccc(N)cc2)CCO1 911783032 OQXVKJHMGUUCLW-HOCLYGCPSA-N 290.407 2.379 10 20 CECD CC[C@H](O)[C@H](C)C(=O)NCc1cc(Cl)ccc1O 911898957 SXRKWLLUPOJNEZ-KWQFWETISA-N 271.744 2.069 10 20 CECD CC[C@H]1CO[C@H](CC)CN1C(=O)c1cc(O)cs1 846660664 YXSHUOXJOUGFDV-GXSJLCMTSA-N 269.366 2.483 10 20 CECD COC[C@H](N[C@@H](C)c1cccc(OC)c1O)[C@H]1CCCO1 846167582 LAMLJILOGNGODE-FPMFFAJLSA-N 295.379 2.245 10 20 CECD C[C@H]1C[C@@H](NCc2cccc(Br)c2O)CCN1 841061544 JYCXQJKCLMUKCL-ONGXEEELSA-N 299.212 2.385 10 20 CECD CCN(CC)c1ccc(CNC[C@H](C)C(=O)O)cc1F 841802161 FZFSWERKEMNZGJ-NSHDSACASA-N 282.359 2.482 10 20 CECD CCOc1cccc(CN(C)Cc2nc(C)no2)c1O 848927422 FJYVXVFGIAJREB-UHFFFAOYSA-N 277.324 2.114 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@H]1CCCN1 841037045 YDTNLXMWKLAIKK-MRVPVSSYSA-N 258.724 2.026 10 20 CECD CC(C)C(=O)NCCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756371659 MIGASMHWYMTHJX-ZYHUDNBSSA-N 294.370 2.441 10 20 CECD C[C@@H](CNC(=O)c1cc(O)cs1)c1nccs1 758735158 JTAVCLGDRSQMFS-ZETCQYMHSA-N 268.363 2.444 10 20 CECD Cc1cccc(O)c1CN1CCCC[C@@H]1CS(C)(=O)=O 877568391 MUCWBEVKKCXOAR-CYBMUJFWSA-N 297.420 2.100 10 20 CECD C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)N(C)C(C)(C)C1=O 761579880 PUOSSCPQODDUPZ-NSHDSACASA-N 289.379 2.486 10 20 CECD COCCN(C)Cc1cc(F)c(N(C)C)cc1F 862215920 FHJWWYMQQGWDPT-UHFFFAOYSA-N 258.312 2.109 10 20 CECD C[C@@H](NCc1nc(C2CC2)n[nH]1)c1c(O)cccc1F 886617042 BZLBGTYVDBUISX-MRVPVSSYSA-N 276.315 2.378 10 20 CECD CC1(C)[C@H](O)C[C@H]1NCc1cc(Cl)cc(F)c1O 779190733 GVRYDSKRUQBOKO-GHMZBOCLSA-N 273.735 2.434 10 20 CECD C[C@H](NC(=O)c1ccon1)c1ccc(N(C)C)cc1 773024049 ZOZNYZZQEUORNN-JTQLQIEISA-N 259.309 2.232 10 20 CECD COCCOCCCN[C@H](C)c1c(O)cccc1F 886493628 UDGOYTMCFQWUSS-LLVKDONJSA-N 271.332 2.235 10 20 CECD CCc1cc(C(=O)NCc2ccc(N(C)C)cc2)no1 887767449 LCBNMDCWUMGIKX-UHFFFAOYSA-N 273.336 2.233 10 20 CECD Cc1ccc(C(=O)N[C@@H](CO)C2CCCCC2)c(O)c1O 781012330 DMOUICNTZUFVCQ-ZDUSSCGKSA-N 293.363 2.077 10 20 CECD O=C(NC[C@@H]1CC1(Cl)Cl)c1cccc(O)c1O 790528481 QHTLGLCRCIVNGD-LURJTMIESA-N 276.119 2.021 10 20 CECD CC(C)CNC(=O)CNCc1ccc2ccccc2c1O 1324337930 WYKQTSVRSGEGLA-UHFFFAOYSA-N 286.375 2.407 10 20 CECD CCc1cccc(CNCC2([S@](C)=O)CCC2)c1O 691465402 LEDRKEHLXBZDGW-IBGZPJMESA-N 281.421 2.345 10 20 CECD CCN1CCN(Cc2ccc(Br)cc2O)CC1 691685649 YAVGNXKPKSLOBJ-UHFFFAOYSA-N 299.212 2.292 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)C2CCCCC2)c1 1351396769 XHNXZBVKPWMGRD-UHFFFAOYSA-N 283.393 2.453 10 20 CECD Nc1ccc(CN2CCNC(=O)[C@H]2c2cccs2)cc1 1356082736 DSYMNHACEQGUTJ-CQSZACIVSA-N 287.388 2.003 10 20 CECD O=C(O)CC1(NCc2cccc(F)c2O)CCC1 1601935775 CVMFFNXZFYFLIO-UHFFFAOYSA-N 253.273 2.018 10 20 CECD CCCN(CC)CCN[C@H](C)c1cc(C(=O)O)ccc1O 1605312527 KMJSZPGYXMWWMD-GFCCVEGCSA-N 294.395 2.473 10 20 CECD O=C(O)c1cnc(SC[C@H](O)CC(F)(F)F)s1 1602537381 QRULMKMEYATRER-SCSAIBSYSA-N 287.284 2.247 10 20 CECD Cc1cccc(CN(C[C@@H](C)C(=O)O)C2CC2)c1O 1600531285 KSLHBYADHQRWDI-LLVKDONJSA-N 263.337 2.386 10 20 CECD C[C@@H](CN[C@@H](C)c1ccc(N(C)C)cc1)C(=O)O 1589067281 GXCRBNCGCYKYPS-QWRGUYRKSA-N 250.342 2.124 10 20 CECD CCN(CCO)Cc1ccc(N(CC)CC)c(F)c1 158658764 YSMAJGOOWCSWGX-UHFFFAOYSA-N 268.376 2.486 10 20 CECD CCO[C@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)C12CCC2 160990401 KUAWBPOWLANSNN-GJZGRUSLSA-N 288.391 2.275 10 20 CECD CC[C@H](O)CCN[C@@H](C)c1cc(OC)ccc1O 168825777 CGESFSRWTWESEG-QWRGUYRKSA-N 253.342 2.212 10 20 CECD COc1ccc(O)c([C@H](C)NCCCN(C)C)c1 19958836 FLSQYUPENBGYDE-NSHDSACASA-N 252.358 2.003 10 20 CECD COc1ccc(N(C)Cc2ccc(OC)nn2)cc1 844357095 ZJDOEUXCODZJTA-UHFFFAOYSA-N 259.309 2.130 10 20 CECD CC1(C)C[C@H](CNC(=O)c2cccc(O)c2O)CCO1 837221082 ODQDYZBSNVVLBY-SNVBAGLBSA-N 279.336 2.033 10 20 CECD Cc1ccc(NCc2cc3c(cc2O)OCO3)cn1 128082322 BLIKKAOHLIGANF-UHFFFAOYSA-N 258.277 2.436 10 20 CECD Oc1cc2c(cc1CNCCC[C@@H]1CCOC1)OCO2 402102502 QUGDXPFVNBFKMI-LLVKDONJSA-N 279.336 2.027 10 20 CECD Cc1c(NCc2ccc(N3CCCC3)cc2)nnn1C 701798507 UAYVBWUJCGGLBY-UHFFFAOYSA-N 271.368 2.336 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)CC[C@@H]1C(=O)O 383287090 UIARZGKNIBWYNO-WFASDCNBSA-N 276.380 2.295 10 20 CECD COc1cccc(CNC(=O)c2ccnc(Cl)c2)c1O 68489208 GMYPPQPPNIKPPD-UHFFFAOYSA-N 292.722 2.379 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@H]2CC=CC[C@H]2C1 311687891 JVSYYSHDFZEKEQ-PHIMTYICSA-N 259.305 2.136 10 20 CECD OCCO[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 179574598 HMYNIBDSSFRULX-ZDUSSCGKSA-N 285.771 2.019 10 20 CECD COc1cc(Cl)cc(CNCCCCCO)c1O 76274282 BHWPXKHURPAZGM-UHFFFAOYSA-N 273.760 2.306 10 20 CECD CC[C@H](C)CC(=O)NCc1cc(OC)ccc1O 189554314 WAZFNTJXUNNACB-JTQLQIEISA-N 251.326 2.453 10 20 CECD CN(C[C@H](O)Cc1ccccc1)c1ccc2c(c1)OCO2 121247217 PGQMJNZXXQTTIZ-OAHLLOKOSA-N 285.343 2.455 10 20 CECD Oc1cc2c(cc1CN1CCC3(CCC3)C1)OCO2 121967525 BJVVWEVZWTWBCM-UHFFFAOYSA-N 261.321 2.497 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2cc(C)ccc2O)C1 185787737 OUNCJKXXZXSYOU-OLZOCXBDSA-N 276.380 2.362 10 20 CECD CCOC(=O)C[C@H]1CCCN1Cc1cc(OC)ccc1O 123308157 UAHMGSTYWQJJJD-CYBMUJFWSA-N 293.363 2.318 10 20 CECD C[C@H](N[C@H](C)CO[C@H]1CCOC1)c1cc(F)ccc1O 185674165 YSKWLTZHDGPNJF-MDZLAQPJSA-N 283.343 2.376 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2CCCS(=O)(=O)C2)c(O)c1 287128172 RNOVYVBSQJIANP-QWHCGFSZSA-N 297.420 2.176 10 20 CECD Cc1cc(O)c(CNc2nnc(-c3nccn3C)o2)cc1C 191134515 MQGVJHPYPJEJDE-UHFFFAOYSA-N 299.334 2.405 10 20 CECD CCCN(CC(=O)O)Cc1ccc(N(C)C)cc1 83662972 OEOXBLYCFQDDTH-UHFFFAOYSA-N 250.342 2.049 10 20 CECD CCOc1cccc(CN2CCO[C@H](C)C2)c1O 131955154 XGQVMKXCQURNQU-LLVKDONJSA-N 251.326 2.012 10 20 CECD C[C@H](N[C@H]1C[C@@H](O)C1(C)C)c1ccc(F)cc1O 228848290 FZTFEFUXECSAGL-AQUOVQTQSA-N 253.317 2.341 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H](N)c2ccccc2)cc1 237082909 MLVBSJCFGWPAEK-KRWDZBQOSA-N 297.402 2.459 10 20 CECD CC[C@@H](C(=O)NCc1ccccc1O)N(CC)CC 269157869 SSTQFDNNYSMMHV-ZDUSSCGKSA-N 264.369 2.129 10 20 CECD CS[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H]1N(C)C 278845751 LLZZHWHZXDTINE-HZPDHXFCSA-N 293.480 2.230 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@@]12CCOC2 368096221 CWXZHOOIXKDDNL-DOTOQJQBSA-N 288.391 2.138 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](O)CCSC 270834546 UKFVKPMNNOLONE-CQSZACIVSA-N 297.420 2.245 10 20 CECD Cc1nn(C)cc1[C@H]1CCCN1C(=O)Cc1ccc(N)cc1 373041301 ZPDWYNFTWGQNHU-MRXNPFEDSA-N 298.390 2.217 10 20 CECD COCCc1nc(CSc2nccs2)no1 289406087 UBDYLIRGKBXHGS-UHFFFAOYSA-N 257.340 2.007 10 20 CECD C[C@@H]1OCC[C@]12CN(Cc1cc(F)ccc1O)C[C@@H](C)O2 280358013 CJWQGBYLMDNNLE-WQGACYEGSA-N 295.354 2.300 10 20 CECD Cc1onc(-c2cccnc2)c1C(=O)N(C)c1cnn(C)c1 375851480 LQNUJDOHBBDULV-UHFFFAOYSA-N 297.318 2.055 10 20 CECD COCCn1cc(CN[C@@H](C)c2cc(C)ccc2O)cn1 282433438 DJUWIRRRZNOLBA-ZDUSSCGKSA-N 289.379 2.394 10 20 CECD CCOC1CC(N(C)C(=O)c2cc(O)cs2)C1 807820025 KDFITDOVANBHEX-UHFFFAOYSA-N 255.339 2.093 10 20 CECD C[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)c1cccnc1 817941824 LBOKTBOSLFEVOX-GUYCJALGSA-N 284.407 2.498 10 20 CECD O=[N+]([O-])c1cnc(Sc2nc3c([nH]2)CCC3)s1 813637772 VEBDWGFGJHFASO-UHFFFAOYSA-N 268.323 2.414 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CCS[C@@H]2C)c(O)c1 827649547 JJBSSMHJZYSWHG-BXKDBHETSA-N 296.392 2.094 10 20 CECD CCN1C[C@@H](NCc2cc(Cl)c(C)cc2O)CC1=O 826064439 KEADXWUGBGTTBJ-NSHDSACASA-N 282.771 2.064 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H](C)S(C)(=O)=O 827938791 SGAURFSWYZLYDZ-GFCCVEGCSA-N 285.409 2.037 10 20 CECD C[C@@H]1C[C@H]1[C@@H]1C[C@H]1NC(=O)c1c(F)ccc(O)c1O 900477962 NTMQDKKIIDCUCP-BDNRQGISSA-N 265.284 2.011 10 20 CECD CC[C@](C)(CNC(=O)NCc1ccc(OC)cc1O)OC 836579478 OEWAGVGHJIGTGJ-OAHLLOKOSA-N 296.367 2.015 10 20 CECD C/C=C\C[C@H](CO)NCc1cc(Cl)ccc1O 588489610 ZUKUVFAVKYBUTE-ZZKXABKFSA-N 255.745 2.462 10 20 CECD CCc1nocc1/C=C1/SC(=S)N(CC)C1=O 834398977 WDEAFXUZBKFNIG-WEVVVXLNSA-N 268.363 2.458 10 20 CECD O=C(NCc1ccccc1O)c1c[nH]c2ncccc12 741280098 WDQYYYOZYCUDTB-UHFFFAOYSA-N 267.288 2.199 10 20 CECD Nc1ccc(Cc2noc([C@@H]3CCSC3)n2)cc1 843158250 AOIUDGUEMDIKBK-SNVBAGLBSA-N 261.350 2.463 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 843056809 AICTXFDFMZVADI-IUCAKERBSA-N 272.751 2.354 10 20 CECD C[C@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(Cl)cc1O 841752539 UFNJJZXDNOUCPB-BDAKNGLRSA-N 291.800 2.129 10 20 CECD CC(C)[C@H]1CCN1C(=O)NCCc1ccc(N)cc1 841960330 NFNPPEZRFWYBIB-CQSZACIVSA-N 261.369 2.251 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C(=O)O)[C@@H]2C)cc1 846283370 DRQBKNOSBVVEDA-SWLSCSKDSA-N 276.380 2.438 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)CC[C@H](C)O 840917770 MMMQWYUDCYTKEY-ZDUSSCGKSA-N 250.386 2.264 10 20 CECD COc1ccc(CN(C)C(=O)c2cc(O)cs2)cn1 749292642 UZFRFXAYPOYMHS-UHFFFAOYSA-N 278.333 2.130 10 20 CECD C[C@@H]1C[C@H]1[C@@H]1C[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 928038875 MGLBDBKDUDEMTR-JDBRIQDBSA-N 273.332 2.272 10 20 CECD COC[C@H](CCO)N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756595697 YCRGDGJLMNGJND-SCVCMEIPSA-N 283.343 2.067 10 20 CECD Cc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)ncn1 759617279 CNAVAQSFSJCBJD-UHFFFAOYSA-N 297.358 2.299 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@H]2CCOC[C@@H]2C)c1 858451117 NSBNNSYVIMQAEB-QWHCGFSZSA-N 292.379 2.172 10 20 CECD C[C@@H](N[C@@H]1COC[C@@H]1O)c1ccc(N2CCCCC2)cc1 866418962 ZWULAFDTGHWKSX-XYPHTWIQSA-N 290.407 2.087 10 20 CECD COC(=O)c1ccc(CNCc2cc(C)ccc2O)[nH]1 862476341 QEFOVOCALKHYLJ-UHFFFAOYSA-N 274.320 2.105 10 20 CECD Cc1ncc(/C=C/C(=O)NCc2ccccc2O)s1 769360968 MFWHHTKVYRXXOE-VOTSOKGWSA-N 274.345 2.487 10 20 CECD CN(Cc1cnccn1)Cc1cc(F)c(N(C)C)cc1F 862234870 DOYHZXCRYUMBCM-UHFFFAOYSA-N 292.333 2.453 10 20 CECD CC(C)CC[C@H](N)C(=O)N[C@H](C)c1ccccc1O 877256234 PYLOIQRDNCWWEL-YPMHNXCESA-N 264.369 2.333 10 20 CECD O=C(N[C@H]1Cc2cccc(O)c2C1)c1cc(O)cs1 760919449 DHWBMCZLLKNOHA-VIFPVBQESA-N 275.329 2.057 10 20 CECD C/C=C\C[C@H](CO)NCc1ccc(N(C)C)c(F)c1 769935724 PZVCAEINNFBMQK-DSYXLKISSA-N 266.360 2.308 10 20 CECD CN(CCOC(C)(C)C)C(=O)c1cc(O)cs1 768354540 YGLROETYABDWKL-UHFFFAOYSA-N 257.355 2.341 10 20 CECD CC(=O)N1CCC[C@H](CNCc2c(C)cccc2O)C1 877491484 ULVAICKSQPQEBW-CQSZACIVSA-N 276.380 2.049 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)COC1(C)CCC1 773745566 LRKSLVXYGRCKNM-LLVKDONJSA-N 293.363 2.104 10 20 CECD COC(=O)[C@@H](N[C@H](C)c1ccccc1O)C1(OC)CCC1 879648894 FIWVYGCQMBQNSX-BXUZGUMPSA-N 293.363 2.154 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1[C@H]2CCCO[C@H]21 779952462 YJRKWULZVOKRHM-BZUAXINKSA-N 288.391 2.102 10 20 CECD COc1ccc(O)c(CN[C@H]2CC[C@H](CO)CC2)c1 271798521 IMKREGTXEMXGPB-AULYBMBSSA-N 265.353 2.042 10 20 CECD Cc1cc(=NCc2ccc(N3CCN(C)CC3)cc2)cc[nH]1 882880555 YESFMJQCFJIGTG-UHFFFAOYSA-N 296.418 2.176 10 20 CECD COc1ccc(CN[C@H]2CSC[C@H]2C)c(O)c1OC 894411923 BTTSEUYOFIBFJL-KOLCDFICSA-N 283.393 2.251 10 20 CECD CC(=O)N1CCN(Cc2cc(F)cc(F)c2O)C(C)(C)C1 894424720 LRSCOSNRXSJRIG-UHFFFAOYSA-N 298.333 2.113 10 20 CECD COc1ccc(CNC(=O)c2n[nH]c3ccccc23)c(O)c1 794382434 WUBNQBFKFVEVGS-UHFFFAOYSA-N 297.314 2.207 10 20 CECD C[C@H]1CN(C)CC[C@H]1N(C)Cc1cc(F)cc(F)c1O 894783209 QTWZINOWQXANEW-IINYFYTJSA-N 284.350 2.442 10 20 CECD O=C(NCc1ccccc1O)c1cc2nccnc2cc1F 792239917 NOPZENCQTXFMCC-UHFFFAOYSA-N 297.289 2.405 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc(CO)c1 798298751 WNEJMHASUKVLRA-UHFFFAOYSA-N 271.316 2.157 10 20 CECD C[C@](O)(CNCc1ccc(N2CCCC2)cc1)C(F)F 704947151 OWQNDJXHQOZNCJ-HNNXBMFYSA-N 284.350 2.393 10 20 CECD CN1CCCC[C@@H](CNCc2cc(F)cc(F)c2O)C1 708555270 NKUWDLJEXUMMNO-NSHDSACASA-N 284.350 2.492 10 20 CECD C[C@H](N[C@H](C)CN1CCCC1=O)c1ccc(F)cc1O 62747749 UTXBIPZCMVBGJW-MNOVXSKESA-N 280.343 2.193 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cc(C)n(C)n2)c1 775370428 NDMUZGDSVYZPFX-LLVKDONJSA-N 275.352 2.294 10 20 CECD CN(CCN1CCCC1)Cc1ccc(N(C)C)cc1 780896388 MTQAMFKBRSSKTO-UHFFFAOYSA-N 261.413 2.280 10 20 CECD CC(C)CNC(=O)CNCc1cc(Cl)c(F)cc1O 1347702665 VIOVYKSEBJQMAX-UHFFFAOYSA-N 288.750 2.047 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1C[C@@H]1F 1346494403 GBCHHECGLOCZOL-SFYZADRCSA-N 260.359 2.100 10 20 CECD C[C@@H](NCCCCC(=O)O)c1c(O)cccc1F 1603248840 WOENOQVCXNHZNI-SECBINFHSA-N 255.289 2.437 10 20 CECD CCN(C)c1ccc(CN[C@H]2CCC[C@H]2C(=O)O)cc1 1609991109 JTBDWYDGBPPSGM-CABCVRRESA-N 276.380 2.486 10 20 CECD CC[C@H](C)[C@H](N)C(=O)NCc1cccc(Cl)c1O 1578229431 CUJLGILKSWKFTC-KWQFWETISA-N 270.760 2.035 10 20 CECD CN[C@@H]1CCN(Cc2cc(OC)cc(C(C)(C)C)c2O)C1 1578609170 PGMBPBGFAWQVFN-CYBMUJFWSA-N 292.423 2.492 10 20 CECD CC(C)[C@H](Sc1ncc(C(=O)O)s1)C(=O)N(C)C 1591052294 PBTMNQQWJQPQKT-QMMMGPOBSA-N 288.394 2.046 10 20 CECD C[C@H](Nc1ccc(-c2nn[nH]n2)cn1)c1ccccc1O 1591771065 UEBIZKYUDOKPPL-VIFPVBQESA-N 282.307 2.140 10 20 CECD COc1ccc(O)c(CNCc2cc(C(=O)O)c(C)[nH]2)c1 1599597947 BPUNMXKLIQJCEV-UHFFFAOYSA-N 290.319 2.025 10 20 CECD CCN(CC)c1ccc(CNCCOCCC(=O)O)cc1 1776861087 RTLUCYSVMKIQKC-UHFFFAOYSA-N 294.395 2.114 10 20 CECD COc1ccc(O)c(CNc2cc(C(=O)O)ccn2)c1 1777367676 HQFXLCIGOGLSHD-UHFFFAOYSA-N 274.276 2.106 10 20 CECD CC[C@@H](CCC(=O)O)NCc1ccc2c(c1)CCO2 1776710361 CITZFUKAVVOUEV-ZDUSSCGKSA-N 263.337 2.355 10 20 CECD C[C@H](Sc1ncc(C(C)(C)C)s1)C(=O)NC(N)=O 164220027 YPJNFYICUKRBFQ-LURJTMIESA-N 287.410 2.116 10 20 CECD c1csc(SCCCNCc2cnc[nH]2)n1 165150319 FHXQGZOTUIJQAA-UHFFFAOYSA-N 254.384 2.138 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCS[C@@H]1C 842779915 SUPGQCLCSWXSHT-MWLCHTKSSA-N 253.367 2.384 10 20 CECD C[C@H]1CCN(CCN[C@@H]2CCc3cccc(O)c32)C1 834611530 MJHJMRIJJLRFKQ-GXTWGEPZSA-N 260.381 2.311 10 20 CECD CCOc1cccc(CN2CC[C@H](C)[C@@H](CN)C2)c1O 229060596 ITNQKEFDCZLQGI-JSGCOSHPSA-N 278.396 2.208 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@](C)(O)C2)c1O 124254472 VUGQKRYIXDUYPM-OAHLLOKOSA-N 281.327 2.081 10 20 CECD COc1cccc(CN[C@@H](C)CC(C)(C)O)c1O 295121304 WORQCSYONQONII-JTQLQIEISA-N 253.342 2.040 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCC(F)F)c1 174393138 JABOJPXGEUDHAN-SSDOTTSWSA-N 274.267 2.026 10 20 CECD Cc1cc(O)c(CNC(C)(C)CCS(C)(=O)=O)cc1C 174640128 KFRGHIYFWAFLLY-UHFFFAOYSA-N 299.436 2.312 10 20 CECD CC(C)NC(=O)[C@@H](C)NCc1cc(Cl)ccc1O 228931449 LCFQJINNMZVEJG-SECBINFHSA-N 270.760 2.048 10 20 CECD C[C@H](N[C@H](C)CO[C@@H]1CCOC1)c1ccccc1O 183549417 BVFLYUICUUKWGM-FRRDWIJNSA-N 265.353 2.237 10 20 CECD CC(C)c1cc(CNC(=O)Cc2ccc(N)cc2)on1 158735579 UKBPQVWSYJNBBY-UHFFFAOYSA-N 273.336 2.239 10 20 CECD O=C(O)C1(NCc2ccc3c(c2)CCO3)CCCC1 284388008 YRTLZAIZEDXGTI-UHFFFAOYSA-N 261.321 2.109 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1C[C@@H]2CNC[C@H]2C1 90319941 RAYOQHZRORSVCL-UWVGGRQHSA-N 287.190 2.350 10 20 CECD CCC[C@](C)(O)CNCc1cc(OCC)ccc1O 264863388 PMZQVTJUUPLQBC-HNNXBMFYSA-N 267.369 2.432 10 20 CECD CCN(CCC1OCCO1)c1ccc(OC)cc1 274422636 FFLQVXPCYDCVHM-UHFFFAOYSA-N 251.326 2.285 10 20 CECD COc1ccc(CNC[C@@H]2CCCN(C(C)=O)C2)cc1C 279656093 FTVNJGAYZWROBT-INIZCTEOSA-N 290.407 2.352 10 20 CECD CC[C@H](NCC[C@@H](O)COC)c1cccc(Cl)c1O 287728630 PATZKGNLEADJAE-MFKMUULPSA-N 287.787 2.484 10 20 CECD Cc1ccc(O)c(CN[C@@H]2COc3ccccc3[C@H]2O)c1 288507092 ILPRUTUVFDXGPK-RHSMWYFYSA-N 285.343 2.285 10 20 CECD CCOc1ccc(O)c(CN2CC[C@]3(CCN(C)C3)C2)c1 292802294 NSKDGNRXRTZUKA-KRWDZBQOSA-N 290.407 2.319 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCCCCF 803401138 TWXQDMRLVQVRSH-XQRVVYSFSA-N 254.257 2.404 10 20 CECD C[C@@H](CN(C)C)N[C@H](C)c1cc(F)cc(F)c1O 806170277 PPCGYARHWYMXEG-DTWKUNHWSA-N 258.312 2.271 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H](F)C(F)(F)F 293546976 SOLHXYWFRBVVSO-LDWIPMOCSA-N 295.232 2.045 10 20 CECD Cc1cc(CNC2(C(N)=O)CCCCC2)ccc1N(C)C 293889041 VABXBCZXJZGUQB-UHFFFAOYSA-N 289.423 2.339 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](O)C[C@@H]2C)c1 292712597 DLHRFMVKVZFOGG-AAEUAGOBSA-N 265.353 2.136 10 20 CECD C[C@H](N[C@@H](CN)C1CCCC1)c1cc([N+](=O)[O-])ccc1O 817981748 NJXWYSWGRFYAGG-HZMBPMFUSA-N 293.367 2.469 10 20 CECD CCOc1ccc(CN(C)C[C@@H]2CCCN2C)c(O)c1 817417587 PZFYCVXCICBJLY-AWEZNQCLSA-N 278.396 2.317 10 20 CECD O=C(OCCC1CCOCC1)c1cccc(O)c1O 814466911 QNGLXXAWBZQHSL-UHFFFAOYSA-N 266.293 2.071 10 20 CECD O=C(NCc1ccccc1O)NCC1CC(F)(F)C1 813614801 LPMOGQGKOIUXQE-UHFFFAOYSA-N 270.279 2.237 10 20 CECD CCc1nn(C)c(CC)c1CC(=O)Nc1ccc(N)cc1 818556211 BCPBHYCNNIQPLC-UHFFFAOYSA-N 286.379 2.308 10 20 CECD CCOc1ccc(CN[C@H](C)c2nc(C)no2)c(O)c1 729684414 OYZUELPWPJATPH-SECBINFHSA-N 277.324 2.333 10 20 CECD CN1C(=O)c2ccccc2N[C@H]1c1cc(C(=O)O)ccc1O 737505311 IDAQZOBTIQVNDM-CQSZACIVSA-N 298.298 2.287 10 20 CECD CCOc1ccc(CNC[C@@H](OC)C(F)(F)F)c(O)c1 733329945 MEDUWXRUXGRJGE-GFCCVEGCSA-N 293.285 2.458 10 20 CECD COc1cccc([C@H](C)NCCc2cnccn2)c1O 846160825 ZAIVHAFLLDNUSU-NSHDSACASA-N 273.336 2.084 10 20 CECD CO[C@@H]1CCC[C@H](CC(=O)NCc2ccc(O)cc2O)C1 910946912 VPEOGGNWRCPEPH-SMDDNHRTSA-N 293.363 2.309 10 20 CECD Cc1cc(CNC(=O)NCCc2ccc(N)cc2)ccn1 841908878 WIDMDFIIWQORHN-UHFFFAOYSA-N 284.363 2.014 10 20 CECD CCc1cccc(CN2CC(=O)N[C@@H]3CCCC[C@@H]32)c1O 848886194 UXCHVBCAZLZLEQ-CABCVRRESA-N 288.391 2.198 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2CCN(C3CC3)C2)c1O 846148258 YTDDKLRMDFBLHU-VXGBXAGGSA-N 276.380 2.288 10 20 CECD CNC[C@@H]1C[C@H](F)CN1Cc1c(O)ccc(Cl)c1F 843122014 NDOWHIWAGVPNDN-IUCAKERBSA-N 290.741 2.317 10 20 CECD C[C@H]1C[C@@H](NCc2ccc3c(c2)CCCN3C)c2ncnn21 924868717 CYTWQZPKXUOOBG-SWLSCSKDSA-N 297.406 2.456 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H]2CCC[C@H]2N)c1 846676721 IVWFSPNGAGPRTC-COPLHBTASA-N 292.379 2.096 10 20 CECD C[C@@H](N[C@H]1C[C@H](O)C1)c1cc(Br)ccc1O 850579422 WTKKMLUPPLCTQI-SZEHBUNVSA-N 286.169 2.329 10 20 CECD C[C@H](N[C@H](C)C1(CO)CC1)c1cc(F)cc(F)c1O 850513637 AHKCJEYYLXZVQG-DTWKUNHWSA-N 271.307 2.482 10 20 CECD Cc1nccc(NCc2ccc(N3CCC(O)CC3)cc2)n1 853956617 XOBVFZMOBLLTHY-UHFFFAOYSA-N 298.390 2.358 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCO2)c1nnc2n1CCC2 921521330 XMNWYBWWSXDDEH-GFCCVEGCSA-N 298.390 2.400 10 20 CECD COc1cccc(CNC(=O)c2cccc3[nH]ncc23)c1O 769507291 CQOLVXMJQGLJAI-UHFFFAOYSA-N 297.314 2.207 10 20 CECD CN(C)c1cc(F)c(CN2CC(OC(F)F)C2)cc1F 862390644 ZTIRBBKXYGKHHL-UHFFFAOYSA-N 292.276 2.454 10 20 CECD CN(Cc1nnc2n1CCCCC2)c1ccc(N)cc1 863558775 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CC[C@H](CC(=O)O)NCc1ccc(OC)c(C)c1 1776955256 VWXNEPVJSVGWOJ-GFCCVEGCSA-N 251.326 2.347 10 20 CECD C[C@@H]1CN(C(=O)/C=C/c2cccnc2)c2cccnc2O1 158410474 JOZOLBSALHMOGZ-NNNHXZLVSA-N 281.315 2.304 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]23)cc1 841298144 MSSQDURMUIOOTQ-BFHYXJOUSA-N 275.352 2.348 10 20 CECD Cc1ccc(O)c(CNC2C[C@@H]3CC[C@H](C2)N3C)c1 322346281 DGRWMXQLQNONRR-GOOCMWNKSA-N 260.381 2.415 10 20 CECD C[C@H]1C[C@H](C(=O)O)CN(Cc2cc(F)cc(F)c2O)C1 708090176 PANVFOMRVBENCZ-WPRPVWTQSA-N 285.290 2.213 10 20 CECD C[C@@H](O)C1(NCc2ccc(Br)cc2O)CC1 827585632 NCYUMFFWBNFDQZ-MRVPVSSYSA-N 286.169 2.158 10 20 CECD CN(Cc1ccccc1O)C(=O)c1[nH]nc2c1CCCC2 119987520 JHGOGXRPSFPKNG-UHFFFAOYSA-N 285.347 2.266 10 20 CECD C[C@@H](CO[C@@H]1CCOC1)N[C@@H](C)c1ccccc1O 183549403 BVFLYUICUUKWGM-RWMBFGLXSA-N 265.353 2.237 10 20 CECD CCO[C@@H]1C[C@H](N(C)C(=O)c2cccc(O)c2O)C1(C)C 185716682 GUSSLHRGMOMTSE-QWHCGFSZSA-N 293.363 2.373 10 20 CECD CCOc1cccc(CN(C)[C@H](C)COC)c1O 132682580 VCHJIMQHXYGXRV-LLVKDONJSA-N 253.342 2.258 10 20 CECD COc1cc(O)c(CN[C@@H]2CCC[C@H]2CCO)cc1OC 190303898 BACNIPWPZPGLST-WCQYABFASA-N 295.379 2.050 10 20 CECD CCCN(CC(=O)O)Cc1cc(Cl)cc(OC)c1O 229118701 GGQAUHUMAPZPKY-UHFFFAOYSA-N 287.743 2.351 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H]2CCCS(=O)(=O)C2)c1 287166535 UHBWVHZTIOZGKJ-STQMWFEESA-N 297.420 2.176 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)C(=O)NC(C)(C)C)c1 135727813 YUPUEWMBZUFQRZ-WDEREUQCSA-N 294.395 2.355 10 20 CECD CN(C)c1ccc(CNC(=O)Nc2cnns2)cc1F 192351184 SQDYNXNGDWTMSO-UHFFFAOYSA-N 295.343 2.065 10 20 CECD C[C@H](CO)CN[C@H](C)c1cc(Br)ccc1O 134914469 CIIQXKAZLGMDRG-DTWKUNHWSA-N 288.185 2.434 10 20 CECD Cc1cccc(CN(C)[C@H]2CCN(C)C[C@H]2C)c1O 290414345 KFYQRUKATXVDGR-HIFRSBDPSA-N 262.397 2.473 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)[C@]1(C)C[C@@H]1F 335602415 ZNJJKIYVQXKCDG-DZGCQCFKSA-N 278.327 2.226 10 20 CECD C[C@@H](CC(=O)Nc1ccc(N)cc1)C1CCNCC1 237596454 OQIOVXTZGCHWGL-NSHDSACASA-N 261.369 2.233 10 20 CECD COc1ccc(O)c(CN[C@@H]2C[C@]2(C)OC(C)C)c1 529670595 VBUYXWPFPWKAIN-CABCVRRESA-N 265.353 2.446 10 20 CECD CC(C)Cn1ncnc1CN(C)Cc1ccccc1O 182873096 CEGOTAYHGADPRC-UHFFFAOYSA-N 274.368 2.272 10 20 CECD CCC1(O)CCN(Cc2ccc(N(C)C)cc2)CC1 271176800 GGJAGOMUVJRBSC-UHFFFAOYSA-N 262.397 2.490 10 20 CECD COC[C@H](C)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273412854 QEOACELHXIYXJF-MNOVXSKESA-N 281.352 2.112 10 20 CECD COC[C@H]1CCCCN(Cc2cc3c(cc2O)OCO3)C1 375096254 DNALPYBSYKZPEB-LBPRGKRZSA-N 293.363 2.369 10 20 CECD CCNC(=O)C[C@@H]1CCCCN1Cc1cc(F)ccc1O 284951960 HQVLUZOPBYYPDP-AWEZNQCLSA-N 294.370 2.412 10 20 CECD CCN(C)CCNCc1cc(Cl)c(F)cc1O 294288037 PFHAYRKYWBFJRI-UHFFFAOYSA-N 260.740 2.226 10 20 CECD Cc1cc(CN(C)C2(C(N)=O)CCCC2)ccc1N(C)C 293866398 SHYWDNUTGHEPFD-UHFFFAOYSA-N 289.423 2.291 10 20 CECD O=C(OC[C@H](F)C(F)(F)F)c1cccc(O)c1O 800203081 IJOBZGWRFCFDKI-ZETCQYMHSA-N 268.162 2.155 10 20 CECD CCCCN(Cc1c[nH]nn1)Cc1ccccc1O 295128654 BYEVZTAGRFHWLB-UHFFFAOYSA-N 260.341 2.313 10 20 CECD CCN(CC)c1ccc(CNCC2(CC(N)=O)CC2)cc1 817411021 LFRDFSXSHUYFDX-UHFFFAOYSA-N 289.423 2.278 10 20 CECD CC[C@H](NCCNC1CC1)c1ccc(F)cc1O 817951775 AKCOVVRMAMZVGL-ZDUSSCGKSA-N 252.333 2.324 10 20 CECD Cc1cc(CN(C)[C@H](CO)COC(C)C)ccc1N(C)C 815101766 AKCUPTIGOYEIPA-MRXNPFEDSA-N 294.439 2.279 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](C)CN)cc1 826020103 QEQGABSSQISKTC-CYBMUJFWSA-N 277.412 2.086 10 20 CECD COc1ccc(CNC[C@H]2CCOC[C@H]2OC)cc1C 824708355 FNBFCSKWEKKRQW-GDBMZVCRSA-N 279.380 2.145 10 20 CECD CN(C)c1ccc(CN(C(=O)Cc2cnc[nH]2)C2CC2)cc1 900125753 XPSDSSSPUYARKU-UHFFFAOYSA-N 298.390 2.209 10 20 CECD COC(=O)CCC(C)(C)NCc1ccc2c(c1)CCO2 733997218 ULESJURFUPWWDO-UHFFFAOYSA-N 277.364 2.443 10 20 CECD CC[C@H](CO)N(C)Cc1ccc(N(C)C)c(C)c1 830352365 LTHPLUDMKMUTRT-CQSZACIVSA-N 250.386 2.264 10 20 CECD CN(C)C1(CNC(=O)c2cc(O)cs2)CCCCC1 732265187 OGKBPJNGNPCZRK-UHFFFAOYSA-N 282.409 2.448 10 20 CECD COc1ccc2c(c1)CCCN2CCn1ccccc1=O 747328875 PHRBIAIQRFFTGO-UHFFFAOYSA-N 284.359 2.310 10 20 CECD Oc1cccc(Cl)c1CNC[C@H]1CCCCN1 841032212 AMSFSGSCTHXMHR-SNVBAGLBSA-N 254.761 2.277 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)CCCN)c1O 841078376 CCPYZTQZHSNVOI-SECBINFHSA-N 272.776 2.271 10 20 CECD CN(C)c1ccc(CN(CC(C)(C)N)C2CC2)cc1 843060982 VQAJPKXRJJUBDX-UHFFFAOYSA-N 261.413 2.454 10 20 CECD Cc1cc(O)c(CN[C@H](CCN)C(F)F)cc1C 841073694 KCBRNCFENFYESC-LLVKDONJSA-N 258.312 2.081 10 20 CECD Cc1cc(Br)c(O)c(CNC[C@@H](N)C2CC2)c1 841048959 IDMPBVDBLRWYMN-GFCCVEGCSA-N 299.212 2.290 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)[C@H](CN)C2)cc1C 841101727 ZTCAASKJNFIRJK-XHDPSFHLSA-N 262.397 2.426 10 20 CECD CCOc1ccc(CN2CCC[C@@H](C)[C@H]2CN)c(O)c1 843051955 NDEPWYXZZKBUHU-IUODEOHRSA-N 278.396 2.350 10 20 CECD O=C(NC[C@H](O)c1ccccc1F)c1cc(O)cs1 746711983 MBRIUSIPZRWOPG-NSHDSACASA-N 281.308 2.056 10 20 CECD COc1ccc(O)c([C@@H](C)NCCOC[C@@H]2CCOC2)c1 756565806 YTBTVPNPRKDUOP-CHWSQXEVSA-N 295.379 2.105 10 20 CECD C[C@@H](NC[C@@](C)(O)C1CC1)c1cc(F)cc(F)c1O 756575680 JRFQSROYEMVXAP-XLKFXECMSA-N 271.307 2.482 10 20 CECD CN(C)c1ccc(CN[C@@H](CCO)C2CCOCC2)cc1 763467820 TUEXCPYLBCCWIQ-KRWDZBQOSA-N 292.423 2.020 10 20 CECD C[C@H](N(C)Cc1cc2c(cc1O)OC[C@H]2O)C1(C)CC1 768463645 KWTAFDQCZGECTJ-IINYFYTJSA-N 277.364 2.438 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2nocc2C)c1 866765773 ZKMONWQUVYFSCK-VIFPVBQESA-N 276.292 2.188 10 20 CECD CCOc1ccc(CN2CC[C@@H](OC)C2)c(O)c1 769445620 ITMXYOSPAZTLRE-CYBMUJFWSA-N 251.326 2.012 10 20 CECD C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)[C@@H]2CCCN2C1=O 761577952 ILYAKNRKJBOETC-FZMZJTMJSA-N 287.363 2.240 10 20 CECD CCOc1ccc(CN(CC)CCOC)c(O)c1 768252542 SQLKVWHYBBKNDI-UHFFFAOYSA-N 253.342 2.259 10 20 CECD C[C@@H](NCCc1ccnn1C)c1cc(F)cc(F)c1O 762778803 PYOYZYGXPGYPGQ-SECBINFHSA-N 281.306 2.297 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@]12CCOC2 763478147 AJOHGRCGSGHMIN-WBVHZDCISA-N 288.391 2.104 10 20 CECD Cc1cccc(O)c1CN[C@@H]1C[C@H](C)N(C2CC2)C1 877094162 NRNNIQPPLJLADC-QWHCGFSZSA-N 260.381 2.415 10 20 CECD Cc1cc(O)c(CNC[C@H]2C[C@H](O)C2)cc1Cl 877811431 KFGISHCAIVZIBL-HOMQSWHASA-N 255.745 2.215 10 20 CECD CCOc1cccc(CN2CCC[C@H]2CCO)c1O 779203148 ZSIJFNOIASWLRP-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD C[C@H](NC(=O)N1CC=CC1)c1ccc(N(C)C)cc1 875507913 MZFXTAVCKIOSON-LBPRGKRZSA-N 259.353 2.395 10 20 CECD C[C@]1(O)CCN(Cc2cc(Cl)cc(F)c2O)C1 775734150 LUHDCBKXQDPUJB-LBPRGKRZSA-N 259.708 2.141 10 20 CECD O=C(COC(=O)c1ccsc1)c1ccc(O)c(O)c1 782127081 BUCUPQKUCKXRSX-UHFFFAOYSA-N 278.285 2.199 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ncccn1 888683376 GNBBHOCWJNJDEW-UHFFFAOYSA-N 298.346 2.383 10 20 CECD Cc1cc(NCc2ccc(N(C)C)cc2)n2nc(C)nc2n1 881774458 RRMPIARAQAXVJH-UHFFFAOYSA-N 296.378 2.419 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@@H](C(=O)NCCc2ccc(N)cc2)C1 884028608 LOQFIPRNRODDAE-NHYWBVRUSA-N 298.390 2.017 10 20 CECD Oc1c(F)cc(F)cc1CNCc1cnc2n1CCCC2 883114352 RWYASUUAJMIWSH-UHFFFAOYSA-N 293.317 2.493 10 20 CECD C[C@@H](NC(=O)NCC1(N)CCCCC1)c1ccccc1O 891976625 FMLPTROJYPMTGB-GFCCVEGCSA-N 291.395 2.414 10 20 CECD COc1cc(C)cc(CNCCc2ccncc2)c1O 894334240 ASZOROIQJHRBQL-UHFFFAOYSA-N 272.348 2.437 10 20 CECD COc1ccc(O)c(CNc2ccc(C(N)=O)c(C)c2)c1 798085132 KMXLIINMNCYDQA-UHFFFAOYSA-N 286.331 2.420 10 20 CECD CCOc1cccc(CNC[C@@H]2CC[C@H](C)O2)c1O 398072106 AHCCKYQYRVNMKM-AAEUAGOBSA-N 265.353 2.448 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@H]1N 1206053367 SRJDPJXLRWLIJL-CZUORRHYSA-N 259.397 2.066 10 20 CECD CCN1CCN(Cc2cc(F)cc(C(C)=O)c2O)[C@@H](C)C1 796314512 GEJWCZHNSPFXSE-NSHDSACASA-N 294.370 2.260 10 20 CECD COC[C@@H](C)NCc1cc(Br)cc(F)c1O 715743467 BVXTUQUKZJYMEE-SSDOTTSWSA-N 292.148 2.418 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)C2(C)CNC2)cc1 1328120757 WQJXPEOEECGNNQ-UHFFFAOYSA-N 289.423 2.101 10 20 CECD O=C(NCc1ccccc1O)c1ncoc1[C@H]1CCCO1 1339140450 JXDCFUMVRWKYND-GFCCVEGCSA-N 288.303 2.162 10 20 CECD CC[C@H](NCc1cc(C(C)C)ccc1O)C(=O)O 1603959317 BOVXWUSLOCZVMU-LBPRGKRZSA-N 251.326 2.468 10 20 CECD Oc1cccc(Cl)c1CN1CCO[C@@H](CF)C1 840955823 ZZMHWBOJRTYCOS-VIFPVBQESA-N 259.708 2.216 10 20 CECD Cn1nc(-c2ccncc2)cc1C(=O)Nc1ccc(N)cc1 1579989200 MBRGCTSZXRRURE-UHFFFAOYSA-N 293.330 2.317 10 20 CECD CCOc1ccc(CN2C[C@@H](C)[C@](C)(C(=O)O)C2)c(O)c1 1597101716 AMUBZTQVYAFVJU-BDJLRTHQSA-N 293.363 2.334 10 20 CECD C[C@H]1CN(Cc2ccc(F)c(F)c2O)C[C@]1(C)C(=O)O 1599929259 CLTAHKPSFOVZGT-RTHLEPHNSA-N 285.290 2.213 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](C)CC(=O)OC 161356688 NHFIOYZLGIADJT-LBPRGKRZSA-N 293.363 2.330 10 20 CECD C[C@H](O)C[C@H](C)NCc1cccc(Br)c1O 164499029 JRKIYGVWWQLXSL-IUCAKERBSA-N 288.185 2.404 10 20 CECD CCC[C@](C)(O)C(=O)N[C@@H](C)c1cc(OC)ccc1O 153888750 IBUMTOKVLACGOW-BONVTDFDSA-N 281.352 2.129 10 20 CECD CCN1CCCN(Cc2ccc(N(C)C)cc2)CC1 155370266 DDCLKQBPNIUBEM-UHFFFAOYSA-N 261.413 2.280 10 20 CECD CCc1nc(CNCc2ccc3c(c2)CCO3)co1 825050631 OQLOQSACCKWSEE-UHFFFAOYSA-N 258.321 2.462 10 20 CECD O[C@@H]1CCCCC[C@H]1NCc1ccc2c(c1)CCO2 135632860 QLUCULUZLZVOOE-HUUCEWRRSA-N 261.365 2.405 10 20 CECD CN1CCC(CNCc2ccc(N(C)C)cc2)CC1 44515269 TZJWVSXWCZRMDW-UHFFFAOYSA-N 261.413 2.184 10 20 CECD O=C(NCc1ccccc1O)c1ccc2[nH]cnc2c1 82285293 YKYDDIVUCWGQFL-UHFFFAOYSA-N 267.288 2.199 10 20 CECD CO[C@@H](C1CC1)[C@H](C)NC(=O)Nc1ccc(N)cc1 388267482 FTLNCUPGMQUNHJ-TVQRCGJNSA-N 263.341 2.204 10 20 CECD COc1ccc(O)c(CN[C@H]2CCO[C@H](C)C2)c1 223169148 OREOJWVAVMPWAV-PWSUYJOCSA-N 251.326 2.058 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCC[C@H]2CO)c1O 50150266 NVXKLFSVGPGGNS-LBPRGKRZSA-N 283.755 2.205 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)NCc1c(O)cccc1Cl 113330516 GALAUYGHRFCNHK-ZJUUUORDSA-N 284.787 2.438 10 20 CECD CCC(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 62574805 MCUHROLSVCXEIB-LBPRGKRZSA-N 262.353 2.048 10 20 CECD C[C@@H](CN1CCOCC1)N[C@@H](C)c1ccc(N(C)C)cc1 37273384 RQFSOJJWCMUCQC-GJZGRUSLSA-N 291.439 2.124 10 20 CECD Cc1cc(S(=O)(=O)N(C)Cc2ccccc2O)c(C)o1 183207853 HIOUZXBYAGPBOB-UHFFFAOYSA-N 295.360 2.423 10 20 CECD Cc1ccc(O)c(CN2CCN(Cc3ccccn3)CC2)c1 121966458 DJRGUVSCARVRFB-UHFFFAOYSA-N 297.402 2.413 10 20 CECD CC(C)C(=O)NCCN(C)Cc1cccc(Cl)c1O 180797756 WNRPYVKKQHYSST-UHFFFAOYSA-N 284.787 2.250 10 20 CECD CCOC(C)(C)CNC(=O)N(C)Cc1ccccc1O 187629036 ROWUPOVJGPPTIQ-UHFFFAOYSA-N 280.368 2.349 10 20 CECD COc1cccc(CN2CCS[C@H]3COCC[C@@H]32)c1O 91856406 QCXHNQYGNVSMGD-JSGCOSHPSA-N 295.404 2.107 10 20 CECD CC[C@H](NC[C@H](C)CO)c1ccc(N(C)C)cc1 268799318 AOQBFNOKJGZUTD-WFASDCNBSA-N 250.386 2.422 10 20 CECD COc1ccc(N2CCN(c3ccnc(C)n3)CC2)cc1 266164040 OTCKZZZPQLHHLD-UHFFFAOYSA-N 284.363 2.120 10 20 CECD CN1CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CC1 269352960 LDNAWWWHZYRBDI-UHFFFAOYSA-N 299.758 2.091 10 20 CECD CCN(CC)c1ccc(CN(C)CCO)cc1F 271004831 MTMRPUHPKXSWSH-UHFFFAOYSA-N 254.349 2.096 10 20 CECD CN1CCCc2cc(CNC(=O)N3CCCCO3)ccc21 283741460 ZHEDFXPTSWEZID-UHFFFAOYSA-N 289.379 2.306 10 20 CECD Cc1cc(Br)cc(CN(C)[C@H](C)CO)c1O 289494194 SBKLEVQOEOVIBR-SECBINFHSA-N 288.185 2.276 10 20 CECD CCC[C@@]1(CO)CCN(C(=O)c2ccc(C)c(O)c2O)C1 293015912 MNHXDLLQWIGMKU-MRXNPFEDSA-N 293.363 2.031 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@@H](O)C(F)(F)F 809751595 SWMFGMXYNWFMRL-GFCCVEGCSA-N 294.292 2.247 10 20 CECD C[C@@H](NC[C@@H](N)c1ccc(N(C)C)cc1)c1ccccn1 817942637 QEOAHJROVKVJBC-CZUORRHYSA-N 284.407 2.498 10 20 CECD c1cc2c(cc1CNCCO[C@@H]1CCCCO1)CCO2 813334094 WUOBMASDMLOLAN-MRXNPFEDSA-N 277.364 2.254 10 20 CECD CO[C@@H]1COCC[C@@H]1CNCc1cccc(Cl)c1O 824708922 LHLNRNMUPVCHRA-ZWNOBZJWSA-N 285.771 2.187 10 20 CECD CN(C[C@H]1CCCCO1)c1ccc(OCC(=O)O)cc1 833692922 BVTSCQRYNSRZPR-CQSZACIVSA-N 279.336 2.155 10 20 CECD O=C(C[C@@H]1CC[C@@H]2C[C@@H]12)OCC(=O)c1ccc(O)c(O)c1 838122584 FHELNVGVGAPENC-JFGNBEQYSA-N 290.315 2.260 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@@H](C)c1ccc(F)cc1O 834880641 MHNYGWNRXHRSBA-FIXISWKDSA-N 283.343 2.233 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCc2c(O)cccc2Cl)C1 843039646 POWQQLBJHGFDLF-BDAKNGLRSA-N 269.728 2.389 10 20 CECD CCNCCCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 841881913 DSPDISUSURKMHW-ZDUSSCGKSA-N 292.427 2.112 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)C[C@@H](C)N)c1O 843129893 SRXJBXQYGXYVLA-RKDXNWHRSA-N 272.776 2.270 10 20 CECD CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(N(C)C)cc1C 840936563 LGKIURFSIRLYQI-JKSUJKDBSA-N 289.423 2.065 10 20 CECD COc1cc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c(O)cc1C 840131221 UIUMECOYBWAISS-RRCSTGOVSA-N 287.359 2.094 10 20 CECD CN(CCc1cccnc1)c1ccc(OCC(=O)O)cc1 846279397 BXCXPSHNCGADDB-UHFFFAOYSA-N 286.331 2.224 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@@H]1CCN1C 925413647 UBEYHWWSMXJKFU-AWEZNQCLSA-N 291.395 2.018 10 20 CECD COc1ccc(CNC(=O)NCC2=CCCC2)c(O)c1 852632729 FOOFFJSOAPYATL-UHFFFAOYSA-N 276.336 2.310 10 20 CECD C[C@H](N[C@@H](C)c1nncn1C)c1cc(F)cc(F)c1O 756531719 BKZSRBIOODAJTN-YUMQZZPRSA-N 282.294 2.211 10 20 CECD Oc1ccccc1CNC[C@@H]1CCCN1CC(F)F 858232490 YYHPLZGHQCROSH-LBPRGKRZSA-N 270.323 2.211 10 20 CECD C[C@@H](N[C@H](C)C1(CO)CC1)c1cc([N+](=O)[O-])ccc1O 850515992 JKRXNPVNYCGOFI-NXEZZACHSA-N 280.324 2.112 10 20 CECD CC[C@H](NCCCS(C)(=O)=O)c1ccc(N(C)C)cc1 765754757 QXLCWHWGSLKAPP-HNNXBMFYSA-N 298.452 2.228 10 20 CECD COc1cccc(CNC(=O)[C@H]2CCC(=O)[C@@H](C)C2)c1O 764103517 YRLTXAXRGKWYOF-QWRGUYRKSA-N 291.347 2.022 10 20 CECD CN(C)c1ccc(CNCc2ccc(O)nc2)cc1F 865437189 CFVAMSYITRFORU-UHFFFAOYSA-N 275.327 2.282 10 20 CECD COc1cccc(CNC(=O)c2cnc(C(C)C)[nH]2)c1O 1116310912 COVUJHGLPBDCTP-UHFFFAOYSA-N 289.335 2.177 10 20 CECD CCNC(=O)c1ccc(NCc2ccccc2O)nc1 774524440 UAVVTHRWWAOBCM-UHFFFAOYSA-N 271.320 2.149 10 20 CECD Cc1cccc(O)c1CN1CCC[C@@H](n2ccnn2)C1 877597248 FLAYZIFDHHKHJQ-CYBMUJFWSA-N 272.352 2.129 10 20 CECD Cc1ccc(O)c(CN(C)[C@@H](C)C(=O)NC(C)(C)C)c1 777219710 MUJIQMLAXZVBRI-LBPRGKRZSA-N 278.396 2.436 10 20 CECD CCOc1ccc(CN2CCC[C@H]2CCO)c(O)c1 779203092 YHNVPWRHLMENSY-ZDUSSCGKSA-N 265.353 2.138 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3F)CC2)cc1 1123767382 IRDCEDCVNRQWJZ-GJZGRUSLSA-N 292.354 2.092 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]([C@H](C)O)C2)cc1OC 780891854 AOAOKUABIYAURT-NWDGAFQWSA-N 295.379 2.002 10 20 CECD Cc1nc([C@H](C)NCc2cc(Cl)c(F)cc2O)n[nH]1 894774883 YXLDNJPQNUPBMC-LURJTMIESA-N 284.722 2.462 10 20 CECD COc1cccc(O)c1CN(C)Cc1cccc(O)n1 897392082 MGSUDIFTFLLDNZ-UHFFFAOYSA-N 274.320 2.133 10 20 CECD COc1ccc(CN2CCC[C@H](CO)[C@@H]2C)c(O)c1OC 894941073 YQQWYHKTMDFPPF-WCQYABFASA-N 295.379 2.002 10 20 CECD COc1cc(C)cc(CN[C@H]2CCN(CC3CC3)C2)c1O 894250463 JZILKRSCAAGVHO-HNNXBMFYSA-N 290.407 2.283 10 20 CECD C[C@@H](NC(=O)NCCC[C@@H]1CCCN1)c1ccccc1O 892159223 ORQLTBKOIRZQCS-OLZOCXBDSA-N 291.395 2.285 10 20 CECD Cc1cc(O)c(CN[C@@H]2COC[C@@H]2C)cc1Cl 896732570 IMRUGQXHSQUVCA-JOYOIKCWSA-N 255.745 2.479 10 20 CECD C[C@H](N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21)C(=O)N(C)C 790743648 YHBUYEVPZBZECC-ATZCPNFKSA-N 280.343 2.146 10 20 CECD COc1cccc(O)c1CN(C)C[C@H]1CCCN(C)C1 768545754 CQBCBSYZAFGBQX-ZDUSSCGKSA-N 278.396 2.174 10 20 CECD CO[C@@H]1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1O 1337284887 XULUWBIUETUKBW-DGCLKSJQSA-N 283.755 2.477 10 20 CECD CC(C)N1CCC[C@@H]1C(=O)N(C)c1ccc(N)cc1 1340848034 NYNMGAKMYUUTGG-CQSZACIVSA-N 261.369 2.104 10 20 CECD O=C(O)C[C@H](NCc1ccc2c(c1)CCCO2)C1CC1 1355405057 FWHWUKBJCIBLQL-AWEZNQCLSA-N 275.348 2.355 10 20 CECD CC(C)CO[C@@H]1CCN(C(=O)Cc2ccc(N)cc2)C1 236637000 AZANVSQFXIAAAT-OAHLLOKOSA-N 276.380 2.085 10 20 CECD O=C(NCc1cccc(O)c1O)c1cc2c(o1)CCCC2 1520510285 YDPGOQWRQOWBBD-UHFFFAOYSA-N 287.315 2.500 10 20 CECD O=C(O)[C@@H]1CC[C@@H](NCc2cc(Cl)ccc2O)C1 1601794593 LXUXGUBHCFIGRX-LDYMZIIASA-N 269.728 2.389 10 20 CECD CC[C@@](C)(NCc1cc(F)cc(C(C)=O)c1O)C(=O)O 1609896933 HGZZJJOJGQQOFD-CQSZACIVSA-N 283.299 2.077 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C[C@@H]1[C@@H](C(=O)O)C1(F)F 1610122362 QRRZRMZQPGTWHV-OLZOCXBDSA-N 298.333 2.150 10 20 CECD CCOC(=O)N1CCC(NCc2ccccc2O)CC1 19965224 JIMBPLAYVNUFCA-UHFFFAOYSA-N 278.352 2.103 10 20 CECD CS(=O)(=O)C1(CNCc2ccc(N)cc2)CCCCC1 1579336315 XKDJZCJDEYNFGU-UHFFFAOYSA-N 296.436 2.106 10 20 CECD Oc1cc(Cl)ccc1CN[C@]12CCC[C@@H]1NCC2 1580888561 QDPBSEDNOCMJBY-KBPBESRZSA-N 266.772 2.420 10 20 CECD N[C@@H]1CCC[C@H](C(=O)NCCCSc2nccs2)C1 158523871 JKJXVGJQVOVVER-WDEREUQCSA-N 299.465 2.259 10 20 CECD COc1ccc(/C=C2\SC(=S)NC2=O)cc1F 8198642 KVOSQTFRHINPKZ-UITAMQMPSA-N 269.322 2.323 10 20 CECD CCCN(CC(=O)N(C)C)Cc1cccc(Cl)c1O 124564616 GTHKUGKQYDTCCI-UHFFFAOYSA-N 284.787 2.346 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccnc2F)cc1 234263813 MKSCHRFAJPMUKJ-UHFFFAOYSA-N 273.311 2.217 10 20 CECD CCOc1cccc(CN[C@@H](C)c2ccn(C)n2)c1O 839189678 BPFGVPZPWZFOTE-NSHDSACASA-N 275.352 2.375 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@H](C(F)(F)F)C1 311665257 YEKFGXRPVAKUAN-ZETCQYMHSA-N 275.226 2.122 10 20 CECD CCc1cccc(CNCc2cnn(C)c2C)c1O 691525566 TWFLVWJQZWZNPB-UHFFFAOYSA-N 259.353 2.286 10 20 CECD CCCCCN(CCO)Cc1cc(OC)c(OC)cc1O 179667830 HHRBMFMABOWTMV-UHFFFAOYSA-N 297.395 2.394 10 20 CECD COc1cccc(CNC(=O)c2n[nH]c3ccccc23)c1O 68488956 XWQHNHVNQYCUOR-UHFFFAOYSA-N 297.314 2.207 10 20 CECD Cc1ccc(C(=O)N(C)c2nccs2)c(O)c1O 177683688 SMXJPASBHTUMMJ-UHFFFAOYSA-N 264.306 2.139 10 20 CECD CC(C)NC(=O)[C@@H](C)NCc1cccc(Cl)c1O 228938868 IXNAETFYOJTDNK-SECBINFHSA-N 270.760 2.048 10 20 CECD C[C@@H](O)C[C@@H]1CCCCCN1C(=O)c1cccc(O)c1O 126645251 ISWNNDCOUCXOFK-NEPJUHHUSA-N 293.363 2.254 10 20 CECD C[C@@H](N[C@H](C)c1nnnn1C1CC1)c1ccc(F)cc1O 189128288 XUNHJEJZPRNJGV-RKDXNWHRSA-N 291.330 2.265 10 20 CECD CNC[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 128315694 QYTFQCUPJHGXED-LLVKDONJSA-N 268.788 2.477 10 20 CECD CSC[C@@H](C)NC(=O)NCc1ccc(N(C)C)cc1 76778026 NQFGKFCPCYUMTJ-LLVKDONJSA-N 281.425 2.303 10 20 CECD COC(C)(C)C[C@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 181125497 RRRZHLZDBLXXKV-IOCXFXADSA-N 293.363 2.431 10 20 CECD COCc1cccc(CNC(=O)Cc2ccc(N)cc2)c1 38010973 QYCUPTOKQKUZIT-UHFFFAOYSA-N 284.359 2.274 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1CC[C@H](O)C1 128161552 SDHOORRBDVREIC-VIFPVBQESA-N 262.136 2.266 10 20 CECD COc1cccc([C@@H](O)CNCc2ccccc2O)c1 134521970 BCPHWVBLRISSPF-INIZCTEOSA-N 273.332 2.224 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@H]2CC[C@@H](C1)N2 132196408 GMJWKLOHUNJCBM-OLZOCXBDSA-N 266.772 2.372 10 20 CECD Cc1cc(O)c(CNc2nnc(-c3cnn(C)c3)o2)cc1C 191129284 OXFZPVONXMMVRW-UHFFFAOYSA-N 299.334 2.405 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCCN2)cc1F 236913030 VSTRYMPTXTYCQF-CQSZACIVSA-N 293.386 2.040 10 20 CECD Nc1ccc(CC(=O)N[C@H]2CCCc3nc(O)ccc32)cc1 269203616 JDAKPHYRYKZPSG-HNNXBMFYSA-N 297.358 2.106 10 20 CECD Cc1cccc(CN[C@H]2COc3ccccc3[C@@H]2O)c1O 368133457 URJYARALXSUHDQ-YOEHRIQHSA-N 285.343 2.285 10 20 CECD CC[C@H](NCc1cc(OC)ccc1O)[C@@H](O)C(F)(F)F 271876156 ZLKYJIRESIGLRT-CMPLNLGQSA-N 293.285 2.192 10 20 CECD Cc1ccc(C(=O)N[C@@]2(C)CCO[C@H]2C2CC2)c(O)c1O 273446254 GROCJZPAMUGHEW-HOCLYGCPSA-N 291.347 2.094 10 20 CECD CCc1nc([C@@H](C)N[C@@H](C)c2ccccc2O)n[nH]1 272863006 NGUIDJMYMNKTCU-VHSXEESVSA-N 260.341 2.485 10 20 CECD CCOC1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 297534614 YAFQZNXDFNFKMH-UHFFFAOYSA-N 286.715 2.175 10 20 CECD CN(CCN(C)C1CC1)Cc1cc(F)ccc1O 290548749 RQJGGGNJTVXVCJ-UHFFFAOYSA-N 252.333 2.057 10 20 CECD Cc1ccc(O)c(CN(CCN(C)C)C[C@@H]2CCCO2)c1 809738022 PKNMBPRGBPRGMN-INIZCTEOSA-N 292.423 2.243 10 20 CECD Cc1cc(CN2CCn3cnnc3[C@@H]2C)ccc1N(C)C 294572277 MEHZVDAYZJYKSP-ZDUSSCGKSA-N 285.395 2.229 10 20 CECD Cc1cc(CN2CC[C@@H](C)[C@H]2CO)ccc1N(C)C 294757050 YBTGOTVDDQRGPD-MLGOLLRUSA-N 262.397 2.264 10 20 CECD COC[C@@]1(CN[C@@H](C)c2ccc(C)c(C)c2O)CCCN1 817974472 MMWJLMHATRSFCC-YOEHRIQHSA-N 292.423 2.428 10 20 CECD CCn1nc(C)c(CN[C@H](C)c2cc(F)cc(F)c2O)n1 818346949 WKMILVREZRPDAE-MRVPVSSYSA-N 296.321 2.441 10 20 CECD Cc1cc(O)c(CN2CCC[C@H]2CO)cc1Cl 824617392 GESVVGUJQQUJGT-NSHDSACASA-N 255.745 2.311 10 20 CECD CCOc1ccc(CN[C@H](CC)[C@H](C)O)c(O)c1 824921745 PQVHBLCLROEXSJ-GXFFZTMASA-N 253.342 2.040 10 20 CECD C[C@@H](NC[C@@H]1CCNC(=O)CC1)c1ccc(N(C)C)cc1 828960328 UGDJWVNCQHFCLL-KGLIPLIRSA-N 289.423 2.320 10 20 CECD CCOc1ccc(O)c(CN2CCCC[C@H]2C(=O)O)c1 820387400 NYAMJSMFOYDWAF-ZDUSSCGKSA-N 279.336 2.230 10 20 CECD CN1CCN(C(=O)/C=C\c2cncc(F)c2)c2cccnc21 492063096 BPVBEGRDCVDUJQ-PLNGDYQASA-N 298.321 2.112 10 20 CECD COC(=O)[C@@H]1CCCC[C@]1(C)NC(=O)c1cc(O)cs1 831624308 TVUOEEXKTLIEAG-HZMBPMFUSA-N 297.376 2.305 10 20 CECD C[C@H](C(=O)NCc1ccccc1O)N1CCCCCC1 735857101 MVUMUNXJHWREQS-CYBMUJFWSA-N 276.380 2.273 10 20 CECD O=C(N[C@H]1CCCN2CCCC[C@@H]12)c1cc(O)cs1 848392139 VIJOFVITTRAPGC-RYUDHWBXSA-N 280.393 2.200 10 20 CECD CC(C)Cn1nccc1/C=C1\SC(=S)NC1=O 843263615 KEWYATOPTCUCFD-UITAMQMPSA-N 267.379 2.028 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCC[C@H]1CCCN1 842007275 XTKHETVFMJSJSE-CQSZACIVSA-N 291.395 2.066 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CCO)C1CC1 840934886 XIYGFKVIKBPNQX-MRXNPFEDSA-N 262.397 2.312 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)CC(C)(C)N 849350557 QGYCWZZASHSAOT-UHFFFAOYSA-N 260.740 2.354 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1CC12CCSCC2 910944049 JUYNEPDCWBPQPJ-LBPRGKRZSA-N 293.388 2.247 10 20 CECD CN1CCCc2cc(CNC(=S)NCC3CC3)ccc21 849256050 NIBIYABDZCPJSC-UHFFFAOYSA-N 289.448 2.443 10 20 CECD C[C@@H](C[C@@H](C)N)NCc1cc(Br)ccc1O 843130023 WQZBNPNPYYFOEL-BDAKNGLRSA-N 287.201 2.370 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)NCCCF)cc1 846711873 QVFGDIXIVKNYIL-UHFFFAOYSA-N 297.374 2.132 10 20 CECD CCN(Cc1ccc(N)cc1)C[C@H](O)C(F)(F)F 1336285375 LIRIBOIGSSKIJJ-NSHDSACASA-N 262.275 2.014 10 20 CECD C/C=C\C(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 752152373 XGZKBRXDLCUZOR-OKEUPSHZSA-N 275.348 2.476 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1cc(F)ccc1O 756731400 ABWIPSRITWDOPL-MNOVXSKESA-N 271.332 2.233 10 20 CECD Cc1ccc(O)c(CNCc2ccc3c(c2)nnn3C)c1 858237093 FKFZTOLONFVHJH-UHFFFAOYSA-N 282.347 2.272 10 20 CECD C[C@@H](NCCOC[C@H]1CCOC1)c1cc(F)ccc1O 756565201 WUVQCBNLKACSKZ-NEPJUHHUSA-N 283.343 2.235 10 20 CECD C[C@@H](NCCCCN)c1ccc(N2CCOCC2)c(F)c1 1118121958 LVYOTVDDKSQZRT-CYBMUJFWSA-N 295.402 2.052 10 20 CECD CC[C@@](C)(O)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776237230 FSXMQXJECMZAHB-BLLLJJGKSA-N 293.411 2.274 10 20 CECD Nc1ccc(CC(=O)Nc2ccnn2CC2CCC2)cc1 877219868 ASNOFQAVEQODCU-UHFFFAOYSA-N 284.363 2.447 10 20 CECD COC(=O)c1cccc(CN[C@H](C)c2ccccc2O)n1 879649623 ZGLBCHVLLXAHRB-LLVKDONJSA-N 286.331 2.425 10 20 CECD O=C(NCc1cccc(Br)c1O)[C@H]1C[C@@H]1F 1123754967 RTUBHAJKCABZFD-CBAPKCEASA-N 288.116 2.129 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1[C@H]2C=CC[C@H]1CC2 779536634 YBQXQABBQZTSQH-MBMDQQRISA-N 271.316 2.431 10 20 CECD CC(C)(C)c1n[nH]cc1C(=O)NCc1cccc(O)c1O 1123888336 HONXESVQTBBFRC-UHFFFAOYSA-N 289.335 2.048 10 20 CECD C[C@H](N[C@@H](C)c1nnnn1C1CC1)c1c(O)cccc1F 886598973 OFIVAVGFGAQFBP-IUCAKERBSA-N 291.330 2.265 10 20 CECD COC(=O)[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@H]1C 787421823 XFPYCGRKSXQSCV-AAEUAGOBSA-N 294.370 2.275 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H]1C 787421147 NUUOWKHLIKYWQP-SWLSCSKDSA-N 276.380 2.136 10 20 CECD COc1cc(C)cc(CN[C@H](C)CCCCO)c1O 894881761 GALYFSJRSUVCHY-GFCCVEGCSA-N 267.369 2.350 10 20 CECD Cc1ccc(C(=O)O[C@H](C)c2cnccn2)c(O)c1O 783343646 IJKSYKXCXXPTQY-SECBINFHSA-N 274.276 2.114 10 20 CECD COc1cc(C)cc(CNCCCOC(F)F)c1O 894678714 DYPJJNIOHXEAFP-UHFFFAOYSA-N 275.295 2.428 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(C)OCCO2)c1 186211595 VBPGXQUBBNSSSB-LLVKDONJSA-N 251.326 2.114 10 20 CECD COc1ccc(CNC(=O)NCCC(C)C)c(O)c1 792763219 OUYOMKOYVUSVOA-UHFFFAOYSA-N 266.341 2.246 10 20 CECD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)Nc2ccc(O)cc2)C1 776743887 BFSYOGAPDDRUEU-GHMZBOCLSA-N 284.381 2.027 10 20 CECD COc1ccc(N(C)Cc2cnc3n2CCC3)cc1 1327893299 UZESCVIQFQGKGY-UHFFFAOYSA-N 257.337 2.474 10 20 CECD Cc1ccc(C(=O)N2CCC(O)(C(C)C)CC2)c(O)c1O 1263999063 VAKOVBNNLSRSNT-UHFFFAOYSA-N 293.363 2.029 10 20 CECD CO[C@@H]1CCC[C@@H](CC(=O)NCc2cccc(O)c2O)C1 1352657848 NIUYQMXNBDIMTA-DGCLKSJQSA-N 293.363 2.309 10 20 CECD CC1(C)OC[C@@H](CSc2ncc(C(=O)O)s2)O1 1604560326 RIVKCUUAUXYYEC-LURJTMIESA-N 275.351 2.085 10 20 CECD C[C@@H](NCc1ncccc1F)c1cc(C(=O)O)ccc1O 1609777208 ACDJAINETSKNQE-SECBINFHSA-N 290.294 2.475 10 20 CECD CC/C=C\CN[C@@H](C)c1cccc(-c2nn[nH]n2)c1O 1604120393 RBDRMVFUIIMLSE-LWTINBJPSA-N 273.340 2.189 10 20 CECD CN(C)CCOc1cccc(CNCc2ccc(N)cc2)c1 1578419385 PGAQLTTYKIXNRE-UHFFFAOYSA-N 299.418 2.499 10 20 CECD COc1ccc(O)c([C@H](C)NCCC[C@@H](C)CO)c1 230669729 FCCDDBYQABVROY-NEPJUHHUSA-N 267.369 2.460 10 20 CECD Nc1ccc(CNC[C@@H]2CCCN(CC3CC3)C2)cc1 1580445662 OBLRUWQWXYJOAA-INIZCTEOSA-N 273.424 2.480 10 20 CECD CCCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 5097655 AEHXIKBGFHZVJS-OAHLLOKOSA-N 277.412 2.272 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccnc(Cl)c1 158975497 JHBLLNFCSVHQOL-UHFFFAOYSA-N 278.695 2.076 10 20 CECD CN1CCC[C@@H](CCNCc2cc(F)ccc2O)C1 839183194 UTANGRJFQSMAQC-LBPRGKRZSA-N 266.360 2.353 10 20 CECD CC1CCN(CCNC(=O)Nc2ccc(N)cc2)CC1 841302477 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291.395 2.121 10 20 CECD C[C@H](N[C@@H]1C=C[C@H](CO)C1)c1ccc(F)cc1O 185829950 JASXQDDCRXLFHX-JBLDHEPKSA-N 251.301 2.119 10 20 CECD CC1(C)[C@@H](NCc2c(O)cccc2Cl)C[C@H]1O 128336507 NCNRIPJIRZTOBQ-NWDGAFQWSA-N 255.745 2.295 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@H](C)CN2CCOCC2)c1 185504756 GQSGABZFUCWGEE-LSDHHAIUSA-N 292.423 2.320 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)O[C@H](C)C2)c1 127005025 QHNNDWJSNDYHMZ-TXEJJXNPSA-N 265.353 2.400 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@@H](C)N1 70075304 LTGGPBGPUYDDLZ-NXEZZACHSA-N 254.761 2.228 10 20 CECD COc1cc(Cl)cc(CN2CCC(CO)CC2)c1O 184677832 MQTYVCACMJTMLH-UHFFFAOYSA-N 285.771 2.259 10 20 CECD C/C=C/C[C@H](CO)NCc1cc(Cl)cc(OC)c1O 186531648 XOATZADZMHVLLI-AAOUONPWSA-N 285.771 2.471 10 20 CECD CC(C)N(C)C[C@@H](C)NCc1ccc2c(c1)CCO2 289698828 DPZPOGAMKUPJEE-CYBMUJFWSA-N 262.397 2.440 10 20 CECD N#Cc1cnn2c(O)cc(CSc3nccs3)nc12 48876296 MCJZIXBEZKLARB-UHFFFAOYSA-N 289.345 2.055 10 20 CECD CN(Cc1cc(C(N)=O)cs1)Cc1ccccc1O 91974641 MFKNMPKTXUDXIP-UHFFFAOYSA-N 276.361 2.185 10 20 CECD CSC1(CNC(=O)Nc2ccc(N)cc2)CC1 235130573 HYKGUBIZNLBCJB-UHFFFAOYSA-N 251.355 2.286 10 20 CECD CC[C@H](C)NC(=O)CCN[C@@H]1CCc2cccc(O)c21 295826686 DRWLZKHQSCXZQI-WCQYABFASA-N 276.380 2.274 10 20 CECD CCN1CCC[C@H]1CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273382736 IPIVKFSLTBJCGC-AAEUAGOBSA-N 293.367 2.435 10 20 CECD CN(C)C(=O)C1(NCc2cc(F)ccc2O)CCCCC1 294976451 JLYHXPBAONYSAJ-UHFFFAOYSA-N 294.370 2.412 10 20 CECD CNC(=O)[C@@]1(C)CCN(Cc2ccc(N(C)C)c(C)c2)C1 294245679 UHKHUMIKKOROBB-KRWDZBQOSA-N 289.423 2.019 10 20 CECD COc1cc(O)c(CN[C@H](C)CCCCO)cc1OC 294953448 DERIQYMGWFMHOR-LLVKDONJSA-N 283.368 2.050 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)N(C)[C@H](C)C2)c1 293737595 VMPDPRQIFXLZRS-BETUJISGSA-N 278.396 2.315 10 20 CECD CCCOc1ccc(CN(C)[C@H](CC)CO)c(O)c1 295061634 GPHACTKSESNPKB-CYBMUJFWSA-N 267.369 2.384 10 20 CECD COC(=O)COc1ccc(N(C)Cc2conc2C)cc1 816567501 CGTUFFYIGSKQQU-UHFFFAOYSA-N 290.319 2.171 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)CC(=O)O 820980281 MQBWHHHLWPIBSK-NSHDSACASA-N 250.342 2.014 10 20 CECD CCn1cnc(C(=O)NCc2ccc3c(c2)CCCN3C)c1 824683135 XFLAKEAKQIJAEX-UHFFFAOYSA-N 298.390 2.215 10 20 CECD O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccsc1 726876634 YQZXAXIGAIFSOJ-WQLSENKSSA-N 270.313 2.210 10 20 CECD CCCN(CC)C[C@H](C)NC(=O)c1c(F)ccc(O)c1O 832274380 ZHCIQDASRBHPLL-JTQLQIEISA-N 298.358 2.087 10 20 CECD C[C@@H](O)c1ccc(CNC(=O)c2cc(O)cs2)cc1 732276712 YBDGMBZQYAJCGI-SECBINFHSA-N 277.345 2.437 10 20 CECD Cc1nccnc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 832431590 RKVCKLKCWBWNBW-NSHDSACASA-N 284.363 2.342 10 20 CECD COc1ccc(N(C)CCN(C)C[C@@H](O)C(C)C)cc1 844402958 YBSRLWQWDKPDRW-MRXNPFEDSA-N 280.412 2.080 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1(C(N)=O)CCCC1 840936317 JEPVMITYCCJCSN-UHFFFAOYSA-N 289.423 2.196 10 20 CECD N[C@@H]1CCO[C@@H]([C@@H]2CCCN(Cc3ccccc3O)C2)C1 844901445 FMAFIBLZPQYUFG-BFYDXBDKSA-N 290.407 2.111 10 20 CECD C[C@H](NC[C@H](O)CN1CCCC1)c1ccc(Cl)cc1O 841744515 IHVAKDHUHVLCOP-AAEUAGOBSA-N 298.814 2.153 10 20 CECD C[C@@H]1NCCN(Cc2cccc(Cl)c2O)[C@H]1C 843058253 QKGHBANQQHJBJI-UWVGGRQHSA-N 254.761 2.228 10 20 CECD CCN1C[C@H](CN[C@H](C)c2cc(C)ccc2O)CC1=O 846210272 WVSPHYLSLOHCCI-OLZOCXBDSA-N 276.380 2.220 10 20 CECD COC(=O)c1cc(CN(C)c2ccc(OC)cc2)cn1C 845999196 RPTKBGBPAMVDDI-UHFFFAOYSA-N 288.347 2.457 10 20 CECD COC1([C@@H](C)NC(=O)N(C)Cc2ccccc2O)CCC1 840451836 CPYJKNBTUURORP-GFCCVEGCSA-N 292.379 2.491 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)[C@H](CO)C2)cc1C 857061108 KANXBYMLXYHMRA-NHYWBVRUSA-N 263.381 2.459 10 20 CECD CN(C)c1ccc(CN[C@H]2[C@H]3OC[C@H]4C[C@@H]2C[C@@H]43)cc1 924573245 GTUUCVRXJZYIOC-GJVDQKBNSA-N 272.392 2.266 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)[C@H]2CN(C)CCO2)c(O)c1 756762279 XEOOAAULNHJHKS-WOSRLPQWSA-N 278.396 2.070 10 20 CECD Cn1ccnc1[C@H]1N(C(=O)Cc2ccc(N)cc2)CC1(C)C 852873361 TWGDEHGPMONLAT-OAHLLOKOSA-N 298.390 2.155 10 20 CECD COC[C@@](C)(O)CN[C@@H](C)c1cc2c(cc1O)CCCC2 756579494 ZZNPZBKCOPVONT-SJCJKPOMSA-N 293.407 2.319 10 20 CECD CCOC(=O)[C@]1(C)CCC[C@H]1NC(=O)c1cc(O)cs1 856303600 LOHXEOQKXVVNSE-BXUZGUMPSA-N 297.376 2.305 10 20 CECD CN(Cc1cn(C)nn1)Cc1cc2c(cc1O)CCCC2 853568414 UVRUDYUDAQTPPE-UHFFFAOYSA-N 286.379 2.032 10 20 CECD CO[C@@H]1CCC[C@@H]1CNC(=O)NCc1cc(C)ccc1O 858346553 OQWCDIGUBAJKPX-IUODEOHRSA-N 292.379 2.315 10 20 CECD C[C@H]1C[C@H](NCCCOCCO)c2c(O)ccc(F)c21 757637683 MHYVOTFSJPCASI-JQWIXIFHSA-N 283.343 2.068 10 20 CECD C[C@H](C[C@H]1CCOC1)NC(=O)NCc1ccccc1O 759768568 RTWGCCJRUTUXMV-VXGBXAGGSA-N 278.352 2.007 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@H]1C(=O)O 863740243 UDGZUTKDKILDII-WCQYABFASA-N 294.370 2.434 10 20 CECD Cc1cccc(O)c1CN(C)CCN1C[C@H](C)O[C@H](C)C1 877485554 ZBPSIMWGRKYVEQ-GASCZTMLSA-N 292.423 2.242 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@H](N)C1(C)C 876767146 CFQCTILSIRQLNS-CABCVRRESA-N 289.423 2.051 10 20 CECD CN(C[C@@H]1CCCC[C@H]1O)C(=O)c1cc(O)cs1 778515207 PCRFWTUFTISFDY-GXSJLCMTSA-N 269.366 2.077 10 20 CECD COC(=O)[C@@H](COC(C)C)N(C)Cc1cc(C)ccc1O 770355354 MARWOPLUUCQPIL-CQSZACIVSA-N 295.379 2.099 10 20 CECD CC(C)(C)c1[nH]cnc1C(=O)NCCc1ccc(N)cc1 876528802 ZNWGAYKICJEWOG-UHFFFAOYSA-N 286.379 2.262 10 20 CECD CCOC(=O)N1CCCN(Cc2c(C)cccc2O)CC1 876654310 BQAUUZNECPKOQX-UHFFFAOYSA-N 292.379 2.365 10 20 CECD C[C@@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccccc1O 877755950 URGYJYUCXKWVKR-JHJVBQTASA-N 297.420 2.399 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)O[C@@]2(CCO[C@H]2C)C1 877487088 UQZVMEZTZKNZEF-ZQIUZPCESA-N 291.391 2.469 10 20 CECD Cc1ccc(NC(=O)NCc2ccccc2O)cn1 770256387 SLJAQJFLUOKMGT-UHFFFAOYSA-N 257.293 2.417 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)NOCCO)c1 776583398 AARYWHUCUTWPSR-UHFFFAOYSA-N 288.347 2.056 10 20 CECD COc1cc(O)c(CNC2(C3CC3)CC2)cc1OC 776231714 GNROITYISHVSOM-UHFFFAOYSA-N 263.337 2.442 10 20 CECD CCOc1ccc(O)c(CN2CCN(C)[C@@H](C)[C@H]2C)c1 775985717 NEYIFYGBNAPILA-QWHCGFSZSA-N 278.396 2.315 10 20 CECD CCOc1ccc(CN2CC[C@@H](C(=O)OC)[C@@H]2C)c(O)c1 787420843 KYLZOKDNDKSCTL-SMDDNHRTSA-N 293.363 2.174 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@H](C(=O)OC)[C@@H]2C)c1 787421157 NYSXTZHEWFAARV-SMDDNHRTSA-N 293.363 2.174 10 20 CECD COc1cccc(CNC(=O)c2ccnc(C)c2)c1O 789995703 JXDMRPKGZZCHDY-UHFFFAOYSA-N 272.304 2.034 10 20 CECD Cc1ccc(C(=O)N2CCOC(C)(C)[C@H]2C)c(O)c1O 780985001 SVKQDGHYYFVHMN-SNVBAGLBSA-N 279.336 2.046 10 20 CECD CCOCc1cc(CN[C@@H](C)C[C@H](C)O)ccc1OC 782978038 JQSVOWKGGTVFCL-STQMWFEESA-N 281.396 2.481 10 20 CECD CC[C@@H](C(=O)NCc1ccc2c(c1)CCCN2C)[C@H](C)O 789964081 SHTLYKSSXAAYIJ-SWLSCSKDSA-N 290.407 2.092 10 20 CECD COc1ccc(CNCc2c(C)noc2C)c(O)c1OC 892675118 VCMAKIPZHHARKT-UHFFFAOYSA-N 292.335 2.304 10 20 CECD CCn1cccc(CNCc2cccc(C)c2O)c1=O 789751407 CYPDXEPSRKCSOH-UHFFFAOYSA-N 272.348 2.172 10 20 CECD CC1=NO[C@H](CNCc2ccc(Br)cc2O)C1 895301431 INPFNIPCHHSIIX-NSHDSACASA-N 299.168 2.409 10 20 CECD COc1cc(C)cc(CN(C)[C@@H]2CCN(C)C[C@@H]2C)c1O 894783023 PGQHMPMGMBHOGV-DZGCQCFKSA-N 292.423 2.481 10 20 CECD Cc1ncc(CNCc2cc(F)cc(F)c2O)o1 708480811 LSOPVHWOGDACJD-UHFFFAOYSA-N 254.236 2.257 10 20 CECD O=C(NCCCSc1nccs1)C1=CCOCC1 793495610 CJTFVOPZYKBLEU-UHFFFAOYSA-N 284.406 2.088 10 20 CECD COc1ccc(CNC(=O)c2ccncc2Cl)c(O)c1 794377880 MGSKICMZBNLVGF-UHFFFAOYSA-N 292.722 2.379 10 20 CECD CC[C@H]1C[C@@H](C(=O)NCc2ccc(OC)cc2O)CCO1 794387457 JDAQMJFYGAKTQS-AAEUAGOBSA-N 293.363 2.222 10 20 CECD CN(C)c1ccc(CNC[C@H]2CCC[C@H](O)C2)cc1 230668693 FYWQKBVDQNHOKH-HOCLYGCPSA-N 262.397 2.393 10 20 CECD C[C@H]1[C@@H](C)OCCN1C(=O)NCc1ccc(N(C)C)cc1 151473393 JPWYTCOIHZXEFA-QWHCGFSZSA-N 291.395 2.071 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1CCCNC1 156730992 KZRWFNNEIUIEDP-CYBMUJFWSA-N 276.380 2.130 10 20 CECD COCC1(C(=O)NCc2ccccc2O)CCCC1 837482960 YABHZEZOGZMVGO-UHFFFAOYSA-N 263.337 2.215 10 20 CECD CCOc1cccc(CNCC2([S@@](C)=O)CCC2)c1O 280616970 KOXLYKZAGCQQSJ-HXUWFJFHSA-N 297.420 2.182 10 20 CECD Oc1cccc2c1[C@H](NCCOCC(F)F)CC2 296425388 LSHDLWBRFOBDRV-SNVBAGLBSA-N 257.280 2.251 10 20 CECD Oc1ccccc1CN=c1ccc(OC(F)F)c[nH]1 380818446 BBFDWCDMEFIXOQ-UHFFFAOYSA-N 266.247 2.423 10 20 CECD CC(C)[C@H](CO)CNCc1cccc(Cl)c1O 394070621 JUJUVUXKSLGLHV-NSHDSACASA-N 257.761 2.400 10 20 CECD CC[C@](C)(O)CNC(=O)NCc1ccc(N(C)C)cc1C 115856191 RTPBKESMRYSSKK-INIZCTEOSA-N 293.411 2.021 10 20 CECD C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCCO1 171143981 YHHFWLGUEKAEAL-ZDUSSCGKSA-N 291.395 2.073 10 20 CECD Oc1c(Cl)cccc1CNCC1(O)CCCC1 124819571 DJPPNWVRCACDJB-UHFFFAOYSA-N 255.745 2.440 10 20 CECD CCCNC(=O)CN[C@@H](C)c1cc(Cl)ccc1O 184881655 MHRJSXQQZCAINT-VIFPVBQESA-N 270.760 2.222 10 20 CECD CCOC(=O)[C@H](NCc1ccccc1O)[C@H](C)CC 187863487 DEDJBZWAOAFMOE-BXUZGUMPSA-N 265.353 2.460 10 20 CECD C[C@H](NC[C@@H](C)CO)c1cc(Br)ccc1O 134914449 CIIQXKAZLGMDRG-BDAKNGLRSA-N 288.185 2.434 10 20 CECD COc1cc(Cl)cc(CN2CCOC[C@H]2C)c1O 228629784 SLJNVWABOIHYTI-SECBINFHSA-N 271.744 2.275 10 20 CECD C[C@H]1C[C@H]1CNC(=O)NCc1ccc(N(C)C)cc1 48141307 IHKRITFLXQGLRY-AAEUAGOBSA-N 261.369 2.208 10 20 CECD CCC[C@@H](NCc1ccc(OC)c(C)c1)C(=O)O 86733433 SSSAWXPGCAEOLI-GFCCVEGCSA-N 251.326 2.347 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C(=O)O)cc1 41689427 KPKGIPGPJRQDDK-NSHDSACASA-N 250.342 2.096 10 20 CECD C[C@@H](NCCOCCO)c1cc(Cl)c(Cl)cc1O 192612011 AISFGOLKSQQPFB-MRVPVSSYSA-N 294.178 2.359 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCN[C@H]1C 92954122 BKFQCUQWGSKQFQ-BBRMVZONSA-N 289.423 2.099 10 20 CECD CCOc1cccc(CNC(C)(C)CC(=O)OC)c1O 236881919 ZZONSAHZSKSSHW-UHFFFAOYSA-N 281.352 2.222 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)C[C@H](CC)OC 817356806 UXIUFBLNVQFGIF-LBPRGKRZSA-N 287.381 2.121 10 20 CECD CCCC[C@H](CN)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 817962743 NWQRCSVHZWTGHJ-GHMZBOCLSA-N 281.356 2.469 10 20 CECD COc1ccc(O)c(CNc2nccn3nc(C)cc23)c1 811805179 LJQMYJMCQWKGNF-UHFFFAOYSA-N 284.319 2.364 10 20 CECD COc1cccc(O)c1CN1CCN(C2CC2)C[C@H](C)C1 824446223 TWUHQLVMNQXEKX-CYBMUJFWSA-N 290.407 2.317 10 20 CECD Cc1cc(O)c(CN(C)CCN(C)C)cc1Cl 825903314 CTYKPMPIPDFALG-UHFFFAOYSA-N 256.777 2.347 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2CCN[C@@H]2C)cc1 827341001 OXNQCOYIZFFXRP-CJNGLKHVSA-N 289.423 2.147 10 20 CECD Nc1ccc(CC(=O)Nc2ccc(N3CCCC3)cn2)cc1 826828962 SEOFIWNSAKQIFD-UHFFFAOYSA-N 296.374 2.445 10 20 CECD O=C(O)/C=C/c1ccc(N2C[C@H]3C=C[C@H]2C3)c([N+](=O)[O-])c1 906151179 AYEKPEKQORROQB-NDYVEPOPSA-N 286.287 2.457 10 20 CECD CN(CC(F)(F)F)C(=O)NCc1ccc(N(C)C)cc1 734512398 IRLNBQZDNGNVAE-UHFFFAOYSA-N 289.301 2.456 10 20 CECD CO[C@H](C1CC1)[C@@H](C)NC(=O)/C=C/c1ccc(O)c(O)c1 837012481 ISZNDQXNTMFCPX-OKBCXWBTSA-N 291.347 2.041 10 20 CECD C[C@@H](NS(=O)(=O)C1(C)CC1)c1ccc(N(C)C)cc1 831140310 JCBCOOSOPYDPRO-LLVKDONJSA-N 282.409 2.286 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc(C)c(C)n2)c1 839685442 VXKVXPJINJORAI-UHFFFAOYSA-N 286.331 2.343 10 20 CECD O=C1C[C@H](CNCc2cccc(Cl)c2O)CN1C1CC1 846071601 GUNOCMLRCDNIBR-SNVBAGLBSA-N 294.782 2.146 10 20 CECD C[C@@]1(CN)CCN(Cc2cccc(Br)c2O)C1 843114533 CYUXWNXMMZJRRX-ZDUSSCGKSA-N 299.212 2.325 10 20 CECD CC[C@H](C)[C@H](O)CN[C@@H](C)c1cccc(OC)c1O 846143862 INJOGQQFMYYTSK-GMXVVIOVSA-N 267.369 2.458 10 20 CECD CCO[C@@H](C)C(=O)NCc1cc(Cl)ccc1O 846473658 VHGXRRGHXXYWNV-QMMMGPOBSA-N 257.717 2.087 10 20 CECD COC[C@@H](C)CC(=O)N[C@H](C)c1cc(OC)ccc1O 755784280 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1776877558 SZPDFOGFLATDTL-UHFFFAOYSA-N 288.391 2.412 10 20 CECD CC[C@H](C)OCC(=O)N[C@H](C)c1cc(OC)ccc1O 162187850 LNXQCRKFKBGGHF-WDEREUQCSA-N 281.352 2.393 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCCCS1 167554047 JHXKOJIZPVQRPL-LBPRGKRZSA-N 251.351 2.294 10 20 CECD CCN1CCC[C@H]1CN[C@@H]1CCc2cccc(O)c21 296095311 UBHLPRDTZSMVCI-UONOGXRCSA-N 260.381 2.453 10 20 CECD COC[C@H](CCO)N[C@H]1C[C@H](C)c2c(C)ccc(O)c21 300419137 PTGGMHIRDFUQMJ-AVGNSLFASA-N 279.380 2.236 10 20 CECD CC[C@@H]1COC(C)(C)CN1C(=O)c1cccc(O)c1O 403861850 ZLPIVOKNYQIQDP-SNVBAGLBSA-N 279.336 2.127 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2ccco2)c1 172042476 ZOXLNASHDWJDEV-UHFFFAOYSA-N 275.304 2.243 10 20 CECD CN1C(=O)/C(=C\c2cccc(C(=O)O)c2)SC1=S 113838506 QPJHOJVJMWLSPK-RMKNXTFCSA-N 279.342 2.216 10 20 CECD CCN(CC)c1ccc(CNS(=O)(=O)C2CC2)cc1 173045471 HQHDOHQNOTVBDY-UHFFFAOYSA-N 282.409 2.115 10 20 CECD CCC[C@](C)(O)C(=O)NCc1ccc2c(c1)CCCN2C 124531050 MMUJRFMRFZHBNT-KRWDZBQOSA-N 290.407 2.236 10 20 CECD C[C@H](NCCOCC(F)F)c1ccc(F)cc1O 188768422 CTWMANAJBQWCLF-QMMMGPOBSA-N 263.259 2.464 10 20 CECD C[C@@]1(O)CCCN(Cc2cccc(Cl)c2O)C1 180377824 BPLXGSMLMWUMDY-CYBMUJFWSA-N 255.745 2.392 10 20 CECD COc1cccc(CN2CC[C@H]([C@H]3CCOC3)C2)c1O 371310498 LIQCONOOWRFZQO-JSGCOSHPSA-N 277.364 2.259 10 20 CECD C[C@H](N[C@@H]1CCO[C@@H]1C)c1ccc(N2CCOCC2)cc1 120533807 RGOGXEUQFWRWQE-JJRVBVJISA-N 290.407 2.351 10 20 CECD CC(C)NC(=O)NCc1ccc(N2CC=CC2)cc1 124731116 HXPGJFCAGLXMBK-UHFFFAOYSA-N 259.353 2.270 10 20 CECD CCOCCCN1CCN(c2ccc(OC)c(F)c2)CC1 84866482 SJHLPDJYJGQRLC-UHFFFAOYSA-N 296.386 2.383 10 20 CECD C[C@@H](N[C@@H]1CC[C@H]1O)c1ccc(Br)cc1O 382327557 VNASZFKZKGIVHR-AVPPRXQKSA-N 286.169 2.329 10 20 CECD CCOc1cccc(CN2CCC[C@H](CC(=O)O)C2)c1O 86757578 VYWZLFDUOPPILO-GFCCVEGCSA-N 293.363 2.478 10 20 CECD Cc1c(CNC(=O)c2ccon2)n(C)c2ccccc12 348636734 YUVYMXSGCLHOEU-UHFFFAOYSA-N 269.304 2.405 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCC[C@@H]2OCC[C@@H]21 268507142 WSAGFBSXMSZQIV-NFAWXSAZSA-N 290.363 2.149 10 20 CECD Cc1cccnc1C(=O)NCc1ccc(N(C)C)cc1 267345966 IKMYZGCFCYPMJS-UHFFFAOYSA-N 269.348 2.386 10 20 CECD C[C@H](CC[S@](C)=O)N[C@H](C)c1ccc(F)c(F)c1O 276896452 IIGAOVKVBSVUIF-LQJGKPAFSA-N 291.363 2.478 10 20 CECD COC1(CC(=O)NCc2ccc(N(C)C)c(F)c2)CCC1 276675557 ZRUWXADRUSHVOD-UHFFFAOYSA-N 294.370 2.467 10 20 CECD CCCOc1ccc(CN(CCO)CCCOC)c(O)c1 276013766 QDGDEWAMKXQLAP-UHFFFAOYSA-N 297.395 2.012 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@H]1CO 276747747 LIUHBYCGGRJQAB-ABAIWWIYSA-N 266.360 2.094 10 20 CECD CCN(CC)c1ccc(CN[C@@]2(CCO)CCOC2)cc1 278500622 NVAGTUBFNUOXCP-KRWDZBQOSA-N 292.423 2.164 10 20 CECD CO[C@@H](C)CN(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 805310505 YIOMVUROCMQSCL-STQMWFEESA-N 293.411 2.490 10 20 CECD COCCOCCN(C)Cc1c(O)ccc2ccncc12 808237557 WOQHQHLSKYELBC-UHFFFAOYSA-N 290.363 2.035 10 20 CECD COCCC(=O)NCc1cc(Cl)cc(Cl)c1O 807837580 WHTQFIIEOYCHCC-UHFFFAOYSA-N 278.135 2.352 10 20 CECD O=C(CNCc1cc(F)ccc1O)Nc1cccc(F)c1 813331806 VMACDVOLVVWGPL-UHFFFAOYSA-N 292.285 2.399 10 20 CECD CC(C)[C@@H](O)C(=O)NCc1cc(Cl)cc(Cl)c1O 813682994 OTWBQZAAMADJKT-SNVBAGLBSA-N 292.162 2.332 10 20 CECD CC[C@H](N[C@H]1CCNC1)c1cccc(Cl)c1O 817945338 ZTPKLTVXYOYTIB-CABZTGNLSA-N 254.761 2.448 10 20 CECD C/C=C\C(=O)NC[C@@H]1CCN(c2ccc(OC)cc2)C1 819578381 JPORQRFQOXSUOA-SCOBNMCVSA-N 274.364 2.214 10 20 CECD Cc1cc(Br)cc(CNC/C=C/CO)c1O 826936762 DUPKOZHSTKXJGU-NSCUHMNNSA-N 286.169 2.101 10 20 CECD COc1cccc(CNC(=O)CSC(C)C)c1O 729859781 WBBZECVNNMOTNH-UHFFFAOYSA-N 269.366 2.159 10 20 CECD C[C@@H](NC(=O)CNC(=O)CC(C)(C)C)c1ccccc1O 827930078 AIWVRQHSDANCQV-LLVKDONJSA-N 292.379 2.122 10 20 CECD C[C@H](NCCN1CCCOCC1)c1cc(Cl)ccc1O 903227313 LIOFMTPDDFDGES-LBPRGKRZSA-N 298.814 2.419 10 20 CECD Cc1cc(O)c(CNCCCn2cncn2)cc1Cl 825228323 WAQBTNYBYYCWNX-UHFFFAOYSA-N 280.759 2.125 10 20 CECD CCC[C@@H](CN(C)c1ccc(OCC(=O)O)cc1)OC 902016588 MGQATRWAKCCCOJ-AWEZNQCLSA-N 281.352 2.401 10 20 CECD CCOc1ccc(N(C)CC(=O)Nc2ccon2)cc1 739922896 PSHZSUXWZSWCFQ-UHFFFAOYSA-N 275.308 2.148 10 20 CECD C[C@H]1C[C@@H](NC(=O)N(C)Cc2ccccc2O)CCN1C 745855147 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COc1ccc(O)c([C@@H](C)NC[C@H](C2CC2)N(C)C)c1 756433541 PWWHHUMLOBZVFJ-IAQYHMDHSA-N 278.396 2.392 10 20 CECD CN(Cc1cc(Cl)cc(Cl)c1O)[C@H]1CCNC1 71309272 OBBLGLLRFLHIFP-JTQLQIEISA-N 275.179 2.493 10 20 CECD Cc1cccc(O)c1CNCCS(=O)(=O)C(C)(C)C 877035912 MHOLVTINSCJMSQ-UHFFFAOYSA-N 285.409 2.004 10 20 CECD CN1CCN(c2ccc(CNC3CCCC3)cc2)CC1 771815457 CQBIJQTUHWSMFV-UHFFFAOYSA-N 273.424 2.471 10 20 CECD COc1ccc(N2CCN(C[C@@H]3CCO[C@H]3C)CC2)cc1 877912514 XOHOGNZRXYZMAC-GJZGRUSLSA-N 290.407 2.242 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1occc1N 1118287421 ZHIHCBCSKAXXHQ-UHFFFAOYSA-N 273.336 2.166 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC[C@H]1CCCO1 787747503 HRGMUDSHPQDUOC-TXNVCOODSA-N 278.304 2.223 10 20 CECD CC(=O)c1cc(F)cc(CN(C)Cc2ncc[nH]2)c1O 788453764 DNXDDDFBHSMRSQ-UHFFFAOYSA-N 277.299 2.089 10 20 CECD COCCN(C)CCCN[C@@H](C)c1c(O)cccc1F 886503045 ZWADWXFPSPYHNM-LBPRGKRZSA-N 284.375 2.150 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C(=O)OC)[C@@H]2C)c1 787421155 NYSXTZHEWFAARV-FZMZJTMJSA-N 293.363 2.174 10 20 CECD CN(C)c1ccc(CNc2c([N+](=O)[O-])cnn2C)cc1 891578369 LJOFXNGUWKXMAP-UHFFFAOYSA-N 275.312 2.006 10 20 CECD C[C@H](N[C@H](C)c1ncnn1C)c1ccc(F)cc1O 276642049 OWOAHINPMHRDGC-DTWKUNHWSA-N 264.304 2.072 10 20 CECD CCOC(=O)[C@@H](NCc1ccc(OCC)cc1O)C1CC1 1326218398 FZVFFLUGRPBZNK-HNNXBMFYSA-N 293.363 2.222 10 20 CECD Cc1cc(C(=O)Nc2c(Cl)ccc3nonc23)no1 1323708598 ZDNLWRBDHPYXNP-UHFFFAOYSA-N 278.655 2.425 10 20 CECD Cc1n[nH]c(C)c1C[C@@H](C)C(=O)NCc1ccccc1O 1333757124 WCPMVVPSJJKITN-SNVBAGLBSA-N 287.363 2.227 10 20 CECD COc1cc(Cl)cc(CN[C@H]2COC[C@H]2C)c1O 699846505 IQEGEMYVMBSZSY-KCJUWKMLSA-N 271.744 2.179 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@]1(F)CCOC1 1259130956 KIXTZWZKEUGPKS-OAHLLOKOSA-N 281.327 2.259 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1C[C@H]1F 1354922535 JOHBHWOCZANGLI-INEUFUBQSA-N 255.636 2.173 10 20 CECD CN(C)c1ccc(OCc2cccnc2N)cc1C(=O)O 1606061306 ZENYWBJULSGFRK-UHFFFAOYSA-N 287.319 2.007 10 20 CECD CCOc1ccc(CN2CCC[C@@](C)(C(=O)O)C2)c(O)c1 1605690478 MDYGVIGYZCBXPI-MRXNPFEDSA-N 293.363 2.478 10 20 CECD Oc1ccc(Cl)cc1CN1CCO[C@@H](CF)C1 840953779 AKTGJPWKGLFJCY-NSHDSACASA-N 259.708 2.216 10 20 CECD CC1(C)C[C@@H](NC(=O)Nc2ccc(N)cc2)CCO1 215383869 GEWXFKCCFCOACB-LBPRGKRZSA-N 263.341 2.348 10 20 CECD Cc1ccc([C@H](C)NC[C@H](C)C(=O)O)c(O)c1C 1594349519 JYGWLVVMQGCYNS-ONGXEEELSA-N 251.326 2.380 10 20 CECD CCN1CCc2cc(CNc3ncncc3C(=O)O)ccc21 1776878025 OYAVALWWTWXPMX-UHFFFAOYSA-N 298.346 2.169 10 20 CECD C[C@H](CNCc1c(O)ccc(Cl)c1F)CC(=O)O 1776423670 WCDJZHXVYDBWNT-ZETCQYMHSA-N 275.707 2.385 10 20 CECD CCOc1ccc(N(C)CCN2CCCC2=O)cc1 150727793 LLDDGHUSMJASEO-UHFFFAOYSA-N 262.353 2.144 10 20 CECD CC(C)CO[C@@H](C)C(=O)N(C)Cc1ccccc1O 920805731 NBJCYVUCENRNNC-LBPRGKRZSA-N 265.353 2.412 10 20 CECD Cc1nccn1CCNCc1ccc2c(c1)CCCO2 921626649 AOQQIISEZFXUOD-UHFFFAOYSA-N 271.364 2.306 10 20 CECD C[C@H](N[C@H]1CCc2cccc(O)c21)c1ccn(C)n1 840816409 VZKJFOCCJIQVRG-GWCFXTLKSA-N 257.337 2.464 10 20 CECD c1cc2c(cc1CN[C@H]1CCN3CCC[C@H]3C1)CCO2 252674530 RUIHHLKIMKYEFW-HOTGVXAUSA-N 272.392 2.338 10 20 CECD Oc1cc2c(cc1CNCCCc1nccs1)OCO2 265519931 HPQCDMVUUJKGFQ-UHFFFAOYSA-N 292.360 2.300 10 20 CECD CC[C@@H](NCc1ccc(N(C)C)cc1)C(C)(C)O 293031449 PTZHZBYRHUFARL-CQSZACIVSA-N 250.386 2.392 10 20 CECD C[C@H](N[C@@H](C)c1nncn1C)c1ccc(F)cc1O 62746962 XDYBETDOFFFZPI-IUCAKERBSA-N 264.304 2.072 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)C(=O)NC(C)(C)C 71122538 WSWFBDZPZWHXHK-LBPRGKRZSA-N 277.412 2.145 10 20 CECD COC[C@H]1CCCCN1Cc1cc2c(cc1O)OCO2 307790788 VHLMXKJIJQEAAP-GFCCVEGCSA-N 279.336 2.122 10 20 CECD COc1ccc(O)c([C@@H](C)NCCOCCF)c1 705761633 MBWRQJNCROHNRL-SNVBAGLBSA-N 257.305 2.038 10 20 CECD COc1ccc(CN[C@@H]2C[C@H](OC)C23CCC3)c(O)c1 713480343 HRFXCZQJGRTXCJ-CABCVRRESA-N 277.364 2.448 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)Nc2nnn[nH]2)c1 118685940 VVNAUUABCVOPOU-UHFFFAOYSA-N 296.334 2.168 10 20 CECD Cc1cc(O)c(CN2CC[C@H](N3CC=CC3)C2)cc1C 172932333 RFQONASROUICKU-INIZCTEOSA-N 272.392 2.455 10 20 CECD CCOc1ccc(O)c(CNCC2(OC)CCC2)c1 181082683 WYJXUKKQLIOGML-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Oc1ccccc1CN1CCC[C@H](c2cc[nH]n2)C1 39353605 OSFKCEOCOBZTEK-LBPRGKRZSA-N 257.337 2.495 10 20 CECD C[C@@H](CCN1CCN(C)CC1)N[C@@H](C)c1ccccc1O 186566936 ANKDEIFTQFDTMM-GJZGRUSLSA-N 291.439 2.069 10 20 CECD CCOC(=O)[C@@H](NCc1cc(OC)ccc1O)[C@@H](C)CC 187865043 KZSYQQLQFCSVTC-NHYWBVRUSA-N 295.379 2.468 10 20 CECD Cc1cccc(CN2CCO[C@H]([C@H]3CCCO3)C2)c1O 245939863 UDUFRDGOFBHYJV-CABCVRRESA-N 277.364 2.080 10 20 CECD C[C@H](N[C@H](C)C[S@@](C)=O)c1ccc(F)c(F)c1O 187913481 GUHHQVJEYKRRLL-PUERIAAYSA-N 277.336 2.088 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(F)cc1O 228946134 YCBJWIVHPPPCPR-VHSXEESVSA-N 268.332 2.095 10 20 CECD COc1cccc(CN2CCC[C@@H]2C[C@@H](C)O)c1O 93482924 NTZMHZATWDNPCR-DGCLKSJQSA-N 265.353 2.136 10 20 CECD C[C@@H]1[C@@H](C(=O)NCc2ccc(O)c(O)c2)[C@@H]1C1CC1 528863871 QVIJZSVNRBVKPM-ULCPSODYSA-N 261.321 2.006 10 20 CECD COC[C@H](C)NCc1ccc(N2CCC(CO)CC2)cc1 268803284 BRUBBOKPFVUEPJ-AWEZNQCLSA-N 292.423 2.020 10 20 CECD CC[C@H](C(=O)N(CC)Cc1ccc(N(C)C)cc1)N(C)C 271093305 VAFIVISGSUQGBH-MRXNPFEDSA-N 291.439 2.441 10 20 CECD CCn1cnnc1CN[C@@H](C)c1ccc(F)c(F)c1O 276899738 IWWQJDKBWNDZDU-QMMMGPOBSA-N 282.294 2.133 10 20 CECD COC[C@@H](CN[C@H](C)c1ccc(C)c(C)c1O)OC 273392632 DVWMDEMKMATAON-CHWSQXEVSA-N 267.369 2.321 10 20 CECD CC[C@@H](NCC(=O)N(C)CC)c1ccc(F)cc1O 287470239 MICRQDDGUSWFEF-GFCCVEGCSA-N 268.332 2.050 10 20 CECD C[C@H](N[C@H]1C[C@H](C)c2c(F)ccc(O)c21)C(=O)NCCF 800499017 SYOJUEUBLHDRAK-QXEWZRGKSA-N 298.333 2.143 10 20 CECD CN(C)c1ccc(CN2CC(C(C)(C)O)C2)cc1F 297353896 GTEKNUWMVFQGDX-UHFFFAOYSA-N 266.360 2.094 10 20 CECD CCOc1ccc(N(CC)CC(=O)NCC2CC2)cc1 299383338 HMGLKTKKODUJPB-UHFFFAOYSA-N 276.380 2.438 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCC2(CO)COC2)c1O 808708025 FMLPNCVIAODTHN-JTQLQIEISA-N 285.771 2.014 10 20 CECD COC(=O)[C@@H](NCc1ccc(N(C)C)c(C)c1)C(C)C 815091021 YXFNLTLDCLMUQK-HNNXBMFYSA-N 278.396 2.348 10 20 CECD CCN(C)c1ccc(CN2CCC[C@H](O)CC2)cc1 815298529 QXIBSNPFHOZNSG-INIZCTEOSA-N 262.397 2.490 10 20 CECD C[C@H](NCc1cc([N+](=O)[O-])ccc1O)c1ccnc(O)c1 815148140 NGHIUDMXJYMWBE-VIFPVBQESA-N 289.291 2.252 10 20 CECD CCC(CC)(CNC(=O)NCc1ccccc1O)C(=O)O 818628161 QWBFCRJPFGVHFF-UHFFFAOYSA-N 294.351 2.082 10 20 CECD CCCN1C[C@H](CNCc2cccc(C)c2O)CC1=O 817410888 JJXNWKQJQWQODC-ZDUSSCGKSA-N 276.380 2.049 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CCc3cccnc32)c1 819878594 HPRMIIKSANNXHP-AWEZNQCLSA-N 298.342 2.142 10 20 CECD COc1cccnc1CNCc1cc(C)ccc1O 825249927 RBWPAPCLLMKXAC-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Cc1ccn(C[C@H](C)C(=O)N[C@H](C)c2ccccc2O)n1 827917556 NJQZQEYDVUUOCZ-WCQYABFASA-N 287.363 2.411 10 20 CECD Oc1ccc(Cl)cc1CN1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 824837467 HOIZTHGRLXXWSC-DDHJSBNISA-N 277.751 2.431 10 20 CECD C[C@H](O)C1(NCc2c(O)ccc(Cl)c2F)CC1 827585420 IKDDMKDXSHHEQA-ZETCQYMHSA-N 259.708 2.188 10 20 CECD OCC[C@@H](N[C@H]1CCc2cccc(O)c21)C1CCOCC1 834766371 SVAOQUHTYRCTQC-CABCVRRESA-N 291.391 2.147 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CCc2ccon2)c1 830539828 AARJEGQZHOVMRB-SNVBAGLBSA-N 290.319 2.199 10 20 CECD CC[S@@](=O)CCN[C@H](C)c1ccc(Cl)cc1O 841762981 LFNJDBAZXOAWDZ-VVVCHXIZSA-N 275.801 2.465 10 20 CECD Nc1ccc(Cc2noc([C@H]3CCc4n[nH]cc4C3)n2)cc1 843160074 VHHQBGJMVCNMQL-NSHDSACASA-N 295.346 2.238 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=N)NC(C)(C)C 849009260 QOJFOTHKRVZGOE-UHFFFAOYSA-N 262.401 2.473 10 20 CECD CCC[C@@H](C)S(=O)(=O)NCc1cc(OC)ccc1O 845872951 ALQSVGAZVGQRDE-SNVBAGLBSA-N 287.381 2.009 10 20 CECD CCNCC1CCN(Cc2cccc(F)c2O)CC1 843055872 RDJZABQSCVOTPY-UHFFFAOYSA-N 266.360 2.353 10 20 CECD COc1cccc(CN[C@H](CN)C2CCCC2)c1O 841088248 UCRUNMQTEGEQKX-CYBMUJFWSA-N 264.369 2.008 10 20 CECD C[C@H]1C[C@H](CN)CN1Cc1cccc(Cl)c1O 843058522 VBMSODVKMFUOCS-VHSXEESVSA-N 254.761 2.215 10 20 CECD C[C@H]1C[C@@H](CN)CN1Cc1cccc(Br)c1O 843057873 NFFQESDXLDGPEL-UWVGGRQHSA-N 299.212 2.324 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1CN 841101392 VSBSIARERROASK-TZMCWYRMSA-N 279.403 2.308 10 20 CECD CC[C@@H](O)CCN[C@@H](C)c1cccc(OC)c1O 846151511 ZFYBBUYDDBJJDX-WDEREUQCSA-N 253.342 2.212 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)C(F)(F)F)c1 743410002 HQALKCXTFYWVAS-SSDOTTSWSA-N 277.242 2.215 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)CO1 842674395 ZYNOVGDNSLDXIS-CMPLNLGQSA-N 252.333 2.159 10 20 CECD C[C@H](NCCCNc1ncccn1)c1ccc(F)cc1O 756643940 WDKKRNZZPDNTAA-NSHDSACASA-N 290.342 2.474 10 20 CECD C[C@@H](NCc1cc[nH]n1)c1cc(F)cc(F)c1O 756552610 GPDITJOTOVVDQG-SSDOTTSWSA-N 253.252 2.244 10 20 CECD Cc1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)n[nH]1 756585957 OZAJJZAEUROZDD-VIFPVBQESA-N 276.296 2.183 10 20 CECD CCOC(=O)[C@H](C)NCc1cc(Cl)cc(F)c1O 763276885 IBUJIACHBIFFQR-ZETCQYMHSA-N 275.707 2.226 10 20 CECD COC[C@@H]1CCCCN(C(=O)c2cc(O)cs2)C1 768734643 ZJJFFFCHRJPIBD-SNVBAGLBSA-N 269.366 2.342 10 20 CECD CCN(CCCN(C)C)Cc1ccc(C)cc1O 877527113 MHTCDBCQIWZTOH-UHFFFAOYSA-N 250.386 2.474 10 20 CECD CN(C(=O)CCCCN1CCCC1)c1ccc(N)cc1 877077544 MJLRKMRTKNJUMU-UHFFFAOYSA-N 275.396 2.498 10 20 CECD Cn1ncc2c1CN(Cc1cc(Cl)c(F)cc1O)C2 877632604 GXRXDXJFVCVMGU-UHFFFAOYSA-N 281.718 2.434 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)[C@@H](O)c1ccc(F)cc1 777525949 OKGIRASJRPIPNB-AMIZOPFISA-N 295.335 2.445 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CC[C@H](C)C2)c1 776477705 UOUKQJZBXQVLHS-WDEREUQCSA-N 263.337 2.453 10 20 CECD CC(C)n1cc(C(=O)N(C)c2ccc(N)cc2)cn1 877076041 LJHNADKDDBKBLX-UHFFFAOYSA-N 258.325 2.323 10 20 CECD O=C(O)[C@H]1C[C@@H](NCc2cc(Cl)cc(F)c2O)C1 874045694 BWXLFYJHBYDOLB-KZCWHLCOSA-N 273.691 2.138 10 20 CECD CCOC(=O)[C@@H](F)C1CN(Cc2c(C)cccc2O)C1 877550730 RIAKPPXZIFUKSR-AWEZNQCLSA-N 281.327 2.034 10 20 CECD OCc1nnc(NCc2cc(Cl)cc(Cl)c2O)o1 779521406 YOCHKCPGWWIRLJ-UHFFFAOYSA-N 290.106 2.186 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCn3ccnc3C2)c1 778190569 ZXQOJYIXJYRJNF-CYBMUJFWSA-N 287.363 2.092 10 20 CECD CC[C@H](N)c1cn(Cc2ccc(N(C)CC)cc2)nn1 881313552 NUSQSLVEQXXQBQ-AWEZNQCLSA-N 273.384 2.192 10 20 CECD CC[C@H](C)C(=O)NCc1ccc(N2CCN(C)CC2)cc1 881849694 TYTVWBHRHRCMSZ-AWEZNQCLSA-N 289.423 2.101 10 20 CECD CC[C@@H](NCc1ccc(OC)c(OC)c1O)[C@H](O)C(C)C 894915434 LKXKZMYCOXASJQ-TZMCWYRMSA-N 297.395 2.295 10 20 CECD C[C@@H](CCO)CNCc1c(O)ccc(Cl)c1F 790970499 JVKJDXXQNRHZJU-QMMMGPOBSA-N 261.724 2.293 10 20 CECD CC(C)c1ncc(NC(=O)c2cccc(O)c2O)cn1 794417162 YRSHWZQRNYJPRE-UHFFFAOYSA-N 273.292 2.264 10 20 CECD Nc1ccc(CC(=O)Nc2ccc3[nH]ncc3c2)cc1 37020162 WRYLWSIPLVWPGS-UHFFFAOYSA-N 266.304 2.326 10 20 CECD O[C@H]1CCCC[C@@H]1CNCc1ccc2c(c1)CCO2 77204685 PTHMOCDONDARFD-CABCVRRESA-N 261.365 2.262 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1cc(C)cc(OC)c1O 1331531337 PNAPCDRFWUKOKE-UHFFFAOYSA-N 295.379 2.483 10 20 CECD Nc1ccc(CNC(=O)N[C@H](C2CC2)C(F)(F)F)cc1 1335723639 AUOCRKUBLKIBLB-LLVKDONJSA-N 287.285 2.409 10 20 CECD CC[C@@H](C)NCc1ccc(N2CCN(C)CC2)cc1 775784769 IEELOIBFOHCVQT-CQSZACIVSA-N 261.413 2.327 10 20 CECD C[C@H](N[C@@H]1CCn2ccnc2C1)c1cc(F)ccc1O 779067753 ZOEQBHSIFMLRNV-CMPLNLGQSA-N 275.327 2.393 10 20 CECD Cc1ccc(O)c(CNC(=O)c2oc(C(=O)O)cc2C)c1 1600465386 WVRWYNZYFSHQBK-UHFFFAOYSA-N 289.287 2.230 10 20 CECD C[C@H](N[C@H]1CSC[C@H]1C)c1cc(C(=O)O)ccc1O 1604328382 DGZURPYZBBDNOI-PTRXPTGYSA-N 281.377 2.493 10 20 CECD CC(C)(CNCc1ccc(Cl)cc1O)C(=O)O 1603644567 JDAIRWJQEWCBAX-UHFFFAOYSA-N 257.717 2.246 10 20 CECD CN(C)c1ccc(CNCCC2(C(=O)O)CCC2)cc1 1777040044 PPKRFOYNJPIYPS-UHFFFAOYSA-N 276.380 2.487 10 20 CECD COc1cc(Cl)cc(CN2C[C@H](C)NC[C@@H]2C)c1O 229103991 ZZQLNTRERNIURH-UWVGGRQHSA-N 284.787 2.236 10 20 CECD C[C@]1(C(=O)O)CCCN1Cc1cc(F)cc(F)c1O 708215094 GSXOYICCMXBKDA-CYBMUJFWSA-N 271.263 2.110 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCN2CCC[C@@H]2C1 708480836 MMVBBCIELRXWNJ-QWHCGFSZSA-N 282.334 2.387 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc2nccn2c1 171803911 IHAFAPYEDJLDFA-UHFFFAOYSA-N 281.315 2.312 10 20 CECD CC(C)[C@H](C)NC(=O)CN1CCCc2cc(CN)ccc21 62801627 MOVLBUQHPIGSPL-ZDUSSCGKSA-N 289.423 2.059 10 20 CECD C[C@@H](CC[S@@](C)=O)NCc1c(O)cccc1Cl 125477675 NDDVLVIBHHKFPX-XYZCENFISA-N 275.801 2.292 10 20 CECD CC[C@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)N(C)C 124610512 DLDQEPIEANXHHI-OAHLLOKOSA-N 277.412 2.051 10 20 CECD COc1ccc(N2CCN(Cc3ccon3)CC2)cc1F 122100022 VESKLNHMJPWCNC-UHFFFAOYSA-N 291.326 2.145 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCc1ccccc1 197057078 QOWABIXYAFJMQE-CLFYSBASSA-N 283.327 2.470 10 20 CECD CC(C)(C)OC(=O)NCCNCc1ccccc1O 134289439 LDLOEJVRITVDGL-UHFFFAOYSA-N 266.341 2.007 10 20 CECD CN(Cc1ccc(N(C)C)cc1)CC(C)(C)CO 294792271 MASCNMYMYWFDPI-UHFFFAOYSA-N 250.386 2.203 10 20 CECD Cc1c(CN=c2ccnc(N(C)C)[nH]2)n(C)c2ccccc12 359836508 AQZCIZPQFOKHFJ-UHFFFAOYSA-N 295.390 2.377 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1CCCOC1 266576755 SZADGUOBEYCVGD-ZDUSSCGKSA-N 289.375 2.314 10 20 CECD C[C@H]1CC/C(=C\C(=O)NCc2ccc(O)c(O)c2)C1 272406668 ZQIVJTWYQFBWRT-NGPGYTDTSA-N 261.321 2.460 10 20 CECD Nc1ccc(CC(=O)N2CC[C@H](Oc3ccccc3)C2)cc1 371262526 NFVVHPVUZXVMIP-KRWDZBQOSA-N 296.370 2.491 10 20 CECD CCOc1cccc(CN2CC3(CCOC3)C2)c1O 293868231 CKFDRQWRVDVJLV-UHFFFAOYSA-N 263.337 2.013 10 20 CECD CCn1cc(CCSc2ncc(C(=O)OC)s2)cn1 294929066 CVPGUXJCMSJWMP-UHFFFAOYSA-N 297.405 2.481 10 20 CECD Cc1ccnc(CNC(=O)N(C)Cc2ccccc2O)c1 297312962 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C[C@@H]1c2nncn2CCN1Cc1cc(Cl)ccc1O 792186034 FVUBGDPXKDVLLW-SECBINFHSA-N 278.743 2.214 10 20 CECD CN1[C@H]2CC[C@H]1CN(Cc1cc(F)cc(F)c1O)CC2 708422200 KEQJDPMWABOFJK-STQMWFEESA-N 282.334 2.339 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)[C@H](C)CN1C 775988534 YRJYZZSSQILFQT-GHMZBOCLSA-N 252.333 2.056 10 20 CECD CCO[C@H](CC(=O)NCc1ccc(N)cc1)C(C)C 1342701085 XCCVKGMHADVXRF-CQSZACIVSA-N 264.369 2.336 10 20 CECD COC[C@](C)(CC(=O)O)NCc1cccc(Cl)c1O 1606785554 RNDMXOIRMAFFKK-ZDUSSCGKSA-N 287.743 2.015 10 20 CECD C[C@@H](NC(=O)[C@@H](CN)c1ccccc1)c1ccccc1O 1579405892 HTPIEUMOTOZSIM-DOMZBBRYSA-N 284.359 2.312 10 20 CECD C[C@H](N[C@H]1CC[C@@H]1C)c1cccc(-c2nn[nH]n2)c1O 1589954861 KBHPKQGPHYJBKS-AUTRQRHGSA-N 273.340 2.021 10 20 CECD CN1CCC[C@H]1CCSc1ncc(C(=O)O)s1 1598592565 GUOOLCGHSKQVKH-QMMMGPOBSA-N 272.395 2.418 10 20 CECD CCN(CC(=O)O)Cc1ccc(N2CCCC2)cc1 1596226269 MGZGGIZKRUOQPJ-UHFFFAOYSA-N 262.353 2.193 10 20 CECD CN(C[C@H]1OCCC1(C)C)c1ccc(OCC(=O)O)cc1 1777054167 VXZKEUBZPCKYKZ-CQSZACIVSA-N 293.363 2.401 10 20 CECD CCC[C@](C)(NCc1ccc(C)cc1O)C(=O)O 1595559253 GBFATOBPDJQNRZ-AWEZNQCLSA-N 251.326 2.434 10 20 CECD C[C@@H](NCCc1ccn(C)n1)c1ccc(F)cc1O 230897544 MFBQOUBWKNNHTA-SNVBAGLBSA-N 263.316 2.158 10 20 CECD CN(Cc1ccccc1O)C(=O)CNc1ccccc1 37823780 QRENZJSVBTVTQF-UHFFFAOYSA-N 270.332 2.463 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)CCN(C)C)c1 49553250 GGRPWUHBVLYWTI-NEPJUHHUSA-N 266.385 2.392 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CC2(C)COC2)c1O 703023354 VDXZNGBGACXDPB-UHFFFAOYSA-N 281.327 2.202 10 20 CECD CC[C@@H](C)[C@@H](CNC(=O)Nc1ccc(N)cc1)OC 381175106 CYACWFYXMKFRAQ-ZWNOBZJWSA-N 265.357 2.451 10 20 CECD COc1cccc(CN2C[C@H](C(=O)O)CC[C@H]2C)c1O 397031579 LTVWCMNPYKBXLY-ZYHUDNBSSA-N 279.336 2.086 10 20 CECD C[C@@H]1C[C@@H](C)N(Cc2cc(F)ccc2O)C[C@@H]1CN 397304694 GHDXMDMMJZUQEV-WZRBSPASSA-N 266.360 2.337 10 20 CECD CCC(CC)(CO)NCc1cc(OC)ccc1O 53047391 FCQSNNGPGNYEIA-UHFFFAOYSA-N 253.342 2.042 10 20 CECD CCOCc1cc(CNCC(C)(C)O)ccc1OC 171785882 FACKVWALUROEFO-UHFFFAOYSA-N 267.369 2.092 10 20 CECD CN(CC(=O)N1CCc2ccccc21)Cc1ccccc1O 109768968 YIWMQUFIXLPCCQ-UHFFFAOYSA-N 296.370 2.413 10 20 CECD COCC[C@@H](C)NC(=O)N[C@@H](C)c1cc(OC)ccc1O 103515419 HBUJTTRTUYMIEE-MNOVXSKESA-N 296.367 2.186 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1CCCC1 115640380 GAKFQRIMMPNEBD-UHFFFAOYSA-N 261.369 2.366 10 20 CECD CCCN1CCN(c2ccc(OC)c(F)c2)CC1 122010321 JHHDRFITRMAHNP-UHFFFAOYSA-N 252.333 2.366 10 20 CECD CSCC[C@@H](C)N(C)C(=O)Cc1ccc(N)cc1 157128920 DTMLIJHZRHGGOR-LLVKDONJSA-N 266.410 2.411 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)C[C@H](C)O1 182423959 CHMJNRCGAMFDDZ-QWRGUYRKSA-N 279.336 2.046 10 20 CECD CCOCc1cc(CNC[C@@H]2CC[C@H](O)C2)ccc1OC 188798038 BQZRTTGQBJWDOH-ZBFHGGJFSA-N 293.407 2.482 10 20 CECD C[C@@H](CCN1CCN(C)CC1)N[C@H](C)c1ccccc1O 186566980 ANKDEIFTQFDTMM-LSDHHAIUSA-N 291.439 2.069 10 20 CECD Cc1noc(C)c1C(=O)N(C)Cc1ccccc1O 48606727 ZZQWYTMPUVPAPK-UHFFFAOYSA-N 260.293 2.269 10 20 CECD CN(Cc1cn(C(C)(C)C)nn1)Cc1ccccc1O 191253445 LALTZIINCIAUSF-UHFFFAOYSA-N 274.368 2.371 10 20 CECD Nc1ccc(CC(=O)NC[C@@H](CCO)c2ccccc2)cc1 238114653 HHODYIMYXWZJFK-MRXNPFEDSA-N 298.386 2.094 10 20 CECD CCO[C@@H]1C[C@H]1C(=O)N[C@H](C)c1cc(OC)ccc1O 245812810 HWVMGNRBQSWZHA-GAJTVXKRSA-N 279.336 2.003 10 20 CECD Oc1cc2c(cc1CN1CC[C@H]3OCCC[C@H]3C1)OCO2 247052913 UIPHSDPSGPAAGP-SMDDNHRTSA-N 291.347 2.122 10 20 CECD CC[C@H](OC)C(=O)NCc1c(O)ccc2c1CCCC2 266458804 GBHNXYLJCCDQGK-HNNXBMFYSA-N 277.364 2.312 10 20 CECD C[C@H]1[C@@H](C)N(Cc2ccc(N(C)C)cc2)CC[S@]1=O 271196719 OAABMCWMIRXIPT-QHRIQVFBSA-N 280.437 2.094 10 20 CECD COCC[C@H](CO)N[C@@H](C)c1cc(Cl)ccc1O 281587930 LMJNZTBEWUDCCL-GXSJLCMTSA-N 273.760 2.094 10 20 CECD Oc1cc(F)c(Cl)cc1CN1CCC[C@@H](O)C1 294817464 FTCVICPDDGTZBH-SECBINFHSA-N 259.708 2.141 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCc2nncn2C)c1O 808675878 WHADBKGDRDBTAE-SECBINFHSA-N 280.759 2.333 10 20 CECD Cc1cnn([C@H]2CCN(Cc3cc(F)ccc3O)C2)c1 290822778 GYWJSNGDVHIWPC-AWEZNQCLSA-N 275.327 2.483 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]3CN(C)CC[C@H]32)c1 290611157 WPKIGHQENSOUCS-XJKSGUPXSA-N 290.407 2.317 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C)CC(C)(C)O)c1 296371899 JGJQQLNIVFZWCN-WDEREUQCSA-N 295.379 2.379 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CCNC2)c2c(O)ccc(F)c21 817944427 BSKMDTSUETVQDL-KKZNHRDASA-N 250.317 2.031 10 20 CECD CCCC[C@H](CN)N[C@H](C)c1cc(C(=O)OC)ccc1O 817962067 HPPMSTZLJVTGLU-DGCLKSJQSA-N 294.395 2.347 10 20 CECD C[C@@H](O)CCN(Cc1ccc(N(C)C)cc1)C1CC1 827441942 GQLQTKRJCKEBDB-CYBMUJFWSA-N 262.397 2.488 10 20 CECD C[C@H](CNC(=O)c1c(F)ccc(O)c1O)C1CC1 825542257 JCDUUYAUXNNWCI-SSDOTTSWSA-N 253.273 2.013 10 20 CECD CCC1(O)CCC(NC(=O)c2c(F)ccc(O)c2O)CC1 827761462 RWMXQGRWNVNXKE-UHFFFAOYSA-N 297.326 2.050 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCC[C@H]2C(=O)OC)c1 824703171 XOOBIILUXIDZOH-KGLIPLIRSA-N 293.363 2.222 10 20 CECD O=C1NC(=S)S/C1=C/c1nccn1-c1ccccc1 588578333 IIXJNHCVCCEIDL-CSKARUKUSA-N 287.369 2.361 10 20 CECD O=C(COC(=O)c1cc(O)cs1)OCc1ccccc1 732355000 ZGYPEIMJQDQTML-UHFFFAOYSA-N 292.312 2.354 10 20 CECD CCN1CCC[C@@H](N[C@H](C)c2cc(OC)ccc2O)C1=O 903392756 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QVNRTAKLZQQGPT-VIFPVBQESA-N 290.741 2.475 10 20 CECD CC(C)(CNCc1cc(F)ccc1O)C1(O)CCOCC1 841889606 FULXLHIJRNOJNE-UHFFFAOYSA-N 297.370 2.189 10 20 CECD CC[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)[C@H](C)O 842234010 MXCGYBNUWHVFQA-AAEUAGOBSA-N 291.391 2.294 10 20 CECD CCO/C=C\C(=O)N[C@H](C)c1ccc(N(C)C)cc1 841187038 PLHJYQFCWGUCTA-NLYDNYMLSA-N 262.353 2.480 10 20 CECD COc1cccc([C@H](C)NCC2=CCN(C)CC2)c1O 846158505 HRQQJCXBHYGPJP-LBPRGKRZSA-N 276.380 2.313 10 20 CECD Cc1nonc1[C@@H](C)NCc1ccc2c(c1)CCO2 924901322 RWWOJQDQSCGIAW-SECBINFHSA-N 259.309 2.164 10 20 CECD COc1ccc(CN[C@H]2C[C@H](NC(=O)C(F)F)C2)cc1C 1019909301 FOCULCFBLPKTOU-HAQNSBGRSA-N 298.333 2.006 10 20 CECD Cc1ccc(C(=O)N2CCc3ccncc32)c(O)c1O 756014415 RLGYFKLKLUOGSL-UHFFFAOYSA-N 270.288 2.004 10 20 CECD COCC1(N[C@@H](C)c2cc(C(=O)OC)ccc2O)CC1 756852173 YRNVAMKSULONPR-JTQLQIEISA-N 279.336 2.008 10 20 CECD C[C@H](N[C@H](C(N)=O)c1ccccc1)c1ccc(F)cc1O 756380290 GRDCNQWIGYEZNL-BONVTDFDSA-N 288.322 2.409 10 20 CECD CSC[C@H](C)C(=O)NCc1cc(C)ccc1O 862760074 LBUIIIAZYXUWQA-JTQLQIEISA-N 253.367 2.316 10 20 CECD CO[C@]1(CN[C@H](C)c2cc(F)cc(F)c2O)CCOC1 763574318 YSCQSOIDIQKGHH-OTYXRUKQSA-N 287.306 2.127 10 20 CECD CCOC(=O)C1(CNCc2ccc(N(C)C)cc2)CC1 770666257 XKBSCORBFCYOSM-UHFFFAOYSA-N 276.380 2.186 10 20 CECD C[C@@H](NCC(=O)N(C)c1nccs1)c1ccccc1O 879648438 PAWXIJJDTKIVSM-SNVBAGLBSA-N 291.376 2.162 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@H]3C[C@@H]3C)CC2)cc1 1116649448 SDSZRQLFGPWMJF-BBRMVZONSA-N 288.391 2.390 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@H](n2cncn2)C1 777221722 LIODYEVEEYWRMR-JTQLQIEISA-N 278.743 2.084 10 20 CECD C[C@@H](N[C@H](CCO)C1CC1)c1c(O)cccc1F 886549118 BUFWXAJNNKMBTD-BXKDBHETSA-N 253.317 2.343 10 20 CECD Cc1c[nH]ccc1=NCc1ccc(N2CCN(C)CC2)cc1 882880020 YDQBGXXLRHYYCH-UHFFFAOYSA-N 296.418 2.176 10 20 CECD O=C(NCc1cnn(CC2CCC2)c1)c1cc(O)cs1 887357325 MKGSHIMYIBQWJV-UHFFFAOYSA-N 291.376 2.380 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cccc(Cl)c2O)[C@H]1C 787420068 CULAUCYRRYZRPP-GXSJLCMTSA-N 283.755 2.429 10 20 CECD COc1ccc(CN2C[C@@H]3[C@@H](C2)C3(C)C)c(O)c1OC 892112923 CUOHRYGTMDGEGR-VXGBXAGGSA-N 277.364 2.497 10 20 CECD COc1ccc(CN2CCO[C@H](C)[C@@H]2C)c(O)c1OC 892048081 HNGPDPCXPGONBG-WDEREUQCSA-N 281.352 2.019 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@H](C)S1=O 792192762 PZVQJSHNUOKZRV-STQMWFEESA-N 280.437 2.094 10 20 CECD COc1ccc(O)c(CN2C[C@@H](C)OC(C)(C)C2)c1 133110725 PEESGMKIUUGAGP-LLVKDONJSA-N 265.353 2.400 10 20 CECD CCN(CCC(=O)O)Cc1ccc(N(C)C)cc1 77253360 OYVDBOCKGRAWDA-UHFFFAOYSA-N 250.342 2.049 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)c2ncnn2C)c1 276744873 ZODMBLMAHMAOOH-WDEREUQCSA-N 260.341 2.241 10 20 CECD Cn1ncc(CCCNCc2ccc(N3CCCC3)cc2)n1 1326258905 PQBWBBWETFOCTO-UHFFFAOYSA-N 299.422 2.138 10 20 CECD COc1ccc(CNCc2c(O)nnc(C)c2C)cc1C 1251740867 MDHMWUFAYWYGFL-UHFFFAOYSA-N 287.363 2.406 10 20 CECD COc1cc(CN(C)Cc2ccccc2O)ccn1 762925151 CQJLDLSCFSXZCU-UHFFFAOYSA-N 258.321 2.428 10 20 CECD C[C@H](N[C@H]1CC[C@H](CO)CC1)c1cc(C(=O)O)ccc1O 1609786469 NFSGCSHCDGELQE-GVXVVHGQSA-N 293.363 2.292 10 20 CECD O=C(O)c1cnc(SC[C@@H]2CCCC[C@H]2O)s1 1602537262 PEQLVCZNWNWPET-JGVFFNPUSA-N 273.379 2.485 10 20 CECD O=C(O)[C@H](CC1CC1)NCc1ccc(Cl)cc1O 1601639944 ULHNRRQTVXFSTE-NSHDSACASA-N 269.728 2.389 10 20 CECD CC[C@H](C)N(CC(=O)O)Cc1ccc(OC)c(OC)c1O 1604961310 GPAZPRBQWSOAEY-JTQLQIEISA-N 297.351 2.095 10 20 CECD COCCN(Cc1cccc(Cl)c1O)C1CCNCC1 1573986391 PEIIJIOCFXBCTG-UHFFFAOYSA-N 298.814 2.246 10 20 CECD Nc1ccc(CNC(=O)[C@H]2CCCN2C2CCCC2)cc1 1580443643 VFZQCSNBFOHSCR-MRXNPFEDSA-N 287.407 2.292 10 20 CECD C[C@H](NCCCCC(=O)O)c1cc([N+](=O)[O-])ccc1O 1589128286 NBYKYYGXKMDEMU-VIFPVBQESA-N 282.296 2.206 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](CC)c2ccccc2O)C1 156377126 NQZLHCSBDXBHEU-GXTWGEPZSA-N 276.380 2.444 10 20 CECD O[C@H]1CC[C@@H](CNCc2ccc3c(c2)CCCO3)C1 922043988 IMXBVCSMKWOHOF-HIFRSBDPSA-N 261.365 2.262 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC[C@@H](C)CO)c1 230669726 FCCDDBYQABVROY-VXGBXAGGSA-N 267.369 2.460 10 20 CECD Oc1ccc(F)cc1CN1CCN(CC(F)(F)F)CC1 179895832 IKMPBFSGMOHOMM-UHFFFAOYSA-N 292.276 2.211 10 20 CECD COc1ccc(O)c([C@H](C)NCCC2CC(O)C2)c1 705245406 OGLURPBRWTUFOI-UNXYVOJBSA-N 265.353 2.212 10 20 CECD Oc1ccc(Br)cc1CN1C[C@@H]2CC[C@H](C1)N2 873215900 GPIDEOCWJKYGIX-TXEJJXNPSA-N 297.196 2.091 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)C(F)(F)C(F)F 186441396 BBQPQIVUUFBFKP-ZCFIWIBFSA-N 295.232 2.045 10 20 CECD Cc1ccc(CNCc2cc3c(cc2O)OCO3)nc1C 314343348 VHBYYWAMWAXBPW-UHFFFAOYSA-N 286.331 2.423 10 20 CECD CCC[C@@H](NCc1ccc(N(C)C)cc1)C(=O)O 75423472 KOGAAWMDQDRGAT-CYBMUJFWSA-N 250.342 2.096 10 20 CECD COCCO[C@@H]1CCN(Cc2cc(C)c(C)cc2O)C1 188920762 XCSXBNTUQCTMCJ-OAHLLOKOSA-N 279.380 2.246 10 20 CECD COc1cc(O)c(CNCc2ccco2)cc1OC 181510203 VGHHPKHWUXVCOL-UHFFFAOYSA-N 263.293 2.292 10 20 CECD CCCCNC(=O)CN(C)c1ccc(OC)cc1OC 131759611 DYZOBSWCLPOGGJ-UHFFFAOYSA-N 280.368 2.056 10 20 CECD CN(Cc1ccccc1O)c1nnc(C(F)F)o1 293016492 KHDNYLGGSANMQK-UHFFFAOYSA-N 255.224 2.349 10 20 CECD Oc1ccc(F)cc1CN1CC[C@H](CN2CCCC2)C1 180188251 VELZQZICLDWULU-CYBMUJFWSA-N 278.371 2.449 10 20 CECD CCN(CC)c1ccc(CN(CCO)CCCOC)cc1 276034655 RXUNMPIIFDZCHD-UHFFFAOYSA-N 294.439 2.364 10 20 CECD CCOC1CC(O)(CNCc2cccc(Cl)c2O)C1 278786916 WDPUXUZSXXERLX-UHFFFAOYSA-N 285.771 2.065 10 20 CECD Cc1ccc(O)c(CN2CC[S@](=O)[C@H](C)[C@@H]2C)c1 271196701 NZRGDDQDGFHBBP-IUUKEHGRSA-N 267.394 2.042 10 20 CECD CC(C)OC[C@@H]1CN(Cc2ccc(N(C)C)cc2)CCO1 372117894 XLNLQLSOEWLQBN-KRWDZBQOSA-N 292.423 2.378 10 20 CECD CC(C)[C@@H](NCc1ccc2c(c1)CCO2)c1nncn1C 285499796 MRUXAMMXPFJYIP-OAHLLOKOSA-N 286.379 2.237 10 20 CECD Oc1c(Cl)cccc1CN1CCOC[C@@H]1[C@@H]1CCCO1 377701410 PAYAPZAMFKAIPG-KGLIPLIRSA-N 297.782 2.425 10 20 CECD CCOc1cccc(CN2CC(O)(c3ccccc3)C2)c1O 291707693 ZMBHZRUJRUNXNI-UHFFFAOYSA-N 299.370 2.494 10 20 CECD Oc1ccccc1CNC[C@H](O)Cc1cccc(F)c1 295119839 NAWKDJDTTPYIEM-OAHLLOKOSA-N 275.323 2.225 10 20 CECD CCCN[C@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 294775273 NGVGSNFSKKFPIP-CYBMUJFWSA-N 277.412 2.099 10 20 CECD C[C@H]1C[C@@H](NCC(C)(C)N)c2c(O)ccc(F)c21 817960279 LNJFZNVVJKFKTE-WCBMZHEXSA-N 252.333 2.407 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@H](C)C1CNC1 817934689 MYZZEFWILOVWBD-UONOGXRCSA-N 275.440 2.190 10 20 CECD COC[C@H](NCc1ccc(N(C)C)c(C)c1)[C@@H]1CCCO1 815104042 XRPCEQSSJAAUCN-RDJZCZTQSA-N 292.423 2.345 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1CCN[C@H]1C 828144361 DAECABJXORRNFX-JSGCOSHPSA-N 276.380 2.129 10 20 CECD CC(C)n1ncc(C(=O)N[C@H](C)c2ccccc2O)c1N 827946964 WEURLGQFFNWOBR-SNVBAGLBSA-N 288.351 2.243 10 20 CECD Cc1cc(O)c(CN2C[C@@H](CO)OC(C)(C)C2)cc1Cl 826131462 SZIHBEDDURBJDX-LBPRGKRZSA-N 299.798 2.326 10 20 CECD CC[C@H](C)OCC(=O)N[C@H](C)c1ccccc1O 827941159 OFEXHXCNHCEAAY-WDEREUQCSA-N 251.326 2.385 10 20 CECD CC[C@H](NCc1ccc(N(C)C)c(F)c1)[C@H](C)O 824921539 MWDYVWIDAYRIJF-GWCFXTLKSA-N 254.349 2.141 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCC[C@H](N)C2)c1 828667882 VSKFKLHIFKAIMS-TUAOUCFPSA-N 292.379 2.096 10 20 CECD C[C@H]1CC(C)(C)CN1C(=O)c1c(F)ccc(O)c1O 839876172 BFLYSDCNXSCYCG-QMMMGPOBSA-N 267.300 2.498 10 20 CECD O=C(Nc1ccn(-c2ccncc2)n1)c1cc(O)cs1 733809359 JPPXRZAQGPCTOR-UHFFFAOYSA-N 286.316 2.287 10 20 CECD CC[C@@H](CNCc1c(O)cccc1Cl)C(=O)O 903706085 USZOLIUXKVZOMS-QMMMGPOBSA-N 257.717 2.246 10 20 CECD CCCOc1ccc(CN[C@@H]2CCO[C@@H]2C(=O)O)cc1C 901918876 IWLSIKDUDMMKRA-HIFRSBDPSA-N 293.363 2.116 10 20 CECD O=C(OCc1cn2ccccc2n1)c1cc(O)cs1 731910194 OEBLZXIROHSBKX-UHFFFAOYSA-N 274.301 2.458 10 20 CECD Oc1ccccc1CN(Cc1cnccn1)C[C@H]1CCCO1 838782393 ANJAJDFZSFBWCU-MRXNPFEDSA-N 299.374 2.363 10 20 CECD COc1cccc(C[C@H](C)NCCc2ccc(N)cc2)n1 841036870 WPUJMHBNJKPIRO-ZDUSSCGKSA-N 285.391 2.436 10 20 CECD COc1cccc(O)c1CN1CCC[C@H]([C@H]2CCNC2)C1 843125188 NRLQZEAPUYUNBL-KBPBESRZSA-N 290.407 2.222 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)c1ncnn1C 840942078 RNTUIPHFXCKYNA-LBPRGKRZSA-N 273.384 2.040 10 20 CECD CC[C@H](NC(=O)Nc1ccc(N)cc1)[C@H](O)C(F)(F)F 841297534 FRWXETYJEORBHU-UWVGGRQHSA-N 291.273 2.092 10 20 CECD COCC[C@@]1(NCc2ccc(N(C)C)cc2C)CCOC1 840940873 MYNZDGYPPHLYKY-QGZVFWFLSA-N 292.423 2.346 10 20 CECD Cc1cc(Br)c(O)c(CN2CC[C@@H](CN)C2)c1 843048406 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RCGTVGMZTGBZLO-UHFFFAOYSA-N 288.391 2.191 10 20 CECD Cc1nnc(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)s1 775432402 CPQLHIDJCVRDDX-VIFPVBQESA-N 290.392 2.404 10 20 CECD Cc1cccc(O)c1CNCC1(S(C)(=O)=O)CCCC1 877519410 RLZSADJWUSFYJD-UHFFFAOYSA-N 297.420 2.148 10 20 CECD C[C@@H](NC(=O)c1ccc(C=O)[nH]1)c1ccc(N(C)C)cc1 775403688 KEXUUPCFZDVPDX-LLVKDONJSA-N 285.347 2.384 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@H]2CO)cc1 889125605 CLUGLOURXNUESX-INIZCTEOSA-N 284.359 2.301 10 20 CECD COc1ccc(CN[C@H]2CC[C@@H](CO)CC2)c(O)c1OC 893131148 AGUDSCKZQRKUKO-BJHJDKERSA-N 295.379 2.050 10 20 CECD CCc1nnc(C(=O)NCc2ccc(N(C)C)cc2)s1 899984197 XJVIWPRBQQWPGM-UHFFFAOYSA-N 290.392 2.097 10 20 CECD C[C@H]1[C@H](CO)CCCN1Cc1cc(F)cc(F)c1O 895014931 QJNCKICSWFGQKT-UWVGGRQHSA-N 271.307 2.263 10 20 CECD C[C@H](N[C@H]1C[C@H](C)c2c(F)ccc(O)c21)C(=O)N(C)C 790743651 YHBUYEVPZBZECC-QXEWZRGKSA-N 280.343 2.146 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](OC)C2CC2)c1 792237718 HRDLVUVDMUZEQL-OTYXRUKQSA-N 279.336 2.003 10 20 CECD O=[N+]([O-])c1cnc(NCc2ccccc2O)s1 83384592 UJHQNYHRCMOKPV-UHFFFAOYSA-N 251.267 2.369 10 20 CECD CCN(Cc1ccc(N2CCCC2)cc1)[C@@H](C)CO 1324553219 CIGQEBYSABMQRO-AWEZNQCLSA-N 262.397 2.490 10 20 CECD Cc1ccc(CCNC(=O)NCc2ccc(N)cc2)o1 1335930185 SAONMBRODSVALF-UHFFFAOYSA-N 273.336 2.212 10 20 CECD C[C@@H]1CN(CCSc2nccs2)C[C@@H](C)O1 1346808395 NNVIWAKKBKCDTP-NXEZZACHSA-N 258.412 2.344 10 20 CECD CC[C@H](F)C(=O)N1CCN(c2ccc(OC)cc2)CC1 1262611076 OLBUCBRNEWSIKB-AWEZNQCLSA-N 280.343 2.092 10 20 CECD CO[C@@H]1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)c(F)c1 1516718589 AQVLVDGZQONWIV-SWLSCSKDSA-N 294.370 2.323 10 20 CECD C[C@@H]1C[C@@H]1[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)O 1776603057 OWWHPMFMEVCJCE-RIEGTJTDSA-N 275.348 2.210 10 20 CECD CCOC(=O)N1CCC(NCc2cccc(C)c2O)CC1 158095658 DQTDTKIGGNESNT-UHFFFAOYSA-N 292.379 2.411 10 20 CECD Fc1cc(CNc2ccon2)ccc1N1CCOCC1 167801038 LIUGRSOWRDWHCB-UHFFFAOYSA-N 277.299 2.262 10 20 CECD COc1ccc(N(C)C(=O)/C=C/c2cnn(C)c2)cc1F 159552447 CJOLPSNOUBRGKA-QPJJXVBHSA-N 289.310 2.244 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)c2ncn(C)n2)c1 275726737 OLTQNXVOBFZMKX-WDEREUQCSA-N 260.341 2.241 10 20 CECD CC(C)N1CC[C@@H](N[C@@H](C)c2ccccc2O)C1=O 179895950 SEODMLLVZASLGJ-WCQYABFASA-N 262.353 2.052 10 20 CECD COc1ccc(CNCc2cccnc2C)c(O)c1 705570097 MXUSMYZAWFDYSY-UHFFFAOYSA-N 258.321 2.394 10 20 CECD COc1cc(C)cc(CN2CCN(CC(C)C)CC2)c1O 119989436 LXTPVDVWHGIVRF-UHFFFAOYSA-N 292.423 2.483 10 20 CECD Cc1ccc(C(=O)OCc2ccccn2)c(O)c1O 110002150 DTYOGWBCAMQZGS-UHFFFAOYSA-N 259.261 2.158 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)C[C@@H]1CCCC[C@@H]1O 181098928 AWYQHKDAWBDOJP-AAEUAGOBSA-N 293.363 2.104 10 20 CECD C/C=C/C[C@@H](CO)NCc1cccc(Cl)c1O 186531279 HYYQSGDZRPLOFS-VUDBWIFFSA-N 255.745 2.462 10 20 CECD C[C@@H](C[S@@](C)=O)N[C@@H](C)c1ccc(F)c(F)c1O 187913449 GUHHQVJEYKRRLL-QQJLPTOTSA-N 277.336 2.088 10 20 CECD COC[C@@H](NCc1cc(F)cc(C(C)=O)c1O)C1CC1 181569824 LAQREFRCRIAAKW-CQSZACIVSA-N 281.327 2.249 10 20 CECD CCO[C@H]1C[C@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 236979083 JSAZKYOTQKZORY-GJZGRUSLSA-N 290.407 2.473 10 20 CECD Cc1ccc(O)c(CN2CCC[C@@H](Cn3ccnn3)C2)c1 92070685 UBQRKQRMMBYKTN-CQSZACIVSA-N 286.379 2.204 10 20 CECD COC(=O)c1cnc(SCCOC(C)C)s1 295260350 INDKGQVPJAZYGK-UHFFFAOYSA-N 261.368 2.447 10 20 CECD COCCCCSc1ncc(C(=O)OC)s1 295391945 VFTBNKSDJBUXSE-UHFFFAOYSA-N 261.368 2.448 10 20 CECD CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(OC)c1O 91892779 YRAAKVPYDRDUCY-CABCVRRESA-N 290.407 2.459 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2[C@H](C)O)c1O 267473896 ZTKPVPCNOKJBIP-XHDPSFHLSA-N 295.354 2.469 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCC2(O)CCOCC2)c1 287605276 SEUWFJVSDZIKDP-CYBMUJFWSA-N 279.380 2.283 10 20 CECD CC[C@@H](NCc1cnnn1C)c1ccc(N(C)C)cc1 287495512 YDPVBRKDWUYJGR-OAHLLOKOSA-N 273.384 2.122 10 20 CECD CN(Cc1cc2c(cc1O)CCCC2)Cc1nncn1C 808215385 QPENQZLBBGJWLH-UHFFFAOYSA-N 286.379 2.032 10 20 CECD C[C@@H]1C[C@@H](CO)CN(Cc2ccc(N(C)C)c(F)c2)C1 817412785 OVXPWOHEGSPWPM-TZMCWYRMSA-N 280.387 2.342 10 20 CECD COC[C@H](C)[C@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 813513052 GQZXLRIYQAGWIH-SRVKXCTJSA-N 295.379 2.064 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@H](O)CC2)cc1 815298530 QXIBSNPFHOZNSG-MRXNPFEDSA-N 262.397 2.490 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)N[C@H](C)[C@@H](C)OC)c1 811957590 GCURIWUEJJYLSZ-GMTAPVOTSA-N 296.367 2.184 10 20 CECD C[C@@H](N[C@@H](CN)C1CC1)c1cc(F)cc(F)c1O 817959583 HGEKQLIMBABFBL-KRTXAFLBSA-N 256.296 2.058 10 20 CECD COC[C@@H]1CCCCN1Cc1cc(OC)c(OC)cc1O 825294571 UCNJHWXRTOYZME-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD CC[C@H](N[C@H](C)CC(=O)NC)c1ccc(C)cc1O 834898662 ATVNGDOAAKENNX-YPMHNXCESA-N 264.369 2.266 10 20 CECD CC[C@H](N[C@@H](C)c1cc(F)cc(F)c1O)[C@H](C)O 834888408 OUJUKAOTNFMWRC-UBJUHAIHSA-N 259.296 2.480 10 20 CECD C[C@@H]1CC[C@@H](CCC(=O)NCc2ccc(O)cc2O)O1 910951258 QIMQBLBYWWBYCI-MFKMUULPSA-N 279.336 2.062 10 20 CECD C[C@@H]1C[C@@H](CN)CN1Cc1cc(Cl)cc([N+](=O)[O-])c1O 843058738 XFIHVOZAOZEKNW-BDAKNGLRSA-N 299.758 2.123 10 20 CECD CCc1cccc(CN2CC[C@H](OC(=O)N(C)C)C2)c1O 848915479 IEXNAJLMDWAHGT-AWEZNQCLSA-N 292.379 2.227 10 20 CECD CN[C@H]1CCCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843048702 QSACQUHRQBDCES-NSHDSACASA-N 299.758 2.138 10 20 CECD CC1(C)CCC[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)C1 841114036 BHGWMVCNZWEWRY-CYBMUJFWSA-N 289.379 2.292 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@H]2CNC(=O)C2)cc1 851717008 UCCDQHWSUBWZOF-OAHLLOKOSA-N 289.423 2.101 10 20 CECD CCOc1ccc(CNCCC[C@H](C)CO)c(O)c1 758577350 DSSIDFLPFWQUFX-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CN(C)c1ccc(CN[C@H](CO)CC(F)(F)F)cc1F 756996499 QNNJOCGODZVVSS-JTQLQIEISA-N 294.292 2.295 10 20 CECD C[C@@H](N[C@@H]1COCC[C@H]1O)c1ccc2ccccc2c1O 866498539 ZCFAZZTXBJPYNT-HFBAOOFYSA-N 287.359 2.346 10 20 CECD CCCN(CCC)Cc1cc2c(cc1O)OC[C@H]2O 768441410 LGAJKYKJBNCQIQ-CQSZACIVSA-N 265.353 2.440 10 20 CECD Cc1cc(O)c(CN[C@H](CCO)C2CCOCC2)cc1C 763467238 QNDVUDVBNATNMV-MRXNPFEDSA-N 293.407 2.276 10 20 CECD Cc1ccc([C@H](C)[C@H](O)C(=O)NCc2ccccc2O)cc1 765178006 QRBCDJCYHOPQOY-GUYCJALGSA-N 299.370 2.481 10 20 CECD CN(Cc1cc2c(cc1O)OC[C@@H]2O)C(C1CC1)C1CC1 768444646 MUGAFHVWICFNIR-HNNXBMFYSA-N 289.375 2.438 10 20 CECD C[C@@H](NCC(=O)NCc1cccs1)c1ccccc1O 879648109 YSVCXKSIASWCCS-LLVKDONJSA-N 290.388 2.421 10 20 CECD C[C@H](NCc1nnnn1-c1ccccc1)c1ccccc1O 775137818 YTAPKFPLBXIXMX-LBPRGKRZSA-N 295.346 2.219 10 20 CECD Cc1cccc(O)c1CN1CC[C@H](C(=O)N2CCCC2)C1 877529631 JODDAWHFWSXPSH-AWEZNQCLSA-N 288.391 2.145 10 20 CECD C[C@H]1NC(=O)N(c2cc(Cl)c(N)c(Cl)c2)C1=O 772127792 VKVPVKHXASVGIE-SCSAIBSYSA-N 274.107 2.020 10 20 CECD O=C(C1CC1)N1CCN(Cc2cccc(Cl)c2O)CC1 775647566 YCBXAAQXGVTZPG-UHFFFAOYSA-N 294.782 2.100 10 20 CECD Cc1cccc(O)c1CN1CCC(c2nncn2C)CC1 876608200 BSYDTPOGDJOATJ-UHFFFAOYSA-N 286.379 2.209 10 20 CECD C[C@@H]1CC[C@H](Cn2cc(COc3ccc(N)cc3)nn2)O1 881393069 HJCJWOPAWAOUML-IAQYHMDHSA-N 288.351 2.007 10 20 CECD C[C@H]1CCN(Cc2cc(F)cc(F)c2O)CC[S@@]1=O 894567040 PHGVUGFMUGIYKP-UGZDLDLSSA-N 289.347 2.013 10 20 CECD Oc1ccccc1CNCc1nc(C(F)F)no1 895727144 PGCUIZPAQKDZNQ-UHFFFAOYSA-N 255.224 2.003 10 20 CECD C[C@H](NC(=O)NCCCCCO)c1ccc(N(C)C)cc1 790812821 LPYDYVFQBBXLCZ-ZDUSSCGKSA-N 293.411 2.275 10 20 CECD Cc1cc(C)c(C(=O)O)cc1/C=C1/SC(=S)NC1=O 794928579 YDGGUVOYMKAMFJ-BJMVGYQFSA-N 293.369 2.490 10 20 CECD CCCN(CCO)Cc1ccc(N2CCCC2)cc1 1319683408 GCQFZCXHRXCNPB-UHFFFAOYSA-N 262.397 2.491 10 20 CECD CCc1cccc(CNC[C@@H](CO)C(C)C)c1O 691452704 MHCZXOHIUZNZFL-AWEZNQCLSA-N 251.370 2.309 10 20 CECD CS[C@@H](CO)[C@H](C)NCc1cccc(Cl)c1O 224857296 YIZRZCDUJWIREW-KWQFWETISA-N 275.801 2.248 10 20 CECD CC[C@H]1CCN(c2nnc(-c3sccc3O)n2C)C1 1339452653 BEDPFLAFFOIJGI-VIFPVBQESA-N 278.381 2.486 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@]1(C)CC1(F)F 817546059 BVDZNAASQHJSSN-GFCCVEGCSA-N 255.264 2.396 10 20 CECD CC[C@H](CCO)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1605022661 XLYNQWATQOJRMO-WDEREUQCSA-N 281.352 2.150 10 20 CECD C[C@@H](CC(=O)O)NCc1cc(Cl)cc(F)c1O 1609888356 IINUOWUWHQVMAT-LURJTMIESA-N 261.680 2.138 10 20 CECD C[C@H]1NCCC[C@H]1NCc1ccc(Br)cc1O 1579499428 PVMDBXVFXKCDMD-BXKDBHETSA-N 299.212 2.385 10 20 CECD Cc1cccc(CNC(=O)CN(C)c2ccc(N)cc2)c1 1579760682 MPGNFUQIFBDBIN-UHFFFAOYSA-N 283.375 2.330 10 20 CECD O=C(O)c1cccc(C(=O)N2Cc3cccc(O)c3C2)c1 1595240889 NZRDZTYEXYECGQ-UHFFFAOYSA-N 283.283 2.246 10 20 CECD CC[C@H](NCC[C@@H](C)F)c1cccc(-c2nn[nH]n2)c1O 1590468149 SWPSFSPKHGHQLP-SKDRFNHKSA-N 293.346 2.361 10 20 CECD CCOCCOCCN[C@H](C)c1ccc(N(C)C)cc1 927091104 VAPVFSRMUUZENN-CQSZACIVSA-N 280.412 2.456 10 20 CECD COc1cccc(CNCC2(O)CCCCC2)c1O 112204814 UPIIIUHRGFPHAH-UHFFFAOYSA-N 265.353 2.186 10 20 CECD C[C@@](O)(CNCc1ccc2c(c1)CCO2)C(F)(F)F 270578095 WAIBQOPPIKMYBF-GFCCVEGCSA-N 275.270 2.024 10 20 CECD CCOC[C@H](C)NCc1ccc(N2CCOCC2)cc1 44690217 IEFNKMDOBZOJOA-AWEZNQCLSA-N 278.396 2.038 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](CN(C)C)C2)c1O 184693361 NQVLTMOVFFOIBU-NSHDSACASA-N 298.814 2.438 10 20 CECD CC[C@@H](C)C[C@H](N)C(=O)NCc1ccc(N(C)C)cc1 401001276 KMAWTVBIMPIKCE-DOMZBBRYSA-N 277.412 2.132 10 20 CECD COc1ccc(O)c(CN[C@H]2CS[C@@H](C)C2)c1 397962964 ISFXLPLUKNATKP-GXSJLCMTSA-N 253.367 2.384 10 20 CECD CN(C)c1ccc(CN[C@@H](C(=O)O)C2CCC2)cc1 399247017 GOOSDIKHBMVLOH-CQSZACIVSA-N 262.353 2.096 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)[C@@](C)(C(=O)O)C1 1600543068 GPZCZAUNYMZODZ-NHYWBVRUSA-N 263.337 2.243 10 20 CECD CN(C)c1ccc(CNC(=O)NCC2CCC2)cc1F 69720464 KUGVBCOPZZFCQY-UHFFFAOYSA-N 279.359 2.491 10 20 CECD COc1cccc(CNC(=O)[C@H](C)C(C)C)c1O 172159632 RVZDPLNVDQXUAV-SNVBAGLBSA-N 251.326 2.309 10 20 CECD CCCn1cc(NC(=O)Cc2ccc(N)cc2)ccc1=O 37766170 ZPLSHKNIFJTDSA-UHFFFAOYSA-N 285.347 2.022 10 20 CECD COc1ccncc1NC(=O)/C=C/c1ccc(O)c(O)c1 180999975 ZRIZYKOXWDWDFC-HWKANZROSA-N 286.287 2.153 10 20 CECD COCc1nc(C)cc(NCc2cccc(OC)c2O)n1 80677740 DAUHEIXVZYCJBS-UHFFFAOYSA-N 289.335 2.258 10 20 CECD CCOc1cccc(CN(C)C[C@@H]2CCC[C@@H]2O)c1O 91899238 LWXZFXDKTSYYTR-JSGCOSHPSA-N 279.380 2.384 10 20 CECD OC[C@@H]1[C@H]2CN(Cc3ccc(N4CCCCC4)cc3)C[C@H]21 367838353 CVSRNLMQAIWGHQ-PIIMJCKOSA-N 286.419 2.347 10 20 CECD COCC[C@@](C)(O)CN[C@H](C)c1ccc(C)c(C)c1O 273581533 MTLGGLRZRUQPDU-CZUORRHYSA-N 281.396 2.447 10 20 CECD CCOc1ccc(O)c(CN(CCCOC)CCOC)c1 271113386 FYKINUCORIICEK-UHFFFAOYSA-N 297.395 2.276 10 20 CECD CC1(C)CCC[C@@]1(O)CNCc1cc2c(cc1O)OCO2 293104975 YAFAUHFZHXLKAU-MRXNPFEDSA-N 293.363 2.152 10 20 CECD Cc1cc(CN(CCO)C(C)C)ccc1N(C)C 293387259 GREIEZMDYLODOE-UHFFFAOYSA-N 250.386 2.264 10 20 CECD C[C@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1cccc(C(F)(F)F)c1O 817977939 RVAPVPJSADPCBV-QAHWYCSRSA-N 286.297 2.279 10 20 CECD C[C@@H]1C[C@@H](CO)CN(Cc2c(O)cccc2Cl)C1 817413327 WKPKYSJEJLZCIT-GHMZBOCLSA-N 269.772 2.496 10 20 CECD Cc1cc(CN(C)[C@@H]2CCCCNC2=O)ccc1N(C)C 815037578 OZUWSGKICJILKN-MRXNPFEDSA-N 289.423 2.162 10 20 CECD CCOc1ccc(CN2C[C@H](C)[C@@](C)(CO)C2)c(O)c1 827699582 JITRWYPCKSVLPW-BLLLJJGKSA-N 279.380 2.241 10 20 CECD C[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@@H]1O2)c1ccc(N(C)C)cc1 837543545 XJZQBJHTVDQHOQ-MPESAESLSA-N 288.391 2.497 10 20 CECD Cc1cc(O)c(CN=c2nc[nH]n2C(C)C)cc1C 840886291 AOXHLWSYFWBXCD-UHFFFAOYSA-N 260.341 2.215 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCC(C)(C)N)c1 843490063 WZSDIFSPMJJYDI-JTQLQIEISA-N 280.368 2.096 10 20 CECD Cc1ccc(O)c(CN2CCNC[C@H]2c2ccncc2)c1 843120472 MFKSOCUWHCPQRN-INIZCTEOSA-N 283.375 2.242 10 20 CECD CC[C@H](C)C[C@H](C)NC(=O)C(=O)Nc1ccc(N)cc1 841049569 LHIYKLBIIZTRIN-QWRGUYRKSA-N 277.368 2.148 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCC[C@@H]1CN 841028522 AKLMIUAEZYZEEJ-CZUORRHYSA-N 261.413 2.278 10 20 CECD CC[C@@H](O)CCNCc1ccc(N(C)C)cc1C 840937435 SWDXJGXYCPTKKF-OAHLLOKOSA-N 250.386 2.312 10 20 CECD CC(=O)C(=O)COc1cc(C(F)(F)F)ccc1F 840212400 JIAXPRSRGFOCLK-UHFFFAOYSA-N 264.174 2.381 10 20 CECD CC(C)C(=O)N1CCC(C(=O)Nc2ccc(N)cc2)CC1 746478619 HEYHSOBYUZUQIA-UHFFFAOYSA-N 289.379 2.102 10 20 CECD COCC[C@@H](CO)N[C@H](C)c1ccc(Cl)cc1O 841751633 IIZZJGHCFJJQLO-KOLCDFICSA-N 273.760 2.094 10 20 CECD COC[C@@H](C)CNC(=O)N[C@H](C)c1ccccc1O 868213673 MKYGCZZWVOQUAA-WDEREUQCSA-N 266.341 2.035 10 20 CECD CCC[C@H](CNC(=O)NCc1cc(C)ccc1O)OC 858500338 BMBFYXWZHBCHLC-CYBMUJFWSA-N 280.368 2.315 10 20 CECD CCOc1cccc(/C=C2\SC(=S)N(C)C2=O)n1 763105290 BLUZBVLOFMOSIU-CLFYSBASSA-N 280.374 2.311 10 20 CECD Cc1cc(NC(=O)NCCc2ccc(O)c(O)c2)sn1 761648657 ATYLKPAKZAUNGJ-UHFFFAOYSA-N 293.348 2.227 10 20 CECD O=C(NCC1(CO)CCCCC1)c1cc(O)cs1 762880792 UTTHDYSFRKNFSQ-UHFFFAOYSA-N 269.366 2.126 10 20 CECD COCCCN(CCOC)Cc1c(C)cccc1O 876626724 GSKJHSAGMDONOT-UHFFFAOYSA-N 267.369 2.186 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NOC1CCCCC1 779316557 FXFFFSUAJAQSLX-VQHVLOKHSA-N 277.320 2.492 10 20 CECD Cc1cccc(O)c1CN1CCN(Cc2ccncc2)CC1 877169737 UIPQYCBJCSPYKQ-UHFFFAOYSA-N 297.402 2.413 10 20 CECD COC(=O)CCCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 776268638 FALWOVAVISRBTA-GFCCVEGCSA-N 292.379 2.273 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC(F)CC2)cc1 883077255 DQHLPGMGHFEQOO-UHFFFAOYSA-N 279.359 2.396 10 20 CECD COC1CCN(CCN[C@H](C)c2ccccc2O)CC1 783518534 DJGQQEWVVJTQPP-CYBMUJFWSA-N 278.396 2.154 10 20 CECD Nc1ccc(CN2CCN3CCOc4cccc2c43)cc1 1120269634 WOUVKGWYEKNUKY-UHFFFAOYSA-N 281.359 2.488 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)N(C)C[C@@H]2C)c1O 894487279 HTUSTQLWBBVADF-STQMWFEESA-N 278.396 2.234 10 20 CECD COc1ccc(CNC(=O)N[C@@H](C)CCSC)c(O)c1 792952329 XYEKDSTTYMIZOT-JTQLQIEISA-N 298.408 2.342 10 20 CECD COc1ccc(CNC(=O)CCc2cscn2)c(O)c1 794384221 XJBBMWKFWRTVRK-UHFFFAOYSA-N 292.360 2.106 10 20 CECD CCCC(=O)NCCC1=CCN(c2cc(F)ncn2)CC1 1089804261 AKFJELFGXYOYIC-UHFFFAOYSA-N 292.358 2.059 10 20 CECD Nc1ccc(N2C[C@@H]3C[C@H](C2)Cn2c3cccc2=O)cc1 56895844 JWWKHJDBUXNPRY-OLZOCXBDSA-N 281.359 2.054 10 20 CECD Nc1ccc(CN2CCC[C@@H]([C@H]3CCCNC3)C2)cc1 1235426951 MAISPCTYJKDBEU-JKSUJKDBSA-N 273.424 2.480 10 20 CECD O=C1CCCN1C1CN(Cc2ccc(N3CCCC3)cc2)C1 1333827287 RCZIEJRFENXUBC-UHFFFAOYSA-N 299.418 2.093 10 20 CECD Nc1ccc(CCNC(=O)N2C[C@H]3CCC[C@H]2C3)cc1 1336125554 UGSMEWYAKBTEMJ-ZFWWWQNUSA-N 273.380 2.395 10 20 CECD CCOC(=O)[C@H](CC1CC1)NCc1ccc(N)cc1 1337838932 VXCVXQYOUXYHJE-AWEZNQCLSA-N 262.353 2.090 10 20 CECD CC(C)CN1CCC[C@H]1C(=O)Nc1ccc(N)cc1 1340461932 KYMAPJGRALSPQM-AWEZNQCLSA-N 261.369 2.328 10 20 CECD CCC(CC)(CNC(=O)NCc1ccc(N)cc1)OC 1353403903 AMFLMBFVBSSSEB-UHFFFAOYSA-N 279.384 2.273 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@@H](C)[C@H](C(=O)O)C2)c1 1600163392 KTEPCXVPPYRRSB-DGCLKSJQSA-N 263.337 2.162 10 20 CECD Cc1oc(C(=O)O)cc1C(=O)NCc1c(O)cccc1F 1600826613 ZCOHXVUDKINBSY-UHFFFAOYSA-N 293.250 2.061 10 20 CECD O=C(O)c1cnc(SCc2nc(C(F)F)no2)s1 1610862467 DTKWAIUKSFYTJZ-UHFFFAOYSA-N 293.276 2.454 10 20 CECD CCOC(=O)C[C@H](NCc1ccc(N)cc1)C(F)(F)F 1577943403 HFSMIKRONKNVCO-NSHDSACASA-N 290.285 2.243 10 20 CECD CCc1oc(/C=C2/SC(=S)N(C)C2=O)cc1C(=O)O 1597791518 NWPPMTIDSJQYBY-WEVVVXLNSA-N 297.357 2.371 10 20 CECD C[C@@H](C(=O)O)[C@@H]1CCCN1Cc1ccc(N(C)C)cc1 1776224908 VBDQQURIBTYKBN-DOMZBBRYSA-N 276.380 2.438 10 20 CECD COc1cccc(CN2CCC[C@@H]2C(C)(C)O)c1O 154415628 GJEUBXXHPWEUGZ-CYBMUJFWSA-N 265.353 2.136 10 20 CECD CN(C)c1ccc(CN2CCC[C@H]2C(C)(C)O)cc1 154448206 FVJAGDOCNLXYPC-HNNXBMFYSA-N 262.397 2.488 10 20 CECD CC[C@H](NCCO[C@@H]1CCOC1)c1ccccc1O 927080445 KVJZACDLWWFPJK-OCCSQVGLSA-N 265.353 2.238 10 20 CECD COc1cccc(CN[C@]2(C)CCO[C@H]2C)c1O 230154045 WPKFLCTWONQEEX-IINYFYTJSA-N 251.326 2.058 10 20 CECD CCN1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)CC1 37322524 MWOZZAFYFJAKAG-UHFFFAOYSA-N 296.798 2.386 10 20 CECD CCN(Cc1ccncc1)C(=O)Cc1ccc(N)cc1 37822690 CQAXUJUWHXEURW-UHFFFAOYSA-N 269.348 2.255 10 20 CECD CCOc1cccc(CN[C@H]2CCN(C3CC3)C2)c1O 44684293 ROHSCOACBWCSFK-ZDUSSCGKSA-N 276.380 2.117 10 20 CECD CO[C@@H]1[C@@H]2C[C@@H]3[C@@H]1N(Cc1cc(F)ccc1O)C[C@@H]3C2 289777726 RNLBQEWWDFBERV-VSGLDEAGSA-N 277.339 2.387 10 20 CECD C[C@H]1CCC[C@@]1(O)CNCc1ccc(N(C)C)cc1 293165403 VWXRMZPUCKVILD-XJKSGUPXSA-N 262.397 2.393 10 20 CECD COc1ccc(O)c(CNC2CCC(N(C)C)CC2)c1 715490398 JPXWJKGAOCTHGK-UHFFFAOYSA-N 278.396 2.363 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H](CO)C(C)C)c1 394028017 IFBNLBJBWGTOMR-VXGBXAGGSA-N 267.369 2.316 10 20 CECD c1csc(SCCCNc2ncnc3[nH]ncc23)n1 301278934 LTFYVKPQIIJLBY-UHFFFAOYSA-N 292.393 2.404 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn[nH]c1C 70983588 GFXONVBLQQLVPO-UHFFFAOYSA-N 286.379 2.446 10 20 CECD OC[C@H]1C=C[C@@H](NCc2c(O)cccc2Cl)C1 129685159 JTSFTGZBROPMEF-VHSXEESVSA-N 253.729 2.072 10 20 CECD Cc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)nc1 180633394 XPQWUHBLEDTLCM-QPJJXVBHSA-N 270.288 2.453 10 20 CECD OCCO[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 180175712 VZQRWYJKPOHIEG-LBPRGKRZSA-N 285.771 2.019 10 20 CECD CCCNC(=O)CCN[C@@H](C)c1ccc(C)cc1O 45072329 VNSMIVMQDKBLQZ-LBPRGKRZSA-N 264.369 2.268 10 20 CECD CC1(NCc2ccc(N3CCOCC3)cc2)CCOCC1 131139496 WKZMKEMMKPRRQP-UHFFFAOYSA-N 290.407 2.182 10 20 CECD CC[C@@]1(C(=O)O)CCCN(Cc2ccccc2O)C1 86784438 YLWSWBARFSRVGK-OAHLLOKOSA-N 263.337 2.469 10 20 CECD C[C@@]1(CN)CCN(Cc2cc(Cl)ccc2O)C1 383389521 JQCUNBMBEBSYKU-ZDUSSCGKSA-N 254.761 2.216 10 20 CECD CC[C@H](NC[C@H]1CN2CCC[C@H]2CO1)c1ccccc1O 252563683 XLXYGFSLQLLGIG-DZKIICNBSA-N 290.407 2.296 10 20 CECD C[C@@H]1CCN(CC(=O)N(C)Cc2ccc(N(C)C)cc2)C1 263678957 HUVSDNYHEUCGRZ-CQSZACIVSA-N 289.423 2.053 10 20 CECD COc1cc(O)c(CN2CCC[C@](C)(O)CC2)cc1OC 279685607 PFYXHYNKQKMYMU-INIZCTEOSA-N 295.379 2.146 10 20 CECD C[C@H](NC[C@H](O)C1CCOCC1)c1cc(Cl)ccc1O 273480124 LWPRGSSUKXYJCD-BONVTDFDSA-N 299.798 2.484 10 20 CECD CC[C@H](NCC1(O)CCN(C)CC1)c1ccc(F)cc1O 285929056 FDNXTSCFLNXTFT-AWEZNQCLSA-N 296.386 2.029 10 20 CECD Cc1cc(O)c(CN2CC(OC(=O)NC(C)C)C2)cc1C 297494776 VKCTYMXXKJAZHP-UHFFFAOYSA-N 292.379 2.328 10 20 CECD O=Cc1c[nH]c(C(=O)NCc2ccc(N3CCCC3)cc2)c1 293568297 SNBFOIKGGJMZGS-UHFFFAOYSA-N 297.358 2.357 10 20 CECD CCN(CCOCCO)Cc1c(O)ccc(Cl)c1F 800531952 INADACMKVPZLJT-UHFFFAOYSA-N 291.750 2.016 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@H]2CCCC[C@@H]2N)cc1 296698309 IBELCDYCLAHTBA-ZBFHGGJFSA-N 289.423 2.276 10 20 CECD C[C@H](NC[C@@H]1CCCCN1)c1cc(F)cc(F)c1O 817948935 FLVNHHVVQQNSLP-ONGXEEELSA-N 270.323 2.463 10 20 CECD C[C@@H](N[C@H]1CCCNCC1)c1cc(F)cc(F)c1O 817969201 RQDGZVJSTWGYBE-KOLCDFICSA-N 270.323 2.463 10 20 CECD CCOc1cccc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)c1O 824837880 JJONAXQGVJSSKQ-KBUPBQIOSA-N 287.359 2.176 10 20 CECD CC(C)[C@@H](C(=O)NCc1ccc(N(C)C)c(F)c1)[C@H](C)N 827901608 RYLHNBXKNMEFLS-XHDPSFHLSA-N 295.402 2.127 10 20 CECD NCC[C@H](NCc1ccc2c(c1)CCCO2)C(F)F 904355469 RZRSZDPOAQWVBH-LBPRGKRZSA-N 270.323 2.084 10 20 CECD C[C@H](NCC[C@H](O)C1CC1)c1cc([N+](=O)[O-])ccc1O 903409462 XCSOYEFCWORQQM-ZANVPECISA-N 280.324 2.112 10 20 CECD COc1cccc(CNC(=O)/C=C(\C)Cl)c1O 901127525 KBHSJVLBNHHQES-SOFGYWHQSA-N 255.701 2.160 10 20 CECD C[C@@H]1C[C@@H](NC[C@]2(C)CCC(=O)N2)c2c(O)ccc(F)c21 834909427 RLWKKRBDSSANQA-RDGWCUKFSA-N 292.354 2.338 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cnn(CC2CC2)c1 588406845 VWZMXFQNXDIMHZ-XQRVVYSFSA-N 299.330 2.356 10 20 CECD Cc1csc([C@H](C)CNC(=O)Cc2ccc(N)cc2)n1 831952560 JSGJEMBFGXKXMG-SNVBAGLBSA-N 289.404 2.496 10 20 CECD CN(Cc1nc(-c2cccnc2)no1)Cc1ccccc1O 734148586 ATXSBPWXXMRQKW-UHFFFAOYSA-N 296.330 2.469 10 20 CECD Cc1cccc2c1N[C@@H](c1cc([N+](=O)[O-])ccc1O)NC2=O 914579762 TYXXJCOELVFQCJ-CQSZACIVSA-N 299.286 2.463 10 20 CECD CCN(C)c1ccc(CNC2(CO)CCSCC2)cc1 839179753 PECMZEBIFJNIGW-UHFFFAOYSA-N 294.464 2.490 10 20 CECD COC(=O)N[C@H](C)Cc1ccc(N(C)C)cc1C 840558425 YCBILBHJNZISAK-LLVKDONJSA-N 250.342 2.348 10 20 CECD CCO/C=C\C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 841187039 PLHJYQFCWGUCTA-WEHUKYGOSA-N 262.353 2.480 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@@H](F)C2)c1O 846119961 LKBNEDHZMNROKY-SNVBAGLBSA-N 284.287 2.243 10 20 CECD CCNC(=S)N[C@H](C)Cc1ccc(N(C)C)cc1C 840871506 ZQSVTTUBNUVPDZ-GFCCVEGCSA-N 279.453 2.476 10 20 CECD CO[C@@](C)(C1CC1)[C@@H](C)NCc1cc2c(cc1O)OCO2 840961777 ZEDCBUQRMFPLNL-QLJPJBMISA-N 293.363 2.414 10 20 CECD COc1ccc(O)c(CN2C[C@H](N)Cc3ccccc32)c1 841106314 JQIZLWZFHOBYPK-CQSZACIVSA-N 284.359 2.291 10 20 CECD CN(C)c1ccc(CNC(=O)CCn2cccc2)cc1F 746018329 BVAYGMPCZFERQM-UHFFFAOYSA-N 289.354 2.400 10 20 CECD NC(=O)c1ccc(CNCc2ccc3c(c2)CCCO3)cc1 921481193 DFEQZDUQQWABLP-UHFFFAOYSA-N 296.370 2.400 10 20 CECD C[C@@H]1C[C@@H](N[C@@H]2CCCN(C)C2=O)c2c(O)ccc(F)c21 756637194 HCXGVRWFIPUXGB-YUSALJHKSA-N 292.354 2.290 10 20 CECD CN(CCc1cccnc1)c1ccc2c(c1)OCO2 756647106 YKNQYXDEMIGEOP-UHFFFAOYSA-N 256.305 2.489 10 20 CECD Cc1cc(NC(=O)NCc2ccccc2O)nnc1C 758244094 SDIMISBELJRFPZ-UHFFFAOYSA-N 272.308 2.121 10 20 CECD CC1(C)C[C@]1(C)NC(=O)/C=C\c1ccc(O)c(O)c1 856138438 YNXZATBZECJFFF-PKYBCLHXSA-N 261.321 2.416 10 20 CECD C[C@H](NC[C@@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 850544536 HKIJRRQOEUQIBV-JQWIXIFHSA-N 294.351 2.360 10 20 CECD CCc1nocc1C(=O)NCc1ccc(N(C)C)cc1 854271495 JFGNJXHUIAJOQP-UHFFFAOYSA-N 273.336 2.233 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CCOC2)c2c(O)ccc(F)c21 756768100 JKRBQEIVVNALIN-KKZNHRDASA-N 251.301 2.458 10 20 CECD COC(=O)c1cnc(SCCc2cnoc2)s1 863342058 YBDMKQWOMNBZPD-UHFFFAOYSA-N 270.335 2.253 10 20 CECD Cc1ccc(O)c(CNC(=O)C(F)(F)C(F)F)c1 862757977 KTXSUMDEFRUWOC-UHFFFAOYSA-N 265.206 2.217 10 20 CECD CO[C@H]1C[C@H](NC(=O)c2cc(C)n(-c3ccccn3)c2C)C1 863666840 ALTCHUVFGCCKSO-HDJSIYSDSA-N 299.374 2.396 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1cccnc1[N+](=O)[O-] 762799790 AXKDZEULARSVQI-VIFPVBQESA-N 289.291 2.444 10 20 CECD COc1cccc(O)c1CN1CCC[C@H]1C[C@@H](C)O 769451865 NWQDOJBGISCRIS-NEPJUHHUSA-N 265.353 2.136 10 20 CECD C[C@H](NC(=O)NCCCCCC(=O)O)c1ccccc1O 874403765 SAIIGKIJBCWDBI-NSHDSACASA-N 294.351 2.397 10 20 CECD Cc1ccc(CN(C)CCCn2ccnc2)c(O)c1 877527603 MDFCNMOBHPGTCM-UHFFFAOYSA-N 259.353 2.419 10 20 CECD COc1ccc(CNC[C@@H]2CCCCN2C(C)=O)cc1C 959842064 OZZBSRPGGXJUJS-INIZCTEOSA-N 290.407 2.494 10 20 CECD C[C@@H](CN[C@H](C)c1c(O)cccc1F)CN(C)C 886613763 DRQHJVKMBJRYBN-WDEREUQCSA-N 254.349 2.380 10 20 CECD CC[C@H](NC(=O)NCc1cccc(OC)c1O)C(F)F 881010919 PBWCXLFYUQERRE-VIFPVBQESA-N 288.294 2.244 10 20 CECD C[C@@H](NC(=O)c1c(F)ccc(O)c1O)c1ccccn1 789938967 KCLNILOSGRFRQC-MRVPVSSYSA-N 276.267 2.123 10 20 CECD CC[C@@H]1CO[C@H](C)CN1Cc1ccc(OC)c(OC)c1O 891475488 GLXYSRKSSRENTE-DGCLKSJQSA-N 295.379 2.409 10 20 CECD CCOC(=O)[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 893867256 TWRFHKGCBDTIIE-SNVBAGLBSA-N 299.317 2.446 10 20 CECD CC[C@H](N[C@H]1CCN(C)C1)c1ccc(F)cc1O 796748349 UNGJBFKNONQWKG-AAEUAGOBSA-N 252.333 2.276 10 20 CECD COc1ccc2c(c1)CCCN2Cc1n[nH]c(C)n1 794271642 NUXBJYUPVXDCTJ-UHFFFAOYSA-N 258.325 2.075 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@H](C(=O)O)CC2)cc1 1332000332 XJBUXRPZSFBYLH-OKILXGFUSA-N 276.380 2.486 10 20 CECD C[C@@]1(CNCc2cc(F)cc(F)c2O)CCCO1 708438228 WGZRGTBSCPSRPW-ZDUSSCGKSA-N 257.280 2.329 10 20 CECD OC[C@@H](Cc1ccccc1)NCc1ccccc1O 63218154 IQSMBJVFCKJXSZ-OAHLLOKOSA-N 257.333 2.085 10 20 CECD CN(C)c1ccc(CN2CCSC[C@H]2CC(=O)O)cc1 91133331 RUKGKACHTNXCAW-CQSZACIVSA-N 294.420 2.145 10 20 CECD C[C@H](Cn1ccnc1)N[C@H](C)c1cc(F)ccc1O 94617560 GNYIBNMUYZJYDL-GHMZBOCLSA-N 263.316 2.467 10 20 CECD CCn1ncnc1CN[C@@H](C)c1ccc(N(C)C)cc1 785808129 IUOJTQOUTCEFRZ-LBPRGKRZSA-N 273.384 2.215 10 20 CECD CON(CC(C)(C)C)C(=O)NCc1ccc(N)cc1 1353538793 BVCKFIBPBZNADD-UHFFFAOYSA-N 265.357 2.388 10 20 CECD CCOCCN1CCN(Cc2cc(C)cc(C)c2O)CC1 164315887 UZHKPNVVVUTMLA-UHFFFAOYSA-N 292.423 2.163 10 20 CECD CC[C@@H](C)CS(=O)(=O)N(C)Cc1ccccc1O 151260454 LSVUCDXKARQSLL-LLVKDONJSA-N 271.382 2.200 10 20 CECD OC[C@@H](CC(F)F)NCc1ccc2c(c1)CCCO2 922059239 JRLMSECNCGDLQA-GFCCVEGCSA-N 271.307 2.117 10 20 CECD COc1cccc(O)c1CN[C@H](C)CCCCO 824655680 YTUXBNXDVGDEPH-LLVKDONJSA-N 253.342 2.042 10 20 CECD CCC[C@H](CCO)CNCc1cc(OC)ccc1O 224876621 RXIRSTYMVCMMLA-GFCCVEGCSA-N 267.369 2.289 10 20 CECD CO[C@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)C1(C)C 227828889 UEZUFNSCRTZZPT-KGLIPLIRSA-N 279.336 2.024 10 20 CECD CO[C@H]1C[C@H](NCc2cc3c(cc2O)OCO3)C1(C)C 227828898 UEZUFNSCRTZZPT-KBPBESRZSA-N 279.336 2.024 10 20 CECD O=C(NC[C@H]1Cc2ccccc21)c1cccc(O)c1O 126468795 ZIWBSDYMXVCCMD-LLVKDONJSA-N 269.300 2.168 10 20 CECD CN1CCC[C@@H]2CN(Cc3ccc(N)cc3)CC[C@@H]21 167470171 GDRLRKQZJWBIHM-ZBFHGGJFSA-N 259.397 2.185 10 20 CECD CC(C)(CN1CCCC1)NC(=O)Nc1ccc(N)cc1 308666893 MQYKHCLHKAAFNG-UHFFFAOYSA-N 276.384 2.265 10 20 CECD Oc1ccc(Cl)cc1CNCCc1cnccn1 390059962 PQABEBKOSNKJCX-UHFFFAOYSA-N 263.728 2.168 10 20 CECD CC(=O)c1cc(Cl)cc(Cn2ccnc2)c1O 176997503 UDDFNPWANMQDSL-UHFFFAOYSA-N 250.685 2.493 10 20 CECD CC1CCN(C(=O)[C@@H](C)N(C)Cc2ccccc2O)CC1 109771875 HGEYRKZSIBIZQE-CQSZACIVSA-N 290.407 2.471 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)OC)cc1 55446564 UJEZHZHFVFYJBW-LBPRGKRZSA-N 264.369 2.184 10 20 CECD C[C@](O)(CNCc1c(O)cccc1Cl)C1CC1 310433812 QVPZOVFSYCOAKM-ZDUSSCGKSA-N 255.745 2.296 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)C3CCC3)C2)cc1 62575107 SONBFFCOMLCVJH-CYBMUJFWSA-N 288.391 2.438 10 20 CECD CN1C(=O)CN(C(=O)/C=C/c2cccnc2)c2ccccc21 178197920 ZAVHRKCYVAYXQL-CMDGGOBGSA-N 293.326 2.104 10 20 CECD C[S@@](=O)c1ccc(NC(=O)c2cccc(O)c2O)cc1 185738834 FVLVFDZTBUBTHF-HXUWFJFHSA-N 291.328 2.088 10 20 CECD CN(C(=O)c1cccc(O)c1O)C(C1CC1)C1CC1 188324901 NLGFOGDYXGVQSF-UHFFFAOYSA-N 261.321 2.358 10 20 CECD CO[C@H](C)CNC(=O)c1cc(C)n(-c2ccccn2)c1C 189091012 DYWDSGXAJJEJRI-GFCCVEGCSA-N 287.363 2.254 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1ccc(N(C)C)cc1 182331736 FSKVAUXMRBKJNC-MRXNPFEDSA-N 275.396 2.373 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)[C@@H](C)N2CCOCC2)c1 185375780 XOCRHWQWKABQPJ-RBSFLKMASA-N 292.423 2.460 10 20 CECD CCNC(=O)CN(CC)Cc1cc(Cl)ccc1O 133612573 JACDNNXRUJZAAL-UHFFFAOYSA-N 270.760 2.004 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ccnc(C(N)=O)c1 132290851 DMDJKEQWBZLYLA-UHFFFAOYSA-N 284.363 2.167 10 20 CECD CCN(CCO)Cc1cc(Br)cc(C)c1O 132477200 NDJGYBRCMODVFW-UHFFFAOYSA-N 288.185 2.277 10 20 CECD CCOC(=O)CCN(Cc1cccc(OC)c1O)C1CC1 92532370 CWYKEYPEGKFARD-UHFFFAOYSA-N 293.363 2.318 10 20 CECD CN(C)c1ccc(CNC(=O)NCCc2ccncc2)cc1 268585827 PAVCBMYAKCDAJE-UHFFFAOYSA-N 298.390 2.190 10 20 CECD CCOCCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273426009 UDCNRYVILGHBMC-JTQLQIEISA-N 268.313 2.378 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCC[C@@H](C)CO)c1 273458024 HMOCWVUVROLPPV-VXGBXAGGSA-N 295.379 2.238 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](CO)CC(C)C)c1 273408991 PDDZRWCXZNRKOV-YPMHNXCESA-N 295.379 2.236 10 20 CECD COC(=O)c1cnc(SC[C@@H](O)C(C)C)s1 298179260 GKFKUIOLLXHGRF-SSDOTTSWSA-N 261.368 2.039 10 20 CECD CC(=O)N1CCC[C@H](CN[C@@H](C)c2cc(F)ccc2O)C1 280939611 IRVILVLIDOQSGH-WCQYABFASA-N 294.370 2.440 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C(C)(F)F)c1 808462144 UHOZWBGDQVRWOW-ZETCQYMHSA-N 259.252 2.233 10 20 CECD COc1cccc(CNC(=O)NCc2occc2C)c1O 292078380 LXIDRQVJJKMZGL-UHFFFAOYSA-N 290.319 2.302 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C(C)(F)F 808463331 BATDHCIRSMFXLX-UHFFFAOYSA-N 256.296 2.332 10 20 CECD CCOc1ccc(O)c(CNCC[C@H](C)CCO)c1 295150694 RAXSXQLSJMECLF-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](C)CSC 808095572 KEUSSXPZODQZMN-JTQLQIEISA-N 288.409 2.493 10 20 CECD COc1ccc(O)c(CN[C@@H](C)COC(C)C)c1 800238249 QTBWMGJQQNDZBX-NSHDSACASA-N 253.342 2.304 10 20 CECD C[C@@H](NC[C@@H]1CCCNC1)c1ccc(F)cc1O 817945954 OHYFCOLFXNSAQK-GHMZBOCLSA-N 252.333 2.182 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@](C)(O)C2CCC2)c1 813489357 WWBVOKFCBCFMQX-HWPZZCPQSA-N 293.363 2.129 10 20 CECD CC(=O)NC1CCN(Cc2ccc(N(C)C)c(C)c2)CC1 815031461 UNUMJSJTQVNQHD-UHFFFAOYSA-N 289.423 2.162 10 20 CECD CN1CC[C@@H]2CN(Cc3cccc(Cl)c3O)C[C@@H]21 824893502 TYLIPJRMXAFAHI-MFKMUULPSA-N 266.772 2.182 10 20 CECD COc1ccc(N2CC[C@@H](CNC3CC(OC)C3)C2)cc1 822494030 DTNFZMZOEVGQDB-CBCUQQMYSA-N 290.407 2.289 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H]2CCCC[C@]2(C)N)cc1 825973930 TUVLFSZMPNLRNX-RDJZCZTQSA-N 289.423 2.276 10 20 CECD Cc1cc(CCNC(=O)CCO)c(C)n1-c1ccccc1 902782965 LIFKDTUWHHAQAT-UHFFFAOYSA-N 286.375 2.135 10 20 CECD O=C1NC(=S)S/C1=C\c1cnc2ccc(Cl)cn12 737444946 WCZDPWRYMZUCSP-BAQGIRSFSA-N 295.776 2.477 10 20 CECD CN(C)Cc1csc(NC(=O)c2cc(O)cs2)n1 839791454 KHJAKMVJPGFZIQ-UHFFFAOYSA-N 283.378 2.224 10 20 CECD CN(C)c1ccc(CNC(=O)OCCCF)cc1F 841480768 RGHTVELGSPQKKA-UHFFFAOYSA-N 272.295 2.478 10 20 CECD COC/C(C)=C/C(=O)N(C)Cc1ccc(N(C)C)cc1 845115597 SNROPMVQXPNMID-JLHYYAGUSA-N 276.380 2.304 10 20 CECD CC[C@H](N)CNC(=O)NCc1ccc(N(CC)CC)cc1 841717544 KJNZVHZZRJXWSI-AWEZNQCLSA-N 292.427 2.069 10 20 CECD COc1cccc(CN2CCC([C@@H]3CCNC3)CC2)c1O 843127086 OJCAFKFURUUSNK-CQSZACIVSA-N 290.407 2.222 10 20 CECD C[C@H](N)C[C@H](C)NCc1cc(Cl)cc(F)c1O 843129059 LYMHNQONIDBXFC-YUMQZZPRSA-N 260.740 2.400 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@@H](O)C(F)(F)F)c1 866463374 NGQLYBXMURKFPW-JOAULVNJSA-N 293.285 2.363 10 20 CECD CCCNCCNC1CCN(c2ccc(OC)cc2)CC1 841046650 KMNIVYVSFLDWQT-UHFFFAOYSA-N 291.439 2.253 10 20 CECD CC(=O)N1CCN(Cc2ccc(N(C)C)cc2C)[C@H](C)C1 840918600 WPBKPSXKEPMMQE-CQSZACIVSA-N 289.423 2.114 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCN(C)OC)cc1 850481130 XMOMXWKCZAFNCG-CYBMUJFWSA-N 265.401 2.287 10 20 CECD C[S@](=O)[C@H]1CCC[C@@H](NCc2ccc3c(c2)CCO3)C1 850356129 NKIYFLVIUAACNS-SIFCLUCFSA-N 293.432 2.401 10 20 CECD C[C@H](N[C@@H](C(N)=O)c1ccccc1)c1ccc(F)cc1O 756380294 GRDCNQWIGYEZNL-ZUZCIYMTSA-N 288.322 2.409 10 20 CECD CC[C@](C)(NCc1ccc(OC)c(C)c1)C(=O)OC 930151110 CZYVCHWPCHJDBQ-HNNXBMFYSA-N 265.353 2.435 10 20 CECD Cc1noc(C2CC2)c1C(=O)NCc1ccccc1O 752595390 DSDNJJPOWKIJAG-UHFFFAOYSA-N 272.304 2.496 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCn2ccnc2C1 877429143 CDUUZGKYSHIYJF-LBPRGKRZSA-N 257.337 2.002 10 20 CECD CC1(F)CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 872692014 VAQXYZYQGDINHH-CYBMUJFWSA-N 281.327 2.142 10 20 CECD O=C(N[C@@H](CO)c1ccc(F)cc1)c1cc(O)cs1 778511762 RPDIATJSWBKSAF-NSHDSACASA-N 281.308 2.056 10 20 CECD CCN(C)c1ccc(CN2CCC[C@]23CCOC3=O)cc1 773845905 JSCVVKRNHJDAAN-QGZVFWFLSA-N 288.391 2.424 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CC[C@H](C)C2)c1O 780791480 CXUVIQIZKDLMLY-CMPLNLGQSA-N 278.352 2.389 10 20 CECD Oc1c(F)cc(F)cc1CN1[C@H]2CC[C@H]1CC(O)C2 893920555 CIZFCZGWPZILQA-QWRGUYRKSA-N 269.291 2.158 10 20 CECD COCC[C@H](C)CNCc1cc(C)cc(OC)c1O 894992184 YEUIHMPIYQLLIE-NSHDSACASA-N 267.369 2.471 10 20 CECD Cn1cc(CCNCc2ccc3c(c2)CCCO3)cn1 1332337728 YXRSBOWXQJDYSK-UHFFFAOYSA-N 271.364 2.077 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OC[C@@H]1CCC[C@@H](O)C1 795491574 SQVZEXDICREPHH-WFMXKNRHSA-N 292.331 2.205 10 20 CECD COc1ccc(NC(=O)c2cccc(O)c2O)c(C)n1 185846147 VDEVMQKKJOLIPE-UHFFFAOYSA-N 274.276 2.062 10 20 CECD CC(C)[C@H](N[C@@H](C)c1cc(F)ccc1O)C(=O)O 94617947 SUQGWBWBFBJLMQ-UFBFGSQYSA-N 255.289 2.291 10 20 CECD CC[C@H](CCO)CNCc1ccc(N(C)C)cc1 94949091 QBDJLLZTJFWWQA-CYBMUJFWSA-N 250.386 2.251 10 20 CECD COC(=O)N(C)CCN[C@@H](C)c1ccc(C)cc1O 689583941 KQVKNXAIQAIXOC-NSHDSACASA-N 266.341 2.049 10 20 CECD Oc1cccc(Br)c1CNCCOCCF 706813139 SROIOPBAQIAQID-UHFFFAOYSA-N 292.148 2.230 10 20 CECD Cc1ncncc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 1320546112 SGEWQMWKSPSTNE-LLVKDONJSA-N 284.363 2.342 10 20 CECD CC[C@H]1CN(Cc2ccc(N)cc2)[C@H](CC)CN1C(C)=O 1336116965 JJOANUVVXQRVEU-SJORKVTESA-N 289.423 2.490 10 20 CECD CCN(Cc1c(O)cccc1OC)C[C@H]1CCOC1 768521736 UOCGOTUXHIBRPZ-GFCCVEGCSA-N 265.353 2.259 10 20 CECD C[C@H]1CN(Cc2ccc(N)cc2)CCN1CC(F)(F)F 1334774830 PUMXRABAPNETSG-NSHDSACASA-N 287.329 2.337 10 20 CECD O=C1CCc2nc(NCCc3ccc(O)c(O)c3)ccc21 1261208399 RVXLDRBRBLXIOM-UHFFFAOYSA-N 284.315 2.276 10 20 CECD CC[C@H](NCCN1CCC(CO)CC1)c1ccccc1O 1342930748 FNRIFQJXUKTSLB-INIZCTEOSA-N 292.423 2.137 10 20 CECD COCCn1cc(CN[C@H](C)c2c(O)cccc2F)cn1 1350086710 UXNODAOAZLWSQP-LLVKDONJSA-N 293.342 2.225 10 20 CECD Cn1c(CNCc2cccc(Cl)c2O)ccc1C(=O)O 1600916129 NODTYWRMMSXVEY-UHFFFAOYSA-N 294.738 2.372 10 20 CECD C[C@H](N[C@H]1COC[C@H]1C1CC1)c1cc(C(=O)O)ccc1O 1604331124 ZOAJIIKXOZCYPW-HERUPUMHSA-N 291.347 2.166 10 20 CECD CO[C@@H]1CC[C@H](N[C@H](C)c2cc(C(=O)O)ccc2O)C1 1599104435 NVXYFOOUPHRZHK-ADEWGFFLSA-N 279.336 2.309 10 20 CECD C[C@H](C(=O)NCCc1ccc(N)cc1)N1CCCCCC1 152501576 ZLKHZCOMTBSRKS-CQSZACIVSA-N 289.423 2.192 10 20 CECD COc1ccc(O)c(CN[C@@H]2C[C@H](OC)C2(C)C)c1 224894953 AOKZKBWVCCZFKB-KGLIPLIRSA-N 265.353 2.304 10 20 CECD CC(C)(C)OC(=O)N1CC(NCc2cc(F)ccc2O)C1 226613417 NPGUUZCHDPKFOR-UHFFFAOYSA-N 296.342 2.240 10 20 CECD COCCN(C)Cc1cc(Cl)cc(OC)c1O 228590972 SWPRAALMDYHZLH-UHFFFAOYSA-N 259.733 2.132 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](C)[C@H](C)N 156574571 JMGLBQOKJYOMHE-STQMWFEESA-N 277.412 2.084 10 20 CECD CC(C)OCCCN(C)Cc1cc2c(cc1O)OCO2 265872728 JSMSFKYBXHTXFK-UHFFFAOYSA-N 281.352 2.368 10 20 CECD CC[C@H](NCC1([S@](C)=O)CC1)c1ccccc1O 282504005 YIXAUYMSDLWTMN-SGTLLEGYSA-N 267.394 2.344 10 20 CECD CC[C@H](NCC1([S@@](C)=O)CC1)c1ccccc1O 282504000 YIXAUYMSDLWTMN-KPZWWZAWSA-N 267.394 2.344 10 20 CECD CN[C@H](CC(C)(C)C)C(=O)NCc1ccccc1O 387604827 WYUFSJSCPFWUFR-GFCCVEGCSA-N 264.369 2.033 10 20 CECD CCN(C[C@H]1CCCN1)c1ccc(OC)c(OC)c1 903431473 VXUFTFDUIJHFBX-GFCCVEGCSA-N 264.369 2.282 10 20 CECD CCc1cccc(CNCC2CC3(C2)OCCO3)c1O 896909662 WMQYZPTZDWDCSY-UHFFFAOYSA-N 277.364 2.197 10 20 CECD CCC[C@@](C)(O)C(=O)NCc1ccc(N2CCCC2)cc1 178462416 ORSTYJBKIWKVJG-QGZVFWFLSA-N 290.407 2.454 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H]2CCCO2)c1 170900713 DIGHETLKZIDBHY-JQWIXIFHSA-N 279.336 2.147 10 20 CECD CN(C)c1ccc(CNc2cccc(-n3cnnn3)c2)cc1 121571074 CPVYYRKLWLWSKA-UHFFFAOYSA-N 294.362 2.340 10 20 CECD COc1ccc(O)c(CN2CCC3(CC2)C[C@H]3C(=O)O)c1 405316684 AVIHUWHCMSZEGW-ZDUSSCGKSA-N 291.347 2.088 10 20 CECD C[C@@H](CO[C@H]1CCOC1)N[C@@H](C)c1cc(F)ccc1O 185674149 YSKWLTZHDGPNJF-GVXVVHGQSA-N 283.343 2.376 10 20 CECD CCCN1CCCN(Cc2ccc(N(C)C)cc2)CC1=O 189204189 JKTRALNIEDKAPO-UHFFFAOYSA-N 289.423 2.197 10 20 CECD CC[C@H](C)[C@@H](C)C(=O)NCCc1ccc(O)c(O)c1 184232486 PEYBOYLMCQOWOY-WDEREUQCSA-N 265.353 2.439 10 20 CECD C[C@H]1CN(C(=O)Cc2ccc(N)cc2)C[C@@H](C)S1 70381536 QXDVVJIDNWOPHF-PHIMTYICSA-N 264.394 2.164 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)CC[C@H](C)O)c1O 135821978 XCTPEGDQZXIWKF-VIFPVBQESA-N 285.771 2.451 10 20 CECD Oc1ccccc1CNC[C@@H]1CSCCS1 131148326 YNIFQIIJFZYYJI-LLVKDONJSA-N 255.408 2.330 10 20 CECD CC(C)N1CC[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 89729016 ROMNGQXXKAVRHQ-XJKSGUPXSA-N 289.423 2.413 10 20 CECD C[C@H](NCCCCCO)c1ccc(F)c(F)c1O 192925120 XETOFSHYBGULPB-VIFPVBQESA-N 259.296 2.484 10 20 CECD C[C@@H](O)c1ccc(CNC(=O)c2cccc(O)c2O)cc1 192989786 MCMAOCBREYWMNS-SNVBAGLBSA-N 287.315 2.081 10 20 CECD Cc1ccc(/C=C2/SC(N3CCOCC3)=NC2=O)s1 96875378 GQVYAJWAMQZXCO-DHZHZOJOSA-N 294.401 2.359 10 20 CECD C[C@H](NC(=O)N(C)Cc1ccccc1O)[C@@H]1CCCCO1 272177837 ZTGVLVWBOPPAAP-WFASDCNBSA-N 292.379 2.491 10 20 CECD C[C@H]1CCC[C@@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272476608 QGAFXYYMGZUUPG-HFBQQIDPSA-N 261.321 2.416 10 20 CECD CN(C)c1ccc(CNC(=O)CCc2ccc(O)nc2)cc1 279813675 XOZWZPJALJLGSC-UHFFFAOYSA-N 299.374 2.102 10 20 CECD COc1ncccc1CCNCc1cc(C)ccc1O 289422012 BPTNJQKHSKWHSH-UHFFFAOYSA-N 272.348 2.437 10 20 CECD CCCCc1ccc(C(=O)OCC(=O)C(C)=O)cc1 808490318 CITNSCXGGKHFQW-UHFFFAOYSA-N 262.305 2.344 10 20 CECD CC[C@H](NC[C@@H](N)c1ccc(N(C)C)cc1)[C@H]1CCOC1 817940428 GEWXFPVDAFAPBK-UAGQMJEPSA-N 291.439 2.157 10 20 CECD COC1([C@@H](C)NCc2cccc(C)c2O)CCOCC1 817419396 GMXHMTPLSDGXJD-CYBMUJFWSA-N 279.380 2.374 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H]2CCCC[C@H]2N)c1 818614614 CWTUEICNTKVSLR-LERXQTSPSA-N 292.379 2.099 10 20 CECD CC(C)(C)c1nnc2n1CCN(Cc1ccccc1O)C2 827792517 ABPPYRVMTDWDCG-UHFFFAOYSA-N 286.379 2.297 10 20 CECD CNC(=O)[C@@H]1CCCN(Cc2cc(Cl)c(C)cc2O)C1 824796475 ILRVJDGRWQWZHW-LLVKDONJSA-N 296.798 2.312 10 20 CECD CCOc1cccc(CN2CCC[C@H]3CN(C)C[C@H]32)c1O 822521312 ZYODXEQSAQXPFZ-DZGCQCFKSA-N 290.407 2.317 10 20 CECD C[C@@]1(C(=O)O)CCN(Cc2c(O)ccc3ccncc23)C1 828028920 IGBIFTVUUNJPMN-MRXNPFEDSA-N 286.331 2.237 10 20 CECD CCOCc1cc(CNCCC(C)(C)N)ccc1OC 903938465 BUPWSEWQUPBZDH-UHFFFAOYSA-N 280.412 2.449 10 20 CECD Cc1ccc(O)c(CNCc2cccc(-c3nn[nH]n3)c2)c1 737363869 FRHIAONMDJKPFG-UHFFFAOYSA-N 295.346 2.171 10 20 CECD CNC(=O)C[C@H](C)N[C@@H](C)c1cc2c(cc1O)CCCC2 834898692 BLSXIJLGJQVTKA-RYUDHWBXSA-N 290.407 2.446 10 20 CECD COC1([C@H](C)NCc2cc3c(cc2O)OCO3)CCC1 840970884 ZGWQNLGGKRYHQY-JTQLQIEISA-N 279.336 2.168 10 20 CECD C[C@@H]1CC(NC(=O)C(=O)Nc2ccc(N)cc2)C[C@@H](C)C1 841047301 ZLZCUTYTCMCTOH-QWRGUYRKSA-N 289.379 2.148 10 20 CECD CC[C@H](C)NC(=O)CCN[C@@H](C)c1cccc(OC)c1O 846142688 GKWNAMWIRJJTKL-RYUDHWBXSA-N 294.395 2.356 10 20 CECD C[C@H](Cc1ccccn1)NCc1cc2c(cc1O)OCO2 848567459 WBRJLUYMNSGIPZ-LLVKDONJSA-N 286.331 2.237 10 20 CECD CCOc1ccc(O)c(CN2C[C@H]3[C@H](C2)C3(F)F)c1 846113542 YMNGKXXDSVGFOS-RYUDHWBXSA-N 269.291 2.488 10 20 CECD NC[C@@H]1CC[C@@H](NCc2c(O)ccc(Cl)c2F)C1 841085224 XBVLPBPKDYZOFL-RKDXNWHRSA-N 272.751 2.402 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@@H]1[C@H]1CCCOC1 843929510 VKNMBCOYEVQIPM-WCQYABFASA-N 291.347 2.129 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCc2n[nH]cc2C1 840935004 ZPQDITZZJBPCHU-OAHLLOKOSA-N 284.407 2.431 10 20 CECD Nc1ccc(NC(=O)NCC2CCN(C3CC3)CC2)cc1 841296863 JGHWCNLKSVTACP-UHFFFAOYSA-N 288.395 2.265 10 20 CECD Cc1cc(O)c(CNCCN(C)CC(F)F)cc1C 858336223 AGPRIUMPRBIOAD-UHFFFAOYSA-N 272.339 2.296 10 20 CECD COc1ccc(N(C)CCn2ccccc2=O)c(OC)c1 752109852 HLQNPAWYOCOWLH-UHFFFAOYSA-N 288.347 2.002 10 20 CECD CCC[C@@H](CNC(=O)NCc1ccccc1O)OCC 858681254 FQTJVDGFHYRZNU-ZDUSSCGKSA-N 280.368 2.397 10 20 CECD COC[C@@](C)(CO)NCc1ccc(N2CCCCC2)cc1 865671371 AAZHECUKPKTYHK-QGZVFWFLSA-N 292.423 2.164 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ncc2n1CCCC2 866597485 TZOANLGJQRUHGC-UHFFFAOYSA-N 285.347 2.197 10 20 CECD CCOC(=O)[C@H](C)[C@H](C)NCc1c(C)cccc1O 877322713 CCHBKYJHWDKALZ-NEPJUHHUSA-N 265.353 2.378 10 20 CECD Cc1ccc(CN[C@@H]2CC(=O)N(C(C)(C)C)C2)c(O)c1 877082392 RIQMNYBDRSKSGK-CYBMUJFWSA-N 276.380 2.190 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCCNC(=O)C2)cc1 876944461 LUHFGZJJBOHDJG-HNNXBMFYSA-N 289.423 2.291 10 20 CECD Cc1ccc(O)c(CN2CCC3(CC2)C[C@H](O)CCO3)c1 897260630 IVWPPGZTNMIOHT-OAHLLOKOSA-N 291.391 2.207 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC(O)(C(F)F)CC1 894501338 WXDOLDOCQFRLMN-UHFFFAOYSA-N 293.260 2.262 10 20 CECD CC[C@@H](NC[C@H](C)S(C)(=O)=O)c1ccc(F)cc1O 796849806 WJWJTHNXMOAIQJ-JOYOIKCWSA-N 289.372 2.005 10 20 CECD CC(C)OC(=O)CC[C@H](C)NC(=O)c1cc(O)cs1 792682115 ITUXFOMZWKPJMG-VIFPVBQESA-N 285.365 2.304 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1ccc(OC)c(OC)c1O 895111606 GUCJLZQJLMQMNN-DGCLKSJQSA-N 297.395 2.296 10 20 CECD CO[C@H](C(=O)NCc1ccc(N(C)C)cc1C)C1CC1 791593804 MAJFJUYPIRNGJN-HNNXBMFYSA-N 276.380 2.102 10 20 CECD [N-]=[N+]=NCc1ccc(C(=O)N2CCOCC2)s1 1537962869 HIASKMQGTKGIPV-UHFFFAOYSA-N 252.299 2.031 10 20 CECD C[C@@H]1Cc2cc(CNC(=O)Cc3ccc(N)cc3)ccc2O1 1341160773 JEGSVHVECDZMAW-GFCCVEGCSA-N 296.370 2.451 10 20 CECD O=C(O)[C@@H](NCc1ccccc1O)c1cccs1 1601675924 GVRFXNDMQVSXJM-LBPRGKRZSA-N 263.318 2.369 10 20 CECD CN(Cc1ccccc1O)c1cc(F)ccc1-c1nn[nH]n1 1604819012 SGSZWSOGQMEIBC-UHFFFAOYSA-N 299.309 2.348 10 20 CECD Cc1ccc(O)c(CNc2cncc(C(=O)O)c2)c1 1594373300 OZLJOQZZMOKFFN-UHFFFAOYSA-N 258.277 2.406 10 20 CECD CCN(C)c1ccc(CN[C@@H](CCOC)C(=O)O)c(C)c1 1776856145 PEWSIFPKYRCYPF-HNNXBMFYSA-N 294.395 2.030 10 20 CECD CN(Cc1ccc(C(=O)O)o1)c1ccc2c(c1)OCO2 1777069988 FYSONZJPKIDRKX-UHFFFAOYSA-N 275.260 2.343 10 20 CECD COc1ccc(O)c([C@@H](C)NCCOC(C)C)c1 163985374 CIJMHMZXYPJSOS-LLVKDONJSA-N 253.342 2.476 10 20 CECD CCC[C@@H](O)CN[C@H](C)c1cc(OC)ccc1O 168771438 DGXDICSGKLLZNU-GHMZBOCLSA-N 253.342 2.212 10 20 CECD COc1cccc(CNCc2cccnc2OC)c1O 37650473 CKZBJZBYAGHMRT-UHFFFAOYSA-N 274.320 2.094 10 20 CECD CS[C@H]1CC[C@H](NC(=O)Cc2ccc(N)cc2)C1 226374497 XWTPMLYYTZAMBB-STQMWFEESA-N 264.394 2.212 10 20 CECD CN(C)c1ccc([C@H]2NC(=O)CN2Cc2ccccc2)cc1 112369978 JSOBSZRBRMZNQG-SFHVURJKSA-N 295.386 2.383 10 20 CECD CC[C@@](C)(O)CNCc1cc(Br)ccc1O 111384721 HCFIHTCDJPUHLO-GFCCVEGCSA-N 288.185 2.405 10 20 CECD O=C(NCCCSc1nccs1)N1CCCC1 115633159 DDSSRNJUICCGBE-UHFFFAOYSA-N 271.411 2.431 10 20 CECD COc1ccc(O)c([C@H](C)Nc2ncc([N+](=O)[O-])cn2)c1 302174976 WRBOWLTUZVZKAT-QMMMGPOBSA-N 290.279 2.272 10 20 CECD C[C@H](NC[C@@]1(O)CCSC1)c1ccc(F)c(F)c1O 187744937 QJKVNZLEHFXMHY-SDBXPKJASA-N 289.347 2.189 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H]([C@@H](C)O)C2)c1 136831208 XXIOTZUTVNMXAX-CHWSQXEVSA-N 279.380 2.384 10 20 CECD CC(C)N1CCC[C@@H](N(C)Cc2ccccc2O)C1=O 177716221 YJAGTQIJVRFMGE-CQSZACIVSA-N 276.380 2.223 10 20 CECD C[C@@H](NCc1cnn(C)c1)c1ccc(F)c(F)c1O 191215728 LGBCUAJWWZPKDL-MRVPVSSYSA-N 267.279 2.255 10 20 CECD C[C@@H]1OCC[C@@H]1NCc1cccc(Br)c1O 134240112 LCKQFJHWECTGSV-KWQFWETISA-N 286.169 2.422 10 20 CECD CCNC(=O)CN(Cc1ccco1)Cc1ccccc1O 96970829 WTEDRKIIMCUOKC-UHFFFAOYSA-N 288.347 2.124 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)S(=O)(=O)C1CC1 266200526 KNOCEVDNTOXGEA-UHFFFAOYSA-N 296.436 2.455 10 20 CECD CCN(CCCN1CCOCC1)c1ccc(OC)cc1 266639651 ADYWKPWKPYVPSV-UHFFFAOYSA-N 278.396 2.244 10 20 CECD CC1(C)[C@H](NC(=O)NCc2ccccc2O)[C@@H]2CCO[C@H]21 266027125 VMWKHNOTWBCKSK-IACUBPJLSA-N 290.363 2.005 10 20 CECD CN1CCOc2ccc(C(=O)NCc3ccccc3O)cc21 367395244 VVTXWGXSPDKJFB-UHFFFAOYSA-N 298.342 2.151 10 20 CECD COC[C@@H](N[C@H](C)c1cc(C(=O)OC)ccc1O)C1CC1 273460337 HXVVEYKFUNRLCA-QMTHXVAHSA-N 293.363 2.254 10 20 CECD C[C@H](NC[C@@H](O)CN1CCCC1)c1cc(Cl)ccc1O 273383858 IVOFPZIJKWOLMX-WCQYABFASA-N 298.814 2.153 10 20 CECD CCOCCOC1CN(Cc2ccc(N(C)C)c(F)c2)C1 272419358 NBGRSVNJHXMVQH-UHFFFAOYSA-N 296.386 2.129 10 20 CECD CN(C)c1ccc(CNCC2(N(C)C)CCC2)cc1F 275582653 IEIAJYPFAXLVIN-UHFFFAOYSA-N 279.403 2.466 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CO)CC2)cc1F 293845118 BFGQPPBDXSDIFM-ZDUSSCGKSA-N 280.387 2.486 10 20 CECD COc1ccc(O)c(CN(C)CCCn2ccnc2C)c1 290645721 YVLPSXXIEILCCG-UHFFFAOYSA-N 289.379 2.428 10 20 CECD Cc1cc(CN(C)CC(=O)NC(C)C)ccc1N(C)C 293562659 SBQSTNSWFCHALW-UHFFFAOYSA-N 277.412 2.017 10 20 CECD CC/C=C/CNCc1cc(OC)c(OC)cc1O 294722806 CRXQHSHOZAJQCP-AATRIKPKSA-N 251.326 2.465 10 20 CECD C[C@H]1[C@@H](N2CCCC2)CCN1C(=O)c1cc(O)cs1 807776953 JILBXJLCAOGLTH-JQWIXIFHSA-N 280.393 2.153 10 20 CECD CC[C@@H](NC[C@@H](O)COC)c1cc(Cl)ccc1O 802310511 WRRXSLXEFRJPDW-ZYHUDNBSSA-N 273.760 2.094 10 20 CECD C[C@H](NCCC1=CCNCC1)c1ccc(F)cc1O 817984807 AIJPLLNWXSAIOI-NSHDSACASA-N 264.344 2.492 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CC[C@H]2O)c2c(O)ccc(F)c21 818357987 MKQIJUMPITXDPI-CZULRBLNSA-N 251.301 2.193 10 20 CECD C[C@H](N)C[C@@H](C)NCc1ccc(N2CCSCC2)cc1 817887685 CDBBDTVYTMWYMY-UONOGXRCSA-N 293.480 2.455 10 20 CECD O=C(c1cc(O)cs1)N1C[C@H](O)C[C@H]1c1ccccc1 821161866 JLNUOIIMHNLAPJ-YPMHNXCESA-N 289.356 2.402 10 20 CECD CCOC(=O)[C@H](C(=O)N[C@H](C)c1ccccc1O)C(C)C 827917252 LUBLMQAFLGNNRE-RISCZKNCSA-N 293.363 2.405 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C[C@@H]1C[C@@H]1C 822511540 HWTSRFFOBRCTFT-JSGCOSHPSA-N 277.364 2.413 10 20 CECD COc1cccc(CNC(=O)NCCc2ccoc2)c1O 822263174 YYRKOXFXHGZUFT-UHFFFAOYSA-N 290.319 2.036 10 20 CECD CCc1oc(C(=O)O)cc1COc1ccc(C(N)=O)cc1 830394900 PUBWKQGBWCWHGH-UHFFFAOYSA-N 289.287 2.218 10 20 CECD CO[C@H]1C[C@H](NC(=O)NCc2ccccc2O)C12CCC2 838062621 WBUYDFVWFDDQPI-KBPBESRZSA-N 290.363 2.149 10 20 CECD CC(C)[C@H](CO)[C@@H](NC(=O)c1cccc(O)c1O)C(C)C 834053061 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CCc1noc(CN[C@@H](C)c2cc(OC)ccc2O)n1 775369326 OCJREDWTVZIKTF-VIFPVBQESA-N 277.324 2.197 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@]2(C)CO)cc1 773847681 OZZBDIZAWSBAAJ-INIZCTEOSA-N 262.397 2.490 10 20 CECD CCOc1ccc(N2CCN(C[C@H](C)OC)CC2)cc1 1116533557 BUACLFCZHUGADN-AWEZNQCLSA-N 278.396 2.242 10 20 CECD Cn1nc(C(C)(C)C)cc1NC(=O)c1cccc(O)c1O 1116849403 PHAXUNYWUFLPFE-UHFFFAOYSA-N 289.335 2.381 10 20 CECD COc1cccc(CN2CCC[C@@H](C(C)(C)O)C2)c1O 877796929 NIRXWXOVRMRAIR-CYBMUJFWSA-N 279.380 2.384 10 20 CECD Cc1cc(Cl)cc([C@@H](C)N[C@@H]2CCOC[C@H]2O)c1O 872140618 UDZVIXJUNJLKSM-OASPWFOLSA-N 285.771 2.154 10 20 CECD C[C@]1(NCc2cc(Cl)cc(F)c2O)CCOC1 776252893 RHMXJGBWJZPJPK-LBPRGKRZSA-N 259.708 2.453 10 20 CECD CCn1ncnc1CN1CCCc2cc(OC)ccc21 785635945 AOHWGEXGYBBYGN-UHFFFAOYSA-N 272.352 2.259 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 896963193 WBXLZBVYRWPRIM-ZDUSSCGKSA-N 294.370 2.277 10 20 CECD COc1ccc(CNC(=O)[C@H](C)CSC)c(O)c1 794387818 MKICYILCSXNMKD-SECBINFHSA-N 269.366 2.016 10 20 CECD COc1ccc(CNC(=O)c2cccc(O)c2O)c(C)c1 790891998 SSBNNJCCJMDLPD-UHFFFAOYSA-N 287.315 2.345 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCO[C@H](C)C2)c1 223169095 OREOJWVAVMPWAV-ZYHUDNBSSA-N 251.326 2.058 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCC1CCOCC1 1325049730 AJEFEGAIPWLURD-RQOWECAXSA-N 291.347 2.044 10 20 CECD O=S(=O)(Nc1ccc(O)cc1F)c1ccc(F)cc1 85203918 QKLOXICRCNBGRU-UHFFFAOYSA-N 285.271 2.471 10 20 CECD Cc1cnc(CCNC(=O)NCc2ccc(N)cc2)c(C)c1 1262588228 ZOEDPKMJAMLCNA-UHFFFAOYSA-N 298.390 2.323 10 20 CECD CC[C@@H](NC(=O)NCc1ccc(N)cc1)[C@@H]1CCCO1 1346406607 ZOELNQNNTMLDID-KGLIPLIRSA-N 277.368 2.026 10 20 CECD O=C(NCc1cccc(O)c1O)[C@H]1C[C@H]2CC[C@H]1C2 1350300717 XBMMYUOEJXGOEK-NHCYSSNCSA-N 261.321 2.150 10 20 CECD Cc1cc(O)c(CN2CC[C@@](F)(C(=O)O)C2)cc1Cl 1600285588 FOEQKEGJCDNDHB-ZDUSSCGKSA-N 287.718 2.353 10 20 CECD CCN(CC)c1ccc(CN(C)[C@H](C)C(=O)O)cc1 734843564 OMSPZFVAZDZVRG-GFCCVEGCSA-N 264.369 2.438 10 20 CECD CO[C@@H]1CCC[C@H]1N[C@@H](C)c1cc(C(=O)O)ccc1O 1599321399 DUKSRKZLNUYWBV-MRCXROJRSA-N 279.336 2.309 10 20 CECD Cn1nccc1CCNCc1c(O)cccc1Cl 231033868 KIVHSTNSHXLQTK-UHFFFAOYSA-N 265.744 2.111 10 20 CECD COc1ccc(O)c([C@@H](C)NCCOCC(F)F)c1 189844203 XBMSJIIINAJENH-SECBINFHSA-N 275.295 2.333 10 20 CECD C[C@H](NCCC1CC(O)C1)c1cc(F)ccc1O 702450875 MXEITNDFDSWTRP-BMQDGWLCSA-N 253.317 2.343 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)O[C@@H](C)C(N)=O 52179603 NSCSUIHZJCCZOJ-JTQLQIEISA-N 292.360 2.186 10 20 CECD CCOC(=O)CN(Cc1cc(OC)ccc1O)CC(C)C 179752018 QLFMDOWPNOAFCG-UHFFFAOYSA-N 295.379 2.422 10 20 CECD CCOCCC(=O)NCc1ccc(N2CCCC2)cc1 170849862 GBSOJIIFLRWARB-UHFFFAOYSA-N 276.380 2.330 10 20 CECD COc1cc(O)c(CN2C[C@@H]3[C@@H](C2)C3(C)C)cc1OC 179445123 UBDKTDMMIKBJKC-VXGBXAGGSA-N 277.364 2.497 10 20 CECD Cc1cccc(CN(C)CC(=O)OC(C)(C)C)c1O 179945673 YJZRIMUMVLTWKK-UHFFFAOYSA-N 265.353 2.474 10 20 CECD CC[C@H](SC)C(=O)NCc1cccc(OC)c1O 125110982 CRSMDQSQBIMBHH-NSHDSACASA-N 269.366 2.159 10 20 CECD CNc1nc(C(=O)NCc2ccc(N(C)C)cc2)cs1 153656484 QBHBQHNPOJPAPE-UHFFFAOYSA-N 290.392 2.181 10 20 CECD CSC[C@@H](CCO)N[C@@H](C)c1ccccc1O 183527111 JJOAUJUPCYVZDI-WDEREUQCSA-N 255.383 2.157 10 20 CECD C[C@@H]1CN(Cc2cc(Br)ccc2O)C[C@@H](C)N1 212466867 QDWNCWOOKKQAAM-NXEZZACHSA-N 299.212 2.337 10 20 CECD CC[C@@H](CSC)NC(=O)NCc1cc(OC)ccc1O 183629136 SNCQZCOHYKIEHF-NSHDSACASA-N 298.408 2.342 10 20 CECD CCOc1cccc(CN(CC)CCOC)c1O 133270309 GUBPVNWJUZXRAL-UHFFFAOYSA-N 253.342 2.259 10 20 CECD Oc1ccc(Br)cc1CNC[C@@H](O)C1CC1 226953513 JNEORTWVXLJAGK-GFCCVEGCSA-N 286.169 2.015 10 20 CECD CN(C)c1ccc(CNC(=O)c2ncc(F)cc2F)cc1 192091455 IJVRNAGEOZBHMK-UHFFFAOYSA-N 291.301 2.356 10 20 CECD COc1ccc(CNCC2(SC)CC2)c(O)c1 193653673 NGJMTPDJMNQKKA-UHFFFAOYSA-N 253.367 2.386 10 20 CECD C[C@H](NCC1(CO)CCOCC1)c1ccc(N(C)C)cc1 90662176 VXRWUXGYEZOSDT-AWEZNQCLSA-N 292.423 2.192 10 20 CECD Cn1cnc([N+](=O)[O-])c1NCc1ccc(N2CC=CC2)cc1 265793707 AETRWUWKRUEZKL-UHFFFAOYSA-N 299.334 2.317 10 20 CECD COc1cc(O)c(CN[C@H]2CCO[C@@H](C)C2)cc1OC 271794260 HQRSXLQFHNRNSX-JQWIXIFHSA-N 281.352 2.067 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2c(O)cccc2Cl)C1 274592635 NROYETQXYBKBGN-SNVBAGLBSA-N 298.770 2.366 10 20 CECD COc1ccc(O)c(CN2CCC[C@](C)(O)CC2)c1 279736166 WRIXKMCQKOKRSV-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)c1ccc(C)c(O)c1O)OC 296269206 WWFXSFDOYXWQQS-JOYOIKCWSA-N 281.352 2.197 10 20 CECD CCC(C)(C)N(C)CC(=O)NCc1ccc(N(C)C)cc1 298719934 UOOPDOSZRGJXMW-UHFFFAOYSA-N 291.439 2.489 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@]1(C)CC1(F)F 817559521 VAEWCLNTSXWQTB-OQPBUACISA-N 285.290 2.190 10 20 CECD CCN(C)c1ccc(CN2C[C@@H](CO)OC(C)(C)C2)cc1 817279791 UTZGPBZAFRBBNT-INIZCTEOSA-N 292.423 2.114 10 20 CECD CC(=O)C1(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1 816180548 SLNLEOLDSCEWAR-LLVKDONJSA-N 274.364 2.299 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)Cc2cnn(C)c2)c1 825045561 HBNFKRPAMFZQTD-NEPJUHHUSA-N 289.379 2.416 10 20 CECD C[C@H]1CCC[C@H]1CNC(=O)c1c(F)ccc(O)c1O 831190926 LHDKIWNDGMDTOL-IUCAKERBSA-N 267.300 2.403 10 20 CECD C[C@@H]1C[C@@H]1C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 833597123 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C[C@H](NCCN1CCO[C@H](C)C1)c1cc(Cl)ccc1O 756544544 KDTYWIQAEJZKIF-NEPJUHHUSA-N 298.814 2.417 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](C)S(C)(=O)=O)c(O)c1C 756770261 VHQWWBUATGECTC-PWSUYJOCSA-N 285.409 2.093 10 20 CECD Cc1cc(NC(=O)COc2ccc(N(C)C)cc2)no1 757701079 ACTYCJGMWMTOFF-UHFFFAOYSA-N 275.308 2.067 10 20 CECD COC[C@@H](NCc1cc(F)cc(C(C)=O)c1O)C(C)C 754386094 UEIWGPRYVLYGJY-CQSZACIVSA-N 283.343 2.495 10 20 CECD CN1CCN(c2ccc(CNC3CC(F)(F)C3)cc2)CC1 758593166 JWVWJUBQMYDEGQ-UHFFFAOYSA-N 295.377 2.326 10 20 CECD COC/C=C\C(=O)NCc1c(O)ccc2c1CCCC2 866770816 GDKZSERVJVJYIS-DAXSKMNVSA-N 275.348 2.090 10 20 CECD CCOc1ccc(CN[C@@](C)(CC)CCO)c(O)c1 761973272 KSNWYUJEBDKZNR-HNNXBMFYSA-N 267.369 2.432 10 20 CECD COCC[C@H](C)NC(=O)N[C@H](C)c1ccccc1O 868192415 KYCLJNXQFGFYCX-WDEREUQCSA-N 266.341 2.177 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C3CC3)n(C)n2)c1 862760967 YCWPLQFLAKYVKB-UHFFFAOYSA-N 285.347 2.242 10 20 CECD CCc1cccc(CN[C@H](C)[C@H](O)C(F)(F)F)c1O 877693776 QSEQFLOBQWCHAQ-PELKAZGASA-N 277.286 2.356 10 20 CECD Cc1ccc(CN[C@H]2CCN(c3ccccn3)C2)c(O)c1 877121222 LTETXLBSQDXVKB-HNNXBMFYSA-N 283.375 2.464 10 20 CECD CC(C)N(C)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775409334 FMWLVVHFCZNKPN-ZDUSSCGKSA-N 277.412 2.270 10 20 CECD CSCCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773144184 FDJNJHMUVUFVLU-LLVKDONJSA-N 281.425 2.476 10 20 CECD O=C1C[C@@H](C(=O)NCc2ccc(O)c(O)c2)c2ccccc21 789815492 DIZNQPVSQPTYTF-CYBMUJFWSA-N 297.310 2.084 10 20 CECD C[C@@H](O)CCCNCc1c(O)ccc(Cl)c1F 788524903 YNQBAAZLLAEVFH-MRVPVSSYSA-N 261.724 2.435 10 20 CECD COC[C@@H](C)CNCc1ccc(N(C)C)cc1C 783626939 DCRRYFAUFOAWOD-LBPRGKRZSA-N 250.386 2.433 10 20 CECD CC[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ncc[nH]1 785420990 JBHTVDRJHRKTPB-VLWUPBBWSA-N 287.319 2.102 10 20 CECD Nc1ccc(CN2CCC([C@@H]3CCCNC3)CC2)cc1 1120269614 VVLJOJRQOXIRHT-MRXNPFEDSA-N 273.424 2.480 10 20 CECD CCOc1ccc(N2CCN(Cc3cn[nH]c3)CC2)cc1 1203100834 JUNLQGDQKANTOG-UHFFFAOYSA-N 286.379 2.131 10 20 CECD COc1cc(Cl)cc(CN2C[C@H](O)C(C)(C)C2)c1O 790936445 CVKAHIXSIDAKQB-LBPRGKRZSA-N 285.771 2.257 10 20 CECD CCOCC1(C(=O)NCc2ccc(N(C)C)cc2)CC1 799299035 STOXXOLBXYMATQ-UHFFFAOYSA-N 276.380 2.186 10 20 CECD C[C@@H](CCNCc1cc(F)cc(F)c1O)CC(=O)O 1334054271 GJYJFEPQJWLMKY-QMMMGPOBSA-N 273.279 2.261 10 20 CECD CCC[C@@H](CNC(=O)NCc1ccc(N)cc1)OCC 1338660775 QODIUIGEJREKAL-AWEZNQCLSA-N 279.384 2.273 10 20 CECD C[C@H](N[C@@H](C)C1(CO)CC1)c1cc(F)ccc1O 829208204 GYGCUPPLXLMMQJ-UWVGGRQHSA-N 253.317 2.343 10 20 CECD C[C@H](N=c1nc[nH]n1CC1CC1)c1ccc(N(C)C)cc1 1262691834 QQKBTEHEEQQBMU-LBPRGKRZSA-N 285.395 2.349 10 20 CECD CC(C)(C(=O)NCc1ccc(N)cc1)c1cccnc1 1342023133 SPBMIHANKNZMHK-UHFFFAOYSA-N 269.348 2.258 10 20 CECD Cc1ccc(N(C)Cc2ccccc2O)nc1C(=O)O 1607792080 RFSLKUXFZSMRSX-UHFFFAOYSA-N 272.304 2.430 10 20 CECD CC(C)(C)[C@H](NCc1ccc(F)c(F)c1O)C(=O)O 1603309496 DBYYMSKWHDYKLY-LLVKDONJSA-N 273.279 2.259 10 20 CECD COCCN(CC(=O)O)Cc1cc(C(C)C)ccc1O 1574152807 JBCBERPGQDIXQD-UHFFFAOYSA-N 281.352 2.049 10 20 CECD COc1cc(O)c(CNC(C)(C)CCC(=O)O)cc1OC 1599446538 YGTJREKUFYBRLR-UHFFFAOYSA-N 297.351 2.142 10 20 CECD CN(C)C1(C(=O)NCCCSc2nccs2)CCC1 158871993 LXDNUINOJLOWCX-UHFFFAOYSA-N 299.465 2.226 10 20 CECD CCN(CC)c1ccc(CNC(=O)C(C)(C)N)cc1F 167740131 NHVHGBMJLHJQCD-UHFFFAOYSA-N 281.375 2.025 10 20 CECD CN(C)c1ccc(CNc2ccc(C(N)=O)cc2)cc1 19911073 UMAVBUJROBYYKE-UHFFFAOYSA-N 269.348 2.464 10 20 CECD CN(C)C(=O)OC1CCN(Cc2ccccc2O)CC1 816655287 ZVDZPSBHBOWPAE-UHFFFAOYSA-N 278.352 2.055 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](CN)C[C@@H]2C)c1O 229104870 YXTZWIZYEUZUPF-VHSXEESVSA-N 284.787 2.223 10 20 CECD C[C@H](CN1CCCC1=O)NCc1cccc(Cl)c1O 124719080 WGNUDLCUEATCEC-SNVBAGLBSA-N 282.771 2.146 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCCCN(C)C2)c1 700817567 VPOIMQGUVFKYMS-CYBMUJFWSA-N 278.396 2.222 10 20 CECD CCn1cc(CN[C@@H](C)c2cc(C)ccc2O)nn1 404462389 SBSWXSKXXNDEDF-NSHDSACASA-N 260.341 2.163 10 20 CECD Nc1ccc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1 713135388 IHJWMBSSFIFSNX-RBSFLKMASA-N 258.365 2.316 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@](C)(O)C(F)F)c1 698571509 UQCFHWCHGJOEHP-SDBXPKJASA-N 275.295 2.068 10 20 CECD CCc1cc(NCc2ccc(N(C)C)cc2)n2ncnc2n1 22623349 LDEMNYLUQBKZEV-UHFFFAOYSA-N 296.378 2.365 10 20 CECD COC(=O)CC(C)(C)NCc1cc(F)cc(C(C)=O)c1O 178329719 HBQDNYRKAKQCIM-UHFFFAOYSA-N 297.326 2.165 10 20 CECD CCCC(=O)N(C)Cc1ccc(N2CCOCC2)cc1 68535563 BURAMKGOUWLYML-UHFFFAOYSA-N 276.380 2.282 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)Cc1ccon1 77247624 JXVSFFWCYGHCGS-UHFFFAOYSA-N 287.363 2.143 10 20 CECD CCN(Cc1cccc(OC)c1O)C[C@@H](O)C(F)(F)F 189863467 VBALBDCHYAAMEH-LLVKDONJSA-N 293.285 2.146 10 20 CECD Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cc(F)ccc1O)CC2 185318281 XUBWENHTKWTETL-JOYOIKCWSA-N 290.342 2.097 10 20 CECD CCCNC(=O)NCc1c(O)ccc2c1CCCC2 80612736 IHXXAWUHMUZZFB-UHFFFAOYSA-N 262.353 2.480 10 20 CECD OC[C@H](NCc1cccc(Br)c1O)C1CC1 381624558 HZYKWAMUSWONPK-NSHDSACASA-N 286.169 2.015 10 20 CECD C[C@@H](Sc1nccs1)C(=O)Nc1ncccn1 48875483 UPBJUWHQLIJVIJ-SSDOTTSWSA-N 266.351 2.052 10 20 CECD CCONC(=O)NCc1ccc(N2CCCC2)cc1 192975835 VLTJSKSFGLBYSF-UHFFFAOYSA-N 263.341 2.038 10 20 CECD Oc1cccc(Cl)c1CNC[C@H]1CC[C@@H](O)C1 236549284 DYGGNQYNPIVWDG-VHSXEESVSA-N 255.745 2.296 10 20 CECD COc1ccc(N(C)CCn2cncn2)cc1Cl 268204874 SAOOLRGBPWYNDA-UHFFFAOYSA-N 266.732 2.077 10 20 CECD COC[C@@H](C)NCc1ccc(N2CCC(CO)CC2)cc1 268803286 BRUBBOKPFVUEPJ-CQSZACIVSA-N 292.423 2.020 10 20 CECD CN(C)[C@H]1CCCN(Cc2cc(F)ccc2O)CC1 375943545 VSQNDTMWWZIMMZ-AWEZNQCLSA-N 266.360 2.447 10 20 CECD C[C@@H]1C[C@@H](CCNC(=O)c2cccc(O)c2O)CCO1 280461379 MHNJWRMQMJXUIN-MNOVXSKESA-N 279.336 2.033 10 20 CECD CN1CCC[C@@]2(CCN(Cc3cc(F)ccc3O)C2)C1 293518950 AXINUHWDWIRQOJ-MRXNPFEDSA-N 278.371 2.449 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H]2COCCO2)c(O)c1 815561484 IHKXOEZXWVJVDW-QWHCGFSZSA-N 265.353 2.075 10 20 CECD COC[C@H](O)CNc1ccccc1OC[C@@H]1CCCCO1 819423270 AKTQVGJVLZMCOB-KGLIPLIRSA-N 295.379 2.054 10 20 CECD O=C1NCCN(Cc2cc(F)ccc2O)c2ccccc21 811508402 OJDOYFLLXHFQPJ-UHFFFAOYSA-N 286.306 2.281 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2ccnc(OC)n2)c1 824548918 QGXUGEHKLWWHLA-SNVBAGLBSA-N 289.335 2.050 10 20 CECD C[C@@H]1C[C@@H]1c1cc(NC(=O)Cc2ccc(N)cc2)n[nH]1 827930177 HQXADVXCQXGAPE-SKDRFNHKSA-N 270.336 2.297 10 20 CECD Cc1cccc(CNC[C@@H]2CC(=O)N(C(C)(C)C)C2)c1O 827554584 GURDUQYJYSEFMW-ZDUSSCGKSA-N 290.407 2.437 10 20 CECD COc1ccc(N(C)C(=O)/C=C/c2cnccc2C)cn1 492542233 ZBDHDCNJGRXZPO-QPJJXVBHSA-N 283.331 2.470 10 20 CECD O=C(N[C@@H]1CCC(F)(F)C1)c1c(F)ccc(O)c1O 826993696 NAWLSINCHGCEPA-ZCFIWIBFSA-N 275.226 2.155 10 20 CECD NCC[C@H]1CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 904405649 MDAGETGFQNLGJR-VIFPVBQESA-N 299.758 2.125 10 20 CECD CN1CCC[C@]2(CCN(C(=O)c3cc(O)cs3)C2)C1 832870503 LZGCXRPZIPLMKF-AWEZNQCLSA-N 280.393 2.012 10 20 CECD CC[C@H](C)C[C@@H](NCc1ccccc1O)C(=O)O 901679352 CXQDNRJPUIKJGB-CMPLNLGQSA-N 251.326 2.371 10 20 CECD COc1ccccc1CNC(=O)c1cc(O)cs1 731863654 ANDUUARPQMXJCR-UHFFFAOYSA-N 263.318 2.392 10 20 CECD COC/C(C)=C\C(=O)NCc1ccc2c(c1)CCCN2C 844356973 JYVLCUDTEXHFOY-LCYFTJDESA-N 288.391 2.278 10 20 CECD COc1ccc2c(c1)CCCN2CN1CC[C@@H](C)C1=O 840030833 FDSUDZHUDRVGPZ-GFCCVEGCSA-N 274.364 2.274 10 20 CECD COc1cccc([C@@H](C)NC[C@H](O)C(C)C)c1O 846145203 NFAHWWSKNLDSKA-PWSUYJOCSA-N 253.342 2.068 10 20 CECD Cc1cccnc1NC(=O)NCc1ccccc1O 748325148 LPTBCERIAHJLFH-UHFFFAOYSA-N 257.293 2.417 10 20 CECD COc1ccc(CNCC[C@]2(O)CCCOC2)cc1C 846111381 SMIFDBFPPBAIPK-MRXNPFEDSA-N 279.380 2.025 10 20 CECD COC(=O)/C=C(\C)CN(C)c1ccc(OC)c(OC)c1 929348232 OMBKTOURKCENSR-DHZHZOJOSA-N 279.336 2.259 10 20 CECD CNC(=O)[C@@H]1CCC[C@@H]1N[C@H](C)c1ccc(C)cc1O 756773629 AMDAVXGQSUOMTN-BNOWGMLFSA-N 276.380 2.266 10 20 CECD Cc1cc(C)c(O)c(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c1 754732685 UTKHMXRPKJEKRT-NQCMUKECSA-N 281.421 2.350 10 20 CECD O=C(CCc1ncc[nH]1)NCc1cc(Cl)ccc1O 857548765 VCEUXWZIFHQTGB-UHFFFAOYSA-N 279.727 2.018 10 20 CECD C[C@H](NC[C@@H]1CCOC1)c1cc(F)cc(F)c1O 756461838 WGJDNMUFGHIZAG-IUCAKERBSA-N 257.280 2.358 10 20 CECD CCC[C@@H](O)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 756575558 HNCOPQCIYWQGPZ-MWLCHTKSSA-N 268.313 2.112 10 20 CECD O=C(OCc1noc(C2CCC2)n1)c1cccc(O)c1O 859641981 FLXIWYWYNIIYNL-UHFFFAOYSA-N 290.275 2.105 10 20 CECD CCC[C@H](O)C(=O)NCc1c(O)ccc2c1CCCC2 934945222 YDSFQKNQMFXALB-HNNXBMFYSA-N 277.364 2.048 10 20 CECD C[C@H](NCCN1CCCC1)c1cc(F)cc(F)c1O 756354759 CQWNXVSSVGVAJP-JTQLQIEISA-N 270.323 2.417 10 20 CECD C[C@@H](N[C@H]1C[C@@H](CO)C1)c1ccc(Cl)cc1O 866415723 CNIKDMUZUWQNKB-KKZNHRDASA-N 255.745 2.467 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)c1cncnc1 760804817 OHKOEZJARZGFLI-UHFFFAOYSA-N 296.374 2.397 10 20 CECD CC[C@](C)(OC)C(=O)NCc1cc(C)ccc1O 862756210 UAEPKQARVRBTEH-AWEZNQCLSA-N 251.326 2.132 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)Cc1cncs1 935948496 NJVOHPBWSFAIPO-UHFFFAOYSA-N 297.376 2.193 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CCO)C2)cc1F 769332371 AXQHQUCGVFNLNN-ZDUSSCGKSA-N 280.387 2.486 10 20 CECD CC[C@H](N[C@H]1CCN(C)C1)c1ccc(N(C)C)cc1 765769585 LHVHGFBIGZGCMC-HOCLYGCPSA-N 261.413 2.497 10 20 CECD CO[C@H](C)CCC(=O)NCc1cc(C)ccc1O 862757570 YUPKCJLSWJYOPA-LLVKDONJSA-N 251.326 2.132 10 20 CECD Cc1ccnn1CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 860950138 JQKBQEPPXMUEFB-ZDUSSCGKSA-N 286.379 2.135 10 20 CECD CCN(CCCN(C)C)Cc1c(C)cccc1O 877527826 SIBUEPLVBKDLSG-UHFFFAOYSA-N 250.386 2.474 10 20 CECD Cc1cccc(CN[C@H](C)[C@@H](O)C(F)(F)F)c1O 877693803 QYMQSPBZSJYRAO-LDYMZIIASA-N 263.259 2.102 10 20 CECD CCO[C@@H]1C[C@H](NCc2cc(Cl)ccc2O)[C@@H]1OC 775977399 CFSHQXZTERUFKK-YUTCNCBUSA-N 285.771 2.328 10 20 CECD Cc1cccc(O)c1CN1CCCC[C@@H]1C1OCCO1 876678632 HTMKRUYKEFCSKL-CQSZACIVSA-N 277.364 2.428 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)Cn1cnnc1 776757273 LGKXESLCYLBGEJ-UHFFFAOYSA-N 273.384 2.212 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@@H](C)COC)cc1 883157802 KQCIRPSDHFVOAF-ZDUSSCGKSA-N 293.411 2.367 10 20 CECD CN1CCC(CN[C@@H]2CCc3cccc(O)c32)CC1 389143288 SXGUCWDEFGMIIX-CQSZACIVSA-N 260.381 2.311 10 20 CECD O=C(Nc1cccc(N2CCC2=O)c1)c1cccc(O)c1O 791091754 HUIKZLCQEJCPRM-UHFFFAOYSA-N 298.298 2.087 10 20 CECD CC[C@H](N[C@H](C)[C@@H]1CN(C)CCO1)c1ccc(F)cc1O 796839550 QUSSHLYYCVIQMO-WPGHFRTFSA-N 296.386 2.291 10 20 CECD CC[C@H](NCCOCCN(C)C)c1ccc(F)cc1O 796962296 TZSMDGNLTFXBTR-AWEZNQCLSA-N 284.375 2.150 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1ccc(C)cc1O 186030283 JRNQKXLOSYITFV-VXGBXAGGSA-N 285.409 2.174 10 20 CECD Cc1cc(C(=O)Nc2c(Cl)ccc3nonc23)n(C)n1 1324859761 WYYBWIGKFIMSGH-UHFFFAOYSA-N 291.698 2.170 10 20 CECD COC(=O)C1(C)CN(Cc2cc(Cl)c(C)cc2O)C1 1333909270 WSJLHAKEWSWFSY-UHFFFAOYSA-N 283.755 2.349 10 20 CECD Cc1n[nH]c(C)c1[C@H]1COCCN1Cc1ccc(N)cc1 1336284627 AWGKJQAFGFSLQH-OAHLLOKOSA-N 286.379 2.182 10 20 CECD Cc1ccc(C(=O)NCCCC(F)F)c(O)c1O 1333625192 HPDYJTOYDURMGO-UHFFFAOYSA-N 259.252 2.181 10 20 CECD Cc1cc(O)c(CN2CCOC[C@H]2CC(=O)O)cc1Cl 1600285484 CPOVPZJQCMEKNU-LLVKDONJSA-N 299.754 2.030 10 20 CECD Cc1cc(CSc2ncc(C(=O)O)s2)ncn1 1600216393 PEQKRSBIVRHSPO-UHFFFAOYSA-N 267.335 2.232 10 20 CECD CCOc1ccc(O)c(CN(C[C@H](C)C(=O)O)C2CC2)c1 1610043100 QDDZGIIUEVCTTB-NSHDSACASA-N 293.363 2.476 10 20 CECD C[C@@](CCF)(NCc1ccc(Cl)cc1O)C(=O)O 1592505436 BPMZXPRJHARNLD-LBPRGKRZSA-N 275.707 2.338 10 20 CECD CCN(C)c1ccc(CN[C@@](C)(COC)C(=O)O)c(C)c1 1776857187 YIPSKOJVDPDWGO-INIZCTEOSA-N 294.395 2.030 10 20 CECD CN(CCc1nccs1)Cc1cc2c(cc1O)OCO2 157129840 AAAMDGIWXRKLAL-UHFFFAOYSA-N 292.360 2.252 10 20 CECD OCC1(CCNCc2ccc3c(c2)CCCO3)CC1 922161774 GYKLYMUOULHWPV-UHFFFAOYSA-N 261.365 2.264 10 20 CECD CC[C@H](NC1CCN(C(C)=O)CC1)c1ccccc1O 37138360 ITTVTAZEGLOACK-HNNXBMFYSA-N 276.380 2.444 10 20 CECD C[C@H](N[C@H](C)c1ccccc1O)C(=O)N1CCCCC1 37784234 OOTYVYHTNJISHE-OLZOCXBDSA-N 276.380 2.444 10 20 CECD C[C@@H]1CC(F)(F)CCN1C(=O)c1cccc(O)c1O 530008408 HTFXRPFFMOQYJV-MRVPVSSYSA-N 271.263 2.358 10 20 CECD CC(C)[C@@H](CO)CNCc1ccc(N(C)C)cc1 394102440 DOIRHXCDPOXOTG-CQSZACIVSA-N 250.386 2.107 10 20 CECD Cc1[nH]ncc1C(=O)NCc1ccc2c(c1)CCCN2C 57550131 HQDRZCZEAPBIMP-UHFFFAOYSA-N 284.363 2.031 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)CCN1C 174514741 WBWVGKFYQJODSP-OCCSQVGLSA-N 279.403 2.464 10 20 CECD CCOC(=O)N[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 179933110 IQJHFZRCZAXGEH-CYBMUJFWSA-N 296.342 2.242 10 20 CECD COCCN(C)Cc1cc(Cl)cc([N+](=O)[O-])c1O 127124449 ZFMXNCYKQZKUJS-UHFFFAOYSA-N 274.704 2.032 10 20 CECD CC[C@H](C(=O)NCCCSc1nccs1)N(C)C 125216866 QLJYJWBRMMVXCN-SNVBAGLBSA-N 287.454 2.082 10 20 CECD Cc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)c(O)c1 185317991 PXPFIGTYLHINSK-YPMHNXCESA-N 286.379 2.266 10 20 CECD CCN(CC)CCCCNC(=O)c1ccc(C)c(O)c1O 182438046 GDZVLMNUBFVRFO-UHFFFAOYSA-N 294.395 2.258 10 20 CECD O=C(NCc1ccccc1O)[C@H]1COc2ccccc2C1 133769319 JLFWBUKQCLYILH-CQSZACIVSA-N 283.327 2.260 10 20 CECD Cc1cccc(CN2CC[C@@H](c3nccn3C)C2)c1O 367698793 FYVWODZFXFPZIH-CQSZACIVSA-N 271.364 2.424 10 20 CECD OCCN(Cc1cccnc1)Cc1cccc(Cl)c1O 271706618 FQQRKAAMOHXAOV-UHFFFAOYSA-N 292.766 2.435 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@H]1CCCc2cn[nH]c21 272561922 BYKGZWSUZJGVIN-PZBABLGHSA-N 299.330 2.028 10 20 CECD COc1cc(O)c(CN2C[C@H](C)[C@@H](C)C2)cc1OC 271121090 YDNUUYQYDNMGEK-QWRGUYRKSA-N 265.353 2.497 10 20 CECD O=C1CCCN1[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 276815681 OQOPVEWTJGIVIX-LLVKDONJSA-N 294.782 2.242 10 20 CECD COCCCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273440145 YECLECYUWQYLDY-JTQLQIEISA-N 268.313 2.378 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCCOC 282453152 ALWHCGFVDXZVLV-UHFFFAOYSA-N 280.368 2.350 10 20 CECD Nc1ccc(CNC(=O)CCCC2CCOCC2)cc1 297259101 RKRXOHIPKNNTFI-UHFFFAOYSA-N 276.380 2.482 10 20 CECD COc1cc(O)c(CNCC2(OC)CCCC2)cc1OC 295582835 BOUIQXOUPMCGEA-UHFFFAOYSA-N 295.379 2.458 10 20 CECD COc1ccc(O)c(CN[C@H](C)COC(C)C)c1 800238248 QTBWMGJQQNDZBX-LLVKDONJSA-N 253.342 2.304 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC1(F)F 294587777 YIJIXRSHNMWGDE-LBPRGKRZSA-N 268.307 2.366 10 20 CECD CN(C)c1ccc(Cn2nc(C(F)(F)F)ccc2=O)cc1 292683749 PDWLVSQTBGBWRD-UHFFFAOYSA-N 297.280 2.376 10 20 CECD Oc1cc(F)c(Cl)cc1CN[C@H]1CCC[C@@H]1O 293696208 SSFGCKXNAFWVLY-QWRGUYRKSA-N 259.708 2.188 10 20 CECD NC[C@@H]1CCCC[C@H]1N[C@@H]1CCc2cccc(O)c21 817959507 GTXDJKTUGNJDAL-BFHYXJOUSA-N 260.381 2.487 10 20 CECD NC(=O)C[C@H](NCc1cc(F)ccc1O)c1ccccc1 816653476 UPLQFLDMKYVNLB-AWEZNQCLSA-N 288.322 2.238 10 20 CECD COC[C@@H](O)CNCc1ccc(N2CCC(C)CC2)cc1 819039816 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C[C@H](NC(=O)N[C@@H]1COC[C@@H]1C)c1ccc(N(C)C)cc1 922055139 MVPSEJPKCPAWBI-SLEUVZQESA-N 291.395 2.148 10 20 CECD CCn1cc(CN[C@@H](C)c2ccc(C)c(C)c2O)nn1 850522488 RNDYBROFGZOVRM-LBPRGKRZSA-N 274.368 2.471 10 20 CECD C[C@@H](NCCC1(C)OCCO1)c1cc([N+](=O)[O-])ccc1O 760883339 JXMNJJOQPJQJIX-SNVBAGLBSA-N 296.323 2.104 10 20 CECD COc1ccc(O)c(CNCC[C@H](O)C2CCCC2)c1 877778694 RADOWJMDCYHZTN-INIZCTEOSA-N 279.380 2.432 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@H](c1cc3c(cc1O)OCO3)N2 877862126 SOERTEHUQBMTNP-OAHLLOKOSA-N 298.298 2.283 10 20 CECD COc1cccc(O)c1CN1CCS[C@H]2COCC[C@H]21 770279153 FSCQYMXOFAFAMY-DOMZBBRYSA-N 295.404 2.107 10 20 CECD CC(C)N(C)C(=O)C1CCN(Cc2ccccc2O)CC1 770509291 KQDAYKBBLKHMTQ-UHFFFAOYSA-N 290.407 2.471 10 20 CECD CC(C)CO[C@@H](C)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773762915 LRTYQRMWPDBNBI-RYUDHWBXSA-N 295.379 2.206 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](O)CCOC(C)C)c1 788276742 UYANTEQZFMHQDV-OLZOCXBDSA-N 297.395 2.227 10 20 CECD COC(=O)CC(C)(C)NCc1cc(C)cc(OC)c1O 894391885 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CCOC(=O)N1CCN(Cc2cccc(CC)c2O)CC1 848875995 FBCJBHVDHCBIKH-UHFFFAOYSA-N 292.379 2.229 10 20 CECD CO[C@H]1CCN(C(=O)NCCc2ccc(N)cc2)[C@@H](C)C1 841958636 HIYXOBNAYHWBGE-WFASDCNBSA-N 291.395 2.020 10 20 CECD Cc1c(CCc2nc(Cc3ccc(N)cc3)no2)cnn1C 843159016 KRSODJKWMBBGFZ-UHFFFAOYSA-N 297.362 2.070 10 20 CECD C[C@H](NCCN1CCOC[C@H]1C)c1ccc(Cl)cc1O 841745735 ACAPMDFTYQNGHX-NEPJUHHUSA-N 298.814 2.417 10 20 CECD CCOc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3)c(O)c1 843054614 WTKRYGNSCAQAHB-KGLIPLIRSA-N 276.380 2.117 10 20 CECD Cc1ccc(C(=O)N2CCCC(F)(F)C2)c(O)c1O 846358460 CXXWENBIQRJTKM-UHFFFAOYSA-N 271.263 2.278 10 20 CECD COc1cc(Cl)cc(CN[C@H]2CC[C@H](CN)C2)c1O 841083244 ABBGIZPKCOAIOV-CABZTGNLSA-N 284.787 2.271 10 20 CECD CC[C@@H]1CCC[C@H]1CNC(=O)C(=O)Nc1ccc(N)cc1 841138104 UCJPEUQBUHWBAL-NEPJUHHUSA-N 289.379 2.150 10 20 CECD N[C@@H]1CCC[C@H]2CN(Cc3cccc(F)c3O)C[C@H]12 843059282 JBZZVXGKYFFZAD-VHRBIJSZSA-N 264.344 2.091 10 20 CECD C[C@@H]1CN(CCN[C@H](C)c2cc(Cl)ccc2O)CCO1 756544550 KDTYWIQAEJZKIF-VXGBXAGGSA-N 298.814 2.417 10 20 CECD CO[C@H](CNC(=O)c1cc(O)cs1)C1CCCC1 856154237 IZUMSNNDBDYDQW-LLVKDONJSA-N 269.366 2.389 10 20 CECD CCC[C@@H](O)CC(=O)N[C@H](C)c1cc(OC)ccc1O 761968209 TUOLSKUSYIYWRB-GHMZBOCLSA-N 281.352 2.129 10 20 CECD CCCCNC(=O)[C@@H](C)N[C@H](C)c1ccccc1O 879649363 RDYNGXPJHOKLML-VXGBXAGGSA-N 264.369 2.348 10 20 CECD Cc1cccc(O)c1CNCCCc1cnn(C)c1 876997507 YPXSUOQZBNTJSZ-UHFFFAOYSA-N 259.353 2.157 10 20 CECD CC(C)OC[C@H](O)CN[C@@H](C)c1ccc(N(C)C)cc1 775834087 JYAFTWUEWDHDMV-XJKSGUPXSA-N 280.412 2.189 10 20 CECD CCOc1ccc(C(=O)NCc2ccccc2O)cn1 1116315396 XJGPUFHRDUALBA-UHFFFAOYSA-N 272.304 2.116 10 20 CECD COc1cc(O)c(CNC[C@@H]2CCC[C@H]2OC)cc1OC 776257553 YFXBDDNGPIUTFU-SMDDNHRTSA-N 295.379 2.314 10 20 CECD CCN(C)c1ccc(CN2CCNC(=O)[C@H]2C(C)C)cc1 773758588 XANLEEOWLKVXSE-MRXNPFEDSA-N 289.423 2.099 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC[C@H]1CCCO1 787747500 HRGMUDSHPQDUOC-FVOPLDGLSA-N 278.304 2.223 10 20 CECD O=C(COC(=O)[C@@H]1CCCCS1)c1ccc(O)c(O)c1 784660650 OOLKMCYXKATYLR-ZDUSSCGKSA-N 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2.092 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2CC(OC)C2)c1 860241493 JXJOPRJFWHNHOU-GRZMOONWSA-N 279.336 2.003 10 20 CECD CCn1nccc1NC(=O)NCc1cc(C)ccc1O 860879677 POGBJWODCDXCFA-UHFFFAOYSA-N 274.324 2.239 10 20 CECD COC(C)(C)CCNC(=O)/C=C/c1ccc(O)c(O)c1 871257019 LWNBLDPYUUTUSJ-FNORWQNLSA-N 279.336 2.042 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)[C@H](C)CN1C 775986254 QOUNBRDGGGNPSG-UONOGXRCSA-N 261.413 2.277 10 20 CECD Cc1ccc(CN(C)Cc2nnc(C)s2)c(O)c1 877640906 HUZUAHFXUZEWFU-UHFFFAOYSA-N 263.366 2.493 10 20 CECD Cc1cccc(O)c1CNCCCN1CCCO[C@H](C)C1 877477674 HHYWXFZOFWDFGU-OAHLLOKOSA-N 292.423 2.291 10 20 CECD C[C@](O)(CNCc1cc(F)cc(F)c1O)c1ccco1 883018579 IQRZXOZDAJZIIO-AWEZNQCLSA-N 283.274 2.261 10 20 CECD C[C@H](CO[C@H]1CCOC1)N[C@H](C)c1c(O)cccc1F 886538916 PUJCNDSIRQVFAT-UTUOFQBUSA-N 283.343 2.376 10 20 CECD CCOc1ccc(CN[C@@H](COC)[C@H]2CCCO2)c(O)c1 788533860 DDLIKVBBGZAOIA-GOEBONIOSA-N 295.379 2.075 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCc1cccc(O)c1O 1123889280 OEOYPZJXHNVBCO-NHCYSSNCSA-N 261.321 2.150 10 20 CECD COc1cccc(CN(CCN(C)C)CC(C)C)c1O 132550733 UCNFNQJFGCZPBO-UHFFFAOYSA-N 280.412 2.420 10 20 CECD Oc1c(Br)cccc1CNCCOCCF 705699487 KFMCAPNUKNPUQD-UHFFFAOYSA-N 292.148 2.230 10 20 CECD CCOC(=O)CCCN(C)Cc1ccccc1O 109771129 FXZZTVULYJWXSD-UHFFFAOYSA-N 251.326 2.167 10 20 CECD CCOc1ccc(N2CCN(C(=O)[C@H](F)CC)CC2)cc1 1337147261 KLMJINIOOBNYNG-OAHLLOKOSA-N 294.370 2.482 10 20 CECD CC(C)[C@H](C(=O)O)[C@@H](C)NCc1cc([N+](=O)[O-])ccc1O 1348958255 QXIKTRORMYAHHE-RNCFNFMXSA-N 296.323 2.135 10 20 CECD CN(C)c1ccc(OCCc2cnoc2)cc1C(=O)O 1606060785 NVTBAYSXQHABBJ-UHFFFAOYSA-N 276.292 2.060 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CCCNCC2)cc1F 1578425665 LRSKCGMMBLLUFQ-CYBMUJFWSA-N 279.403 2.371 10 20 CECD Cc1c(CNC[C@H]2CCC3(CNC3)O2)n(C)c2ccccc12 1579534664 OHYPBYKDYRVLTJ-CQSZACIVSA-N 299.418 2.097 10 20 CECD CCN(C)c1ccc(CNCCOCCC(=O)O)c(C)c1 1776856361 PKOFYIGCUYDPIR-UHFFFAOYSA-N 294.395 2.032 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C(C)(C)F)c1 155988053 PARRJELGXNDOJI-MRVPVSSYSA-N 255.289 2.326 10 20 CECD c1cc2c(cc1CN[C@H]1CCCNCC1)CCCO2 904355025 KAIFPXXYYNCZCJ-HNNXBMFYSA-N 260.381 2.243 10 20 CECD Oc1ccc(F)cc1CNCCOCC(F)(F)F 226583736 XAQTWTFCVLMUGE-UHFFFAOYSA-N 267.222 2.200 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@@H]1CCc2cccc(O)c21 296666482 FPJAABBICDOWBD-AJLCLMPTSA-N 267.394 2.126 10 20 CECD C[C@H](NC[C@H](O)C1CCC1)c1ccc(F)cc1O 316068316 ZJCHXHWVTRURBC-XPTSAGLGSA-N 253.317 2.343 10 20 CECD CC[C@@H](C)[C@H](CNC(=O)Nc1ccc(N)cc1)OC 381175105 CYACWFYXMKFRAQ-MFKMUULPSA-N 265.357 2.451 10 20 CECD Oc1ccc(Cl)cc1CNCC1CC2(C1)OCCO2 922797378 DYSZAXMEHHOOKD-UHFFFAOYSA-N 283.755 2.288 10 20 CECD Nc1ccc(CC(=O)N[C@H]2CCc3ccccc3C2)cc1 51630394 XWJYYAVNHNHJQG-KRWDZBQOSA-N 280.371 2.485 10 20 CECD C[C@@H]1C[C@H]1NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 108796264 QUMXMCYDLKEUDK-MPHRNGTFSA-N 286.375 2.061 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1CCCOC1 114375514 IZCLFTVUGYQISG-SNVBAGLBSA-N 286.422 2.168 10 20 CECD C[C@@H](NCCCN1CCOC1=O)c1ccc(N(C)C)cc1 178586832 SKVMSVDLCBFUAN-CYBMUJFWSA-N 291.395 2.246 10 20 CECD Cc1ccc(O)c(CN2CCNC(=O)[C@@H]2CC(C)C)c1 188920549 AIEAFWDBHUDISF-AWEZNQCLSA-N 276.380 2.047 10 20 CECD CO[C@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)C(C)(C)C 180835895 UQEXMKMOXKPIBM-IZPAUZPXSA-N 293.363 2.288 10 20 CECD CO[C@](C)(CNCc1cc(F)ccc1O)C1CC1 291051802 NDKSDEDEABERJK-CQSZACIVSA-N 253.317 2.436 10 20 CECD COc1cccc(C(=O)NCc2ccccc2O)c1OC 133787032 UWHULYHZTKNHJH-UHFFFAOYSA-N 287.315 2.339 10 20 CECD C[C@@H]1OCCN(Cc2ccc(N3CCOCC3)cc2)[C@@H]1C 93418093 YSJKWDJUNDSTDW-CABCVRRESA-N 290.407 2.132 10 20 CECD CN(Cc1coc(S(C)(=O)=O)c1)Cc1ccccc1O 528415701 GENCMWPFOJIUKE-UHFFFAOYSA-N 295.360 2.021 10 20 CECD CC[C@@H](NC[C@H]1COCCN1)c1cc(Cl)ccc1O 530223917 IXPUBWKDZYKBMV-WCQYABFASA-N 284.787 2.075 10 20 CECD C[C@@H](CCO)NCc1cc(Br)ccc1O 164216547 GJMNNYUDTVOGQH-QMMMGPOBSA-N 274.158 2.015 10 20 CECD COc1ccc(N(C)CC(=O)N2CCC2)cc1Cl 268158875 IWXHDTUDFODEDX-UHFFFAOYSA-N 268.744 2.017 10 20 CECD Cc1nc(CCN[C@H](C)c2ccc(C)c(C)c2O)n[nH]1 273435104 LXBIPKROQIFQBS-LLVKDONJSA-N 274.368 2.329 10 20 CECD C[C@H](N[C@H](C)[C@@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O 273610365 VPQKOGHOQMRVKD-OUAUKWLOSA-N 280.324 2.376 10 20 CECD CC[C@H]1CN(Cc2c(O)cccc2Cl)C[C@H]1O 271412538 XXQROTWGFYMGEH-TVQRCGJNSA-N 255.745 2.248 10 20 CECD CCOC1CC(O)(CNCc2cc(C)c(C)cc2O)C1 277711265 MQMQASJMEHSXKM-UHFFFAOYSA-N 279.380 2.029 10 20 CECD CN(Cc1ccccc1O)Cc1ncnn1C(C)(C)C 282974748 DBAFMXHMOJHVOZ-UHFFFAOYSA-N 274.368 2.371 10 20 CECD OC/C=C/CNCc1cc(Cl)cc(Cl)c1O 717477672 GECBVYLMRODEDJ-OWOJBTEDSA-N 262.136 2.337 10 20 CECD CN(Cc1cc(F)ccc1O)[C@@H]1CC(C)(C)OC1=O 814179793 YTQRJAPZALYETI-LLVKDONJSA-N 267.300 2.057 10 20 CECD CC1(C)C[C@@H]1CNC(=O)c1c(F)ccc(O)c1O 825818742 GZDCWTCAHNQLOC-SSDOTTSWSA-N 253.273 2.013 10 20 CECD C[C@H](N[C@@H]1CCN(C(C)(C)C)C1=O)c1ccccc1O 822812848 OHEPJQQDASXVIW-WCQYABFASA-N 276.380 2.442 10 20 CECD C[C@H]1C[C@@H]1C(=O)N(CC(=O)O)Cc1cc(Cl)ccc1O 833597126 JCNLDAYVTMWBJJ-KWQFWETISA-N 297.738 2.115 10 20 CECD CCc1noc(C)c1CNC(=O)c1cc(O)cs1 832865953 ODTQZZMANGNMIU-UHFFFAOYSA-N 266.322 2.243 10 20 CECD CCN(C)c1ccc(CN(C)[C@H](C)CCO)cc1 844452634 WZJWTBNKLHEMQL-CYBMUJFWSA-N 250.386 2.345 10 20 CECD CC(C)[C@@H](NC(=O)c1cccc(O)c1O)C1(CO)CCC1 848122394 SFHNFJORMNRYRP-CQSZACIVSA-N 293.363 2.015 10 20 CECD CC1(C)CNCCN1Cc1cccc(Cl)c1O 843054568 UDCFBRNUTNSCCT-UHFFFAOYSA-N 254.761 2.229 10 20 CECD CCc1onc(C)c1NC(=O)NCCc1ccc(N)cc1 841164886 XTEBCMHWZAOIBV-UHFFFAOYSA-N 288.351 2.492 10 20 CECD CC[C@H](N[C@@H]1COC[C@H]1OC)c1ccc(N(C)C)cc1 842911891 ODQMTVHIFBGAKE-ARFHVFGLSA-N 278.396 2.207 10 20 CECD CCN1C[C@@H](CN[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 846209993 VFSILPSFIRXPDK-UONOGXRCSA-N 289.423 2.272 10 20 CECD CCCC[C@H](CN)NCc1cc(OCC)ccc1O 841030230 VCDZCCZEUKIAEU-CYBMUJFWSA-N 266.385 2.398 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Cc1cncc(O)c1 848369799 HHYDEBXHYFLORM-UHFFFAOYSA-N 299.374 2.021 10 20 CECD Cc1ccc(CNCc2ccc(N(C)C)c(F)c2)nn1 840886334 CHBZMILYMBXHJK-UHFFFAOYSA-N 274.343 2.280 10 20 CECD COc1cc(C)cc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1O 840130091 VQXLEIRTTPTILJ-LXTVHRRPSA-N 287.359 2.094 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@H](C)c1cc(F)cc(F)c1O 756773963 DFKBRZZIAZYPML-ZDSQKVDBSA-N 298.333 2.236 10 20 CECD COCC1(N[C@H](C)c2cc([N+](=O)[O-])ccc2O)CC1 756851956 XIMHKEXOELDYMX-SECBINFHSA-N 266.297 2.130 10 20 CECD Cc1ccc([C@@H](C)Nc2cnn(CCO)c2)c(O)c1 756854609 GAZZIJIWCMKWBC-LLVKDONJSA-N 261.325 2.063 10 20 CECD CN(CCNCc1cccc(Cl)c1O)CC(F)F 862550828 PYBKWHGOKPVGML-UHFFFAOYSA-N 278.730 2.332 10 20 CECD CN(CCNCc1cc(Cl)cc(F)c1O)CC(F)F 862550088 IQMLSZMBTHRNDC-UHFFFAOYSA-N 296.720 2.471 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)C1CC(O)C1 761221991 GYQOVGABINZXCY-UHFFFAOYSA-N 259.708 2.140 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCC[C@H](C(=O)N(C)C)C1 877044975 MXTJDRUKESKTIK-UONOGXRCSA-N 290.407 2.437 10 20 CECD CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@@H](C)[S@]1=O 877517407 NQGZCDWXDMSTPB-BBEGDGIKSA-N 281.421 2.432 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](OCCOC)C2)cc1 773887850 ITRHZDJXJFZOQF-KRWDZBQOSA-N 292.423 2.380 10 20 CECD OC1CCN(c2ccc(CN3CC(C(F)F)C3)cc2)CC1 877580164 GCHQRWRPASXPFP-UHFFFAOYSA-N 296.361 2.345 10 20 CECD C[C@@H](NC(=O)N1CCCOCC1)c1ccc(N(C)C)cc1 776249704 RDCMJKWJZPXVLW-CYBMUJFWSA-N 291.395 2.246 10 20 CECD C[C@@H](NCCC1CC(O)C1)c1c(O)cccc1F 886601327 PCNYZLDLOJWDOB-KPPDAEKUSA-N 253.317 2.343 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@@H](C)c1c(O)cccc1F 886619079 RSHLMESLSKJBFU-MISXGVKJSA-N 283.343 2.233 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@@H](CF)C2)cc1 883077171 AYHPAJNKMWSFOX-ZDUSSCGKSA-N 279.359 2.254 10 20 CECD CCOc1ccc(CNCC2(CO)CCC2)c(O)c1 784673674 IIUODVWYQDBFSK-UHFFFAOYSA-N 265.353 2.043 10 20 CECD CC1=NO[C@@H](CNCc2cc(F)c(N(C)C)cc2F)C1 895302164 PCKJPQLRRBTBES-LLVKDONJSA-N 283.322 2.285 10 20 CECD COc1ccc(CN2CCC(F)(F)C2)c(O)c1OC 893307403 FVRYZPFUZRQUPU-UHFFFAOYSA-N 273.279 2.250 10 20 CECD CC[C@@H](NCc1ccc(OC)c(OC)c1O)[C@H]1CCCO1 893256419 RQWIINUSCNZLHK-CHWSQXEVSA-N 295.379 2.457 10 20 CECD NC(=O)[C@@H]1CN(Cc2ccccc2O)C[C@H]1c1ccccc1 895007114 TUUVUYHOHANQAB-JKSUJKDBSA-N 296.370 2.093 10 20 CECD CC[C@H](N[C@@H]1CCC[C@H]1C(=O)NC)c1ccc(F)cc1O 796852612 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JXQGDIIGRWCKIJ-UHFFFAOYSA-N 253.342 2.303 10 20 CECD Oc1ccc(CCNc2nc(C3CC3)ns2)cc1O 92665954 RNWBKYBXZNKLJO-UHFFFAOYSA-N 277.349 2.481 10 20 CECD C[C@@H](CNC(=O)N(C)Cc1ccccc1O)N(C)C1CC1 105267338 SVMCYJLEQWHMIN-LBPRGKRZSA-N 291.395 2.016 10 20 CECD COc1ccc(O)c(CN(C)[C@@H]2CCSC2)c1 179681207 AZWFSFSQNRXMSH-LLVKDONJSA-N 253.367 2.338 10 20 CECD CC1(C)[C@@H]2CN(Cc3cc4c(cc3O)OCO4)C[C@H]21 172942037 CDGWHYDTQSACLG-GHMZBOCLSA-N 261.321 2.209 10 20 CECD COC(C)(C)CNCc1cc(Cl)cc([N+](=O)[O-])c1O 174597801 VVRGJRZKBLRJOI-UHFFFAOYSA-N 288.731 2.468 10 20 CECD CC[C@H](CCO)NC(=O)NCc1ccc(N(C)C)cc1C 77831705 YFTCICAJAJHWOV-CQSZACIVSA-N 293.411 2.021 10 20 CECD C[C@@H](CO[C@H]1CCOC1)N[C@@H](C)c1ccccc1O 183549433 BVFLYUICUUKWGM-AVGNSLFASA-N 265.353 2.237 10 20 CECD CCCOc1ccc(CN[C@H]2C[C@H](O)C2(C)C)c(O)c1 189346617 YXXVVGSRVMLFET-GJZGRUSLSA-N 279.380 2.430 10 20 CECD COCC(C)(C)C(=O)N[C@H](C)c1cc(OC)ccc1O 131502529 FUKKHPZJELZHPP-SNVBAGLBSA-N 281.352 2.251 10 20 CECD COc1ccc(O)c(CN[C@@]2(C)CCO[C@H]2C)c1 230392182 RNMATMBKPUEZEK-HZMBPMFUSA-N 251.326 2.058 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1ccc(C)c(C)c1O 273445324 DYDTXPZDFPWZFA-DGCLKSJQSA-N 299.436 2.483 10 20 CECD CC[C@@H]1CN(Cc2cc(C)ccc2O)C[C@H](C)[S@@]1=O 289831903 UGWDDIDKMGUPBM-CFZJUORYSA-N 281.421 2.432 10 20 CECD CO[C@H]1CCCN(C(=O)c2ccc(C)c(O)c2O)CC1 371687537 YZXRHRLTFSTBOG-NSHDSACASA-N 279.336 2.047 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)C[C@@H](C)[S@@]1=O 289848971 UVTRLZLKZXIKOM-GIQGCJHYSA-N 297.420 2.132 10 20 CECD CC(C)c1noc(CCC(=O)NCc2ccccc2O)n1 299583276 RKDGPINFJRTUBJ-UHFFFAOYSA-N 289.335 2.148 10 20 CECD NC(=O)C[C@H](NCc1ccc2c(c1)CCO2)c1ccccc1 293207816 YCZZNTRUDBZEIT-INIZCTEOSA-N 296.370 2.328 10 20 CECD COc1ccc(O)c(CNCc2cnc([C@@H](C)O)s2)c1 809620773 VIGCKKMOLNTYRK-SECBINFHSA-N 294.376 2.200 10 20 CECD C[C@@H](NC(=O)CCc1ncccn1)c1ccc(N(C)C)cc1 812545101 WZHZXAJEQHQNEM-CYBMUJFWSA-N 298.390 2.353 10 20 CECD C[C@@H]1C[C@H](NC[C@@H]2CNCCCO2)c2c(O)ccc(F)c21 817982504 UFNNYIZWZVEVQT-MDZLAQPJSA-N 294.370 2.048 10 20 CECD NC(=O)[C@H]1CC[C@H](CNCc2ccc3c(c2)CCO3)CC1 817413280 VOWYOEBKOUSWPV-MQMHXKEQSA-N 288.391 2.003 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC2(O)CCC2)cc1 822595464 GAZUMIHFDSOWSD-UHFFFAOYSA-N 290.407 2.454 10 20 CECD Cc1cc(Cl)cc(CN(C)[C@@H](C)C(=O)O)c1O 820976814 SDGUITNRIZVBKP-QMMMGPOBSA-N 257.717 2.259 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC[C@@H]1CCNC1 829764754 WHYIOFPIXOBVPD-CQSZACIVSA-N 289.423 2.067 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2CC[C@H](F)C2)c1O 824571946 SMQHNQWIAHRGOD-VIFPVBQESA-N 274.679 2.498 10 20 CECD Cc1c[nH]c(CC(N)=O)c1C(=O)N1C[C@H](C)c2ccccc21 900219585 ZETQVLHBGOQGDI-NSHDSACASA-N 297.358 2.115 10 20 CECD Oc1cccc2c1[C@H](NC[C@@H](O)COc1ccccc1)CC2 834502625 RKSYMSZCMJOAED-GDBMZVCRSA-N 299.370 2.409 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1c[nH]nc1C 734468089 KFQGREFHJYZSMS-UHFFFAOYSA-N 272.352 2.023 10 20 CECD CC(C)COCCC(=O)N(C)Cc1ccccc1O 917311121 FITFIUORRALWJB-UHFFFAOYSA-N 265.353 2.413 10 20 CECD NC[C@H](NCc1ccc2c(c1)CCO2)C1CCCC1 841087862 RBUVSECGWLFREE-HNNXBMFYSA-N 260.381 2.229 10 20 CECD C[C@@H]1C[C@H](NCc2cccc(Cl)c2O)CCN1 841061178 FWGQDNUZVGBHAB-MWLCHTKSSA-N 254.761 2.276 10 20 CECD C[C@H](COCC1CC1)NCc1cc(F)ccc1O 846072868 JRIFUAUMJRADND-SNVBAGLBSA-N 253.317 2.436 10 20 CECD CC[C@@H](CN(C)Cc1ccc(N2CCOCC2)cc1)OC 842146918 FBLPZSBACHXBMO-KRWDZBQOSA-N 292.423 2.380 10 20 CECD COc1cccc(CNc2ncnc3ccncc23)c1O 752636753 UTGCFQVCRYSONS-UHFFFAOYSA-N 282.303 2.351 10 20 CECD Cc1ccc(O)c(CNC(=O)CCOCC(C)C)c1 862759901 MLVAQGVECRYCCC-UHFFFAOYSA-N 265.353 2.380 10 20 CECD C/C=C/C[C@H](CO)NCc1c(O)cccc1Cl 769936076 CYZGVMQQRURFFM-VMZHVLLKSA-N 255.745 2.462 10 20 CECD CSC1(C(=O)NCc2cc(C)ccc2O)CC1 862757080 GZCKVFFKOXPUEE-UHFFFAOYSA-N 251.351 2.212 10 20 CECD COc1cc(O)c(CN2CCCOC[C@@H]2C)cc1OC 768462939 OZXQJNNKIPHMGF-NSHDSACASA-N 281.352 2.020 10 20 CECD Cc1ccc(CN[C@@H](C2CC2)[C@]2(CO)CCCO2)c(O)c1 877553588 AUHBTSYNTCHHAL-DLBZAZTESA-N 291.391 2.110 10 20 CECD CN1CCN(C(=O)/C=C\[C@H]2CCCNC2)c2ccccc21 876731219 GJHBCOZWOXHRJG-QIAWRQBBSA-N 285.391 2.025 10 20 CECD CC[C@H](CO)C(=O)NCc1ccc(N(CC)CC)cc1 779744773 SFCWPJNPEZIUMY-CQSZACIVSA-N 278.396 2.168 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H](S(C)(=O)=O)CC1 877499930 MIIJJMBUCOBOPV-ZDUSSCGKSA-N 297.420 2.100 10 20 CECD C[C@@H](NC[C@H]1C[C@@H](N)C1)c1cc(F)cc(F)c1O 873252083 PCNGKUVGLHUOET-MRTMQBJTSA-N 256.296 2.058 10 20 CECD C[C@@H](NC(=O)NCc1cc[nH]n1)c1ccc(N(C)C)cc1 773369350 UIDZGCAZCDSLHY-LLVKDONJSA-N 287.367 2.036 10 20 CECD CCN(C)c1ccc(Cn2cc(Cn3cccn3)nn2)cc1 881316661 XWPUACAXIYETLI-UHFFFAOYSA-N 296.378 2.027 10 20 CECD COc1ccc(CN[C@H](C)C(F)(F)F)c(O)c1OC 894518700 LHGOXJWSUQBTBW-SSDOTTSWSA-N 279.258 2.450 10 20 CECD O=C(N[C@@H](c1ccncc1)C1CC1)c1cccc(O)c1O 890907228 CNNUKYSGXCZDBI-CQSZACIVSA-N 284.315 2.374 10 20 CECD C[C@H](NCC1(N(C)C)CC1)c1ccc(F)cc1O 397850265 GVBFWAUPWBCYNQ-JTQLQIEISA-N 252.333 2.276 10 20 CECD C[C@H]1CCN(CCNCc2ccc(N(C)C)cc2)C1 744450059 KBWFVRDMFUZMGZ-AWEZNQCLSA-N 261.413 2.184 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cccnc2O)c1 714983875 GGGXARIGSSFMRG-SNVBAGLBSA-N 274.320 2.352 10 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2.400 10 20 CECD COc1ccc(O)c(CN[C@H]2CCS[C@H]2C)c1 310528699 YQQRPEAOPOZIPA-CABZTGNLSA-N 253.367 2.384 10 20 CECD CC(C)[C@@H](CO)CN[C@H](C)c1ccc(F)cc1O 394044440 HXLJACSHLFCPRM-GHMZBOCLSA-N 255.333 2.446 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)Cc1ncnn1C 176992506 XLUKTUMCZJDCNW-UHFFFAOYSA-N 299.422 2.437 10 20 CECD COc1ccc(N2CCCN(C(=O)C(C)C)CC2)cc1 55877507 ZWLPSFOFVDNMAF-UHFFFAOYSA-N 276.380 2.390 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccoc2C)c1 114541712 BGTQMPAPUYDLSF-UHFFFAOYSA-N 261.277 2.232 10 20 CECD CN(C)CC(=O)N(C)Cc1ccc(N2CCCCC2)cc1 171357237 PXBMVJQZKWZPFV-UHFFFAOYSA-N 289.423 2.197 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCCS2)c1 149695402 MGVZRQBGMGHHFC-LBPRGKRZSA-N 253.367 2.386 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1cccc(C#N)c1 183463230 IMCHZQZSQONECU-LLVKDONJSA-N 296.326 2.330 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@H]1CC=CCC1 156614664 KGNCDCNHBLFRSN-LBPRGKRZSA-N 261.321 2.113 10 20 CECD CC[C@H](NC(=O)c1ccc(C)c(O)c1O)[C@H]1CCCO1 182905444 METHRJGKNZCNPX-NWDGAFQWSA-N 279.336 2.094 10 20 CECD CN1CCCN(Cc2cccc(Br)c2O)CC1 211486520 CGQHMQLKPCHMEY-UHFFFAOYSA-N 299.212 2.292 10 20 CECD COC[C@H](C)CN[C@H](C)c1cc(OC)ccc1O 45656224 UIWNBNQOJSPKRQ-GHMZBOCLSA-N 253.342 2.334 10 20 CECD CNC[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 40592982 XXKVRSMLPSZEDG-LLVKDONJSA-N 268.788 2.477 10 20 CECD Cc1cc(C)c(O)c(CN2CCS(=O)(=O)CC[C@H]2C)c1 191340665 CWUOXODVIIYDSI-CYBMUJFWSA-N 297.420 2.018 10 20 CECD Cc1ccc(O)c(CN(C2CC2)[C@H](C)CS(C)(=O)=O)c1 93392891 NRFIFQSYYGKAPA-GFCCVEGCSA-N 297.420 2.098 10 20 CECD C[C@@H](NC[C@H]1COCCN1)c1ccc2ccccc2c1O 530221800 DJTSRTULJGBMSG-OCCSQVGLSA-N 286.375 2.184 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1occ2c1CCC2 802778994 LJKCZDAUYBPGFP-UHFFFAOYSA-N 287.315 2.152 10 20 CECD CNC(=O)C1CCN(Cc2ccc(N(C)C)c(C)c2)CC1 293553415 RICUWGPGDCZNEZ-UHFFFAOYSA-N 289.423 2.019 10 20 CECD Oc1c(Cl)cccc1CN1CCC[C@@H](O)CC1 294098038 RXZWRWNDGBMVAV-LLVKDONJSA-N 255.745 2.392 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H](CO)CC2)cc1F 293845108 BFGQPPBDXSDIFM-CYBMUJFWSA-N 280.387 2.486 10 20 CECD CN(CCC1CC1)C(=O)c1c(F)ccc(O)c1O 295473816 PEZHPAJIKBSQRY-UHFFFAOYSA-N 253.273 2.109 10 20 CECD C[C@H]1Cc2c[nH]nc2[C@H](C(=O)NCc2ccccc2O)C1 816911964 FQAVWAYIRVGWBC-GXFFZTMASA-N 285.347 2.098 10 20 CECD CC[C@@H](NCC1(N)CCC1)c1ccc(F)cc1O 817964773 IFEHIAOLLPUVJF-GFCCVEGCSA-N 252.333 2.453 10 20 CECD CC[C@H](NCCNCCOC)c1ccc(N(C)C)cc1 817965047 OBAFITVXNKWERW-INIZCTEOSA-N 279.428 2.029 10 20 CECD Cc1cc(O)c(CN(CC(N)=O)C(C)C)cc1Cl 824522472 OXXXQZVEBOYRTM-UHFFFAOYSA-N 270.760 2.050 10 20 CECD CCOc1cccc(CN[C@@H](C)c2nc(C)no2)c1O 729684760 VTGHDJLCTLHKEG-VIFPVBQESA-N 277.324 2.333 10 20 CECD CCC(CC)(CC(=O)O)NCc1cc2c(cc1O)OCO2 828799529 DWRYGKKFDJWZBQ-UHFFFAOYSA-N 295.335 2.244 10 20 CECD C[C@]1(C(=O)O)CCN(Cc2cccc(Cl)c2O)C1 833554496 UVFXJBLNTYVORO-ZDUSSCGKSA-N 269.728 2.342 10 20 CECD CN(C)c1ccc(CN[C@@H](CC(F)F)C(=O)O)cc1F 901811284 DTIAVLUDFXTWDK-JTQLQIEISA-N 290.285 2.090 10 20 CECD COCC1CCC(NC(=O)c2c(F)ccc(O)c2O)CC1 839855077 YBQJTLDEUJYASR-UHFFFAOYSA-N 297.326 2.172 10 20 CECD CC[C@@](C)(CC(=O)OC)NCc1ccccc1O 748242536 OVFQIUDMZWFTGI-AWEZNQCLSA-N 251.326 2.214 10 20 CECD COc1ccc(O)c(CNCc2ccc(CCN)cc2)c1 841031909 BDPAWIMJJTUZSV-UHFFFAOYSA-N 286.375 2.192 10 20 CECD CN(C)C(=O)[C@H]1CCN(Cc2c(O)ccc3ccccc23)C1 840177782 LQKSDRUEFNEZOM-AWEZNQCLSA-N 298.386 2.456 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC(C)(N)CC1 843107553 OVJXDTOGUGDPBI-UHFFFAOYSA-N 261.413 2.374 10 20 CECD C[C@H]1[C@@H](C)NCCN1Cc1c(O)ccc(Cl)c1F 843057171 GHXKWJUPQYQTHZ-BDAKNGLRSA-N 272.751 2.367 10 20 CECD CCC(CC)N(C(=O)C(=O)Nc1ccc(N)cc1)C1CC1 841100916 NYTOFIHVWLYLBL-UHFFFAOYSA-N 289.379 2.387 10 20 CECD NC[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 843047171 HXIPKMZCMLKAFR-VIFPVBQESA-N 272.751 2.355 10 20 CECD Oc1c(Br)cccc1CN[C@@H]1CCCNCC1 841057106 IFHICYLWECCJBL-LLVKDONJSA-N 299.212 2.386 10 20 CECD CCO[C@H]1C[C@@H](N[C@@H](C)c2cc(C(=O)OC)ccc2O)C1 840764794 ZLVFABADBJZFLT-WCFLWFBJSA-N 293.363 2.397 10 20 CECD CNC(=O)[C@@H]1CCCN(Cc2ccc(N(C)C)cc2C)C1 840914858 HHLXAPTYHHAURI-OAHLLOKOSA-N 289.423 2.019 10 20 CECD 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CC(C)(CCCNCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1324575959 QFPPWCGPYYUAFM-UHFFFAOYSA-N 296.323 2.281 10 20 CECD C[C@@H](CCO)N(C)Cc1ccc(N2CCCC2)cc1 1329630634 JSUFJRZBYOBVGA-AWEZNQCLSA-N 262.397 2.490 10 20 CECD COC(=O)[C@H]1CCC[C@H]1NCc1cccc(Cl)c1O 1320837917 VWLRGYZBWVJEHI-CMPLNLGQSA-N 283.755 2.477 10 20 CECD Cc1cc(O)c(CNCC(=O)NCC(C)C)cc1Cl 1327828611 FSECHWPWCOXRCX-UHFFFAOYSA-N 284.787 2.216 10 20 CECD C[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)[C@@H]1CN 70175325 OMHOTDWAVXAHRA-CZUORRHYSA-N 261.413 2.312 10 20 CECD Cc1coc(C)c1C(=O)NCCc1ccc(O)c(O)c1 786392814 NYIZKWSWEFWYRK-UHFFFAOYSA-N 275.304 2.280 10 20 CECD CN(C)c1cc(F)c(CN2CC[C@@](O)(C3CC3)C2)cc1F 1261829489 RGXMXWBKNNNULA-INIZCTEOSA-N 296.361 2.378 10 20 CECD CC(C)c1[nH]ccc1C(=O)NCc1cccc(O)c1O 1347232699 ALSYQGFMWFMOEB-UHFFFAOYSA-N 274.320 2.479 10 20 CECD Cc1cc(O)c(CN2CCSC[C@@H](C(=O)O)C2)cc1C 1600285482 CMQXKEIRSLYYDP-ZDUSSCGKSA-N 295.404 2.259 10 20 CECD CC(C)(C)CC[C@@H](NC(=O)c1cc(O)cs1)C(=O)O 1588648913 SHTFNPFSZOTLHR-SECBINFHSA-N 285.365 2.463 10 20 CECD CCOc1cccc(CN2CCC[C@H](C)[C@H]2CN)c1O 250516600 OROJWMQXNUNPKK-GXTWGEPZSA-N 278.396 2.350 10 20 CECD C[C@@H]1C[C@@H]1[C@H](NCc1cc(F)c(N(C)C)cc1F)C(=O)O 1776602431 JBMDNBJJNJMPTD-YACGNSKGSA-N 298.333 2.230 10 20 CECD CN(C)c1ccc(CN[C@]2(C(=O)O)CC[C@H]3C[C@@H]32)cc1 1777040001 VHPABVXOBMFJNY-DUVNUKRYSA-N 274.364 2.096 10 20 CECD CC(C)NCCC(=O)NCCCSc1nccs1 160059267 BZCLYAHZCVAALB-UHFFFAOYSA-N 287.454 2.130 10 20 CECD Cc1nn(C)c(C)c1CNCc1cc(F)ccc1O 226590527 LTUWFFPHYRXCLF-UHFFFAOYSA-N 263.316 2.171 10 20 CECD COc1cc(Cl)cc(CN2CC[C@@H](N)C[C@H]2C)c1O 252856636 LZNIGIMYPJFGHQ-BXKDBHETSA-N 284.787 2.366 10 20 CECD Cc1ccc(O)c(CN[C@H](CO)CC(F)(F)F)c1 717817950 NNYAASDRKVRJKT-JTQLQIEISA-N 263.259 2.104 10 20 CECD CN(C)C(=O)CSc1ncc(-c2ccccc2)n1C 7129445 BCKPANUTLRHBRA-UHFFFAOYSA-N 275.377 2.267 10 20 CECD CCO[C@@H]1C[C@@](CO)(NCc2cccc(C)c2O)C1(C)C 188908008 VREXSYRLETYNSF-PBHICJAKSA-N 293.407 2.356 10 20 CECD C[C@@H]1CN(C(=O)/C=C/c2ccc(O)c(O)c2)CCS1 181042249 XSQCMWFMGIAGPV-RXNUUUNCSA-N 279.361 2.075 10 20 CECD O=S(=O)(NCc1ccccc1O)c1ccccc1F 158586011 VMADOQBTNAQMFX-UHFFFAOYSA-N 281.308 2.010 10 20 CECD Cn1c(=O)oc2cc(NCc3ccccc3O)ccc21 127886883 KJONDNXFPXZHEO-UHFFFAOYSA-N 270.288 2.449 10 20 CECD C[C@@H](N[C@H]1CCc2[nH]ncc2C1)c1ccc(F)cc1O 186115065 KHFJJLONKLMDMN-SKDRFNHKSA-N 275.327 2.463 10 20 CECD CC(C)NC(=O)CN[C@H](C)c1cc2c(cc1O)CCCC2 184896096 WIWGQHFEXBXCSD-GFCCVEGCSA-N 290.407 2.446 10 20 CECD C[C@H](NCc1ncn(C)n1)c1cc2c(cc1O)CCCC2 186214443 SZTWTTPOYLCPPD-NSHDSACASA-N 286.379 2.250 10 20 CECD CO[C@H]1C[C@@H](NCc2cc(F)ccc2O)C1(C)C 226613496 GFCYOCWAXQRSML-OLZOCXBDSA-N 253.317 2.434 10 20 CECD CSC[C@H]1CCCN1Cc1cc2c(cc1O)OCO2 130987862 PRLGXGITNRZAOD-LLVKDONJSA-N 281.377 2.448 10 20 CECD C[C@]1(CN)CCN(Cc2cc(Cl)ccc2O)C1 383389518 JQCUNBMBEBSYKU-CYBMUJFWSA-N 254.761 2.216 10 20 CECD C[C@@H](NC[C@@H](O)C(F)(F)F)c1cc(F)ccc1O 230659306 IOPOSMAQGAYLOE-LHLIQPBNSA-N 267.222 2.105 10 20 CECD Cc1ccc([C@@H](O)CNCc2cc([N+](=O)[O-])ccc2O)o1 265934484 DVAINQAGOVSLER-ZDUSSCGKSA-N 292.291 2.025 10 20 CECD COCCOCCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273425835 UAXMBOMFXPHPSJ-NSHDSACASA-N 298.339 2.004 10 20 CECD COc1cc(Cl)cc(CN2CC[C@](O)(C3CC3)C2)c1O 376040525 ATKVGCRRTGBRIH-OAHLLOKOSA-N 297.782 2.401 10 20 CECD CCO[C@@H]1C[C@H](NCc2ccccc2O)[C@]12CCCO2 272650468 FKXSDGITPSEBCV-ARFHVFGLSA-N 277.364 2.208 10 20 CECD CCCOc1ccc(CNCC2([S@](C)=O)CC2)c(O)c1 282296360 JJPXWNMWUCWCRF-FQEVSTJZSA-N 297.420 2.182 10 20 CECD Cc1cc(C)c([C@@H](C)NCC(C)(C)OCCO)c(O)c1 294114731 KGTVHSHGIAJMOB-CYBMUJFWSA-N 281.396 2.447 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H](C)C[C@@H](CO)C2)c1O 398774041 BCDLTAGMJSOHOC-ZYHUDNBSSA-N 295.354 2.184 10 20 CECD NC[C@@H]1CCCC[C@@H]1N[C@H]1CCc2cccc(O)c21 817959509 GTXDJKTUGNJDAL-IHRRRGAJSA-N 260.381 2.487 10 20 CECD CC(C)CCN1C(=O)CN(Cc2ccccc2O)C1=O 819166574 YGNPPCDHVXUMFK-UHFFFAOYSA-N 276.336 2.203 10 20 CECD C[C@H]1C[C@@H](CO)CN(Cc2ccc(N(C)C)cc2)C1 817280911 FEWJYFDGQFSARK-DZGCQCFKSA-N 262.397 2.203 10 20 CECD CC[C@@H](N[C@@H]1COCC[C@H]1OC)c1ccccc1O 724906990 VSUWSLYTUGFRPD-UMVBOHGHSA-N 265.353 2.237 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CC(C)=NO1 824234172 FRXJNMZMQRBWLS-HNNXBMFYSA-N 289.379 2.266 10 20 CECD CC(C)C[C@H](NCc1ccc(N(C)C)c(F)c1)C(=O)O 901640507 RZKNFVDHHJQEJO-ZDUSSCGKSA-N 282.359 2.481 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](C)c1cnccn1 906714085 NWGQRMIQFFUYJR-CYBMUJFWSA-N 298.390 2.271 10 20 CECD COC(=O)N1CCN(Cc2cc(Cl)c(C)cc2O)CC1 824602268 SSTAPMSUSAZAQZ-UHFFFAOYSA-N 298.770 2.238 10 20 CECD CCOCc1cc(CN[C@H](C)[C@H](C)C(=O)O)ccc1OC 901448776 MTPSANCVQYIDAK-NWDGAFQWSA-N 295.379 2.431 10 20 CECD Cc1cnc(CCNCc2ccc3c(c2)CCO3)cn1 835060177 BHBWYINIZUWMON-UHFFFAOYSA-N 269.348 2.052 10 20 CECD CCC(C)(C)OCC(=O)OCC(=O)c1ccc(O)c(O)c1 838411632 SUQWJPSPIMTLFV-UHFFFAOYSA-N 296.319 2.029 10 20 CECD C[C@@H]1CC[C@@H](CNC(=O)c2c(F)ccc(O)c2O)C1 831005845 QRKWDQYGCXLNRR-RKDXNWHRSA-N 267.300 2.403 10 20 CECD COc1cccc([C@H](C)N[C@@H](CCO)CSC)c1O 846144530 LCXJSAZIHXRUFM-QWRGUYRKSA-N 285.409 2.165 10 20 CECD C[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)c1ccn(C)n1 840816787 PXZCGLSNEVYDRZ-ZJUUUORDSA-N 290.323 2.446 10 20 CECD CCOc1ccc(CN[C@@H](C)CCCN)c(O)c1 841078383 CEPNAIQQRWCPCW-NSHDSACASA-N 252.358 2.008 10 20 CECD CC[C@H](NCc1cc2c(cc1O)OCO2)[C@@H](O)C(C)C 840966532 HLDDNUGZFCLPPX-NHYWBVRUSA-N 281.352 2.006 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1nc(C2CC2)no1 843350618 QKXTWZNNSINKMG-UHFFFAOYSA-N 284.363 2.359 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CC[C@H](C(=O)O)C2)c1 843038803 KRLKUYMAVGCRCQ-CMPLNLGQSA-N 279.336 2.134 10 20 CECD CCOc1ccc(CNC[C@]2(C)CCCNC2)c(O)c1 841056149 CXPDPGOYMRGWIW-MRXNPFEDSA-N 278.396 2.270 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC(C)(N)CC2)c1O 843376063 TZJJAXRDGVROCG-UHFFFAOYSA-N 280.343 2.047 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@](C)(O)C(F)(F)F 840936231 HCRUDQHSBVQPFW-ZDUSSCGKSA-N 290.329 2.464 10 20 CECD C[C@@H]1CCNC[C@H]1NCc1ccc(N2CCCC2)cc1 841059003 IYMWOIFCGALOKD-RHSMWYFYSA-N 273.424 2.374 10 20 CECD NC[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 843047789 VGTMKOIJZZQGSI-SNVBAGLBSA-N 254.761 2.216 10 20 CECD COC(=O)c1cc(CN(C)c2ccc(OC)cc2)c[nH]1 845999705 XXZUSGGSZCXPMN-UHFFFAOYSA-N 274.320 2.446 10 20 CECD CC(C)CCOCCOC(=O)c1cccc(O)c1O 758556018 CEQRRMDLCVSYJQ-UHFFFAOYSA-N 268.309 2.317 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)N(C)OC)c1ccc(N(C)C)cc1 858578519 JTOREOPWOQPTOA-SWLSCSKDSA-N 293.411 2.202 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc(C3CC3)nn2C)cc1 929405227 OAGZARSRBQGQQU-UHFFFAOYSA-N 298.390 2.294 10 20 CECD COC(=O)C1(CNCc2ccc3c(c2)CCO3)CCCC1 753588909 ILKCKGLJWKGJNH-UHFFFAOYSA-N 289.375 2.445 10 20 CECD COc1ccc2c(c1)CCCN2CCCCS(C)(=O)=O 759687569 AFOPBOOSPDPZBE-UHFFFAOYSA-N 297.420 2.273 10 20 CECD COCc1nc(OC)cc(Sc2nccs2)n1 753552224 BBQRHFIWNJNTOD-UHFFFAOYSA-N 269.351 2.239 10 20 CECD COc1ccc(CN[C@H]2CCc3c[nH]nc3C2)cc1C 758506738 SEEZPJDTRBMVFY-AWEZNQCLSA-N 271.364 2.374 10 20 CECD Cc1noc(C2CC2)c1C(=O)NCc1ccc(O)c(O)c1 752599062 FLCGZRGBYITEGJ-UHFFFAOYSA-N 288.303 2.202 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC(C)(C)OC)c1 756645418 FUBKZIJBUMVEDE-SNVBAGLBSA-N 281.352 2.254 10 20 CECD COc1cccc(O)c1CNc1cncc(N(C)C)c1 865668857 SLAKKGBHRYVODL-UHFFFAOYSA-N 273.336 2.474 10 20 CECD CCc1ncc(S(=O)(=O)Nc2ccc(O)cc2)s1 763372587 CTFUUAPLFLFWOX-UHFFFAOYSA-N 284.362 2.212 10 20 CECD Cc1cccc(O)c1CN1CC[C@H](N2CCCC2)C1 876659430 WZZSEDGYVCZNDZ-AWEZNQCLSA-N 260.381 2.371 10 20 CECD C[C@](O)(CCNC(=O)c1cc(O)cs1)c1ccccc1 779506544 WHEHYZYPUADSDY-HNNXBMFYSA-N 291.372 2.481 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@H]2C[C@@H]2C1 887767312 HITGHCQJUCPWIC-HUUCEWRRSA-N 285.391 2.448 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N1C[C@H]2C[C@@H]2C1 888295819 WXXVZJVJYZVYBH-ZIAGYGMSSA-N 273.380 2.222 10 20 CECD CC(C)S(=O)(=O)CCN[C@H](C)c1c(O)cccc1F 886610492 CHACCYRVUVNHSC-SNVBAGLBSA-N 289.372 2.005 10 20 CECD Oc1c(F)cc(F)cc1CN(C1CC1)C1COC1 894868877 KLPVJQLNPADBBW-UHFFFAOYSA-N 255.264 2.034 10 20 CECD COc1ccc(CNC[C@H](C)SC)c(O)c1OC 893183214 TZEQOAYYLOZOIB-VIFPVBQESA-N 271.382 2.251 10 20 CECD COc1cc(C)cc(CN(C)CC2(O)CCCC2)c1O 894033472 FCKVITKOPHYMIT-UHFFFAOYSA-N 279.380 2.446 10 20 CECD COc1cccc(O)c1CN1CCn2nc(C3CC3)cc2C1 896939445 HIVOOWBVTLBEKG-UHFFFAOYSA-N 299.374 2.491 10 20 CECD COCCN1CC[C@H](N[C@H](C)c2ccc(C)cc2O)C1 273604689 SVOUTIAQPNFXPD-KGLIPLIRSA-N 278.396 2.072 10 20 CECD CCOc1ccc(CN2CCCN3CCC[C@H]3C2)c(O)c1 1237041441 JINJQPOJARHFGK-HNNXBMFYSA-N 290.407 2.461 10 20 CECD CN1C[C@H]2CN(Cc3c(O)cccc3Cl)C[C@H]2C1 278538643 CITNWIRBJXZNIE-PHIMTYICSA-N 266.772 2.039 10 20 CECD OCCCCNCc1c(O)cccc1Br 706846481 KDTIGLVNSQATJK-UHFFFAOYSA-N 274.158 2.017 10 20 CECD CCc1cccc(CN[C@@H](C)CCN(C)C)c1O 691484846 WSPBMHUERGCMJG-LBPRGKRZSA-N 250.386 2.384 10 20 CECD C[C@]1(CNC(=O)NCc2ccc(N)cc2)CCCC[C@@H]1O 1337017659 AUVRSMAITXOAQF-GOEBONIOSA-N 291.395 2.009 10 20 CECD C[C@H]1CC(F)(F)CCN1C(=O)Cc1ccc(N)cc1 697154602 GMDTZDVJJJVHAI-JTQLQIEISA-N 268.307 2.458 10 20 CECD C[C@H]1C[C@@H](C(=O)Nc2c(Cl)ccc3nonc23)CO1 1346941259 PIFNHAUZQUNWPM-NKWVEPMBSA-N 281.699 2.240 10 20 CECD CC(=O)N[C@@H]1Cc2ccccc2N(Cc2ccc(N)cc2)C1 1262487750 DLZNTVNOBZSWQP-QGZVFWFLSA-N 295.386 2.336 10 20 CECD COc1ccc(CNC[C@H]2CCC[C@@H](O)C2)c(O)c1OC 1342959651 HEMAAUJMLSPEIH-WCQYABFASA-N 295.379 2.050 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1nccnc1C 1347902562 XLPWLEUFEUXSES-UHFFFAOYSA-N 299.378 2.481 10 20 CECD O=C(O)c1ccc(CNC(=O)c2cc(O)cs2)s1 1602341702 DMEVSNYGFYOPAZ-UHFFFAOYSA-N 283.330 2.143 10 20 CECD C[C@@H](CNCc1c(O)ccc(Cl)c1F)CC(=O)O 1776423669 WCDJZHXVYDBWNT-SSDOTTSWSA-N 275.707 2.385 10 20 CECD C[C@@H](NCC(C)(C)F)c1cc(C(=O)O)ccc1O 1593240209 KZJGPCBCMRAFHT-MRVPVSSYSA-N 255.289 2.489 10 20 CECD C[C@H](NCCCC1(O)CCC1)c1cc(C(=O)O)ccc1O 1593264586 KRHZIMUSPZSHFK-NSHDSACASA-N 293.363 2.436 10 20 CECD COc1cccc(CN[C@@H]2CCN3CCC[C@@H]3C2)c1O 112017185 CUVLSCBCTBJFPJ-ZIAGYGMSSA-N 276.380 2.117 10 20 CECD COc1cc(Cl)cc(CNCC2CCN(C)CC2)c1O 228673616 UWWUTSFDEDZOEJ-UHFFFAOYSA-N 298.814 2.486 10 20 CECD C[C@@H](NCCC1(O)CCC1)c1ccc(F)cc1O 284222634 CXCZMZJKPUERKV-SNVBAGLBSA-N 253.317 2.487 10 20 CECD CCc1cccc(CN2CCN(CC)[C@H](C)C2)c1O 709290790 PDPJWUZYTYCWSI-CYBMUJFWSA-N 262.397 2.481 10 20 CECD Oc1ccccc1CN1CCO[C@@H](C(F)(F)F)C1 698953451 NBVLDNXWTKSLFS-LLVKDONJSA-N 261.243 2.155 10 20 CECD CCCN(C)CC(=O)N(C)Cc1ccc(N(C)C)cc1 63755704 DICDTOSCKQZDOD-UHFFFAOYSA-N 277.412 2.053 10 20 CECD Cc1nccn1C[C@H]1CCCN1C(=O)Cc1ccc(N)cc1 178847483 JSSYTDZRGQSTBX-MRXNPFEDSA-N 298.390 2.007 10 20 CECD CNCC1CCN(Cc2cc(Cl)ccc2O)CC1 63158847 UQKOJDNPEOGMEZ-UHFFFAOYSA-N 268.788 2.477 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Cc2ccoc2)c1 184979732 URKYRMRFEXDTMO-SNVBAGLBSA-N 275.304 2.414 10 20 CECD COc1ccc(O)c(CNC(=O)c2csnc2C)c1 181220688 HQINYMYFZOOCRM-UHFFFAOYSA-N 278.333 2.096 10 20 CECD CN1CCCc2cc(CNC(=O)C3=CCOCC3)ccc21 184339534 YMRFHUZJIGJRKA-UHFFFAOYSA-N 286.375 2.032 10 20 CECD CCC[C@@H](CCO)CNC(=O)/C=C/c1ccc(O)c(O)c1 181207697 CUBXJPRZAUTNEQ-IYNGYCSASA-N 293.363 2.026 10 20 CECD CCOC(=O)c1cnc(S[C@@H](C)CCO)s1 380965300 CNLOWNFOFKFDLA-ZETCQYMHSA-N 261.368 2.183 10 20 CECD CC(C)(O)CCNCc1cccc(Br)c1O 381145153 NLYPVYKQSNDXDF-UHFFFAOYSA-N 288.185 2.405 10 20 CECD Cc1csc(CNC(=O)N(C)Cc2ccccc2O)n1 45356979 WORDLZOXBMVFMD-UHFFFAOYSA-N 291.376 2.499 10 20 CECD CC[C@H](O)CN(Cc1ccccc1O)C[C@@H]1CCCO1 268573872 RQSUQNCUCJUYMU-GJZGRUSLSA-N 279.380 2.144 10 20 CECD CC(C)n1ccc(C(=O)NCc2ccc(N(C)C)cc2)n1 264866135 GWODYGIHUQEZCQ-UHFFFAOYSA-N 286.379 2.460 10 20 CECD CCOC[C@H]1CCCN(C(=O)c2c(F)ccc(O)c2O)C1 276615875 QBKVRKPVFFFPQP-JTQLQIEISA-N 297.326 2.126 10 20 CECD COc1ccc(CNC(=O)N[C@H]2CCC2(C)C)c(O)c1 806021174 FGKSZKUIAYVOGF-ZDUSSCGKSA-N 278.352 2.389 10 20 CECD O=C(NCCOC1CCCCC1)c1c(F)ccc(O)c1O 294950531 VWPHJYZTTHGOAH-UHFFFAOYSA-N 297.326 2.316 10 20 CECD COc1cccc(CN2CCC[C@H]3CN(C)CC[C@@H]32)c1O 290641809 YMXYPIUKZUZQMM-ZFWWWQNUSA-N 290.407 2.317 10 20 CECD CC(F)(F)CCNC(=O)NCc1ccccc1O 297067864 DGFWNADOYBDFFX-UHFFFAOYSA-N 258.268 2.237 10 20 CECD C[C@H](N)C[C@H](C)NCc1ccc(N2CCSCC2)cc1 817887683 CDBBDTVYTMWYMY-KBPBESRZSA-N 293.480 2.455 10 20 CECD CC(C)Cc1cc(NC(=O)Cc2ccc(N)cc2)n(C)n1 827947262 LYTYBXJBEARXPF-UHFFFAOYSA-N 286.379 2.382 10 20 CECD COc1ccc(N2CCC(N[C@@H]3COC[C@@H]3C)CC2)cc1 903394373 AYNUBICSGGMUIH-SUMWQHHRSA-N 290.407 2.289 10 20 CECD CN(Cc1nc(C(F)F)no1)c1ccc2c(c1)OCO2 822780390 ITIBFNOJOJBIBX-UHFFFAOYSA-N 283.234 2.372 10 20 CECD COc1cccc(CNC(=O)N[C@@H]2CCC[C@@H]3C[C@@H]32)c1O 828357796 DSVULCUKXSUJRK-KGYLQXTDSA-N 290.363 2.389 10 20 CECD C[C@H](NCC1(N)CC1)c1ccc(Br)cc1O 902408154 XHBJWGDDKMZZRA-QMMMGPOBSA-N 285.185 2.297 10 20 CECD Nc1ccc(Cc2noc(COC(F)(F)F)n2)cc1 904503726 IUBYYFINZFKMKK-UHFFFAOYSA-N 273.214 2.279 10 20 CECD Cc1cc(C)n(CCOC(=O)c2cc(O)cs2)n1 732354738 XZSYMXHXHLRHBJ-UHFFFAOYSA-N 266.322 2.124 10 20 CECD Cc1ccc(C(=O)NC2(C(F)(F)F)CC2)c(O)c1O 837678466 MXNQSTUVQKGXEP-UHFFFAOYSA-N 275.226 2.231 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2cccc(OC)c2O)C1=O 903387217 DNGUNVXHJTYVAX-AAEUAGOBSA-N 292.379 2.062 10 20 CECD COc1ccc(CNC(=O)c2cc(O)cs2)cc1O 732270928 XRNJUQQKPUEKLR-UHFFFAOYSA-N 279.317 2.098 10 20 CECD CC(C)C[C@@H]1C[C@H]1NC(=O)c1c(F)ccc(O)c1O 839800479 SILXLZPUQLRJAC-PSASIEDQSA-N 267.300 2.401 10 20 CECD CCN1C[C@H](N[C@H](C)c2c(C)cc(C)cc2O)CC1=O 834892225 UQVITIHEEFPJFF-CHWSQXEVSA-N 276.380 2.280 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CCc3c[nH]nc3C1)CC2 834620985 ZTXMVVSAOPZDTH-QWHCGFSZSA-N 269.348 2.250 10 20 CECD C[C@H](N)C[C@@H](C)NCc1cc(Cl)cc(F)c1O 843129053 LYMHNQONIDBXFC-JGVFFNPUSA-N 260.740 2.400 10 20 CECD CNC[C@H]1CCCN1Cc1cccc(Br)c1O 843055357 IAIGMKSYIJRBPT-LLVKDONJSA-N 299.212 2.339 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CO[C@@H](C)C2)c1 842926694 AZPJHMXIDSULDZ-JBLDHEPKSA-N 279.336 2.007 10 20 CECD CN(C)c1ccc(CNC(=O)N2C[C@@H]3[C@@H](C2)C3(F)F)cc1 844782685 XLUCWKHZRBAWIO-CHWSQXEVSA-N 295.333 2.159 10 20 CECD Oc1cccc(Cl)c1CNC[C@H](O)c1ccco1 747098896 DVZDBEDWQOPNJQ-LBPRGKRZSA-N 267.712 2.462 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)NC(C)(C)C 921612734 DYXJIYKUAOLLTJ-GFCCVEGCSA-N 290.407 2.404 10 20 CECD CC(C)(C)C(C)(C)CNC(=O)C(=O)Nc1ccc(N)cc1 841134120 LLSSFOIGHGYCIP-UHFFFAOYSA-N 291.395 2.396 10 20 CECD CC(C)COC[C@H](O)CNCc1ccc2c(c1)CCCO2 921587106 POVOYJSZKKZGAL-MRXNPFEDSA-N 293.407 2.135 10 20 CECD COCCCn1nccc1CNCc1cc(C)ccc1O 858238961 GATADQFENMLTDT-UHFFFAOYSA-N 289.379 2.223 10 20 CECD COCCN(CCF)c1ccc(OC)c(OC)c1 759343304 NVIAYDKTTOUIJI-UHFFFAOYSA-N 257.305 2.126 10 20 CECD CC(=O)c1cc(F)cc(CN[C@]2(C)CCO[C@H]2C)c1O 755155664 CNMGZAOMDRAXLP-ZUZCIYMTSA-N 281.327 2.391 10 20 CECD CNC(=O)[C@H]1CCC[C@H]1NCc1c(O)cccc1Cl 765796557 OJPDYWQJHXJIJM-JOYOIKCWSA-N 282.771 2.050 10 20 CECD CC(C)c1ocnc1C(=O)NCCc1ccc(O)c(O)c1 762268496 IOBHNMQBCASWQX-UHFFFAOYSA-N 290.319 2.182 10 20 CECD CC[C@@H]1NC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 761579901 QNPIHYKHZKWAEH-GWCFXTLKSA-N 275.352 2.144 10 20 CECD Cc1ccc(O)c(CNC(=O)CSC(F)F)c1 862754364 BNZVMWXUDRTRAR-UHFFFAOYSA-N 261.293 2.273 10 20 CECD Clc1cnc(Sc2nnnn2C2CC2)s1 765000443 NFSJMEYYVVZTPV-UHFFFAOYSA-N 259.747 2.269 10 20 CECD CN(C)c1cc(F)c(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1F 895780811 VGZVLQTTWSGHDA-IETSOEAISA-N 296.361 2.234 10 20 CECD COc1cc(C)cc(CN[C@H]2c3ccccc3C[C@H]2O)c1O 894340529 PKOAKGHWNCTJPP-WBVHZDCISA-N 299.370 2.457 10 20 CECD COc1cccc(CNC(=O)[C@H]2CCC(F)(F)C2)c1O 795073801 PSVHAUCONXMTMJ-VIFPVBQESA-N 285.290 2.452 10 20 CECD CCOc1ccc(CNC2(CN(C)C)CCC2)c(O)c1 798501459 DEXOGCMPHOUNEJ-UHFFFAOYSA-N 278.396 2.365 10 20 CECD Oc1c(Br)cccc1CNCc1cc[nH]n1 42412612 PIOFADHCTGDOQS-UHFFFAOYSA-N 282.141 2.168 10 20 CECD Nc1ccc(Cc2nc([C@@H]3CN4CCC3CC4)no2)cc1 1345958381 WYOJSJBCNKDYPE-CQSZACIVSA-N 284.363 2.052 10 20 CECD CN(C)[C@H]1CCCC[C@H]1NC(=O)c1cc(O)cs1 1350552920 JVVMWGOKKCCREG-MNOVXSKESA-N 268.382 2.056 10 20 CECD Oc1cc(F)c(Cl)cc1CN1C[C@@H]2CC[C@H](C1)N2 1580888501 NELYWFYOARSTSP-AOOOYVTPSA-N 270.735 2.121 10 20 CECD C[C@H]1CC[C@@](NCc2cc([N+](=O)[O-])ccc2O)(C(=O)O)C1 1776629011 YBCJCFZXNKSQDN-XPTSAGLGSA-N 294.307 2.033 10 20 CECD O=C1NC(=S)S/C1=C/c1cc(F)ccc1O 158625289 OYVGSDJFPJGOKG-XBXARRHUSA-N 255.295 2.020 10 20 CECD COCCOc1ccccc1NC[C@@H](O)CC(F)(F)F 819425911 JIVOYHGMSHYBOJ-JTQLQIEISA-N 293.285 2.437 10 20 CECD COc1cccc(O)c1CNC[C@H]1CC[C@H](C)O1 835088553 SLMILJBYLGOENU-WDEREUQCSA-N 251.326 2.058 10 20 CECD Cc1cc(NC(=O)c2cccc(O)c2O)ccc1O 126577175 IJZUXTLISIYOQB-UHFFFAOYSA-N 259.261 2.364 10 20 CECD CCNCC1CCN(Cc2cccc(OC)c2O)CC1 129887240 SZCIDRHUSCOQBB-UHFFFAOYSA-N 278.396 2.222 10 20 CECD CN1CC[C@]2(CCN(Cc3cc(F)ccc3O)C2)C1 292791776 MNLFQDMETFZCNK-HNNXBMFYSA-N 264.344 2.059 10 20 CECD C[C@@H](NCCO)c1ccc(Cl)c(Cl)c1O 134911012 MDRUCCCGAKLEOV-ZCFIWIBFSA-N 250.125 2.342 10 20 CECD COc1ccc(N2CCC(NC(=O)c3ccc[nH]3)CC2)cc1 102381991 CNZUBBKVSCVTEY-UHFFFAOYSA-N 299.374 2.422 10 20 CECD CCN(CC)CC(=O)NCc1ccc2c(c1)CCCN2C 57550222 SPVCZACCUQEDCY-UHFFFAOYSA-N 289.423 2.027 10 20 CECD CCn1nccc1/C=C1\SC(N2CCCCC2)=NC1=O 178865252 FGJYGTXVHDGQHN-BENRWUELSA-N 290.392 2.359 10 20 CECD C[C@H](NC[C@@H](C)CN1CCOCC1)c1ccc(F)cc1O 185504815 OFELBBKJPNZENZ-OLZOCXBDSA-N 296.386 2.150 10 20 CECD CC[C@H](N[C@@H](C)CCS(C)(=O)=O)c1ccccc1O 156382570 RAMRENSWCTXHIL-AAEUAGOBSA-N 285.409 2.256 10 20 CECD CCCNC(=O)CN(CCC)Cc1ccc(N(C)C)cc1 123237767 ZNVSCPYYYOKXOX-UHFFFAOYSA-N 291.439 2.491 10 20 CECD CCn1cnnc1CNCc1ccc(N2CCCC2)cc1 218220670 XLKWUNSQWHXQFS-UHFFFAOYSA-N 285.395 2.188 10 20 CECD C[C@H]1Oc2ccccc2O[C@H]1C(=O)Nc1ccc(N)cc1 195308633 HWOMRRDLJNBZMO-MEBBXXQBSA-N 284.315 2.436 10 20 CECD CN(c1ccc(CNC(=O)CCN)cc1)C1CCCCC1 237053895 CBKCAXYCJWVMBW-UHFFFAOYSA-N 289.423 2.421 10 20 CECD CN(C(=O)/C=C\c1cncc(F)c1)c1ccccn1 255839552 AFYQEQWKJQGVRR-WAYWQWQTSA-N 257.268 2.292 10 20 CECD CCOCc1cc(CNC2CCN(C)CC2)ccc1OC 266113959 NLPSRAKZEFNQDZ-UHFFFAOYSA-N 292.423 2.416 10 20 CECD Cc1ccc(C(=O)NCCCC(F)(F)F)c(O)c1O 272765057 RACRGKCKTHCPIW-UHFFFAOYSA-N 277.242 2.479 10 20 CECD COc1ccc(O)c(CN2CC[C@@](CO)(C(C)C)C2)c1 378129362 MDDDXJRNMAIRNC-MRXNPFEDSA-N 279.380 2.241 10 20 CECD CCc1cc(C(=O)NCc2ccc(N(C)C)c(F)c2)[nH]n1 299410516 BKWODBKPWUZISX-UHFFFAOYSA-N 290.342 2.107 10 20 CECD C[C@H](CCCO)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 296530970 QKVUKDOHZMALHM-GHMZBOCLSA-N 282.340 2.360 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@H](N3CCCC3)C2)cc1 394555985 FELFAEGQVFYMJV-HNNXBMFYSA-N 288.395 2.361 10 20 CECD COC(=O)c1cnc(SC[C@H]2CCOC2)s1 295397806 VXULUHGELQFGKN-ZETCQYMHSA-N 259.352 2.058 10 20 CECD COC[C@H](O)CN[C@H](C)c1cc(Cl)cc(C)c1O 808717011 BRDCSOWUGIKDBH-MWLCHTKSSA-N 273.760 2.012 10 20 CECD C[C@@H](N[C@@H]1CC12CCNCC2)c1cc([N+](=O)[O-])ccc1O 817976665 QOSZZRAIAVOCKI-QMTHXVAHSA-N 291.351 2.093 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1ccc(N(C)C)cc1 814300944 NLEOZCQWPMVXCJ-AWEZNQCLSA-N 291.439 2.395 10 20 CECD Cc1cc(O)c(CN(C)[C@@H]2CCN(C)C2=O)cc1Cl 824835986 FTOVCCSBXBALDO-GFCCVEGCSA-N 282.771 2.017 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1cc(C)ccc1O 824701859 CUMSQRHVOUZUMH-OLZOCXBDSA-N 263.337 2.132 10 20 CECD C[C@@H](NC(=O)c1ncc2n1CCCC2)c1ccccc1O 827917687 PBBBDNFNAYAAMI-LLVKDONJSA-N 285.347 2.416 10 20 CECD Cc1cc(CN(C)CCO)ccc1N1CCCCC1 827390073 LRHHUGWUFVRFFE-UHFFFAOYSA-N 262.397 2.409 10 20 CECD CN(C)c1ccc(CNCC2(N)CC2)c(C(F)(F)F)c1 904445622 YETRALKETAFFET-UHFFFAOYSA-N 287.329 2.352 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](CO)[C@H]2C)c1O 839668897 JZVFRRIFDSJDPF-ZYHUDNBSSA-N 295.354 2.327 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@H]1CCc2cccc(O)c21 834765513 NBSPOJUAWHELPH-VNHYZAJKSA-N 277.364 2.163 10 20 CECD CCCCCCN(C)CC(=O)NCCc1ccc(N)cc1 832659246 WKZXTYTZKGSPEW-UHFFFAOYSA-N 291.439 2.440 10 20 CECD CCOc1ccc(O)c(CN2[C@H]3CC[C@H]2CC(=O)C3)c1 839132273 XQBSEXQDPBWVDV-STQMWFEESA-N 275.348 2.487 10 20 CECD CCN(CC)CCOCCN[C@@H]1CCc2cccc(O)c21 834764523 FHYVEYWAXDFDNH-OAHLLOKOSA-N 292.423 2.328 10 20 CECD C[C@H](NCCC1CCNCC1)c1cc([N+](=O)[O-])ccc1O 844922928 DFCFEGGCQWGVSA-NSHDSACASA-N 293.367 2.341 10 20 CECD Cc1cccc(CN2CCNC[C@@H]2c2ccncc2)c1O 843120475 MGHHWXOPVOQXIL-MRXNPFEDSA-N 283.375 2.242 10 20 CECD CCc1cccc(CNc2cnn(CCN(C)C)c2)c1O 848894718 HOVXPHMCMOQCNM-UHFFFAOYSA-N 288.395 2.325 10 20 CECD COCC(C)(C)c1nc(Cc2ccc(N)cc2)no1 843160495 YSWVTJHTIVJHLB-UHFFFAOYSA-N 261.325 2.167 10 20 CECD Cc1ccc([C@@H](C)NCCS(=O)(=O)C2CC2)c(O)c1C 840882847 KJRGMJIYSAOTKK-GFCCVEGCSA-N 297.420 2.237 10 20 CECD COC(=O)c1ccc(CN(C)c2ccc(OC)cc2)[nH]1 845998037 IZMPLNRFCRGJMU-UHFFFAOYSA-N 274.320 2.446 10 20 CECD COc1cccc([C@@H](C)NC[C@H](O)CC(C)C)c1O 846142319 RIJVZYVHZXWDKX-VXGBXAGGSA-N 267.369 2.458 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnco1 758775905 KCCIGQIRMAWTMF-UHFFFAOYSA-N 273.336 2.403 10 20 CECD CCOc1nc(C(=O)NCc2cc(Cl)ccc2O)co1 857548184 HMQBWYHSEUZYLL-UHFFFAOYSA-N 296.710 2.362 10 20 CECD CN(C)c1ccc(CN(C)c2cnc(F)cn2)cc1 853093746 QOAZTIYZXRVYAI-UHFFFAOYSA-N 260.316 2.318 10 20 CECD C[C@@H](NC1COC(C)(C)OC1)c1ccc(F)cc1O 757698425 QWBOORZIFRPEPY-SECBINFHSA-N 269.316 2.333 10 20 CECD CCOC(=O)CCCNC(=O)N[C@H](C)c1ccccc1O 868000622 SRLVIDSSQYZDCD-LLVKDONJSA-N 294.351 2.096 10 20 CECD CCOC(=O)N1CCC(NCCc2ccc(N)cc2)CC1 71428879 ASJYCJBHAJPWTE-UHFFFAOYSA-N 291.395 2.022 10 20 CECD CCn1ncc(C(=O)NCc2cc(C)ccc2O)c1C 869411763 ZQMUPECYWMBFHX-UHFFFAOYSA-N 273.336 2.155 10 20 CECD CC(C)(C)[C@H](O)C(=O)NCc1c(O)ccc2c1CCCC2 765177593 OYRIJHMUPWTUSR-OAHLLOKOSA-N 291.391 2.294 10 20 CECD CC(C)OCCNCc1ccc(N2CCC(O)CC2)cc1 877336028 NGWYWCUEFJWLES-UHFFFAOYSA-N 292.423 2.162 10 20 CECD COC(=O)[C@H](N[C@H](C)c1ccccc1O)c1cccnc1 879649607 XUIQBKHGQOVGNE-IAQYHMDHSA-N 286.331 2.352 10 20 CECD Cc1cccc(CN2CCN(CC(C)C)C(=O)[C@H]2C)c1O 779201869 HKZSHQQOBAJVQG-CQSZACIVSA-N 290.407 2.389 10 20 CECD Cc1ccc(CN2CCNC(=O)[C@@H]2CC(C)C)c(O)c1 877461359 DWWVKNMYAALYPL-AWEZNQCLSA-N 276.380 2.047 10 20 CECD C[C@@H](CC(=O)N(C)c1ccc(N)cc1)[C@H]1CCCNC1 877079232 VLXODPLIDVOSDL-STQMWFEESA-N 275.396 2.257 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@H]1CNCCCO1 1118122141 PUSYVMWWCQJUSB-RDBSUJKOSA-N 290.407 2.217 10 20 CECD CCN(C)c1ccc(CN2CCC[C@@]23CCOC3=O)cc1 773845902 JSCVVKRNHJDAAN-KRWDZBQOSA-N 288.391 2.424 10 20 CECD CC[C@@H](NCCOC[C@@H]1CCOC1)c1ccccc1O 775503361 GHPDAMJJNXIOBG-UKRRQHHQSA-N 279.380 2.486 10 20 CECD O=C(COC(=O)[C@@H]1Cc2ccccc21)c1ccc(O)c(O)c1 783881999 VQXCTVCGZMOAHM-CYBMUJFWSA-N 298.294 2.164 10 20 CECD CCCC[C@H](CN)NC(=O)N[C@H](C)c1ccccc1O 892039316 AHQWKVICXRSVOT-VXGBXAGGSA-N 279.384 2.270 10 20 CECD CC[C@@H](NCC1(CO)CC1)c1ccc(F)cc1O 796778150 FVEYHXAEIDGYIP-GFCCVEGCSA-N 253.317 2.345 10 20 CECD CC(=O)NCCC1=CCN(c2ccnc(C3CC3)n2)CC1 1089802577 SFEZKHQREGPXFH-UHFFFAOYSA-N 286.379 2.017 10 20 CECD C[C@@H]1CCCC[C@H]1OCC(=O)NCc1cccc(O)c1O 1348045648 FTEFQOPQPYYPGV-BXUZGUMPSA-N 293.363 2.309 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCC(=O)O 1605187266 RGJSOTMWIYVZEN-UHFFFAOYSA-N 250.342 2.015 10 20 CECD CC[C@@H]1OCC[C@H]1N[C@H](C)c1cc(C(=O)O)ccc1O 1605754519 RPGJJTJKPMVROE-IUPBHXKESA-N 279.336 2.309 10 20 CECD CCC[C@@H](NCc1ccc(OCC)cc1O)C(=O)O 1605354527 JDJNGAOTESMLJN-GFCCVEGCSA-N 267.325 2.134 10 20 CECD C[C@@H](NC1CNC1)c1ccc(N2CCCCC2)cc1 169172050 YWYNPAVDDSHOCI-CYBMUJFWSA-N 259.397 2.299 10 20 CECD COC[C@@H]1CCCN(Cc2cc(OC)c(OC)cc2O)C1 160193539 WJYXQFIDCUJCPB-GFCCVEGCSA-N 295.379 2.268 10 20 CECD COc1cc(CN(C)[C@@H](C)C(=O)OC(C)C)c(O)cc1C 160409605 QAXFWRMQFZCMHB-LBPRGKRZSA-N 295.379 2.481 10 20 CECD c1cnc(CCNCc2ccc3c(c2)CCCO3)cn1 921965896 DOTQDQGRTNOYBG-UHFFFAOYSA-N 269.348 2.134 10 20 CECD Cc1cc(CNCc2ccc(N(C)C)cc2)n(C)n1 284002027 PIZBPQDWOUHIHB-UHFFFAOYSA-N 258.369 2.084 10 20 CECD Cc1cc(CN[C@@H](C)c2ccc(F)cc2O)n(C)n1 284408852 QDKXUSMGNGGTMC-JTQLQIEISA-N 263.316 2.424 10 20 CECD COCCNc1nnc(Sc2nccs2)s1 309626255 GMINZLIIMADFOM-UHFFFAOYSA-N 274.396 2.204 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)c2n[nH]c(C)n2)c1 392461489 OZHSZDLZLHHZGM-BDAKNGLRSA-N 276.340 2.239 10 20 CECD Oc1c(Cl)cccc1CN1CCC2(CC1)OCCO2 179665738 RGBIHIPQGKLRJX-UHFFFAOYSA-N 283.755 2.385 10 20 CECD CCCC[C@H](NCc1ccc2c(c1)CCO2)C(=O)OC 135198132 SBQAIQNPCWIOHX-AWEZNQCLSA-N 277.364 2.443 10 20 CECD CC(C)(C)OC(=O)N[C@H]1CCN(Cc2ccccc2O)C1 179565458 NATMZWNRCPWXFK-ZDUSSCGKSA-N 292.379 2.491 10 20 CECD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@H]3C2)c(O)c1O 182839397 XPDSPLHUFDEPBT-WCQYABFASA-N 291.347 2.047 10 20 CECD COc1ncc(C)cc1NC(=O)c1cccc(O)c1O 187160689 WANCTVITFHIMJK-UHFFFAOYSA-N 274.276 2.062 10 20 CECD C[C@]1(CNC(=O)Cc2ccc(N)cc2)CCCS1 133873669 SSHQKBDOJCDWCT-CQSZACIVSA-N 264.394 2.213 10 20 CECD COCCOCCN(C)Cc1c(O)cccc1Cl 290095522 HHUPRNQZOCTZRD-UHFFFAOYSA-N 273.760 2.140 10 20 CECD COc1cccc(CNC(=O)[C@@H]2[C@@H](C)[C@@H]2C2CC2)c1O 528858156 AAKBZMQCIQZABH-CUOATXAZSA-N 275.348 2.309 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCCC(C)(C)CO 267242864 XYHVINJSPCQXOM-UHFFFAOYSA-N 294.395 2.332 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CC(=O)N(C3CC3)C2)c(O)c1C 273541970 YIPTZGTWRIKXCB-STQMWFEESA-N 288.391 2.423 10 20 CECD COc1cccc(CN[C@]2(C)CCO[C@@H]2C2CC2)c1O 273090083 KUWKAAOCLHJROT-HZPDHXFCSA-N 277.364 2.448 10 20 CECD Cc1ccc(O)c([C@H](C)NCCC2(O)CCOCC2)c1 287605281 SEUWFJVSDZIKDP-ZDUSSCGKSA-N 279.380 2.283 10 20 CECD C[C@H](N[C@H]1C[C@@H](C)c2c(F)ccc(O)c21)C(=O)NCCF 800499020 SYOJUEUBLHDRAK-YWVKMMECSA-N 298.333 2.143 10 20 CECD COCCN(C)CCN[C@@H](C)c1c(C)cc(C)cc1O 293261022 CAGKZVKSFIWPON-AWEZNQCLSA-N 280.412 2.238 10 20 CECD CC1(C)CC[C@@H](COC(=O)c2cccc(O)c2O)O1 803439648 FSMYAOOKBRYJFZ-VIFPVBQESA-N 266.293 2.212 10 20 CECD O=S(=O)(CC1CCCC1)NCc1ccccc1O 269664952 CCUYCIBWJJRLQS-UHFFFAOYSA-N 269.366 2.002 10 20 CECD CC(=O)C(=O)COC(=O)c1ccc2[nH]c3c(c2c1)CCCC3 808489757 ZBADXITXCSSHBF-UHFFFAOYSA-N 299.326 2.362 10 20 CECD Cc1ccc(C(=O)OCCOC(C)(C)C)c(O)c1O 727004493 METZCBZWKVWSLJ-UHFFFAOYSA-N 268.309 2.378 10 20 CECD COC1([C@@H](C)NCc2cc([N+](=O)[O-])ccc2O)CCC1 839661147 SSVYTLHKTVKJDF-SNVBAGLBSA-N 280.324 2.348 10 20 CECD CN(C)c1cccc(CNC(=O)c2cc(O)cs2)c1 731872220 AIAHHCZGHWUNMI-UHFFFAOYSA-N 276.361 2.450 10 20 CECD CN(CCCCNC(=O)NCc1ccccc1O)C1CC1 836687043 LXPIMJSEDNCJRJ-UHFFFAOYSA-N 291.395 2.066 10 20 CECD C[C@H](N)C[C@@H](C)NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 831150171 HDADPTWZZRHCNC-YNEHKIRRSA-N 292.427 2.239 10 20 CECD O=C(NC1(CCO)CCCCC1)c1cc(O)cs1 831816526 BABWGABOHJRDML-UHFFFAOYSA-N 269.366 2.269 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)C12CCC2 838062627 WBUYDFVWFDDQPI-ZIAGYGMSSA-N 290.363 2.149 10 20 CECD CC(C)n1cc(NC(=O)NCCc2ccc(N)cc2)cn1 841132519 PGBRRXWPBYIQNL-UHFFFAOYSA-N 287.367 2.410 10 20 CECD COc1cc(O)c(CNC[C@@H]2C[C@@H](C)O[C@@H]2C)cc1OC 840963975 PSINRNLSTQPAPH-UTUOFQBUSA-N 295.379 2.313 10 20 CECD C/C=C(/CC)C(=O)N(CC(=O)O)Cc1ccccc1O 911489645 VHAHNAIXVBPIGF-JYOAFUTRSA-N 277.320 2.162 10 20 CECD C[C@H](N[C@@H](C)[C@H](O)C(F)(F)F)c1ccccc1O 866466075 YUYLSYJPFRCTQO-LAEOZQHASA-N 263.259 2.355 10 20 CECD Cc1cc(O)c(CN[C@H]2CCN(C(C)(C)C)C2=O)cc1C 842720787 LZOICJDTNYNCIQ-AWEZNQCLSA-N 290.407 2.498 10 20 CECD COC(=O)[C@@H](CC1CC1)NCc1ccc(OC)c(C)c1 840959110 UABJSDDEQTYLPN-CQSZACIVSA-N 277.364 2.435 10 20 CECD CCn1ccc(NCc2cc([N+](=O)[O-])ccc2O)n1 850363949 SLCXGMODQONUHZ-UHFFFAOYSA-N 262.269 2.129 10 20 CECD CNC[C@H]1CCN(Cc2ccc(N(C)C)c(C)c2)C1 923291892 TXTLZKRIYZBSER-OAHLLOKOSA-N 261.413 2.102 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)c1cn(C(C)C)cn1 753949924 IANNAGPYIBDDOM-UHFFFAOYSA-N 295.364 2.279 10 20 CECD O=C(Cc1cccnc1)NCc1cc(Cl)ccc1O 857547507 HNWKOFOWBIHACR-UHFFFAOYSA-N 276.723 2.300 10 20 CECD CC(C)(C)OC(=O)N1CCCN1C(=O)c1cc(O)cs1 765338408 STOKTQYSNUNAHU-UHFFFAOYSA-N 298.364 2.452 10 20 CECD CCN(Cc1cc2c(cc1O)OC[C@@H]2O)CC(C)C 768438534 BHCUMIAITFTXGE-AWEZNQCLSA-N 265.353 2.296 10 20 CECD C[C@@H](NC(=O)NCCCn1ccnc1)c1ccccc1O 864425257 XTYHIXHLUXBVAI-GFCCVEGCSA-N 288.351 2.039 10 20 CECD Cc1ccc(CN[C@@H]2CN(C3CC3)C[C@@H]2C)c(O)c1 877095209 PPRXNXLFSDBKMB-SWLSCSKDSA-N 260.381 2.273 10 20 CECD CO[C@H](C)CCNCc1ccc(N2CCC(O)CC2)cc1 876997430 WXXQELOSQAIBIU-CQSZACIVSA-N 292.423 2.162 10 20 CECD C[C@@H]1COCCCN1C(=O)NCc1ccc(N(C)C)cc1 772928633 NPRWJPKFMAQVSA-CYBMUJFWSA-N 291.395 2.073 10 20 CECD CC[C@@](C)(O)CNCc1cc(Cl)cc(F)c1O 775890652 HEGATTIYSZWQKX-GFCCVEGCSA-N 261.724 2.435 10 20 CECD Cc1ccnc(N2CCN(Cc3ccc(N)cc3)CC2)c1 1120262846 FPYHHJFFWVVOIT-UHFFFAOYSA-N 282.391 2.294 10 20 CECD C[C@H](N[C@H](C)c1c(O)cccc1F)c1nncn1C 886523297 ZXWPIIXPAGMGRA-BDAKNGLRSA-N 264.304 2.072 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CC[C@H](C)C2)c1O 780791482 CXUVIQIZKDLMLY-JQWIXIFHSA-N 278.352 2.389 10 20 CECD CCOc1ccc(CNCCC[C@H](C)O)c(O)c1 788524547 RNFUIXRPHLYTOZ-NSHDSACASA-N 253.342 2.042 10 20 CECD COc1cc(C)cc(CNC[C@@H](C)CCCO)c1O 894876129 FJDOSACOSKZSAJ-NSHDSACASA-N 267.369 2.207 10 20 CECD C[C@H]1CCSCCN1C(=O)c1cc(O)cs1 792520486 CILUJMRJMTXQAF-QMMMGPOBSA-N 257.380 2.421 10 20 CECD C[C@H](N[C@H](C)c1ncn(C)n1)c1cc(F)ccc1O 275774200 VFFSEGNROMTZHP-DTWKUNHWSA-N 264.304 2.072 10 20 CECD CC(C)(O)CCNCc1c(O)cccc1Br 706883101 AGZMSSQFPLAALJ-UHFFFAOYSA-N 288.185 2.405 10 20 CECD CCCN1CC[C@H](NCc2cc(F)cc(F)c2O)C1 708516731 KXAGALSYMMIXNF-LBPRGKRZSA-N 270.323 2.244 10 20 CECD COc1ccc(O)c([C@@H](C)NCCN2CC[C@H](C)C2)c1 775370864 XAHZYVGHEBKTBZ-QWHCGFSZSA-N 278.396 2.393 10 20 CECD CC[C@H](CCO)CN[C@@H](C)c1cc(OC)ccc1O 94948704 MPQOIBJNDFCXKU-NWDGAFQWSA-N 267.369 2.460 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)N1CC(F)(F)C1 1348462891 LXFBPKGCRRDTDV-UHFFFAOYSA-N 295.333 2.447 10 20 CECD O=C1CC[C@H]2CN(Cc3ccc(N4CCCC4)cc3)CCN12 1341551663 AGQHCDUWKUTXSV-KRWDZBQOSA-N 299.418 2.093 10 20 CECD C[C@@H](O)C1(NCc2ccc(N3CCCC3)cc2)CC1 1261691452 PHBAWVSGUGABGR-CYBMUJFWSA-N 260.381 2.290 10 20 CECD O=C(O)C1(CNCc2ccc3ccccc3c2O)CC1 1601708637 YIIQASGQEZLFQJ-UHFFFAOYSA-N 271.316 2.500 10 20 CECD CCc1cccc(CN[C@](C)(CCF)C(=O)O)c1O 1597586875 NCVNLLXDADZIKT-CQSZACIVSA-N 269.316 2.247 10 20 CECD CC(C)[C@@H](NCc1cccc(Cl)c1O)C(=O)O 158742154 JKVRTUDTRREZNZ-SNVBAGLBSA-N 257.717 2.244 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2([S@@](C)=O)CCC2)c1 281071295 OGOCLBCPEJUQGK-BIBXISHDSA-N 297.420 2.353 10 20 CECD C[C@H](CC(C)(C)O)NCc1cc(F)cc(F)c1O 708498013 WKDAVYTUSREZGZ-MRVPVSSYSA-N 259.296 2.310 10 20 CECD CCCc1cc(C(=O)NCc2cc(OC)ccc2O)[nH]n1 174958017 RTPZNWKNSSXRDL-UHFFFAOYSA-N 289.335 2.006 10 20 CECD C[C@@H](NC[C@@H]1CC[C@H](O)C1)c1cc(F)ccc1O 189299928 QEFPFYJKQCYOSA-FOGDFJRCSA-N 253.317 2.343 10 20 CECD C[C@H](CNC(=O)Cc1ccc(N)cc1)CN1CCCCC1 38042233 NYCFPIBZWVQKON-CQSZACIVSA-N 289.423 2.050 10 20 CECD CC(C)(C)OC(=O)CCNCc1ccc2c(c1)CCO2 174431307 GBFPGULIIVQWDY-UHFFFAOYSA-N 277.364 2.443 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)Cc1cccn1C 128305371 OBHVZOZXIRBTQO-UHFFFAOYSA-N 274.320 2.091 10 20 CECD Cc1ccc(O)c(CN(C)CCN2C[C@H](C)O[C@H](C)C2)c1 193400662 SNCOQRTYKNQKTP-GASCZTMLSA-N 292.423 2.242 10 20 CECD O=C(c1c[nH]nc1[C@H]1CCCNC1)N1CCc2ccccc21 422909794 GVKPUEOFJOYJBW-ZDUSSCGKSA-N 296.374 2.080 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCCCC2)c1O 278914050 SVZYKWZEVSETHG-UHFFFAOYSA-N 266.297 2.295 10 20 CECD CCN(CCCN1CCCC1)C(=O)c1cccc(O)c1O 276451266 MPRNMLVXBJDTGM-UHFFFAOYSA-N 292.379 2.046 10 20 CECD Cc1cc(O)c(CN2CC[S@](=O)C[C@H](C)C2)cc1C 277442689 KEOYKJGADDLXAU-WYRIXSBYSA-N 281.421 2.209 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)CC1CCCC1 269821182 SENMESBDKGFRKG-UHFFFAOYSA-N 283.393 2.344 10 20 CECD CC[C@@H](NCC(=O)NCC(F)F)c1ccc(C)cc1O 280941510 SNBZNOJEXMUNFE-LLVKDONJSA-N 286.322 2.123 10 20 CECD CC[C@@H](NCCCc1cnn(C)n1)c1ccc(F)cc1O 293791791 UJCAWULWQILXLW-CQSZACIVSA-N 292.358 2.333 10 20 CECD CN(C)c1ccc(CNC(=O)CC[C@@H]2CCCN2)cc1F 292104155 OSVBKIHMSVCEBQ-ZDUSSCGKSA-N 293.386 2.040 10 20 CECD CCc1nocc1CN(C)Cc1cc2c(cc1O)OCO2 293714418 SRBOUZVZQJRWGK-UHFFFAOYSA-N 290.319 2.303 10 20 CECD COc1cccc(CNCC[C@]2(O)C[C@H]3CC[C@H]2C3)c1O 813784168 UNKBVRJMLOYYKE-JDFRZJQESA-N 291.391 2.432 10 20 CECD CCOc1ccc(CN2C[C@H](C(=O)O)CC[C@H]2C)c(O)c1 817881187 PXPYQAUBFOOFLS-DGCLKSJQSA-N 293.363 2.476 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@](C)(O)C2CCC2)c1 813489359 WWBVOKFCBCFMQX-QFYYESIMSA-N 293.363 2.129 10 20 CECD COC(=O)C1(C)CN(Cc2cccc(Cl)c2O)C1 822534745 VUTUXMSUJMAXHJ-UHFFFAOYSA-N 269.728 2.041 10 20 CECD CN(C)c1ccc(CNC(=O)c2cscn2)cc1F 728471488 PIQYYTFKDZAQJY-UHFFFAOYSA-N 279.340 2.278 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@H](C)c1ccc(C)cc1O 724872453 LLMXUUUSYPHGON-UXIGCNINSA-N 265.353 2.155 10 20 CECD CC(C)N(CC(=O)O)Cc1cccc(Cl)c1O 820014825 ALBGVIBFSUQGQE-UHFFFAOYSA-N 257.717 2.341 10 20 CECD Cc1cc(O)c(CN[C@H](C)CN2CCOCC2)cc1Cl 825114716 VTDIRDHYFNKYMO-GFCCVEGCSA-N 298.814 2.164 10 20 CECD C[C@H]1CCCC[C@@H]1NC(=O)COC(=O)c1cc(O)cs1 731911235 GZZSQKBRZWZCGU-ONGXEEELSA-N 297.376 2.305 10 20 CECD Cc1ccc(C(=O)NCc2ccc(N(C)C)cc2C)nn1 839684117 SVZPSCJJWPJXOB-UHFFFAOYSA-N 284.363 2.089 10 20 CECD O=C(O)CN(Cc1ccccc1O)C(=O)CC1CCCC1 911483982 IQUIYJUTIFIYLJ-UHFFFAOYSA-N 291.347 2.386 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H](C)c1cc(C)ccc1O 834904841 RPBPHUVYYWLJHE-NJZAAPMLSA-N 265.353 2.155 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1nn(C)cc1C 839621769 MEQOPRMUTDMMQV-UHFFFAOYSA-N 287.363 2.487 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1CCN(C)CC1 840930969 BUGXREUHVHUECD-UHFFFAOYSA-N 275.440 2.492 10 20 CECD CCOc1ccc([C@@H]2NC(C)(C)C(=O)N2CC)c(O)c1 840831171 DIEFMQZFDQGMMX-CYBMUJFWSA-N 278.352 2.020 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@H]12)NCc1ccc(O)cc1O 910945434 WHCWVKDFHPEXNS-KWBADKCTSA-N 261.321 2.150 10 20 CECD CCC1(CC)CCN(C(=O)C(=O)Nc2ccc(N)cc2)C1 841063196 JSMAICURQVIPHZ-UHFFFAOYSA-N 289.379 2.246 10 20 CECD Cc1cc(O)c(CN2C[C@H]3C[C@H]2C(=O)O3)cc1C(C)C 840109602 BOTZVIXIOLRQPI-OCCSQVGLSA-N 275.348 2.324 10 20 CECD CC[C@H](SC)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 844163222 VVDSKXPACXIPDT-KGLIPLIRSA-N 295.452 2.010 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H](CN)C1 843047099 NZJAGEWSGFJNDN-CQSZACIVSA-N 261.413 2.232 10 20 CECD COc1cccc([C@@H](C)NCCCn2cccn2)c1O 846139756 YZUNNLVJFLYPSR-GFCCVEGCSA-N 275.352 2.338 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H](N)CC(F)F 843413525 ROVRJJZDXRHNEZ-NSHDSACASA-N 286.322 2.113 10 20 CECD CC(C)[C@@H](CO)CNCc1cc(F)c(N(C)C)cc1F 858164516 ZSKDXOIEYOELPX-GFCCVEGCSA-N 286.366 2.385 10 20 CECD CC[C@@H](NC[C@H]1C[C@@H](O)C1)c1ccc(F)cc1O 858543224 HEWOPKBKFZHISW-SUZMYJTESA-N 253.317 2.343 10 20 CECD CN1CCN(c2ccc(CNC(C)(C)CF)cc2F)CC1 1116630269 BATTZGGXRGYFMK-UHFFFAOYSA-N 297.393 2.415 10 20 CECD C[C@@H]1[C@@H](C)N(Cc2ccc(N(C)C)c(F)c2)CCN1C 775983982 DUPKMDNQPNSEJR-CHWSQXEVSA-N 279.403 2.416 10 20 CECD Cc1cccc(O)c1CN1CC[C@@H](C(=O)N2CCCC2)C1 877529632 JODDAWHFWSXPSH-CQSZACIVSA-N 288.391 2.145 10 20 CECD CC(C)SCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 773768200 CZAOYYIPEHBADY-JTQLQIEISA-N 283.393 2.287 10 20 CECD C[C@H](N[C@@H](CO)CC(F)F)c1c(O)cccc1F 886600909 FFJIXTNWKGKSBH-JGVFFNPUSA-N 263.259 2.198 10 20 CECD Cc1cc(N(C)Cc2ccccc2O)n2nc(C)nc2n1 882139586 YVHIGPVGJVUZCR-UHFFFAOYSA-N 283.335 2.083 10 20 CECD COc1ccc(NC(=O)c2cc(O)cs2)c(O)c1 785425723 VAUBWAGOHHCVCZ-UHFFFAOYSA-N 265.290 2.420 10 20 CECD CCC(=O)NC1CC(CNCc2ccc(OC)c(C)c2)C1 961440587 RCUOMOVIZDPMFM-UHFFFAOYSA-N 290.407 2.398 10 20 CECD COc1ccc(CN2CCCOC[C@@H]2C)c(O)c1OC 892077829 ZPIIAUJDWOYNBJ-NSHDSACASA-N 281.352 2.020 10 20 CECD COc1cc(O)c(CN2CCC[C@@](C)(OC)C2)cc1OC 793217756 PJUNPBLUQHAYFG-MRXNPFEDSA-N 295.379 2.410 10 20 CECD CC[C@@H](C)CC(=O)NCc1ccc(OC)cc1O 794390464 JUCNJBZOCGHZLL-SNVBAGLBSA-N 251.326 2.453 10 20 CECD CC[C@@H](NCc1ccc(N(CC)CC)cc1)C(=O)O 75423919 FQTUTIOVXHFTQZ-CQSZACIVSA-N 264.369 2.486 10 20 CECD c1cc(N2CCCC2)ccc1CN[C@H]1CCCNC1 1246173433 HBLPUJGYGHIDPX-HNNXBMFYSA-N 259.397 2.128 10 20 CECD C[C@H](Cn1ccnc1)N[C@H](C)c1ccc(F)cc1O 62747599 SMLHPDHBPGBXCR-GHMZBOCLSA-N 263.316 2.467 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCCSC1 1337444158 HIFIOUGQALVURM-HWKANZROSA-N 265.334 2.034 10 20 CECD Cc1ccc(CNCCC(=O)N2CCC[C@H](C)C2)c(O)c1 1330626800 SAZBWMUAULLSOG-AWEZNQCLSA-N 290.407 2.439 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@@H]2OCCC[C@@H]2C1 1347321905 DSOZSDSKHQPGTI-KOLCDFICSA-N 267.350 2.095 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)[C@H]1C[C@@H]1F 1351666298 LJBODPDYTFCTMO-AAEUAGOBSA-N 263.312 2.245 10 20 CECD C[C@@H](CC(=O)O)NCc1cccc(Br)c1O 1609888091 CUCKLFLJMPHXID-ZETCQYMHSA-N 288.141 2.108 10 20 CECD Cc1nc(N(C)Cc2ccccc2O)ccc1C(=O)O 1600708309 KHZPLTPADXQCHN-UHFFFAOYSA-N 272.304 2.430 10 20 CECD C[C@H](C(=O)NCc1c(O)ccc2ccccc12)[C@@H](C)N 1576088910 UVPXHDRWAMBNCG-WDEREUQCSA-N 272.348 2.145 10 20 CECD CCN(C)c1ccc(CN2CC[C@@](CF)(C(=O)O)C2)cc1 1776855886 BMNTVWUPFUSUMW-INIZCTEOSA-N 294.370 2.389 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccc(C=O)[nH]2)c1 153915803 AASXXKYUFIEZNZ-VIFPVBQESA-N 288.303 2.032 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)c2nncn2C)c1 37017588 CSQJKVFWYYXPHA-WDEREUQCSA-N 260.341 2.241 10 20 CECD CN(Cc1ccccc1O)C(=O)CC[C@H]1CCOC1 176014970 RYJXTNTVVXCTRN-LBPRGKRZSA-N 263.337 2.167 10 20 CECD C[C@@]1(NCc2cc(F)cc(F)c2O)CCCOC1 708438207 VSNOWOGGVAZERA-CYBMUJFWSA-N 257.280 2.329 10 20 CECD C[C@@]1(C(=O)O)CCCN1Cc1ccc(Cl)cc1O 1589187576 VYDJEHTZIWQGAD-ZDUSSCGKSA-N 269.728 2.485 10 20 CECD CN1C[C@@H](N(C)Cc2cc(Cl)ccc2O)CCC1=O 862428645 UEJDHTMFBDJCGN-LBPRGKRZSA-N 282.771 2.098 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccco2)cc1F 58482934 PTKMGUCFANWAER-UHFFFAOYSA-N 291.326 2.484 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C(F)(F)C(F)F)c1 179427544 LPPKHZOYEQURAN-ZCFIWIBFSA-N 295.232 2.478 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cn(C)cn1 178230129 ZHGSWKXVCZSFOT-UHFFFAOYSA-N 273.336 2.178 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccc(Cl)o1 122027056 CIYXQGUOTABKSB-UHFFFAOYSA-N 281.695 2.317 10 20 CECD CCOC(=O)N1CC[C@@H](NCc2cc(C)ccc2O)C1 185779546 LZBHDRYPQZZJSA-CYBMUJFWSA-N 278.352 2.021 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)N[C@H]1CCSC1 75463566 VGXSFWVANPHSPH-ZDUSSCGKSA-N 293.436 2.400 10 20 CECD CC[C@H](OC)C(=O)NCc1ccc(N2CCCC2)cc1 49422626 VNWPZQZYNGSTMX-HNNXBMFYSA-N 276.380 2.328 10 20 CECD Cc1ccc(CNC(=O)NCc2ccc(N(C)C)cc2)cn1 43862592 VJOQFZWXYXRIIK-UHFFFAOYSA-N 298.390 2.455 10 20 CECD COCCC1(CNC(=O)c2cccc(O)c2O)CCCC1 193133908 VFTXTOHRFHLEJW-UHFFFAOYSA-N 293.363 2.425 10 20 CECD O=C(Nc1ncccc1OC(F)F)c1cccc(O)c1O 193014729 ZRRNAMUMSUWREL-UHFFFAOYSA-N 296.229 2.347 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccc(O)cc2)cc1 46072477 ICGQPYKIIFJIQM-UHFFFAOYSA-N 299.374 2.458 10 20 CECD COc1ccc(N(C)CC(=O)N[C@H](C)C(C)C)c(OC)c1 131888978 FLGADXYDLJMBBS-GFCCVEGCSA-N 294.395 2.301 10 20 CECD CCN(CC)c1ccc(CNC(=O)/C=C/CN(C)C)cc1 265653908 OZXCRFVGVUZWTD-BQYQJAHWSA-N 289.423 2.267 10 20 CECD C[C@H](N[C@@H]1CCSC1)c1cc([N+](=O)[O-])ccc1O 273488177 NRSLSBMMOUYCMF-DTWKUNHWSA-N 268.338 2.457 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cc(F)ccc2O)[C@]12CCCO2 368698221 JUSAUTXFDFNCHY-BZUAXINKSA-N 295.354 2.348 10 20 CECD Cc1ccc([C@@H](C)N[C@H](CO)c2cnn(C)c2)c(O)c1C 273498525 PTWZNTVAUBHNOX-IUODEOHRSA-N 289.379 2.127 10 20 CECD Cc1ocnc1CNC(=O)N(C)Cc1ccccc1O 271816006 RPQZLHZFHXBRFC-UHFFFAOYSA-N 275.308 2.030 10 20 CECD Cc1cc(C)c([C@H](C)N[C@@H](C)C(=O)NCCF)c(O)c1 285366503 VUMKVGLTAOAZOP-RYUDHWBXSA-N 282.359 2.134 10 20 CECD Cc1cccc(CNCC2(S(C)(=O)=O)CCCC2)c1O 289266669 GAUFHQZNJJDAKJ-UHFFFAOYSA-N 297.420 2.148 10 20 CECD CCC[C@@]1(CO)CCN(Cc2cccc(OC)c2O)C1 290247287 VITFQESPNZASBE-MRXNPFEDSA-N 279.380 2.385 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ncn(C(C)(C)C)n1 292356939 CMQBLVPGVLSKKY-UHFFFAOYSA-N 288.351 2.011 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)CCN(C2CC2)C1 294657115 ADOMATJLXLHOHZ-GFCCVEGCSA-N 278.371 2.447 10 20 CECD Cc1n[nH]c(CN(Cc2ccc(N(C)C)cc2)C2CC2)n1 292155759 JYZYGURXGFHIRP-UHFFFAOYSA-N 285.395 2.344 10 20 CECD CCCCN(CCCO)Cc1cc(OC)ccc1O 809752597 SRZSJRWYGIPYTJ-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CC[C@H](O)CNc1ccccc1OCCCOC 819422065 RWQIMVMNDPXPQQ-LBPRGKRZSA-N 253.342 2.285 10 20 CECD Cc1ccc([C@H](C)N[C@H]2CC23CCNCC3)c(O)c1 817976494 MAVAAACEGPQWON-WFASDCNBSA-N 260.381 2.493 10 20 CECD CC[C@H]1NCC[C@@H]1C(=O)NCCCSc1nccs1 829528621 UFACECIGFJDNMQ-WDEREUQCSA-N 299.465 2.130 10 20 CECD C[C@@H]1C[C@H](O)CN(Cc2cccc(Cl)c2O)C1 825315458 BCQXUVZOKMDZFD-KOLCDFICSA-N 255.745 2.248 10 20 CECD C[C@@H](NC(=O)COCc1cccnc1)c1ccccc1O 827946814 SHJIOEJIRAPZOC-GFCCVEGCSA-N 286.331 2.181 10 20 CECD Cc1cc(NC(=O)NCc2ccccc2O)ccc1C(N)=O 732433337 IOMSCFGPWFHWQV-UHFFFAOYSA-N 299.330 2.121 10 20 CECD CC(=O)Nc1cccc(CNC(=O)c2cc(O)cs2)c1 731869456 IEFRUTCQOXUHSQ-UHFFFAOYSA-N 290.344 2.342 10 20 CECD CC[C@H](NC(COC)COC)c1ccc(C)cc1O 834890548 LAAJTQMAKRFLKY-AWEZNQCLSA-N 267.369 2.403 10 20 CECD CCN1CCC[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 903391977 KDVIAXXSSDKXAP-XJKSGUPXSA-N 289.423 2.414 10 20 CECD Oc1c(Cl)cccc1CN1CC(OC(F)F)C1 839145826 VRTPQNJTNKHCFL-UHFFFAOYSA-N 263.671 2.469 10 20 CECD O=C1NC(=S)S/C1=C/c1cnc2ccc(Cl)cn12 737444948 WCZDPWRYMZUCSP-FPYGCLRLSA-N 295.776 2.477 10 20 CECD Cc1nccn1C[C@H](C)CNC(=O)c1cc(O)cs1 732274136 CVPUVEQJAPAYMC-SECBINFHSA-N 279.365 2.025 10 20 CECD C[C@H](NCc1ccccc1O)c1ccc(-c2nn[nH]n2)cc1 736135306 PFICHPQYZPBLHG-NSHDSACASA-N 295.346 2.423 10 20 CECD CN(C)c1ccc(CNC(=O)N2CC[C@@H](F)C2)cc1 836223640 DEEJFZYEVAYUPB-GFCCVEGCSA-N 265.332 2.006 10 20 CECD O=C(NCc1ccc(N2CCOCC2)cc1)OC1CCC1 830167159 HTXYFAZPWNJVHE-UHFFFAOYSA-N 290.363 2.302 10 20 CECD CC(C)[C@@H]1C[C@H]1CNC(=O)c1c(F)ccc(O)c1O 839786215 PZPRMOPURGKJTJ-IUCAKERBSA-N 267.300 2.259 10 20 CECD COc1cccc([C@H](C)N[C@H](CO)C(C)C)c1O 846149574 JVNZCMQSJFGSNQ-CMPLNLGQSA-N 253.342 2.068 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H]2CCc3c(nnn3C)C2)c1 848565218 VEYJTJQDHDLMPD-NEPJUHHUSA-N 286.379 2.037 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](C)[C@H]2CN)c1 843051754 LJUHNVOYJRBRIY-SWLSCSKDSA-N 278.396 2.350 10 20 CECD CCc1cccc(CNC[C@@H]2CCOC[C@H]2OC)c1O 848915843 MNOXDLDWXXMIGO-DZGCQCFKSA-N 279.380 2.096 10 20 CECD C[C@@H]1SCC[C@@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 844106851 LFUMBOVADTYDJV-JAQYDWNVSA-N 279.361 2.121 10 20 CECD CCOC(=O)CCN(C)CCN(C)c1ccc(OC)cc1 844399864 QRCWWUDEPDMGGA-UHFFFAOYSA-N 294.395 2.016 10 20 CECD C[C@H]1C[C@H](Nc2cnn(CCO)c2)c2c(O)ccc(F)c21 756855871 ODZJTBUMTCXXSO-CABZTGNLSA-N 291.326 2.381 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCN2CC[C@@H](O)C2)c1O 858547242 DWJFXHLMSOVNAZ-WCQYABFASA-N 298.814 2.071 10 20 CECD C[C@@H](N[C@H](C)c1cc2c(cc1O)CCCC2)C(=O)N(C)C 756738235 DQISIRQHNGWMGA-VXGBXAGGSA-N 290.407 2.398 10 20 CECD Cc1ccc(O)c(CNC(=O)CC[C@H]2CCCO2)c1 862760829 XADDMUYLQVTHBJ-CYBMUJFWSA-N 263.337 2.276 10 20 CECD C[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)C1 768438034 OQQYSNPMFGOMRN-YGRLFVJLSA-N 263.337 2.050 10 20 CECD CCN(CC(=O)N(C)C)Cc1ccc(N(CC)CC)cc1 768309058 XHMAHYJOFLCTFL-UHFFFAOYSA-N 291.439 2.443 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1C[C@@]12CCOC2 764124096 BROMCGVMNACBBL-ZWNOBZJWSA-N 298.433 2.168 10 20 CECD CCN(C(=O)/C=C/c1cn(C)cn1)c1ccc(OC)cc1 930065872 BMVGVIYCDZUINS-BJMVGYQFSA-N 285.347 2.495 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1C(=O)O 863740245 UDGZUTKDKILDII-YPMHNXCESA-N 294.370 2.434 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](CCO)C2)cc1F 769332370 AXQHQUCGVFNLNN-CYBMUJFWSA-N 280.387 2.486 10 20 CECD C[C@H](NCc1cccc(Cl)c1O)[C@H](O)C(F)(F)F 877693647 MRBRHINHQSCMRF-WKEGUHRASA-N 283.677 2.447 10 20 CECD CCO[C@H](C(=O)NCc1cc(C)ccc1O)C1CC1 862754419 XOCSBHAMMCXSIY-AWEZNQCLSA-N 263.337 2.132 10 20 CECD O=C1OCC[C@]12CCCN2Cc1cc(Cl)cc(F)c1O 779198905 PHXKZNJEUZEVCW-CQSZACIVSA-N 299.729 2.466 10 20 CECD C[C@H](O)C[C@@H](C)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 776246005 IXUNAJODOYTRFO-AGIUHOORSA-N 293.411 2.272 10 20 CECD CC[C@@H](C)n1nccc1C(=O)NCc1ccc(O)c(O)c1 1123769869 OYPMUCWHEVMLBG-SNVBAGLBSA-N 289.335 2.195 10 20 CECD CCN1CCC[C@@H](CNCc2cc(F)cc(F)c2O)C1 882942498 FFWIXSCLHNCOHH-NSHDSACASA-N 284.350 2.492 10 20 CECD COC(=O)[C@H]1CCN(Cc2cccc(Cl)c2O)[C@@H]1C 787420069 CULAUCYRRYZRPP-KOLCDFICSA-N 283.755 2.429 10 20 CECD C[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C[C@@H]1CO 895380533 ZGHYPYHGHLVFFM-MWLCHTKSSA-N 271.307 2.121 10 20 CECD COc1ccc(CNC(=O)c2cc(O)cs2)c(O)c1 796346165 LXZLVJINNQMOJU-UHFFFAOYSA-N 279.317 2.098 10 20 CECD COc1cccc(CNCc2ccc(C(=O)O)cc2)c1O 76272140 WIIQSCSPVPLCJN-UHFFFAOYSA-N 287.315 2.389 10 20 CECD C[C@@H](NCC(C)(C)N1CCOCC1)c1ccccc1O 20120631 POWRSMWVUPNNKJ-CYBMUJFWSA-N 278.396 2.154 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@@H]1CCCCN1C 1263768591 ZTWYZOLQMQOMKN-AWEZNQCLSA-N 291.395 2.018 10 20 CECD CC[C@H](CN[C@@H](C)c1cccc(OC)c1O)C(=O)O 1603567877 KYJDPMJZHMGDKE-VHSXEESVSA-N 267.325 2.162 10 20 CECD COc1cc(C)c(CN2CC[C@@H](C)[C@@H](C(=O)O)C2)c(O)c1 1574181548 BZGMUSMHFGIGOO-YGRLFVJLSA-N 293.363 2.252 10 20 CECD c1cc2c(cc1CNC[C@H]1CCCNCC1)CCO2 1580889913 FFRDZWSMKFXJHV-ZDUSSCGKSA-N 260.381 2.101 10 20 CECD C[C@H](NC(=O)[C@H]1CC[C@@H](C(=O)O)C1)c1ccccc1O 1594237949 CKAFMGBZPBOWJG-GARJFASQSA-N 277.320 2.070 10 20 CECD CC1(CNC(=O)Nc2ccc(N)cc2)CCOCC1 232883962 OPBDEPCRUPLGQL-UHFFFAOYSA-N 263.341 2.207 10 20 CECD C[C@H]1CCC[C@]1(O)CNCc1ccc(N(C)C)cc1 293165395 VWXRMZPUCKVILD-BBRMVZONSA-N 262.397 2.393 10 20 CECD COc1cccc(CN[C@@H]2CCCOCC2)c1O 386534698 PVAXXYDSSGSWHV-GFCCVEGCSA-N 251.326 2.060 10 20 CECD CN(C)c1ccc(CNC(=O)CN2CCCCCC2)cc1 7115167 WLEPDHLEARUBPE-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COc1cccc(CNC(=O)c2cc(Cl)c[nH]2)c1O 105652648 IYEFIZRWUCATJJ-UHFFFAOYSA-N 280.711 2.312 10 20 CECD CN(C)CCn1ccc(NCc2c(O)cccc2Cl)n1 119770251 WHOUTYLBLMTUKG-UHFFFAOYSA-N 294.786 2.416 10 20 CECD COC(=O)c1coc(CN(C)Cc2ccccc2O)c1 111235544 NVDWOVLRACBMQX-UHFFFAOYSA-N 275.304 2.404 10 20 CECD CC(C)N(C)C(=O)[C@@H](C)N(C)Cc1ccccc1O 177676258 RHZVYSYXWARPKK-GFCCVEGCSA-N 264.369 2.079 10 20 CECD CCNC(=S)N[C@H](C)c1ccc(N2CCOCC2)cc1 65222469 HJWOAICZTRDPPN-GFCCVEGCSA-N 293.436 2.068 10 20 CECD c1cc(N2CCCCC2)ccc1CNC[C@H]1COCCO1 37998059 GTKIMALVPJTYMD-KRWDZBQOSA-N 290.407 2.182 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)CC1OCCO1 181972694 KICRSUYUZXKDOR-UHFFFAOYSA-N 290.407 2.482 10 20 CECD CCCNC(=O)CN[C@@H](C)c1cc2c(cc1O)CCCC2 184881865 KGLFZWVBQMHLSE-LBPRGKRZSA-N 290.407 2.448 10 20 CECD CN1c2ccccc2C(=O)N[C@@H]1c1cc([N+](=O)[O-])ccc1O 41864162 QBPADGNMPBDNMD-AWEZNQCLSA-N 299.286 2.179 10 20 CECD CCN(CC)c1ccc(CNC2(CO)CCOCC2)cc1 227213388 KBWROUJJFZSDBY-UHFFFAOYSA-N 292.423 2.164 10 20 CECD CN(C)CCN(C(=O)Cc1ccc(N)cc1)c1ccccc1 237113785 YENRXNQTAREGAI-UHFFFAOYSA-N 297.402 2.406 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)C[C@H]1CCC[C@H]1O 271252675 ITKJYTFDRWAHDH-CZUORRHYSA-N 280.387 2.485 10 20 CECD CC[C@H]1CO[C@@H](C)CN1C(=O)c1ccc(C)c(O)c1O 272751954 OKXXILFZTPUCTP-QWRGUYRKSA-N 279.336 2.046 10 20 CECD CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccccc1O)CC2 271461763 XEHLABOXSYVVPS-HZPDHXFCSA-N 291.391 2.144 10 20 CECD CC[C@H](NCc1cc(C)ccc1O)[C@@H](O)C(F)(F)F 271015698 TVQPGSWEULOLKB-CMPLNLGQSA-N 277.286 2.492 10 20 CECD Cc1ncc2c(n1)CC[C@H](NCc1cccc(C)c1O)C2 361991776 PQHASEMUANLNGA-HNNXBMFYSA-N 283.375 2.446 10 20 CECD Cc1ccc(O)c(CN(C)CCN2CCOC(C)(C)C2)c1 279327213 CSZPBAGPFOJYOC-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CCc1ocnc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 274994153 ZITTUJVBAAXFAO-VIFPVBQESA-N 290.319 2.009 10 20 CECD C[C@](O)(C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 286099304 RFUIUAIYVUSUGN-QGZVFWFLSA-N 288.391 2.064 10 20 CECD CNC(=O)[C@H](CCSC)N[C@H](C)c1cc(C)ccc1O 806662245 AYVSNIBVADTKFL-YPMHNXCESA-N 296.436 2.219 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C)SC 808094290 IYINOMTZJKTQHO-VIFPVBQESA-N 274.382 2.246 10 20 CECD NC(=O)CC1CN(Cc2cc(-c3ccccc3)ccc2O)C1 297335037 FFLJUKQQGVMPLZ-UHFFFAOYSA-N 296.370 2.366 10 20 CECD Cc1ccnc(CNC(=O)/C=C\c2ccc(O)c(O)c2)c1 818440252 YIWRFYMTMIUQOJ-HYXAFXHYSA-N 284.315 2.131 10 20 CECD COCC1(NCc2ccc(N(C)C)c(F)c2)CCOCC1 814302024 NBWBGLJXZQLIOX-UHFFFAOYSA-N 296.386 2.177 10 20 CECD C[C@@H]1OCC[C@@]1(O)CNCc1ccc2ccccc2c1O 816593872 HEYKCSKSDSIXEY-YVEFUNNKSA-N 287.359 2.175 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C(C)(C)C(=O)O)c1O 825946887 VZIOKYQWRDVOBA-UHFFFAOYSA-N 283.299 2.029 10 20 CECD O=C(NC[C@@H]1CCCCS1)c1c(F)ccc(O)c1O 828253798 YLTJFCXSWNGCHP-QMMMGPOBSA-N 285.340 2.252 10 20 CECD Cc1cc(O)c(CN2CCNC(=O)C[C@@H]2C)cc1Cl 825935165 NZZGDKQIIMBVBE-JTQLQIEISA-N 282.771 2.064 10 20 CECD Cc1cc(O)c(CN2CC(=O)N(C3CC3)C2)cc1Cl 825738849 UUJRXDMMFKIWQS-UHFFFAOYSA-N 280.755 2.118 10 20 CECD C[C@H]1CC[C@@H](C)N1CC(=O)N[C@H](C)c1ccccc1O 827936714 AYZPMLQHZYLOLQ-FRRDWIJNSA-N 276.380 2.442 10 20 CECD CC(=O)N[C@@](C)(C(=O)N[C@H](C)c1ccccc1O)C(C)C 828538831 AZWFCNJTJYTGGL-BDJLRTHQSA-N 292.379 2.120 10 20 CECD CCOC[C@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 837985892 SDZQIAFDVULTHS-GFCCVEGCSA-N 293.363 2.437 10 20 CECD COC1CCC(NC(=O)/C=C/c2ccc(O)c(O)c2)CC1 837958086 WGNCAYARVSVNED-YCRREMRBSA-N 291.347 2.185 10 20 CECD CC1(C)C[C@@H](O)CCN(C(=O)c2cc(O)cs2)C1 839786868 HDZMSHBDIPHLIM-VIFPVBQESA-N 269.366 2.077 10 20 CECD CC(C)[C@]1(CO)CCCN(C(=O)c2cc(O)cs2)C1 832907930 CANDTFHCBZDNPL-CQSZACIVSA-N 283.393 2.324 10 20 CECD C[C@@H](N[C@H]1CCN(CC(F)F)C1)c1ccccc1O 841765336 PPCSOUJHDPBDCQ-MNOVXSKESA-N 270.323 2.382 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCCC2=O)c(O)c1C 846205940 LCBHRTDLLNBIBP-CYBMUJFWSA-N 276.380 2.282 10 20 CECD N[C@H]1CCC[C@H](NCc2cc(Cl)ccc2O)C1 841055258 MQRKPOJNAATIOP-RYUDHWBXSA-N 254.761 2.405 10 20 CECD CCC(=O)CCN(C)CCN(C)c1ccc(OC)cc1 844402942 XOJPIILKABSVTD-UHFFFAOYSA-N 278.396 2.432 10 20 CECD COC/C(C)=C\C(=O)N(C)Cc1ccc(N(C)C)cc1 845115598 SNROPMVQXPNMID-RAXLEYEMSA-N 276.380 2.304 10 20 CECD C[C@@H](CCNC(=O)c1cc(O)cs1)N1CCCCC1 753520019 DOLHUFHSVKJBLU-NSHDSACASA-N 282.409 2.448 10 20 CECD Cc1cnc(CN(C)c2ccc3c(c2)OCO3)cn1 756643637 DXKDYAJPSOPOQO-UHFFFAOYSA-N 257.293 2.150 10 20 CECD OC[C@@H](CN[C@@H]1CCc2cccc(O)c21)CC1CC1 850546423 ZPSCJIIKKAXUTB-TZMCWYRMSA-N 261.365 2.378 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@]2(C)CC2(F)F)c1 862755522 VFZNUKDOBJASBA-LBPRGKRZSA-N 255.264 2.362 10 20 CECD C[C@@H](NC(=O)N[C@H](C)c1ccccc1O)c1ccn(C)n1 868698774 XVJDUOCWTROATP-GHMZBOCLSA-N 288.351 2.247 10 20 CECD CCCN(Cc1ccccc1O)C[C@@]1(OC)CCOC1 876654765 OTGMZTOGULIZSF-INIZCTEOSA-N 279.380 2.410 10 20 CECD Cc1ccc(CN[C@@H]2CCN(CC(F)(F)F)C2)c(O)c1 876990783 CQPYLVHJWCBQMF-GFCCVEGCSA-N 288.313 2.427 10 20 CECD CN(C)c1ccc([C@H](CN[C@H]2CCSC2)N(C)C)cc1 898451352 YCKGEXWUAOYKAK-HOCLYGCPSA-N 293.480 2.450 10 20 CECD C[C@@H](NCc1cc(F)cc(F)c1O)c1ccn(C)n1 883145171 QJEZKCXSVLSYEY-MRVPVSSYSA-N 267.279 2.255 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCC(F)(F)C2)c(O)c1O 780983865 NEPBENNPNSICQM-MRVPVSSYSA-N 271.263 2.324 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)CC[C@@H]1O 1204324537 MSXZQWZZOHQIMI-YOEHRIQHSA-N 274.408 2.490 10 20 CECD COc1cccc(CN(C)CC[C@@H](N)C(C)C)c1O 133338369 MUJPZSWHKQUZNB-CYBMUJFWSA-N 266.385 2.206 10 20 CECD CCOc1cccc(CN[C@H](C)[C@@H]2CCOC2)c1O 135213480 MFLDAFWLCXNSQP-DGCLKSJQSA-N 265.353 2.306 10 20 CECD CCc1cccc(CN[C@H](C)c2noc(C)n2)c1O 1329982354 JVCSDRQXFYEIMM-SECBINFHSA-N 261.325 2.497 10 20 CECD Nc1ccc(CC(=O)NCCSC(F)(F)F)cc1 195170091 RKBNBJXKEXZDMJ-UHFFFAOYSA-N 278.299 2.181 10 20 CECD OC[C@H](CC(F)(F)F)NCc1cc(Cl)ccc1O 717714225 XCYKDNRCASOUHK-VIFPVBQESA-N 283.677 2.449 10 20 CECD CN(CCOC(C)(C)C)C(=O)NCc1ccc(N)cc1 1335723917 DDMKMPHNPLXUNC-UHFFFAOYSA-N 279.384 2.225 10 20 CECD CCCc1[nH]ccc1C(=O)NCc1cccc(O)c1O 1520508470 BZOVWPXJNZFJHF-UHFFFAOYSA-N 274.320 2.308 10 20 CECD CC(=O)C(=O)CSc1cc(Cl)ccc1C(=O)O 1589020670 DSXOCPZQCREXHI-UHFFFAOYSA-N 272.709 2.288 10 20 CECD CC(C)c1ccc(O)c(CN(C)[C@H](C)C(=O)O)c1 1591974197 RDDOYDGEFARPQU-SNVBAGLBSA-N 251.326 2.421 10 20 CECD COc1cc(C)cc(CN2CCN(CC3CC3)CC2)c1O 164191139 OJIKGNOIRVYHAW-UHFFFAOYSA-N 290.407 2.237 10 20 CECD C[C@@H](NC[C@@H]1CCOC1)c1ccc(N2CCOCC2)cc1 153088335 HGVYOCIHPALRCV-CABCVRRESA-N 290.407 2.210 10 20 CECD CC(=O)NC[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 155602110 UGTJWMXOTSDPRL-INIZCTEOSA-N 289.423 2.101 10 20 CECD CNC(=O)[C@@]1(C)CCN(Cc2cc(Cl)ccc2O)C1 228099082 HFNWUOCMTOHOLG-AWEZNQCLSA-N 282.771 2.004 10 20 CECD Cc1cc(NS(=O)(=O)c2cncc(F)c2)ccc1O 148641789 IMHSNQZJMJWQOC-UHFFFAOYSA-N 282.296 2.036 10 20 CECD COC(=O)N1CCC(N[C@@H](C)c2ccccc2O)CC1 154099647 PBIJJJZNTZLALX-NSHDSACASA-N 278.352 2.274 10 20 CECD C[C@@H]1CCSCCN1C(=O)c1cccc(O)c1O 276899828 RYWRZPGINBLXGJ-SECBINFHSA-N 267.350 2.065 10 20 CECD C[C@H](CC[S@](C)=O)N[C@@H]1CCc2cccc(O)c21 296666491 FPJAABBICDOWBD-QAMHXRKUSA-N 267.394 2.126 10 20 CECD Oc1ccc(Cl)cc1CNC[C@@]1(O)CCSC1 304673389 YBWMERAQCXYGGS-LBPRGKRZSA-N 273.785 2.003 10 20 CECD CCC[C@@](C)(CO)NCc1cccc(OC)c1O 304831195 IRBSUIVGBGYYMC-AWEZNQCLSA-N 253.342 2.042 10 20 CECD CCOC(=O)CC(=O)[C@@H](C)Sc1nccs1 315166727 HIWTYYLAPPESQD-SSDOTTSWSA-N 259.352 2.146 10 20 CECD Oc1c(F)cc(F)cc1CNCCCCn1ccnc1 708482782 YKOMLAXEYITIAP-UHFFFAOYSA-N 281.306 2.437 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)[nH]n1 54128835 BSAKOHPVNKRXJH-UHFFFAOYSA-N 272.352 2.056 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCCO2)cc1F 66841314 RBFIBTXDXQOLRL-HNNXBMFYSA-N 294.370 2.467 10 20 CECD CCOC(=O)CN(Cc1cccc(OC)c1O)C(C)C 179424975 JHRIAMFXWWCXEE-UHFFFAOYSA-N 281.352 2.174 10 20 CECD CCOC(=O)C[C@@H]1CCCN1Cc1cc(OC)ccc1O 123307912 UAHMGSTYWQJJJD-ZDUSSCGKSA-N 293.363 2.318 10 20 CECD COC(=O)COc1ccc(N(C)CCOC(C)C)cc1 183808421 IRCAUELFMMXZGI-UHFFFAOYSA-N 281.352 2.100 10 20 CECD NC(=O)CC[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 180010958 AYYUBZXEAVSHNO-NSHDSACASA-N 280.343 2.009 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)C(C)(C)F 188906853 JEMYUNRXKSJLBO-UHFFFAOYSA-N 266.316 2.226 10 20 CECD CN(Cc1ccccc1O)C[C@@H]1CC2(CCC2)C(=O)O1 192102785 JKXHWZWWNIQHBZ-ZDUSSCGKSA-N 275.348 2.310 10 20 CECD C[C@@H](NCc1cc(Cl)cc(Cl)c1O)C(=O)O 49354251 CQXBXAMAHWNZSB-RXMQYKEDSA-N 264.108 2.262 10 20 CECD C[C@@H](CNCc1cc2c(cc1O)OCO2)N1CCCCC1 42880281 DJGBTOIVJHLPMF-LBPRGKRZSA-N 292.379 2.085 10 20 CECD CC(C)n1nccc1C(=O)NCCc1ccc(N)cc1 852796545 VTRZQLUBAYJDPX-UHFFFAOYSA-N 272.352 2.019 10 20 CECD C[C@@H](NC[C@@](C)(O)C1CC1)c1ccc(F)cc1O 386613309 KXENWSDEUVFSCV-YMTOWFKASA-N 253.317 2.343 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccn(C)c2)cc1 268635068 YUOBJWPAUGCZDO-UHFFFAOYSA-N 257.337 2.021 10 20 CECD CO[C@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@H](C)C1 281653433 BRJLVMPNPKEBCH-YJLKIPLNSA-N 291.347 2.137 10 20 CECD CC(C)N(CCCO)Cc1ccc(N(C)C)cc1 298705295 ISMDGAYZGJDGOL-UHFFFAOYSA-N 250.386 2.345 10 20 CECD CCOc1ccc(O)c(CN2CC(O)(c3ccccc3)C2)c1 291619358 RNQSLPFLEVVKID-UHFFFAOYSA-N 299.370 2.494 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CCCN(CCCO)C2)c(O)c1 297385146 RKLJQYVQGIUJOI-HUUCEWRRSA-N 292.423 2.198 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)Nc1ccnnc1 297428596 ODUNBHBXFGULBF-UHFFFAOYSA-N 298.346 2.383 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](N)C1CCC1 399192482 QPBJJJGNFGALDJ-MRXNPFEDSA-N 289.423 2.229 10 20 CECD C[C@@H](C(=O)NCc1cc(Cl)cc(Cl)c1O)N(C)C 813684033 JLHNGCJCYZIKQE-ZETCQYMHSA-N 291.178 2.265 10 20 CECD CSC[C@H](O)CNc1ccccc1OCCF 819488537 MGLQRGQMBKEJIP-SNVBAGLBSA-N 259.346 2.171 10 20 CECD C[C@H](N)CCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 817953864 VKVUAVCSXLWIKM-WCABBAIRSA-N 252.333 2.407 10 20 CECD CCOc1cccc(CN[C@H](C)c2nc(C)no2)c1O 729684759 VTGHDJLCTLHKEG-SECBINFHSA-N 277.324 2.333 10 20 CECD CCN(CC)C(=O)CNCc1cc(Cl)c(C)cc1O 825160525 RXERJHXDEGJNGX-UHFFFAOYSA-N 284.787 2.312 10 20 CECD CCN1C[C@@H](N[C@@H](C)c2c(C)cc(C)cc2O)CC1=O 834892235 UQVITIHEEFPJFF-STQMWFEESA-N 276.380 2.280 10 20 CECD CC[C@@H](N[C@@H]1COC[C@@H]1OC)c1ccc(C)cc1O 840826255 JACBOJSUWBZUGS-NFAWXSAZSA-N 265.353 2.155 10 20 CECD CCOc1cccc(CNC[C@H](C(=O)O)C(C)C)c1O 848640566 RWUCZYJFQOSKFI-LBPRGKRZSA-N 281.352 2.237 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCO[C@H]1c1ccncc1 845833292 JSUWRBLLFFYBSU-ZBFHGGJFSA-N 298.342 2.181 10 20 CECD CCOc1ccc(O)c(CN2CCC3(CCNCC3)C2)c1 843120216 ZQCVRPDMAGOXQN-UHFFFAOYSA-N 290.407 2.366 10 20 CECD C[C@@H]1SCCN(C(=O)NCCc2ccc(N)cc2)[C@H]1C 841954418 METJDAKMIICELV-RYUDHWBXSA-N 293.436 2.347 10 20 CECD CO[C@](C)(C1CC1)[C@@H](C)NCc1cc2c(cc1O)OCO2 840961769 ZEDCBUQRMFPLNL-HWPZZCPQSA-N 293.363 2.414 10 20 CECD CCN(CC)C(=O)CN(C)Cc1ccc(N(C)C)cc1C 840908809 YAGIOFZEQCKGAW-UHFFFAOYSA-N 291.439 2.361 10 20 CECD CC[C@H](C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856210239 SZOJGBLMWPHLJM-ZDUSSCGKSA-N 290.407 2.310 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@]2(C)CCOC2)c1 755528587 FNROIIXXKCMOQB-BMIGLBTASA-N 279.336 2.005 10 20 CECD CCON(C)C(=O)NCCCSc1nccs1 753589715 ROVWAQQIQDCMIK-UHFFFAOYSA-N 275.399 2.218 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](C)[C@@H](CO)C2)c1 857061140 KPPBDYZPACLYJW-GXTWGEPZSA-N 279.380 2.241 10 20 CECD CC[C@@H]1OCC[C@H]1NC(=O)N[C@H](C)c1ccccc1O 868697329 HBLFYCCETSEMFG-QKCSRTOESA-N 278.352 2.320 10 20 CECD Cc1ccc(CN[C@H]2CCc3n[nH]cc3C2)c(O)c1 877053649 UZQBAOROVOELID-ZDUSSCGKSA-N 257.337 2.071 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CC=CC[C@H]3C1)[C@H](O)CO2 872713167 LICZAQDQQGYWFG-BFQNTYOBSA-N 287.359 2.216 10 20 CECD CC(C)c1ncncc1C(=O)N(C)c1ccc(N)cc1 877078505 SDKWOAHCUZTNBL-UHFFFAOYSA-N 270.336 2.459 10 20 CECD CN(C(=O)CC[C@H]1CCCNC1)c1ccc(N)cc1 877074259 DYZSYYMFZBRKQF-GFCCVEGCSA-N 261.369 2.011 10 20 CECD CN1CCN(c2ccc(CNC[C@@H]3C=CCC3)cc2)CC1 883238342 ZCKXGFXUFFICEO-MRXNPFEDSA-N 285.435 2.494 10 20 CECD CO[C@]1(C)CCCN(C(=O)NCc2ccc(N)cc2)CC1 1120677174 MCTLJMJLIZJAJN-MRXNPFEDSA-N 291.395 2.369 10 20 CECD O=C(O)C[C@@H](CNCc1ccc2c(c1)CCCO2)C(F)F 1120087436 INPFQGWOEJVQIV-LBPRGKRZSA-N 299.317 2.457 10 20 CECD COC1(CN[C@H](C)c2c(O)cccc2F)CCOCC1 886553784 VMFUJTHHSZMHPT-LLVKDONJSA-N 283.343 2.378 10 20 CECD COc1cc(C)cc(CNCCN2CCC[C@H]2C)c1O 894393254 JYSOVJSGVKGKHB-CYBMUJFWSA-N 278.396 2.283 10 20 CECD CCC[C@]1(NCc2ccc(OC)c(OC)c2O)CCOC1 894418177 HQRHIRZNTRQVFX-INIZCTEOSA-N 295.379 2.458 10 20 CECD C[C@@H]1CCN(Cc2c(O)ccc(Cl)c2F)[C@@H]1CO 792181186 XPCJLWNDQXWDIH-LDYMZIIASA-N 273.735 2.387 10 20 CECD COc1ccc(CNC(=O)c2c(F)ccc(O)c2O)cc1 790070256 NNADESVNCKOYFE-UHFFFAOYSA-N 291.278 2.176 10 20 CECD C[C@@H]1C[C@@H](NCc2c(O)cccc2Br)CO1 706835616 CEMZIDMGYNCVSM-RKDXNWHRSA-N 286.169 2.422 10 20 CECD C[C@@H](N[C@H](CCO)C1CC1)c1cc(F)ccc1O 756740708 SSJFWUKMVCHBSS-NOZJJQNGSA-N 253.317 2.343 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCC[C@H]2OC)c1 1338905042 OEMWICYSCFDDOH-ITDIGPHOSA-N 293.363 2.393 10 20 CECD CC[C@H]1CN(Cc2c(O)cccc2OC)CCO1 768238042 PAZJBZDBVHIYGG-NSHDSACASA-N 251.326 2.012 10 20 CECD CC(C)(C)[C@@H](NCc1ccc(F)c(F)c1O)C(=O)O 1603309497 DBYYMSKWHDYKLY-NSHDSACASA-N 273.279 2.259 10 20 CECD CCOCCC1(CNC(=O)Cc2ccc(N)cc2)CC1 1578104042 FBIRLQHIZLIUFH-UHFFFAOYSA-N 276.380 2.134 10 20 CECD CC[C@H](C)N[C@H](CC)c1cccc(-c2nn[nH]n2)c1O 1590413557 ANXKNZZJQHUUTB-JOYOIKCWSA-N 275.356 2.412 10 20 CECD CCCNC(=O)CN[C@H](C)c1ccc(N(C)CC)cc1 158300035 MCGZBEPQZYFFTC-CYBMUJFWSA-N 277.412 2.320 10 20 CECD CC[C@H](O)CCN[C@H](C)c1cc(OC)ccc1O 168825963 CGESFSRWTWESEG-MNOVXSKESA-N 253.342 2.212 10 20 CECD COc1cccc(O)c1CNC[C@]1(O)CCCC1(C)C 815147656 UVNDKILZTXBYFT-MRXNPFEDSA-N 279.380 2.432 10 20 CECD COc1ccc(N(C)Cc2noc3c2COCC3)cc1 930841255 HVLKSIJPBCZDNQ-UHFFFAOYSA-N 274.320 2.392 10 20 CECD CCCN(Cc1cnn(CC)n1)c1ccc(CN)cc1 839058411 PATDDEBKCQBQSR-UHFFFAOYSA-N 273.384 2.173 10 20 CECD CN(CCC(=O)O)Cc1cc(Br)ccc1O 234291078 LZMLRUHMIFUPLK-UHFFFAOYSA-N 288.141 2.061 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccc(N)cc1 37823743 NBZPLJYFELBFDM-UHFFFAOYSA-N 270.332 2.176 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@@H](C)CC(N)=O 168829372 UMKMMOYKLBGMAC-OUAUKWLOSA-N 262.353 2.102 10 20 CECD COc1ccc(O)c([C@H](C)NCCC(=O)N2CCCC2)c1 20127269 PBMCJHQKXOGLBL-LBPRGKRZSA-N 292.379 2.064 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCC[C@H]3OCC[C@H]23)c(O)c1O 182617152 LYLPIHOEKSFHSY-RAIGVLPGSA-N 291.347 2.094 10 20 CECD CC(C)NC(=O)CN(C)Cc1cccc(Cl)c1O 124519590 KBIZGGLOWPTNRT-UHFFFAOYSA-N 270.760 2.002 10 20 CECD CCn1nccc1C(=O)NCCCSc1nccs1 131292229 CHMFWGBOKZYTAU-UHFFFAOYSA-N 296.421 2.272 10 20 CECD CCN(C)CCNCc1cc(Br)ccc1O 227440945 XBVNZIOJSPAQRZ-UHFFFAOYSA-N 287.201 2.196 10 20 CECD COc1ccc(O)c(CNC[C@H]2CCCCO2)c1 42814613 OMIOBCDNGYYNRB-CYBMUJFWSA-N 251.326 2.060 10 20 CECD CCCCC(=O)NCc1ccc(N2CCOCC2)cc1 49740517 CPHYCPQPYZSKMD-UHFFFAOYSA-N 276.380 2.330 10 20 CECD CNC(=O)[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 93360796 JEEGOPJHRZOPIK-SNVBAGLBSA-N 282.771 2.004 10 20 CECD C[C@@H](O)C[C@@H]1CCCN1Cc1ccc(N(C)C)cc1 93481986 GBKHNOHONYHFIY-CJNGLKHVSA-N 262.397 2.488 10 20 CECD CC[C@@H](NCc1cc(C)ccc1O)[C@@H](O)C(F)(F)F 271015704 TVQPGSWEULOLKB-ZYHUDNBSSA-N 277.286 2.492 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@@]2(CCOC2)O1 280331013 RELRTFUZPIUTKB-IAQYHMDHSA-N 297.782 2.425 10 20 CECD COCCN(CCN(C)C)Cc1c(O)cccc1Cl 289420785 JCAVTWKBPOMYAI-UHFFFAOYSA-N 286.803 2.056 10 20 CECD CCCCN(CCS(C)(=O)=O)Cc1ccccc1O 282363240 DKWTZMHYEBCOPG-UHFFFAOYSA-N 285.409 2.039 10 20 CECD C[C@@H](N[C@@H]1CCc2c[nH]nc2C1)c1ccccc1O 371684851 HWDKZKIOBPISDL-ZYHUDNBSSA-N 257.337 2.323 10 20 CECD COC[C@@H]1CN(Cc2ccc(N(C)C)c(C)c2)C[C@H](C)O1 294699757 UJUMXWKMWZJUPD-HOCLYGCPSA-N 292.423 2.297 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](CN)CC(C)C)c1 817959801 VGBJZVWMZMMJDC-WCQYABFASA-N 294.395 2.203 10 20 CECD Cc1ccc(O)c(CN(C)[C@H]2CC(C)(C)OC2=O)c1 814179941 KDFXAIOODAQION-LBPRGKRZSA-N 263.337 2.227 10 20 CECD O=C(CC[C@@H]1CCNC1)NCCCSc1nccs1 829527612 AZYADONGUWRSBW-LLVKDONJSA-N 299.465 2.131 10 20 CECD Cc1c(CNC(=O)C(C)(C)CO)n(C)c2ccccc12 581082195 PXOGUVMDMZVQOU-UHFFFAOYSA-N 274.364 2.121 10 20 CECD COc1cccc(CNC(=O)c2cc(O)cs2)c1 731863721 BTOSMPHRUWCISH-UHFFFAOYSA-N 263.318 2.392 10 20 CECD O=C1[C@H](N[C@H]2CCc3cccc(O)c32)C[C@@H]2CCCCN12 834911865 BGJONJJSLUWRLF-MELADBBJSA-N 286.375 2.123 10 20 CECD CN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(O)cs2)C1 830576308 FNFRTROAAUSVRR-ZYHUDNBSSA-N 280.393 2.010 10 20 CECD CC[C@@](C)(CNC(=O)NCc1cccc(OC)c1O)OC 838661868 TXFWDBOKPZGYDZ-HNNXBMFYSA-N 296.367 2.015 10 20 CECD CCc1cccc(CN2C[C@@H](C)C[C@@H](CO)C2)c1O 848917982 MALIZMBLTRYAHU-QWHCGFSZSA-N 263.381 2.405 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1ccc(N(C)C)cc1C 840916928 OCCWHXPVOVVIMS-MRXNPFEDSA-N 289.423 2.162 10 20 CECD O=C(c1cc(O)cs1)N1CCOC[C@@H]1C1CCC1 844148792 DUZHCLFQPDIBJA-LLVKDONJSA-N 267.350 2.095 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)C[C@@H](C)OC)cc1 844853224 CRHPVGGLMPPKCS-CYBMUJFWSA-N 294.395 2.015 10 20 CECD Cc1ccnc(CNC(=O)NCCc2ccc(N)cc2)c1 841909880 JJBPDGXFHWGVFC-UHFFFAOYSA-N 284.363 2.014 10 20 CECD CN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)C1(CN)CCC1 843125405 VQAKRNPLZJHSMT-UHFFFAOYSA-N 299.758 2.267 10 20 CECD Cc1cccc(CN[C@@H]2CCCC(F)(F)[C@H]2O)c1O 840971667 SCYUTNJFRPGQBC-YPMHNXCESA-N 271.307 2.339 10 20 CECD C[C@H](CCNCc1c(O)cccc1Cl)N(C)C 697838343 PXZVTRBFVOXTSS-SNVBAGLBSA-N 256.777 2.475 10 20 CECD Cc1n[nH]c(C)c1CN(C)c1ccc(OCC(=O)O)cc1 1119537911 UUJPZDDECIYVOR-UHFFFAOYSA-N 289.335 2.126 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNC2(CO)CCCCC2)c1 776498170 IEVUKMKUQVPRGH-UHFFFAOYSA-N 280.324 2.085 10 20 CECD C[C@@H](NC(=O)c1n[nH]c2c1CCC2)c1ccc(N(C)C)cc1 773019465 XRKOXMOBTAAGEH-LLVKDONJSA-N 298.390 2.455 10 20 CECD COc1ccc(/C=C/C(=O)NCc2ccc(O)c(O)c2)cc1 778929785 NTIOGFPYCPKVGQ-WEVVVXLNSA-N 299.326 2.436 10 20 CECD CC1(C)CCC[C@]1(O)CNC(=O)NCc1ccc(N)cc1 1120676726 ARPILJYTTVSEDM-INIZCTEOSA-N 291.395 2.009 10 20 CECD CC1=CCCN(c2nnc(-c3sccc3O)n2C)C1 1121366969 WCOIZYKKGFYVDE-UHFFFAOYSA-N 276.365 2.406 10 20 CECD CCOc1ccc(N(C)Cc2ncnn2CC)cc1 785690336 FHNFVDZOFAQQOA-UHFFFAOYSA-N 260.341 2.333 10 20 CECD CON1CCC(N(C)Cc2cc(F)cc(F)c2O)CC1 894970415 YSCSUHPYMORQQR-UHFFFAOYSA-N 286.322 2.128 10 20 CECD Cc1cccc(O)c1CN1CCC2(CC1)C[C@@H](O)CCO2 897257970 FNBYNVVDGUPYAW-AWEZNQCLSA-N 291.391 2.207 10 20 CECD COC(=O)[C@@H]1CC[C@H](N[C@@H](C)c2cc(OC)ccc2O)C1 790762183 OPLQBBVUSVXUJV-TUAOUCFPSA-N 293.363 2.393 10 20 CECD CN1CCC(CN[C@H]2CCc3cccc(O)c32)CC1 389143287 SXGUCWDEFGMIIX-AWEZNQCLSA-N 260.381 2.311 10 20 CECD CN[C@H](C)CCN[C@H](C)c1cc(F)cc(F)c1O 1325742091 BFWWOKSRZWLQHT-RKDXNWHRSA-N 258.312 2.319 10 20 CECD CN(C)c1ccc(CNc2ncc([N+](=O)[O-])cn2)cc1 302089716 GIWVDWSLQSZNNC-UHFFFAOYSA-N 273.296 2.063 10 20 CECD CC(C)[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)CCO1 279778173 HDFMFNKDXKKDHA-ZWNOBZJWSA-N 279.336 2.031 10 20 CECD COc1cccc(O)c1CNCC1(CO)CCCCC1 751508967 FCHYAYXQCDQFOM-UHFFFAOYSA-N 279.380 2.433 10 20 CECD O=C(COCC1CC1)Nc1c(Cl)ccc2nonc12 1326697406 FEFOOBOZVCHTNM-UHFFFAOYSA-N 281.699 2.241 10 20 CECD C[C@H](NCCc1cnn(C)c1)c1cc(F)cc(F)c1O 1321023666 OHPBDBDWBRFTBN-VIFPVBQESA-N 281.306 2.297 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2n[nH]cc2C)c1 716484106 SLYFIRPSEYVFGU-SNVBAGLBSA-N 261.325 2.283 10 20 CECD CSC[C@@H](CCO)NCc1ccc2c(c1)CCCO2 1332780718 CWEUJMGXFURSCV-CQSZACIVSA-N 281.421 2.215 10 20 CECD CC[C@@H](C)C[C@H](N)C(=O)N[C@H](C)c1ccccc1O 1341541040 MNWIWLFCWVVVHB-WZRBSPASSA-N 264.369 2.333 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2ccc(N3CCCC3)cc2)C1 1350726041 GCRMPWRTEIBUBZ-SHTZXODSSA-N 288.391 2.328 10 20 CECD Cc1cc(O)c(CN[C@H]2CC=C(C(=O)O)C2)cc1C 1600285963 JLFYBUQRQCZOSO-ZDUSSCGKSA-N 261.321 2.272 10 20 CECD CC[C@@H](F)C(=O)N[C@@H](C)CNCc1ccc(OC)c(C)c1 1754278678 IYGABNFCKIHZON-GXTWGEPZSA-N 296.386 2.346 10 20 CECD C[C@H](NC[C@H]1CCC[C@@H](O)C1)c1cc(C(=O)O)ccc1O 1593252114 NZPLQNGLOVSVJT-GMXVVIOVSA-N 293.363 2.292 10 20 CECD COc1cccc(CNCc2cncn2C(C)C)c1O 822481109 JBYSZRJONDAOMH-UHFFFAOYSA-N 275.352 2.468 10 20 CECD CC(F)(F)C1(C(=O)NCCc2ccc(O)c(O)c2)CC1 1118749476 VFTLKCPAFQPSCL-UHFFFAOYSA-N 285.290 2.192 10 20 CECD OCCCSCCNCc1ccc(N2CCCC2)cc1 222942613 GCBATVLIYBPJHN-UHFFFAOYSA-N 294.464 2.492 10 20 CECD CC[C@H]1CN(Cc2cc(F)cc(C(C)=O)c2O)CCO1 37323499 QAFYVDCFSZNTKI-ZDUSSCGKSA-N 281.327 2.345 10 20 CECD COc1cccc(CN2CC[C@H](OC)C[C@@H]2C)c1O 282395560 RJHXGEFLWXVUKS-AAEUAGOBSA-N 265.353 2.400 10 20 CECD CC(C)S(=O)(=O)CCN[C@H](C)c1ccc(F)cc1O 312030917 XQJQUKYTQRDEKW-SNVBAGLBSA-N 289.372 2.005 10 20 CECD C[C@H]1CC[C@H](C(=O)O)CN1Cc1cc(F)ccc1O 397483162 GSRHOCGIEZKQPM-UWVGGRQHSA-N 267.300 2.216 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1CCCO1 52851327 SXZPJNBYRIYERI-HNNXBMFYSA-N 276.380 2.280 10 20 CECD CCOc1ncccc1NC(=O)c1ccc(C)c(O)c1O 181959239 IWSODICCJOCRDM-UHFFFAOYSA-N 288.303 2.452 10 20 CECD Cn1cnnc1CN1CCCc2cc(OC(F)F)ccc21 195515166 BFRPHGYYESHKRP-UHFFFAOYSA-N 294.305 2.369 10 20 CECD CCC[C@H](C)CS(=O)(=O)NCCc1ccc(N)cc1 193338787 UESAUJIJAZIUIW-LBPRGKRZSA-N 284.425 2.167 10 20 CECD COc1cc(Cl)cc(CN[C@H](C(=O)O)C2CC2)c1O 229118463 BIWNPIQYAZMMEX-NSHDSACASA-N 285.727 2.007 10 20 CECD COc1cccc(CNCCC2(OC)CCC2)c1O 292832578 APYGAVOGIBKYPU-UHFFFAOYSA-N 265.353 2.450 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)N(C)Cc2ccccc2O)[C@H]1C 383981626 SESPYOXHGMUYBY-OHTBPHCPSA-N 277.364 2.410 10 20 CECD C[C@H](C(=O)NCCc1ccc(O)c(O)c1)C(C)(F)F 293680991 KURRVJGHQCKPPK-MRVPVSSYSA-N 273.279 2.048 10 20 CECD CC(=O)N(C)C1CCN(Cc2cc(Cl)ccc2O)CC1 92538408 NMHBTOAMHTWOLR-UHFFFAOYSA-N 296.798 2.488 10 20 CECD CC(C)(C)c1cc(C(=O)NCCc2ccc(N)cc2)[nH]n1 236775115 LWEBTKMESHJRDT-UHFFFAOYSA-N 286.379 2.262 10 20 CECD CC(C)[C@@H](CO)N[C@H](C)c1ccc(N(C)C)cc1 92392239 FYXLKMDFVPOYII-IUODEOHRSA-N 250.386 2.420 10 20 CECD CCN(CC[C@@H]1CCOC1=O)c1ccc(OC)cc1 267921775 FKMFXFHJJXWFCV-GFCCVEGCSA-N 263.337 2.475 10 20 CECD CCCCCNC(=O)CN(C)Cc1ccccc1O 269661898 UMXPCMQIGPKKPP-UHFFFAOYSA-N 264.369 2.130 10 20 CECD CC[C@@H]1C[C@@H](CC(=O)NCc2ccc(O)c(O)c2)CCO1 272882225 VOVZODLKLRJACO-WCQYABFASA-N 293.363 2.309 10 20 CECD CC[C@H](NC[C@]1(O)CCO[C@H]1C)c1ccc(N(C)C)cc1 278890244 TXZCBNJFWJLRSZ-RRQGHBQHSA-N 292.423 2.333 10 20 CECD C[C@@H](CCN(C)C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273570619 KNGITJUFLHKYAE-QWRGUYRKSA-N 281.356 2.291 10 20 CECD CC[C@H](NCc1cc(F)ccc1O)[C@H](O)C(F)(F)F 272520642 YFPDBPGHVAHJJS-ONGXEEELSA-N 281.249 2.323 10 20 CECD CNC(=O)CCCN[C@H](C)c1cc(Cl)ccc1O 273597400 QYPOFCSNCIEFRD-SECBINFHSA-N 270.760 2.222 10 20 CECD Cc1nc([C@H]2CCCN(Cc3cc(F)ccc3O)C2)n[nH]1 272478893 SLURWOSCHHQNEZ-NSHDSACASA-N 290.342 2.337 10 20 CECD CCOC1CC(O)(CN[C@H](C)c2cc(F)ccc2O)C1 278504521 QVIAWUILARNEKL-CKQAKLJMSA-N 283.343 2.112 10 20 CECD CN(c1ccc(CNC(=O)CO)cc1)C1CCCCC1 270841427 VRIGGRWTTJQBNP-UHFFFAOYSA-N 276.380 2.064 10 20 CECD CCN(CC)c1ccc(CN[C@@]2(C)CCOC2=O)cc1 289945961 XCLPUAFJROGDOF-INIZCTEOSA-N 276.380 2.328 10 20 CECD CN(C)c1ccc(CN2CCC[C@@](F)(CO)C2)cc1 286822975 KPGQVOFXKMQMFH-HNNXBMFYSA-N 266.360 2.049 10 20 CECD CC/C=C/CNCc1ccc([N+](=O)[O-])c(OC)c1O 294990286 KQAQOBOXTFXWQQ-SNAWJCMRSA-N 266.297 2.365 10 20 CECD Cc1cc(CN(C)[C@@H](C)C[S@](C)=O)ccc1N(C)C 294751499 XRDAQTIXPXUOCJ-DJJJIMSYSA-N 282.453 2.260 10 20 CECD Cc1ccc(O)c(CNCc2nnc(C(C)C)[nH]2)c1 294858223 STXLNBNIFIMVTE-UHFFFAOYSA-N 260.341 2.232 10 20 CECD C[C@@H](N)CN[C@H](C)c1cc(Br)ccc1O 817971525 DWEVCBNIONMMBF-HTQZYQBOSA-N 273.174 2.153 10 20 CECD COc1cc(O)c(CNCC(C)(F)F)cc1OC 816643136 WHOJPXRMPDTYGU-UHFFFAOYSA-N 261.268 2.154 10 20 CECD C[C@@H]1C[C@H](NC[C@@H](N)c2ccc(N(C)C)cc2)c2nccn21 817942289 NPSXLTACOIAXJY-WQVCFCJDSA-N 299.422 2.245 10 20 CECD CC[C@@](C)(CN(C)c1ccc(OCC(=O)O)cc1)OC 902014977 GNPQJYJIGBMUJO-HNNXBMFYSA-N 281.352 2.401 10 20 CECD C[C@H](N)C[C@H](C)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 902519211 XYWGMOCLUSVOQX-ZQIUZPCESA-N 292.471 2.071 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H]2CC(=O)O)c1 833662598 HCKQLHOETCDAEQ-GFCCVEGCSA-N 279.336 2.230 10 20 CECD CN(CC1(F)CC1)c1ccc(OCC(=O)O)cc1 902014906 FVMKMGCQWWJDQW-UHFFFAOYSA-N 253.273 2.088 10 20 CECD Cc1csc(CNC(=O)NCc2ccccc2O)n1 748463489 SUSFXBAIALUSBB-UHFFFAOYSA-N 277.349 2.157 10 20 CECD Cc1cc(CC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)on1 845957639 QNCWHKYJQDPFLY-LBPRGKRZSA-N 287.363 2.469 10 20 CECD CCn1nnc(C)c1CN[C@H](C)c1cc(OC)ccc1O 845971793 NCBJRMHOYQJPLD-SNVBAGLBSA-N 290.367 2.171 10 20 CECD C[C@H]1CC2(CCOCC2)CN1C(=O)Cc1ccc(N)cc1 843513518 GUONAOSKGLGUQV-ZDUSSCGKSA-N 288.391 2.229 10 20 CECD CCN(CC)c1ccc(CNc2cc(=O)n(C)cn2)cc1 848647789 WMBSQLYOOBZREE-UHFFFAOYSA-N 286.379 2.239 10 20 CECD O=C(NCc1cc(Cl)ccc1O)NCC1CC1 844280527 HQNHWUKQTPPFED-UHFFFAOYSA-N 254.717 2.255 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H]1CCO 840938107 CQGNWHWLBZSHBN-HNNXBMFYSA-N 262.397 2.408 10 20 CECD COC1(COC(=O)c2cccc(O)c2O)CCCC1 758581913 PQNIGASMTPUCMU-UHFFFAOYSA-N 266.293 2.214 10 20 CECD CCOCCC1(CNC(=O)c2cc(O)cs2)CC1 752627059 KDALBVMDVNQMGN-UHFFFAOYSA-N 269.366 2.390 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H](O)CN(C)C(C)C 851792039 JXFHFYFUNHOUIT-INIZCTEOSA-N 294.439 2.305 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1[C@H]2C[C@@H]3CN[C@H]1[C@H]3C2 925499180 WRYYKOMXFRFZAN-CENPHQPOSA-N 285.435 2.147 10 20 CECD COCC[C@](C)(O)CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 756583609 CIMWWDOKVZLHDL-IETSOEAISA-N 297.370 2.457 10 20 CECD CO[C@H](CNC(=O)N[C@H](C)c1ccccc1O)C1CC1 868652085 AFOMVFUGTIOPOK-QMTHXVAHSA-N 278.352 2.177 10 20 CECD CNC(=O)[C@H]1CCC[C@H]1NCc1ccc(OC)c(C)c1 765797181 QEBOBIMSHCLSKI-UONOGXRCSA-N 276.380 2.008 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@H]2CCCCO2)c1 862758210 SPJIEFLHOVKSTJ-CYBMUJFWSA-N 263.337 2.276 10 20 CECD CC[C@H](NC[C@](C)(O)COC)c1ccc(N(C)C)cc1 765934132 AEJSOKCIPLFTOE-HOTGVXAUSA-N 280.412 2.191 10 20 CECD Cc1cccc(O)c1CNCC1([S@](C)=O)CCC1 877496190 NWLPHLDCEFAIRN-SFHVURJKSA-N 267.394 2.091 10 20 CECD CC(C)[C@H](F)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 784464210 ZJAJRUKBNJJJFN-ZANVPECISA-N 269.316 2.139 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1ccc(OC)c(OC)c1O 895111609 GUCJLZQJLMQMNN-YPMHNXCESA-N 297.395 2.296 10 20 CECD C[C@@H](Cc1cccc(O)c1)NC(=O)c1cccc(O)c1O 790893276 FZAGSVJMONFGNK-JTQLQIEISA-N 287.315 2.164 10 20 CECD CCn1cc(NC(=O)N(C)Cc2ccccc2O)cn1 48351596 ZBNNRMHROBHDDT-UHFFFAOYSA-N 274.324 2.273 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1Cc2ccccc2O1 135358936 SGDGOKPHWYJDKJ-HNNXBMFYSA-N 269.300 2.012 10 20 CECD O=C(O)[C@@H]1CC[C@H](NCc2cc(F)cc(F)c2O)C1 1350654497 ZOYRUYGQVMENMQ-XCBNKYQSSA-N 271.263 2.013 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(N)ccn1 1518677541 FGLNUBSUPNOCIU-UHFFFAOYSA-N 298.390 2.392 10 20 CECD CCCc1nc(C(=O)NCc2ccc(N)cc2)co1 1524008234 FHGUIUWGDQCLMT-UHFFFAOYSA-N 259.309 2.139 10 20 CECD CCCc1ncc(C(=O)NCc2cccc(O)c2O)s1 1520509747 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C[C@@H]1[C@H](CO)CCCN1Cc1ccc(N(C)C)cc1 839672809 HOXTWIPCUQONJA-HIFRSBDPSA-N 262.397 2.345 10 20 CECD CN(C)c1ccc(CNC(=O)C(C)(C)CCC(=O)O)cc1 911119334 GZHBHJDFHSQYJP-UHFFFAOYSA-N 292.379 2.260 10 20 CECD COc1cc(O)c(CN2CCCC[C@@H]2[C@H](C)N)cc1OC 843044719 GHEHQPMUJDQNGN-WCQYABFASA-N 294.395 2.111 10 20 CECD COC(C)(C)C[C@@H](C)NC(=O)NCCc1ccc(N)cc1 841837427 JYKGURYLQDMLPI-GFCCVEGCSA-N 293.411 2.314 10 20 CECD CCCN(CC(=O)N(C)C)Cc1ccc(N(C)C)cc1C 840912059 ZQIRBGCOGNQPSM-UHFFFAOYSA-N 291.439 2.361 10 20 CECD COc1cccc([C@H](C)N[C@H](C)[C@@H]2CCOC2)c1O 846149450 ZNKHVWLRJSUZQI-GRYCIOLGSA-N 265.353 2.476 10 20 CECD O=C(COC(=O)c1cccc(F)c1)c1ccc(O)c(O)c1 916590342 QBPNHHICAFKVJA-UHFFFAOYSA-N 290.246 2.277 10 20 CECD Oc1cc2c(cc1CN1CCNCc3ccccc31)OCO2 841035251 JHZMKEMVZYUQDZ-UHFFFAOYSA-N 298.342 2.231 10 20 CECD C[C@H](NCCN1CCC(O)CC1)c1ccc(Cl)cc1O 841752910 CUWLRGMNJSNQPS-NSHDSACASA-N 298.814 2.153 10 20 CECD COCC1(CNC(=O)NCc2cc(C)ccc2O)CCC1 858425700 JHUOBZVJLFDHSU-UHFFFAOYSA-N 292.379 2.317 10 20 CECD CC(C)[C@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 756336969 RDYVAXJRYFLESO-NSHDSACASA-N 275.707 2.384 10 20 CECD CN1CCCc2cc(CNC(=O)[C@]3(C)CCOC3)ccc21 754203289 ZKTJUOMTNOLFOZ-QGZVFWFLSA-N 288.391 2.112 10 20 CECD CN(C)c1cc(F)c(CN2CC([C@H]3CCOC3)C2)cc1F 862351143 KPCFLRYOQHIPNU-NSHDSACASA-N 296.361 2.499 10 20 CECD CCC[C@@H](CNC(=O)/C=C/c1ccc(O)c(O)c1)OCC 862418496 MBUYEPCCVGBQRL-XOVSCCBYSA-N 293.363 2.432 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)[C@H](F)c1ccccc1 769607626 OOZYLKRAZPKDHP-OAHLLOKOSA-N 289.306 2.467 10 20 CECD CN(Cc1ccc(N2CCC(O)CC2)cc1)CC(F)F 876639739 IFXNCCSOKLMXCG-UHFFFAOYSA-N 284.350 2.345 10 20 CECD O=C(CCC(=O)c1ccccn1)NCc1ccccc1O 771418991 UOTJCQVYILSTKY-UHFFFAOYSA-N 284.315 2.067 10 20 CECD C[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C1CCC1 779541808 KJOCRSQBMYDXCZ-BJPMOSCESA-N 261.321 2.416 10 20 CECD CCOc1ccc(CN[C@H]2CCCC[C@@H]2O)c(O)c1 778214598 OIODVUCGXNQCOH-KBPBESRZSA-N 265.353 2.184 10 20 CECD Cc1ccc(CNCC(C)(C)[C@]2(O)CCCOC2)c(O)c1 877637255 GMCLRRGYDVDYMU-KRWDZBQOSA-N 293.407 2.358 10 20 CECD CC(=O)N1CC[C@@H](CN(C)Cc2ccc(C)cc2O)C1 876815239 OPMWTMXSIUCCPD-AWEZNQCLSA-N 276.380 2.001 10 20 CECD COCC1(C(=O)N[C@@H](C)c2cc(OC)ccc2O)CC1 778914938 OYIPTWKFBHFOJK-JTQLQIEISA-N 279.336 2.005 10 20 CECD C[C@H](OC(=O)/C=C/c1ccc(O)c(O)c1)c1cnccn1 784287929 WGDNORPEQJRZSP-GFAPAMAISA-N 286.287 2.205 10 20 CECD CC[C@@H]1C(=O)N(CC)CCN1Cc1cc(F)cc(F)c1O 894504286 NKKPITYBOSMMRP-CYBMUJFWSA-N 298.333 2.113 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2ccc(N(C)C)c(F)c2)C1 792202536 PDKAACPCZFSMGZ-OLZOCXBDSA-N 294.370 2.323 10 20 CECD COc1ccc(CNC(=O)c2c(O)cccc2F)c(O)c1 794388318 WITUUFYSSUMKBG-UHFFFAOYSA-N 291.278 2.176 10 20 CECD CCOc1ccc(CN2CCC[C@](C)(CO)C2)c(O)c1 1319707176 KNLWXOQWMSZBRH-INIZCTEOSA-N 279.380 2.385 10 20 CECD CN(Cc1nc(C2CC2)no1)Cc1ccccc1O 109770364 HBHAMRALIHTGBW-UHFFFAOYSA-N 259.309 2.285 10 20 CECD CCN(Cc1ccc(N2CCCC2)cc1)[C@H](C)CO 1324157794 CIGQEBYSABMQRO-CQSZACIVSA-N 262.397 2.490 10 20 CECD COc1cccc(CNCCC(C)(C)OC)c1O 711883852 JRTWMTKTFNRAPJ-UHFFFAOYSA-N 253.342 2.306 10 20 CECD CCCC[C@H](NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1255787009 SIRHQCZBSXORPA-NSHDSACASA-N 282.296 2.033 10 20 CECD Cc1ccc(CCNC(=O)NCc2ccc(N)cc2)nc1 1338623010 AKHOQFUQIVBCOD-UHFFFAOYSA-N 284.363 2.014 10 20 CECD Nc1ccc(CCNC(=O)N[C@H]2CCC[C@H](F)C2)cc1 1332141847 JVOZMJTWTLZSMM-JSGCOSHPSA-N 279.359 2.391 10 20 CECD CC1=NO[C@@](C)(C(=O)N(C)Cc2ccc(N(C)C)cc2)C1 1335561305 ZFSZYADFTARTTN-MRXNPFEDSA-N 289.379 2.266 10 20 CECD Cc1ccc(O)c(CNC(=O)NC/C=C/C2CC2)c1 1331059136 RJQAUGGOHAQMIH-NSCUHMNNSA-N 260.337 2.466 10 20 CECD O=C(NCc1ccccc1O)NC[C@H]1C[C@H]2C=C[C@H]1C2 1352045115 CBCICRYYQRYJKZ-SGMGOOAPSA-N 272.348 2.404 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cc(N)ccn1 1520709396 BGEVHJVFDFVUIT-UHFFFAOYSA-N 284.363 2.002 10 20 CECD CCc1nc(CN[C@H](C)c2cc(C(=O)O)ccc2O)co1 1610071979 VCCYTWMYGIQPIM-SECBINFHSA-N 290.319 2.492 10 20 CECD C[C@@H](CNCc1ccc2c(c1)CCO2)N(C)C1CC1 105487958 OTBOHINJSBLWEF-LBPRGKRZSA-N 260.381 2.194 10 20 CECD CCCC[C@](C)(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776768670 CAIOTMWNHUQNDX-AWEZNQCLSA-N 296.323 2.424 10 20 CECD CCN1CCc2cc(CNCCCC(=O)O)ccc21 1776877268 GJWPUDQYCYICJJ-UHFFFAOYSA-N 262.353 2.023 10 20 CECD CC(F)(F)C[C@H](NCc1ccc2c(c1)CCO2)C(=O)O 1776443515 ZOWBGPNQMHENTI-NSHDSACASA-N 285.290 2.210 10 20 CECD CC(C)(CCO)NCc1cc(Br)ccc1O 164846905 JYKQADXNOLSDTL-UHFFFAOYSA-N 288.185 2.405 10 20 CECD CC(C)(O)[C@@H]1CCCN1Cc1cc(F)ccc1O 154475515 OPORVXGKDYDJFK-ZDUSSCGKSA-N 253.317 2.267 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2cc(Br)ccc2O)C1 220339337 ONKDRIXWLBFGHK-VHSXEESVSA-N 299.212 2.324 10 20 CECD Cc1c([C@@H](C)NCc2cc(F)ccc2O)cnn1C 226584572 FXXGIUWLVYKBKW-SECBINFHSA-N 263.316 2.424 10 20 CECD CO[C@@H]1C[C@H](NCc2cc3c(cc2O)OCO3)C1(C)C 227828894 UEZUFNSCRTZZPT-UONOGXRCSA-N 279.336 2.024 10 20 CECD CCC[C@@H](NCc1cc(Cl)cc(OC)c1O)C(=O)O 229118160 RMBUXAFCTZLTTN-SNVBAGLBSA-N 287.743 2.397 10 20 CECD C[C@@](O)(CNCc1c(O)cccc1Cl)C(F)(F)F 270472719 HZJMRFUSTPEWKV-SNVBAGLBSA-N 283.677 2.449 10 20 CECD CCOc1cccc(CN[C@H]2CO[C@@H](C)C2)c1O 402351355 SHVCXWRNOTZAGT-CMPLNLGQSA-N 251.326 2.058 10 20 CECD COc1ccc(O)c(CN[C@@H](C)[C@@H](OC)C2CC2)c1 388240764 QNDODUNXIXYKOJ-ZUZCIYMTSA-N 265.353 2.304 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)CCN1C 174514753 WBWVGKFYQJODSP-JSGCOSHPSA-N 279.403 2.464 10 20 CECD C[C@@H](O)[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 305824292 BYSFBFVKAHWZIS-NXEZZACHSA-N 255.745 2.248 10 20 CECD O=C(/C=C/c1ccc(O)cc1)NCc1ccc(O)c(O)c1 127535711 UCFIAPQNFRUJTK-XBXARRHUSA-N 285.299 2.133 10 20 CECD Cc1cc(N(C)Cc2ccc(N(C)C)cc2)n2ncnc2n1 60847409 PBWYWCMSLOMZGO-UHFFFAOYSA-N 296.378 2.135 10 20 CECD Oc1ccc(F)cc1CN1CCO[C@@H]2CCC[C@@H]21 226562636 IOAPSYCCMZFNFY-GXTWGEPZSA-N 251.301 2.285 10 20 CECD COc1cc(Cl)cc(CN(C)C[C@H](C)C(=O)O)c1O 229119065 XEYWGQVOCSQEFA-QMMMGPOBSA-N 287.743 2.207 10 20 CECD COc1cccc(CNC2(C)CCOCC2)c1O 131191748 BPLBKRNCGIBIHZ-UHFFFAOYSA-N 251.326 2.060 10 20 CECD CCOc1ccc(O)c(CN2CCN(C)CC2(C)C)c1 93457424 ZWBDQDVIVZLYIW-UHFFFAOYSA-N 278.396 2.317 10 20 CECD NCC[C@H]1CCCN(Cc2cc(F)ccc2O)C1 236262129 XNLNWSWFIXQOEL-LLVKDONJSA-N 252.333 2.092 10 20 CECD Cc1ccc([C@H](C)NCC(=O)NCC2CC2)c(O)c1C 273497851 YFCLOZPSWLLBDZ-LBPRGKRZSA-N 276.380 2.186 10 20 CECD COc1ccc(N2CCCN(C(=O)c3ccc[nH]3)CC2)cc1 364455811 ZVAQSCKYNNWRRX-UHFFFAOYSA-N 299.374 2.376 10 20 CECD Cc1cccc(CN2CCO[C@@]3(CCO[C@@H]3C)C2)c1O 279607287 FFYMFZSTCKQPPT-CJNGLKHVSA-N 277.364 2.080 10 20 CECD COCc1nsc(N(C)Cc2ccccc2O)n1 276348932 UCAKLZGPNFSWNI-UHFFFAOYSA-N 265.338 2.027 10 20 CECD CC[C@H](NCCS(=O)(=O)CC)c1ccc(C)cc1O 280089831 MGZATEOEHAZFKE-ZDUSSCGKSA-N 285.409 2.176 10 20 CECD COc1cccc(CNS(=O)(=O)CCC2CCC2)c1O 290672062 GKHXIKGEUXWGGY-UHFFFAOYSA-N 299.392 2.010 10 20 CECD Cc1cc(CN(C)CC2(O)CCOCC2)ccc1N(C)C 294427695 DTSWDOFDYGXIMF-UHFFFAOYSA-N 292.423 2.034 10 20 CECD C[C@H](N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21)C(=O)NCCF 800499018 SYOJUEUBLHDRAK-WCABBAIRSA-N 298.333 2.143 10 20 CECD CC[C@H](NC1CCNCC1)c1ccc(F)cc1O 817936749 QWUCRUZZGVFZDT-ZDUSSCGKSA-N 252.333 2.324 10 20 CECD Cc1cc(CN2CCN(C)C(=O)C2(C)C)ccc1N(C)C 815059554 DJLWQVCJHFXRRL-UHFFFAOYSA-N 289.423 2.114 10 20 CECD C[C@@H](C(=O)O)N(C)Cc1cccc(Br)c1O 819895163 ABFRGVYWSWPFBW-ZETCQYMHSA-N 288.141 2.060 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ccnc(F)c2)c1 728982049 IYCGLOPZQMUYQP-SECBINFHSA-N 290.294 2.426 10 20 CECD CC(C)C[C@H](CNC(=O)c1cc(O)cs1)N(C)C 827487987 BGCWNXVPYXHNRB-SNVBAGLBSA-N 270.398 2.160 10 20 CECD CCN(CC)c1ccc(CN(C)Cc2cnn[nH]2)cc1 827336138 ANPQOWPWHZUXHC-UHFFFAOYSA-N 273.384 2.283 10 20 CECD CN(Cc1c(O)ccc2ccncc12)[C@H]1CCOC1 730260252 MUXNPCSMLMRHPG-LBPRGKRZSA-N 258.321 2.161 10 20 CECD COC1([C@@H](C)NC(=O)c2cc(O)cs2)CCC1 839875364 KVFQPMCPYZAPNN-MRVPVSSYSA-N 255.339 2.141 10 20 CECD C[C@H](NC(=O)Nc1ccc(N)cc1)C(C)(C)CN(C)C 841300508 SEXPWTJBJOJZDC-NSHDSACASA-N 278.400 2.367 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)[C@H](O)C(F)(F)F)c1 866463376 NGQLYBXMURKFPW-UBJUHAIHSA-N 293.285 2.363 10 20 CECD CC(C)[C@H](Sc1ncc(Cl)s1)C(=O)NC(N)=O 849997942 HVCFTGBYMKZEHK-LURJTMIESA-N 293.801 2.108 10 20 CECD CCCCNC(=N)NCc1cc(Cl)ccc1O 849049999 WNUGNEQOBKTQKT-UHFFFAOYSA-N 255.749 2.460 10 20 CECD Oc1cccc(Cl)c1CNCCCNC1CC1 841092016 JNQIGKNGMNTJDL-UHFFFAOYSA-N 254.761 2.277 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@@H](CN)C1CC1 841945227 BHDDDBJDPBBIJX-AWEZNQCLSA-N 291.395 2.051 10 20 CECD COC[C@H](N[C@@H](C)c1cccc(OC)c1O)C1CC1 846157671 OAHRJPHVABLYJQ-GWCFXTLKSA-N 265.353 2.476 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)c2ccncc2)cc1 844851590 BAOSNYYIBCRNQQ-UHFFFAOYSA-N 299.374 2.299 10 20 CECD CCOC(=O)CCN(C(=O)Cc1ccc(N)cc1)C(C)C 848442539 FRXJJXYBPSQNOU-UHFFFAOYSA-N 292.379 2.002 10 20 CECD CCOc1ccc(N(C)CCOCCOC)cc1 750827134 WDTQZJFQXBCMAB-UHFFFAOYSA-N 253.342 2.185 10 20 CECD CC[C@@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C1CC1 855856963 FTMNPSMNPAJMRH-WNPFHQFXSA-N 261.321 2.416 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2scnc2C)c1 858194165 YDTGZLCIRSYLLM-UHFFFAOYSA-N 291.376 2.465 10 20 CECD CCOc1cccc(CN[C@H](C(=O)OC)C(C)(C)C)c1O 768525247 VBDMNYILKNVZBK-CQSZACIVSA-N 295.379 2.468 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1nc(C2CC2)no1 866016736 UJEUXXITUMOXNB-UHFFFAOYSA-N 293.710 2.236 10 20 CECD CN(Cc1cc2c(cc1O)CCCC2)[C@H]1CCOC1 768450108 HWYQOKFCECHZGV-HNNXBMFYSA-N 261.365 2.492 10 20 CECD CN(C)c1ccc(CNC(=O)c2cc(C(F)F)[nH]n2)cc1 877978659 OWHHXACBYWUKHD-UHFFFAOYSA-N 294.305 2.343 10 20 CECD CC[C@H](C(=O)N(C)c1ccc(N)cc1)N(CC)CC 877077958 XATLKIAJDNTFNG-CQSZACIVSA-N 263.385 2.352 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCCO1)c1ccc(N(C)C)cc1 773013814 ZWVBMAMLBWASRM-DOMZBBRYSA-N 276.380 2.499 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H](C)CS(C)(=O)=O)cc1 773754099 CPGIEFXUPFFYQL-ZDUSSCGKSA-N 298.452 2.008 10 20 CECD Cc1cccc(CN2CCC(CCC(N)=O)CC2)c1O 775712368 GQSORFUXRADUSL-UHFFFAOYSA-N 276.380 2.178 10 20 CECD CCc1nnc(COC(=O)c2cc(O)cs2)s1 785316755 NPLIAMADCNGWPS-UHFFFAOYSA-N 270.335 2.225 10 20 CECD C[C@H](OC(=O)c1cc(O)cs1)c1cnccn1 783608475 RAXKISSANITXRO-ZETCQYMHSA-N 250.279 2.162 10 20 CECD CNC(=O)CC1CCN(Cc2cc(F)cc(F)c2O)CC1 894045302 YFNYIDUTOUPPHF-UHFFFAOYSA-N 298.333 2.019 10 20 CECD COCCCCNCc1cc(C)cc(OC)c1O 894181430 UUNSAQVZEPDEGB-UHFFFAOYSA-N 253.342 2.225 10 20 CECD c1cc(N2CCCC2)ccc1CN1CCCNCC1 1204655144 YLHOFKOHFVZVOX-UHFFFAOYSA-N 259.397 2.082 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C1(CO)CC1 1330193571 WZDOXWFBWHXEEU-UHFFFAOYSA-N 260.381 2.244 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(=O)[C@H](F)CC 1353713278 KQHGEFOMQXRCFC-GFCCVEGCSA-N 297.326 2.032 10 20 CECD C[C@H](NCCc1ccoc1)c1cccc(-c2nn[nH]n2)c1O 1603665146 ZKHXEKQJHVSZFI-JTQLQIEISA-N 299.334 2.059 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@](C)(C(=O)O)C2)c1 1607621046 QJRWFNKOVMCCEJ-HNNXBMFYSA-N 263.337 2.306 10 20 CECD CN(C)c1ccc(CNc2ccc(C(=O)O)nc2)cc1 1606055709 NVWXCOZHCCCLMI-UHFFFAOYSA-N 271.320 2.458 10 20 CECD Cc1nocc1CSc1ncc(C(=O)O)s1 1600818118 JUMGVBIVXDUKDH-UHFFFAOYSA-N 256.308 2.430 10 20 CECD C[C@H](NCC1(C(=O)O)CC1)c1ccc(N(C)C)cc1 1604336566 GTYJOMDQMJQRJP-NSHDSACASA-N 262.353 2.268 10 20 CECD CCC[C@H](O)CCNCc1cc(F)cc(F)c1O 922816860 KQOONMIGCFOWHM-NSHDSACASA-N 259.296 2.311 10 20 CECD COc1cc(CN2CC[C@H]3CC[C@@H](C2)N3C)c(O)cc1C 160330401 RVVLHUSKQFAPTG-CABCVRRESA-N 290.407 2.378 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C(=O)OC)cc1 37073705 MLQHPYAGXWWRLC-LBPRGKRZSA-N 264.369 2.184 10 20 CECD Cc1ccc([C@@H](C)NCC2([S@](C)=O)CC2)c(O)c1 282187432 GAUHKKWQJCDNPA-ZMZPIMSZSA-N 267.394 2.262 10 20 CECD CCc1nc(CNCc2c(O)cccc2Cl)n[nH]1 296019442 MFDXVOGFYJTHAQ-UHFFFAOYSA-N 266.732 2.016 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(CO)CCC2)c1 186547051 ILDQBYPRGSZBHO-NSHDSACASA-N 265.353 2.214 10 20 CECD Cn1ccc(CNCc2ccc(Br)cc2O)n1 691477495 SYMCCHKKGFULJG-UHFFFAOYSA-N 296.168 2.178 10 20 CECD CCc1cccc(CN[C@@H](C)C(=O)N2CCCC2)c1O 691461207 UKPSJQWWEBKTOJ-LBPRGKRZSA-N 276.380 2.055 10 20 CECD CCCN1CC[C@H](NCc2cc(F)ccc2O)C1 389440439 NPULIUGJFKHBSJ-ZDUSSCGKSA-N 252.333 2.105 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CCc2[nH]ncc2C1 124549645 GRBWAUZIMYAYEC-SNVBAGLBSA-N 277.755 2.416 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1csc(C2CC2)n1 182536790 OWIFZMOUSOCLLD-UHFFFAOYSA-N 290.344 2.362 10 20 CECD CC(C)[C@@H](CN[C@@H](C)c1ccccc1O)N1CCOCC1 183395154 NVQMOTGOVJXQCD-GOEBONIOSA-N 292.423 2.400 10 20 CECD C[C@@H](NCC(=O)NCC1CC1)c1cc(Cl)ccc1O 186505113 XXUTUSRTLOCXRN-SECBINFHSA-N 282.771 2.222 10 20 CECD CN(Cc1ccccc1O)C(=O)Nc1nc2ccccn2n1 183051754 WWXNQCRQEBNLHF-UHFFFAOYSA-N 297.318 2.099 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](CN3CCCC3)C2)c1 180392698 QLMHOYJUGCZKML-AWEZNQCLSA-N 290.407 2.319 10 20 CECD CCCN(CCO)Cc1cc(Cl)cc(OC)c1O 184673673 BYUBZUWJNJUGKS-UHFFFAOYSA-N 273.760 2.259 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2ccc(=O)[nH]c2)cc1 46740665 UGLJTODETOORIM-UHFFFAOYSA-N 299.374 2.151 10 20 CECD CO[C@@H](C)CC(=O)NCc1ccc(N2CCCC2)cc1 195434999 ILBBQFPIAQUACG-ZDUSSCGKSA-N 276.380 2.328 10 20 CECD CCOCCO[C@H]1CCN(Cc2cc(C)ccc2O)C1 92067542 DEJMRVRYWIQBIX-HNNXBMFYSA-N 279.380 2.328 10 20 CECD C[C@H](Cn1ccnc1)N[C@@H]1CCc2cccc(O)c21 296066664 RYLJQQRKLNVUEM-DGCLKSJQSA-N 257.337 2.254 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCc1ccncc1 268645881 PEJAXWQWPBSZKE-UHFFFAOYSA-N 285.347 2.171 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](C)C[C@@H](C)O)c1 273555691 GXADQPZMGDCAAN-TUAOUCFPSA-N 295.379 2.236 10 20 CECD CN(C)c1ccc(CNS(=O)(=O)CC(C)(C)C)cc1 281756412 LBQXIQFYWVUFAO-UHFFFAOYSA-N 284.425 2.218 10 20 CECD CC(=O)N1C[C@@H]2CCC[C@H](NCc3ccccc3O)[C@H]2C1 808445184 AIIWYUARLCKPMM-JYJNAYRXSA-N 288.391 2.129 10 20 CECD Cc1cc(CN2CCCC[C@H]2CO)ccc1N(C)C 815017722 UGKMLNBQBOGGJQ-HNNXBMFYSA-N 262.397 2.408 10 20 CECD CCC(N)(CC)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 817960931 UPNMRDLHAVKRBC-NSHDSACASA-N 294.395 2.347 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@H]2C[C@H](F)CN2)cc1 817976706 RXNXEOWKHZFZCS-QEJZJMRPSA-N 279.403 2.493 10 20 CECD Cc1cc(O)c(CN[C@@H](C)C(=O)N2CCCC2)cc1Cl 825768702 VYWNENDYSRUUTJ-NSHDSACASA-N 296.798 2.455 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCC[C@H]([S@](C)=O)C2)c1 826910383 GHQAQUJAOXQXJC-VQZRKKFQSA-N 297.420 2.180 10 20 CECD C/C(Cl)=C/C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 907274558 RLCNJSWHLYYFBG-BZJXQOFCSA-N 269.728 2.288 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N[C@@H]1CCC[C@@H]2C[C@@H]21 838256473 SGYNPGXINUWGIK-DFIPAEPRSA-N 273.332 2.416 10 20 CECD CN(CC(=O)Nc1ccc(O)cc1)Cc1ccccc1O 731844867 KODNWWILHRFBQN-UHFFFAOYSA-N 286.331 2.168 10 20 CECD CN(C(=O)COC(=O)c1cc(O)cs1)c1ccccc1 731910737 BKDGFKNLLNLWFC-UHFFFAOYSA-N 291.328 2.274 10 20 CECD C[C@@H]1CC(C)(C)CN1C(=O)c1c(F)ccc(O)c1O 839876169 BFLYSDCNXSCYCG-MRVPVSSYSA-N 267.300 2.498 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCN(CC3CC3)C1)CC2 834575887 PHUNMUDISQIDFU-HUUCEWRRSA-N 272.392 2.453 10 20 CECD Cn1cnnc1CN(Cc1ccccc1O)C1CCCC1 732204079 BQXWZRZTGRTCED-UHFFFAOYSA-N 286.379 2.466 10 20 CECD CCC1CN(Cc2ccc(N3CCN(C)CC3)cc2)C1 835074743 MJBAKIWAGRUCCD-UHFFFAOYSA-N 273.424 2.280 10 20 CECD CC[C@@H](N[C@H](CO)CCF)c1ccc(F)cc1O 846207526 CRSKRGHODKRBLJ-CMPLNLGQSA-N 259.296 2.293 10 20 CECD Cc1cc(CN(C)c2ccc(OCC(=O)O)cc2)no1 846279838 NLOXCXGUIOJCKL-UHFFFAOYSA-N 276.292 2.083 10 20 CECD Cc1ccc(CNCc2ccc(N(C)C)cc2C)nn1 840897681 NLULNXFFUMFDKI-UHFFFAOYSA-N 270.380 2.449 10 20 CECD Nc1ccc(C(=O)NCc2ccc(N3CCCC3)cc2)cn1 746314014 IHSFTTRHSQRPFJ-UHFFFAOYSA-N 296.374 2.194 10 20 CECD CCc1cccc(CN2CCO[C@@]3(CCO[C@@H]3C)C2)c1O 848908381 SHBWRCFMGLZWBO-DYVFJYSZSA-N 291.391 2.334 10 20 CECD CSC[C@H](CCO)NCc1ccc(N(C)C)cc1C 840933057 FBGIONKBXNOAND-AWEZNQCLSA-N 282.453 2.265 10 20 CECD CCC(=O)N[C@H]1C[C@H](NCc2ccc(OC)c(C)c2)C1 1019909613 RCIGWHRERIOGGH-HDJSIYSDSA-N 276.380 2.150 10 20 CECD CCN[C@H](C)CNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 841881776 UTFQUKZYUCBPRX-OLZOCXBDSA-N 292.427 2.111 10 20 CECD COC[C@H](C)CNCc1cc(F)c(N(C)C)cc1F 858108310 BOBYIOROOVBKGK-SNVBAGLBSA-N 272.339 2.403 10 20 CECD C[C@@H]1CCN(Cc2cc(Cl)ccc2O)C[C@@H]1CO 857061446 QWDRKKYJFSCVDX-ZYHUDNBSSA-N 269.772 2.496 10 20 CECD CC[C@@H](N[C@@H]1CCN(C(C)=O)C1)c1ccc(F)cc1O 857084340 NKMVSUCPGAUAOQ-TZMCWYRMSA-N 280.343 2.193 10 20 CECD CC[C@H](NC)C(=O)NCc1ccc(N(CC)CC)c(F)c1 852805282 VDXSXAFYLKZVDO-AWEZNQCLSA-N 295.402 2.286 10 20 CECD CN(C[C@H]1COC(C)(C)O1)c1ccc2c(c1)OCO2 851868804 VIFLACGMBWHHAZ-NSHDSACASA-N 265.309 2.003 10 20 CECD Fc1cc(CN[C@H]2C=CCC2)ccc1N1CCOCC1 850358735 KKZCKUIQBKBYTL-AWEZNQCLSA-N 276.355 2.471 10 20 CECD C[C@H]1C[C@@H](NCCC(=O)N(C)C)c2c(O)ccc(F)c21 756517980 RTYPBTQUGIEZLX-GXSJLCMTSA-N 280.343 2.148 10 20 CECD C[C@H](N[C@H]1CCN(C2CC2)C1)c1cc([N+](=O)[O-])ccc1O 756535571 RFRSZSZFTOTDHX-QWRGUYRKSA-N 291.351 2.188 10 20 CECD CN(Cc1cc(F)c(N(C)C)cc1F)CC(C)(C)CO 862385121 PGESOYMWULBVPI-UHFFFAOYSA-N 286.366 2.481 10 20 CECD CCn1ncc(C(=O)N(C)c2ccc(N)cc2)c1C 877075388 BCENMMFXYJVQQY-UHFFFAOYSA-N 258.325 2.070 10 20 CECD COc1ccc(CNCCCF)cc1Cn1cccn1 873080348 OSUJBQVKXLGAFS-UHFFFAOYSA-N 277.343 2.389 10 20 CECD Cc1cccc(O)c1CN1C[C@@H](C)O[C@@]2(CCCOC2)C1 877494281 JIMNXBDMZQKYKV-PBHICJAKSA-N 291.391 2.471 10 20 CECD C[C@H](NC(=O)N[C@@H](C)C(C)(C)O)c1ccc(N(C)C)cc1 776237186 DYDPGQCHAAPNNU-RYUDHWBXSA-N 293.411 2.272 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1nccs1 770495440 PXVIJZXDZXBJGF-UHFFFAOYSA-N 275.377 2.448 10 20 CECD CCN(CC)CC[C@@H](C)NC(=O)NCc1ccccc1O 1122445731 YYTIKZKUWBYUTM-CYBMUJFWSA-N 293.411 2.312 10 20 CECD C=C/C=C/CCNC(=O)NCc1ccc(OC)cc1O 883828412 RDQBFIADLHRUTR-SNAWJCMRSA-N 276.336 2.332 10 20 CECD Cc1cccc(CNCCCn2ccnc2C)c1O 271793572 ATNBLMWORXIVTP-UHFFFAOYSA-N 259.353 2.385 10 20 CECD C[C@@H](NC(=O)CCc1cnccn1)c1ccc(N(C)C)cc1 793856348 PRPLKUKSDQHPSG-CYBMUJFWSA-N 298.390 2.353 10 20 CECD CN(CC(=O)N1CCCCCC1)Cc1ccccc1O 111236160 BSJJJUVNJFGNJG-UHFFFAOYSA-N 276.380 2.227 10 20 CECD CC1(C)CC[C@H](CNC(=O)Cc2ccc(N)cc2)OC1 711341172 ZVASJQWAGFNNEB-CQSZACIVSA-N 276.380 2.133 10 20 CECD CN(C)c1ccc(CN2CCC[C@](C)(C(=O)O)C2)cc1 86782704 KJCUNKZITAHDLW-INIZCTEOSA-N 276.380 2.439 10 20 CECD CO[C@@H](CNCc1cccc(C)c1O)C(F)(F)F 776175103 UWQWUQJYFSJGKX-JTQLQIEISA-N 263.259 2.368 10 20 CECD CO[C@@H]1CCC[C@@H]1C(=O)N[C@H](C)c1ccccc1O 1262636857 BYDCQIHNCPKMEW-SCDSUCTJSA-N 263.337 2.385 10 20 CECD O=C(O)c1cncnc1NCc1cc(Cl)ccc1O 1608983756 AYJPXTFOWASJPU-UHFFFAOYSA-N 279.683 2.146 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc(C(=O)O)cc1 1601239303 WQRUNPBXKXOSEQ-KRXBUXKQSA-N 299.282 2.448 10 20 CECD Cc1oc(C2CC2)nc1C(=O)NCc1cccc(O)c1O 1548791632 QOZINAXTYKSASS-UHFFFAOYSA-N 288.303 2.202 10 20 CECD Nc1ccccc1C(=O)NCc1c(O)cccc1F 1574287758 XPXZRUIIMSMQRX-UHFFFAOYSA-N 260.268 2.044 10 20 CECD C[C@H](C(=O)O)N(Cc1cccc(F)c1O)C1CCC1 1589486711 LFWMRSHDVJQLDQ-SECBINFHSA-N 267.300 2.359 10 20 CECD CCc1cccc(CNC[C@@H](C(=O)O)C(C)C)c1O 1593642777 WUAPQYZLRBPJMP-CYBMUJFWSA-N 265.353 2.401 10 20 CECD Nc1ccc(CC(=O)N[C@@H]2CCO[C@H]2c2ccccc2)cc1 161620351 YROONCYUZCSZJA-AEFFLSMTSA-N 296.370 2.458 10 20 CECD C[C@@H](NCC[C@H](O)C1CC1)c1cc(F)ccc1O 903406157 GZZFINDKWOMNGD-RNCFNFMXSA-N 253.317 2.343 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ncccc1Cl 815833873 IMTFPFZQELQCLU-UHFFFAOYSA-N 292.722 2.119 10 20 CECD C[C@@H](CNCc1cc(F)ccc1O)N1CCCCC1 226585833 KZOPMUKJVVVDFP-LBPRGKRZSA-N 266.360 2.495 10 20 CECD CCN1CCC(CNCc2cccc(OC)c2O)CC1 44517499 CROZXBMGNRWXPU-UHFFFAOYSA-N 278.396 2.222 10 20 CECD CCN(CC)c1ccc(CNC(=O)CC(C)(C)N)cc1 178711883 NFIWFYCPILKITE-UHFFFAOYSA-N 277.412 2.276 10 20 CECD Oc1ccc(F)cc1CN1CCOCC2(CCOCC2)C1 183270670 WOIJBBVNOAHWCJ-UHFFFAOYSA-N 295.354 2.160 10 20 CECD O=C(Nc1ccc(-c2nnc[nH]2)cc1)c1cccc(O)c1O 187086473 CJAXHENTMRYAPT-UHFFFAOYSA-N 296.286 2.135 10 20 CECD Cc1ccc([C@H](C)NCCNC(=O)c2ccco2)c(O)c1 184917276 AISGQJBRFQBZKE-LBPRGKRZSA-N 288.347 2.374 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CCN(C(C)C)C2=O)c1 182436006 ZYDGHQRSWPXDDU-RISCZKNCSA-N 292.379 2.061 10 20 CECD CO[C@H](C)CN(C)c1ccc(/C=C/C(=O)O)cc1[N+](=O)[O-] 313749879 QDZSXNNLWPZLNO-BREXMAIKSA-N 294.307 2.164 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC[C@@H]1CCCCO1 183223007 QOQDAVNOLCQEHJ-IYNGYCSASA-N 291.347 2.186 10 20 CECD Cc1cc(C)c(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)[nH]1 183480542 YONMQMMZGYEOTR-NSHDSACASA-N 288.347 2.404 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCC[C@@H](N(C)C)C2)c(O)c1O 182563189 RAFQAVPHDPFSKE-NWDGAFQWSA-N 292.379 2.009 10 20 CECD CN1CC[C@@H](NCc2cc(Cl)cc(Cl)c2O)C1 42544582 XNXNWDPSPRIGPJ-SNVBAGLBSA-N 275.179 2.493 10 20 CECD CCOc1cccc(CN[C@H](C)C[C@H](C)O)c1O 228067386 FRMGSPSYPOQACK-MNOVXSKESA-N 253.342 2.040 10 20 CECD Cc1c(CNC(=O)COC(F)F)n(C)c2ccccc12 355444365 VPDRFVPBYHJFJK-UHFFFAOYSA-N 282.290 2.342 10 20 CECD CC[C@H](NC[C@H](O)C1CCOCC1)c1ccccc1O 274879188 HFQFIHIGFJERBE-HOCLYGCPSA-N 279.380 2.220 10 20 CECD COC(=O)[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1C 373498197 OPDRCUCBZJXXDT-DGCLKSJQSA-N 294.370 2.133 10 20 CECD COCC1(CNC(=O)N(C)Cc2ccccc2O)CCC1 282155556 HINVIVIKSAJJMS-UHFFFAOYSA-N 292.379 2.350 10 20 CECD Cc1ncncc1C(=O)NCc1ccc2c(c1)CCCN2C 299373925 JIJGGJQHZBWUPE-UHFFFAOYSA-N 296.374 2.097 10 20 CECD C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(Br)cc1O 817977281 GBZZKCBGNHJJPV-XDRUHAPNSA-N 297.196 2.023 10 20 CECD COc1ccc(N2CC[C@H](CN[C@H](C)C[C@@H](C)N)C2)cc1 818616588 YNCQGKNJBATKKH-RBSFLKMASA-N 291.439 2.237 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCN[C@H](C)C2)c1 817970770 DWGUFMMGPJRVTO-GRYCIOLGSA-N 264.369 2.192 10 20 CECD CC[C@@H](O)[C@H](C)C(=O)N(C)Cc1ccc(N(C)C)cc1 900026109 IWIYKLMESPPAPK-SWLSCSKDSA-N 278.396 2.118 10 20 CECD CCc1nc(CNCc2cc(Cl)c(C)cc2O)n[nH]1 826024354 ZYJYOTJZLHFVAR-UHFFFAOYSA-N 280.759 2.324 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](C(=O)O)C2)c1 833662876 LETQNQITGKQFMZ-NSHDSACASA-N 279.336 2.088 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@@H](CC)c1ccc(F)cc1O 834905123 SVMRJNDKBORAKD-GZBFAFLISA-N 283.343 2.376 10 20 CECD CCN(C(=O)/C=C\c1cnn(C)c1)c1ccccc1OC 914519203 JRLPDDRWGRSGPB-KTKRTIGZSA-N 285.347 2.495 10 20 CECD COc1cccc(CNC(=O)NCc2ccccc2O)c1 748326084 ZGCVXIHKGDSZLS-UHFFFAOYSA-N 286.331 2.400 10 20 CECD CCC[C@H]1C(=O)NCCN1Cc1cccc(CC)c1O 848891278 YHLLBPSABNMWIQ-AWEZNQCLSA-N 276.380 2.055 10 20 CECD Cc1cc(Br)cc(CN2CC[C@H](CN)C2)c1O 843048435 URBNRZCJVGPLCG-SNVBAGLBSA-N 299.212 2.244 10 20 CECD C[C@H]1CC[C@H](CNC(=O)NCc2cc(Cl)ccc2O)O1 845253656 YALJDODCKLHCFI-JOYOIKCWSA-N 298.770 2.412 10 20 CECD CC(C)c1ccccc1C=C1C(=O)N(C)C(=O)N(C)C1=O 846758624 QSYPBMCJPUYFQQ-UHFFFAOYSA-N 286.331 2.244 10 20 CECD CCOCc1cc(CNC[C@H]2CCN2C)ccc1OC 922573903 HFXSZFPZTIWEIB-OAHLLOKOSA-N 278.396 2.025 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)C[C@]1(C)CO 852701880 GPJNPSRCEIZMJC-XJKSGUPXSA-N 262.397 2.203 10 20 CECD COC1([C@H](C)NC(=O)NCc2cc(C)ccc2O)CCC1 858542349 KMRLKZGZMQBLPH-LBPRGKRZSA-N 292.379 2.457 10 20 CECD COC1CCC(NCc2cc([N+](=O)[O-])ccc2O)CC1 753676606 IUIMJABGKQEMIG-UHFFFAOYSA-N 280.324 2.348 10 20 CECD CCN1CCN(Cc2ccc(N(C)C)c(F)c2)C[C@@H]1C 769381442 OFVKSWACXIMHOA-ZDUSSCGKSA-N 279.403 2.418 10 20 CECD Cc1cc(O)nc(C(C)(C)NCc2ccc3c(c2)CCO3)n1 862432529 HEICHQYKINVPJP-UHFFFAOYSA-N 299.374 2.450 10 20 CECD C[C@@H](NCc1ccn(C)c(=O)c1)c1ccc(N(C)C)cc1 775835620 VMVGAGRYMJMPHO-CYBMUJFWSA-N 285.391 2.302 10 20 CECD COCCC(C)(C)NCc1ccc([N+](=O)[O-])c(OC)c1O 775029555 PFDJFNOIARXYFH-UHFFFAOYSA-N 298.339 2.214 10 20 CECD CC[C@H](NC[C@H](O)CN(C)C)c1cc(Cl)ccc1O 775501297 GCMIVIQYMFUXGC-AAEUAGOBSA-N 286.803 2.009 10 20 CECD O=C(NCc1ccccc1O)c1ccc2cc[nH]c2n1 779535841 LHQFGNRXVUMPJJ-UHFFFAOYSA-N 267.288 2.199 10 20 CECD CCOc1ccc(CN[C@H](C)[C@@H]2CCOC2)c(O)c1 776220360 WJXPZFGRSFFJHO-DGCLKSJQSA-N 265.353 2.306 10 20 CECD CCOc1ccc(CNC[C@@H]2CC[C@@H](O)C2)c(O)c1 788971054 ANOFTWQARCLTTG-DGCLKSJQSA-N 265.353 2.042 10 20 CECD COc1ccc(CNCCOC2CCCC2)c(O)c1OC 892714113 MYTXILHVSMVMMI-UHFFFAOYSA-N 295.379 2.458 10 20 CECD O=C1CCCN1C1CN(Cc2ccc3ccccc3c2O)C1 897784454 UGNTXRLMKOGUJE-UHFFFAOYSA-N 296.370 2.352 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@@H]1CCCCO1 1325345936 POJPNKYVWOUJFJ-VIFPVBQESA-N 281.699 2.384 10 20 CECD CSCC1CCN(C(=O)Cc2ccc(N)cc2)CC1 719278036 AELAVSZZFDHSLU-UHFFFAOYSA-N 278.421 2.413 10 20 CECD CC(C)OCCCCNC(=O)NCc1ccc(N)cc1 1335559671 ZUOZYHHWCMPZQH-UHFFFAOYSA-N 279.384 2.273 10 20 CECD Nc1ccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)cc1 1345160411 VLOSIESUATXGTB-AWEZNQCLSA-N 297.406 2.186 10 20 CECD CN(CC(F)(F)F)c1nnc(-c2sccc2O)n1C 1262854701 UDHSEQAKFJFPCK-UHFFFAOYSA-N 292.286 2.248 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCCC[C@H]2N)c1O 1579145537 RVJCBMWTXKGIFJ-CHWSQXEVSA-N 264.369 2.069 10 20 CECD Nc1ccc(OC(=O)COCCOc2ccccc2)cc1 1580449577 OXMQACXQCIELKX-UHFFFAOYSA-N 287.315 2.270 10 20 CECD Nc1ccc(CNC(=O)Nc2cccc3c2OCO3)cc1 1580445410 BWGLYKGHBDVOCX-UHFFFAOYSA-N 285.303 2.319 10 20 CECD Nc1ccc(CC(=O)Nc2c[nH]c3nccc-3c2)cc1 1580442868 IRFCFIZGDHKGOA-UHFFFAOYSA-N 266.304 2.278 10 20 CECD COc1cccc(CN[C@@H](C(=O)O)c2cccs2)c1O 1599674483 QAKJKYXBSONSDZ-GFCCVEGCSA-N 293.344 2.378 10 20 CECD CC[C@H](CC(=O)O)NCc1ccc2c(c1)CCCO2 1776955295 JGWYNLDPFKWNTI-CYBMUJFWSA-N 263.337 2.355 10 20 CECD C[C@@H]1CC[C@@](NCc2ccc(N(C)C)cc2)(C(=O)O)C1 1776628249 IXAUCYVBUAVJHA-WBMJQRKESA-N 276.380 2.486 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)N(C)C)cc1F 162483607 TXYFORJIQJNZGW-UHFFFAOYSA-N 295.402 2.192 10 20 CECD COC(=O)C1CCC(NCc2ccccc2O)CC1 264421304 RCJFOXQKLZWNKK-UHFFFAOYSA-N 263.337 2.214 10 20 CECD COc1ccncc1CNCc1cc(C)ccc1O 292624393 IZSMFRXBVVVSPH-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Cc1ccc(O)c(CN2CC[C@@]3(CCN(C)C3)C2)c1 292752737 IPVDHQDPPHVIQZ-MRXNPFEDSA-N 260.381 2.228 10 20 CECD C[C@H]1C[C@H](NCc2ccc3c(c2)CCCN3C)CO1 402373581 ZFRLDFMXJXRDLO-WFASDCNBSA-N 260.381 2.336 10 20 CECD COc1cccc(CN(C)C2CCC(N)CC2)c1O 91844414 BSOCLWBBQLTHST-UHFFFAOYSA-N 264.369 2.103 10 20 CECD Cc1cc(Br)c(O)c(CN[C@@H]2CC[C@H]2O)c1 378675381 OIDJJQLNABWSDU-GHMZBOCLSA-N 286.169 2.076 10 20 CECD CC[C@H](NCc1cc(Cl)cc(OC)c1O)[C@H](C)O 386742855 YVRSUHPZBSMSIU-KWQFWETISA-N 273.760 2.303 10 20 CECD CC(C)(N)CC(=O)NCc1ccc(N2CCCC2)cc1 178710641 SQDJSHHOCIAOEC-UHFFFAOYSA-N 275.396 2.030 10 20 CECD Oc1cc2c(cc1CN(C[C@H]1CCOC1)C1CC1)OCO2 54495155 LQRDBPTZQQVDSD-LLVKDONJSA-N 291.347 2.122 10 20 CECD C[C@H]1C[C@H](C)CN(C(=O)CN(C)Cc2ccccc2O)C1 111236501 NGMNSPGTJYXLGY-KBPBESRZSA-N 290.407 2.329 10 20 CECD COC(=O)CCCc1nc(CSc2nccs2)no1 110143452 USPHVGDRKWAQPX-UHFFFAOYSA-N 299.377 2.314 10 20 CECD COc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)cn1 180588825 MPOZJLPXPAHUAA-ZZXKWVIFSA-N 286.287 2.153 10 20 CECD CCn1[nH]c(C)nc1=NCc1c(C)c2ccccc2n1C 414293144 CBIDOURPSQYEKA-UHFFFAOYSA-N 283.379 2.441 10 20 CECD CC(C)(C)C(=O)N1CCN(Cc2ccccc2O)CC1 179556325 RYRMOCIRTUTUQZ-UHFFFAOYSA-N 276.380 2.083 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCSC2)c1 226381173 PTBOTJBJMXVLCJ-JTQLQIEISA-N 253.367 2.244 10 20 CECD COCc1nc(CNCc2cc(OC)ccc2O)cs1 266203575 MAERUOWXDQFTBU-UHFFFAOYSA-N 294.376 2.294 10 20 CECD CN(Cc1cc(Br)ccc1O)CC(C)(C)O 93414369 DMNJUHBCESCWAC-UHFFFAOYSA-N 288.185 2.357 10 20 CECD COC(=O)c1ccc(CNCc2ccc3c(c2)CCO3)o1 265236074 VSZLRUALXAPJJA-UHFFFAOYSA-N 287.315 2.291 10 20 CECD CN1CC[C@@H]2CCN(Cc3ccc(N(C)C)cc3)[C@H]2C1 272267705 BHWSAPQRFQTZKG-WBVHZDCISA-N 273.424 2.279 10 20 CECD CC[C@@H]1CO[C@H](C)CN1C(=O)/C=C/c1ccc(O)c(O)c1 272685302 SSGOGYQMOFLNFV-BVKQBWKVSA-N 291.347 2.137 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@](O)(C3CC3)C2)c1O 377265695 HFIPOSXRBHPXME-MRXNPFEDSA-N 293.338 2.081 10 20 CECD C[C@H](CF)NC(=O)NCc1ccc2c(c1)CCCN2C 287100878 AHMTZHRDGDRADY-LLVKDONJSA-N 279.359 2.226 10 20 CECD CC[C@@H](NCCN(C)CCOC)c1ccc(C)cc1O 280251825 WREKQGVUEOOAST-OAHLLOKOSA-N 280.412 2.320 10 20 CECD Cc1ccc(O)c(CN2CCc3ccccc3[C@@H]2C(N)=O)c1 378350988 QQHSAPAWEMLVHQ-QGZVFWFLSA-N 296.370 2.285 10 20 CECD CCCCOCCCNC(=O)NCc1ccccc1O 299539362 UYLDUMKHWVDHGT-UHFFFAOYSA-N 280.368 2.398 10 20 CECD CC(C)OC[C@@H](CO)N(C)Cc1ccc(N(C)C)c(F)c1 809768074 BMXCXXHRUSPZRY-CQSZACIVSA-N 298.402 2.109 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CC[C@H](CC)O1 819761487 RWANCBURSXDRHB-AAEUAGOBSA-N 298.379 2.452 10 20 CECD COc1ccc(CN[C@@H]2CC[C@H](C(=O)O)C2)cc1C 819162311 RVRJOPZOYYWIPN-QWHCGFSZSA-N 263.337 2.347 10 20 CECD CC[C@@H](NCCCN1CCNCC1)c1ccc(C)cc1O 817936589 POLVQGPRRZVUTL-MRXNPFEDSA-N 291.439 2.037 10 20 CECD CC[C@@H](NC1CCNCC1)c1ccc(F)cc1O 817936747 QWUCRUZZGVFZDT-CYBMUJFWSA-N 252.333 2.324 10 20 CECD C[C@@H](NCC1(CC(N)=O)CC1)c1cc(Cl)ccc1O 817584940 BEDVFCWQKDZXGW-SECBINFHSA-N 282.771 2.352 10 20 CECD CC[C@H](NC[C@H]1CCCN1)c1ccc(F)cc1O 817954595 ZMDVMWFKTLKAMD-YPMHNXCESA-N 252.333 2.324 10 20 CECD Cc1cc(O)c(CN2CCOC[C@]23CCOC3)cc1Cl 825773526 JEEGXSQMSFBNHD-OAHLLOKOSA-N 297.782 2.345 10 20 CECD CCCCC[C@@H](O)C(=O)N(C)Cc1ccccc1O 827081615 NJDDBRJOFQCMAN-CQSZACIVSA-N 265.353 2.292 10 20 CECD CC[C@@H](N[C@@H](C)CC(=O)NC)c1ccc(N(C)C)cc1 834900228 ODPRNUPBIPPZQB-SWLSCSKDSA-N 277.412 2.318 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)C(F)F 839920913 VLUIJMDUWAGROT-SNVBAGLBSA-N 270.323 2.373 10 20 CECD CC(C)O[C@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)C1 839147560 NALVBGJXILKDAS-TXEJJXNPSA-N 279.336 2.167 10 20 CECD O=C(/C=C\C1CCCC1)NCc1ccc(O)c(O)c1 843830306 GKYAPCNRIQJRKH-VURMDHGXSA-N 261.321 2.460 10 20 CECD C[C@]1(CNC(=O)NCc2cc(Cl)ccc2O)CCOC1 844971337 GLKQGLJUZUCRQV-CQSZACIVSA-N 298.770 2.271 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@]2(CCNC2)C1 843120540 PBAYYRJCZIBYTP-AWEZNQCLSA-N 266.772 2.231 10 20 CECD O=C(/C=C\[C@H]1CCOC1)NCc1cc(Cl)ccc1O 846476170 JTMQMCHOCOHCHO-GZXOQBQISA-N 281.739 2.255 10 20 CECD CCN(C(=O)/C=C/c1cnn(C)c1)c1ccc(OC)cc1 914478489 UJVHQIXUWGYGNG-BJMVGYQFSA-N 285.347 2.495 10 20 CECD COc1cccc([C@H](C)NCCC2(C)OCCO2)c1O 846161665 ADYWRYQHEGYMGE-NSHDSACASA-N 281.352 2.205 10 20 CECD CCC[C@@]1(C)C(=O)NCCN1Cc1cccc(CC)c1O 848906473 WTZZQSVEJHWASF-KRWDZBQOSA-N 290.407 2.445 10 20 CECD COC(=O)C1(CNCc2ccc(N(C)C)cc2C)CC1 840939452 YDLGXJLYDGYFKK-UHFFFAOYSA-N 276.380 2.104 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@@H]12)NCc1ccc(O)cc1O 910945438 WHCWVKDFHPEXNS-OUJBWJOFSA-N 261.321 2.150 10 20 CECD CCCN(C)C[C@H]1CCN(C(=O)c2cc(O)cs2)C1 743783013 MNAZSJLNSICIKC-LLVKDONJSA-N 282.409 2.258 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)N1CCCc2cc(CN)ccc21 843350688 WQSNDNQNIVGUBS-OLZOCXBDSA-N 289.423 2.201 10 20 CECD CCCN(Cc1cc2c(cc1O)OCO2)C1CCNCC1 843044991 PBLBQWABSJMDDL-UHFFFAOYSA-N 292.379 2.085 10 20 CECD CCOc1ccc(O)c(CN2[C@H]3CCNC[C@H]2CC3)c1 843058607 WSDXKLBVFNAGPF-ZIAGYGMSSA-N 276.380 2.117 10 20 CECD CN(Cc1ccoc1)C(=O)NCCc1ccc(N)cc1 841961976 JAJXTDZGOCFZPR-UHFFFAOYSA-N 273.336 2.246 10 20 CECD C[C@H]1CNC[C@@H](C)N1Cc1cc(Br)ccc1O 843066074 SABLFMZKBYVBRD-AOOOYVTPSA-N 299.212 2.337 10 20 CECD CCOc1ccc(O)c(CN2C[C@H]3CCC[C@@]3(N)C2)c1 857226302 KISNRORGNISBMM-CZUORRHYSA-N 276.380 2.104 10 20 CECD Cc1cc(Cl)cc([C@H](C)NCCN2CC[C@H](O)C2)c1O 858601317 DWJFXHLMSOVNAZ-AAEUAGOBSA-N 298.814 2.071 10 20 CECD CC1CCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768437837 KFQFIQULKVHQDS-CQSZACIVSA-N 263.337 2.050 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cc(C(C)C)nn2C)c1 862757922 IIPIZWKHPBDJDY-UHFFFAOYSA-N 287.363 2.488 10 20 CECD C[C@@H](NC(=O)CCc1cn[nH]c1)c1ccc(N(C)C)cc1 863906779 WNCDIXWUHWGEQW-GFCCVEGCSA-N 286.379 2.286 10 20 CECD C[C@H]1CN(C)[C@H](C)CN1Cc1ccc(N(C)C)c(F)c1 775983109 BCEMKENWEYEHSW-OLZOCXBDSA-N 279.403 2.416 10 20 CECD CCOC(=O)N[C@H]1CCCN(Cc2c(C)cccc2O)C1 876580115 GBADWPSKJFVLDK-ZDUSSCGKSA-N 292.379 2.411 10 20 CECD CC(C)CN1CCN(Cc2cc(F)ccc2O)[C@@H](C)C1=O 779202581 OSCXDWQXRDJQRP-LBPRGKRZSA-N 294.370 2.220 10 20 CECD CC(=O)c1ccc(C(=O)NCc2ccc(N(C)C)cc2)o1 770823709 NOWSIUCVSZHDLG-UHFFFAOYSA-N 286.331 2.478 10 20 CECD CC(C)CO[C@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773762918 LRTYQRMWPDBNBI-VXGBXAGGSA-N 295.379 2.206 10 20 CECD CC[C@H](N)c1cn(Cc2ccc(N(C)C)c(C)c2)nn1 881377200 IGQOQGUDNXKJSV-ZDUSSCGKSA-N 273.384 2.111 10 20 CECD C[C@@H](N[C@H](C)c1ncnn1C)c1c(O)cccc1F 886598581 FROCYSIEXGOUDN-RKDXNWHRSA-N 264.304 2.072 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@@H](C)c1c(O)cccc1F 886627150 UTAPDQWLLBVQIM-UWVGGRQHSA-N 268.332 2.095 10 20 CECD C[C@@H](NC(=O)NC1CCC(N)CC1)c1ccccc1O 892020882 CLLFMIZVTHJAJO-VOMCLLRMSA-N 277.368 2.022 10 20 CECD COCCOCCCNCc1c(O)ccc(Cl)c1F 790947572 SFJMXEQOVICTQQ-UHFFFAOYSA-N 291.750 2.327 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1cc(F)ccc1O 186030510 IYGPEZYADKMXMO-UWVGGRQHSA-N 289.372 2.005 10 20 CECD CCOC(=O)C[C@H]1CCCN1C(=O)c1cc(O)cs1 1329210073 SKOMROVNHQXBPN-SECBINFHSA-N 283.349 2.012 10 20 CECD C[C@H](NCCOC[C@@H]1CCCO1)c1ccc(F)cc1O 756583311 NBCXCZNKLXAJLV-AAEUAGOBSA-N 283.343 2.378 10 20 CECD C[C@H](CNCc1ccc(Br)cc1O)N(C)C 691456318 SKFOJGJFXLMHGB-SECBINFHSA-N 287.201 2.194 10 20 CECD COc1ccc(N2CCC(Nc3ccnc(N)n3)CC2)cc1 1337757458 SGEQIDCVVZWOLS-UHFFFAOYSA-N 299.378 2.148 10 20 CECD O=C(O)[C@H](CC(F)F)NCc1ccc2c(c1)CCCO2 1333948464 PVIOGORAYKGIBX-NSHDSACASA-N 285.290 2.210 10 20 CECD O=C(O)c1cncnc1NCc1ccc(N2CC=CC2)cc1 1602543154 GXIAVHCSRXCVKB-UHFFFAOYSA-N 296.330 2.163 10 20 CECD Cc1cc(CN[C@](C)(CCF)C(=O)O)ccc1N(C)C 1600205078 NCOOYTQDHNFOKM-OAHLLOKOSA-N 282.359 2.354 10 20 CECD C[C@@H]1[C@@H](C(=O)O)CCN1Cc1cc(Cl)cc(F)c1O 1609835442 UMPBEEQWGSVQOV-XCBNKYQSSA-N 287.718 2.480 10 20 CECD CCN(C)c1ccc(CN[C@H]2CCC[C@@H]2C(=O)O)cc1 1609991111 JTBDWYDGBPPSGM-GJZGRUSLSA-N 276.380 2.486 10 20 CECD CN(Cc1cccnc1[N+](=O)[O-])c1ccc(N)cc1 1578497075 IAJZQBZTPJRICQ-UHFFFAOYSA-N 258.281 2.208 10 20 CECD COC(=O)C(C)(C)CNCc1ccc(OC)c(C)c1 258879611 HVXYUPSDBPBWDD-UHFFFAOYSA-N 265.353 2.292 10 20 CECD CCc1cccc(CN(C)[C@H]2CCC(=O)N(C)C2)c1O 862428131 LMZIFABIOXGZHO-AWEZNQCLSA-N 276.380 2.007 10 20 CECD C[C@@H]1CCN(Cc2cc(F)ccc2O)[C@@H](C(=O)O)C1 1594424433 SPONXXLBSLFSBP-BXKDBHETSA-N 267.300 2.216 10 20 CECD COc1cccc(CN2CCO[C@H]3CCC[C@H]32)c1O 228144239 YHKJPXVBHSRNLB-OLZOCXBDSA-N 263.337 2.154 10 20 CECD CC[C@@H](NCCc1ccnn1C)c1ccccc1O 158119941 RVXSFEZZDSGOJY-CQSZACIVSA-N 259.353 2.409 10 20 CECD CN(C)c1ccc(CN2CCC(C(=O)O)CC2)cc1 3747733 SYHPGOBIUIBASH-UHFFFAOYSA-N 262.353 2.049 10 20 CECD Cc1cccc(CN(CC(N)=O)Cc2ccccc2)c1O 180206270 PLCVYGCFISPSHR-UHFFFAOYSA-N 284.359 2.188 10 20 CECD C/C=C/C[C@H](CO)NCc1cccc(OCC)c1O 185828531 IOKSJAKINQZJBD-MASHWEEQSA-N 265.353 2.208 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C2(CO)CC2)c1O 285408771 FTXQECRWJIIOFF-UHFFFAOYSA-N 283.755 2.205 10 20 CECD Cc1nccc(N[C@@H](C)Cc2ccc(O)c(O)c2)n1 184146991 HTJATJHIRQPMEN-VIFPVBQESA-N 259.309 2.239 10 20 CECD O=C(NCc1ccccc1O)c1cc(F)cc([N+](=O)[O-])c1 134484051 DVMQBBYZZPWSKM-UHFFFAOYSA-N 290.250 2.370 10 20 CECD CC(C)NC(=O)N(Cc1ccccc1O)C[C@@H]1CCCO1 42839786 ZPDKXZDWSNJUMK-AWEZNQCLSA-N 292.379 2.491 10 20 CECD COc1cccc(CN(C)Cc2ccccn2)c1O 273408069 NULLGLNCNZUNBS-UHFFFAOYSA-N 258.321 2.428 10 20 CECD Oc1ccccc1CN1CCC([C@H](O)c2ncc[nH]2)CC1 375689465 DYHCQUZVWJALSO-HNNXBMFYSA-N 287.363 2.061 10 20 CECD Cc1nc(C(C)(C)NCc2cc(F)ccc2O)no1 272384652 IBIBBTBGGARRDG-UHFFFAOYSA-N 265.288 2.248 10 20 CECD Nc1ccc(CC(=O)N2CCOC[C@@H]2c2ccccc2)cc1 370271802 XUHDGBHNMNYNOM-QGZVFWFLSA-N 296.370 2.411 10 20 CECD CCOc1cccc(CN2CCC[C@](F)(CO)C2)c1O 289932285 WMIKXHVDTRRILP-OAHLLOKOSA-N 283.343 2.087 10 20 CECD O=C1CCc2cc(C(=O)NCc3ccccc3O)ccc2N1 389187318 SRFUFZMIEWZYRD-UHFFFAOYSA-N 296.326 2.207 10 20 CECD CCN(CC)CCCOC(=O)c1ccc(C)c(O)c1O 800158523 RWIOXXVPDHYTDY-UHFFFAOYSA-N 281.352 2.295 10 20 CECD CCCCOCCOC(=O)c1ccc(C)c(O)c1O 805433622 UPAIBHUKJJIFRP-UHFFFAOYSA-N 268.309 2.380 10 20 CECD CC(F)(F)C(=O)NCCCSc1nccs1 808463474 JDFYXVYWWLMKRI-UHFFFAOYSA-N 266.338 2.397 10 20 CECD CN1CCCc2cc(CNCc3ccc(O)nc3)ccc21 392713914 NBEOHEOURNUDTP-UHFFFAOYSA-N 283.375 2.459 10 20 CECD Oc1cccc2c1[C@@H](NCc1nnc3n1CCCCC3)CC2 296081235 SPWWJESOMPBRQT-ZDUSSCGKSA-N 298.390 2.487 10 20 CECD COc1cccc(CNCc2ccc(F)nc2)c1O 809740001 JTCGZYGYFBIGMN-UHFFFAOYSA-N 262.284 2.225 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(N)cc2)no1 818545248 RUZCVRQYDLKZNR-UHFFFAOYSA-N 273.336 2.353 10 20 CECD Cc1cc(Cl)cc([C@H](C)NC[C@@H]2CNCCCO2)c1O 817981410 JANJIQKRVWPGCO-AAEUAGOBSA-N 298.814 2.383 10 20 CECD C[C@H](N[C@@H]1CCCNCC1)c1cc(F)ccc1O 817968452 JNYDPBIILHZMTD-CMPLNLGQSA-N 252.333 2.324 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)C[C@H](C)N)cc1 826019911 NFGCJHCRMPEANN-ZDUSSCGKSA-N 277.412 2.229 10 20 CECD COc1cc(O)c(CN[C@@H](C)C2CC2)cc1OC 824691099 TUCJAXINFUHNCW-VIFPVBQESA-N 251.326 2.298 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)CC(=O)O)CC2)cc1 820841522 VLLGWGBDDGXYDE-LBPRGKRZSA-N 292.379 2.117 10 20 CECD O=C(O)[C@@H]1CCCN(Cc2cc3c(cc2O)CCC3)C1 739582656 HHSKTPIXUMLUSD-CYBMUJFWSA-N 275.348 2.178 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@H]2CCC[C@@H]3C[C@H]23)c1 838474512 LKGQPXCPJCBEIW-SWHYSGLUSA-N 290.363 2.389 10 20 CECD COC(=O)c1cnc(SC[C@@H]2CCCN2C)s1 917778784 UPIBNSMORMTGMM-QMMMGPOBSA-N 272.395 2.116 10 20 CECD CCOc1ccc(CN[C@H](CN)C(C)(C)C)c(O)c1 841086688 CUFSXZBOWUONCP-CQSZACIVSA-N 266.385 2.254 10 20 CECD CN1CCCc2cc(CN[C@@H]3CCC[C@H](N)C3)ccc21 848718426 MOVAWMRTBQAVCR-JKSUJKDBSA-N 273.424 2.429 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H](c3cccnc3)C2)c(O)c1O 843968891 UYTNMCYNRKAMML-CYBMUJFWSA-N 298.342 2.431 10 20 CECD C[C@H](O)CN(Cc1cc(Cl)ccc1O)C1CC1 848928837 PBTCRSWFHGNEEV-VIFPVBQESA-N 255.745 2.391 10 20 CECD Oc1ccccc1CN1CCC[C@@H]([C@@H]2CCNC2)C1 843125662 DKCKMAGILXTXJS-ZIAGYGMSSA-N 260.381 2.214 10 20 CECD CN(CC(C)(C)C)C(=O)NCCc1ccc(N)cc1 841953862 FCLRWLYLEMFKND-UHFFFAOYSA-N 263.385 2.499 10 20 CECD C[C@H]1[C@H](CO)CCCN1Cc1ccc(N(C)C)c(F)c1 840978244 MQBPYAVYAYLSGJ-JSGCOSHPSA-N 280.387 2.485 10 20 CECD COC(=O)CN(Cc1ccc(N(C)C)cc1C)C(C)C 840910149 LIUQQFPAOODKKL-UHFFFAOYSA-N 278.396 2.444 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C)[C@@H](CN)C2)cc1C 841101726 ZTCAASKJNFIRJK-NHYWBVRUSA-N 262.397 2.426 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCO2)C(=O)N1CCCC1 922092482 VVZIFTANTYYTSW-ZDUSSCGKSA-N 288.391 2.112 10 20 CECD Fc1cc(CN[C@@H]2C=CCC2)ccc1N1CCOCC1 850358738 KKZCKUIQBKBYTL-CQSZACIVSA-N 276.355 2.471 10 20 CECD O=C(C[C@@H]1CSCCS1)NCc1ccccc1O 752130767 VANSWVRYARBLLI-LLVKDONJSA-N 283.418 2.247 10 20 CECD COc1ncccc1CNCc1c(C)cccc1O 876925581 MIPUUIFREAOMAY-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Cc1ccn2ncc(C(=O)NCc3ccccc3O)c2c1 766847646 DHALCXQIZJKGFA-UHFFFAOYSA-N 281.315 2.278 10 20 CECD CCOc1ccc(CN(C)CC2(O)CCC2)c(O)c1 761220833 YUZFTFKWIQXJOF-UHFFFAOYSA-N 265.353 2.138 10 20 CECD Cc1ccc2c(c1)C(=O)N[C@@H](c1cccc(O)c1O)N2 877862533 YENHCRUXPODVIW-AWEZNQCLSA-N 270.288 2.260 10 20 CECD Cc1ccc(CN[C@H]2CCC[C@@H](C(=O)N(C)C)C2)c(O)c1 877045114 QDMODHQCBQBQPY-HIFRSBDPSA-N 290.407 2.437 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@H]2CC[C@@H](C)O2)c1 875657970 VKDPSHPMWXNVQC-DGCLKSJQSA-N 278.352 2.067 10 20 CECD CCCN(CC(=O)OCC)Cc1c(C)cccc1O 876630769 KGYSFGUGRQSKDJ-UHFFFAOYSA-N 265.353 2.476 10 20 CECD COC(=O)[C@H](N[C@H](C)c1ccccc1O)C1(OC)CCC1 879648896 FIWVYGCQMBQNSX-RISCZKNCSA-N 293.363 2.154 10 20 CECD CC(C)N1CCC[C@@H](N[C@H](C)c2ccccc2O)C1=O 879648183 BZFTVGORSKVCRC-TZMCWYRMSA-N 276.380 2.442 10 20 CECD Cc1cc(C)c(NC(=O)c2cccc(O)c2O)cc1CO 787567787 MZBSJUVAAZYOFA-UHFFFAOYSA-N 287.315 2.459 10 20 CECD COc1cc(C)cc(CNC[C@@H](OC)C2CC2)c1O 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CHTHGMQSMLTLML-KCJUWKMLSA-N 286.169 2.279 10 20 CECD CN(C)CCCN(C)Cc1cc(F)cc(F)c1O 708382718 GZSQIIBVNGMVDX-UHFFFAOYSA-N 258.312 2.054 10 20 CECD COC[C@H]1CCCN1Cc1cc(F)cc(C(C)=O)c1O 79498136 QRTNQHQQEIWSTI-CYBMUJFWSA-N 281.327 2.345 10 20 CECD CCN1CCN(C(=O)/C=C\c2cn(C)cn2)c2ccccc21 1337778338 MLVKLNBDVDBDCC-HJWRWDBZSA-N 296.374 2.306 10 20 CECD O[C@H]1C[C@H](CNCc2ccc(N3CCCC3)cc2)C1 720894801 ZIELWDPCEBRHTD-KOMQPUFPSA-N 260.381 2.147 10 20 CECD COc1cccc2c1OC[C@H](NCc1ccc(N)cc1)C2 1262487849 ICDZMHIDOKYONX-OAHLLOKOSA-N 284.359 2.371 10 20 CECD COc1cccc(O)c1CN[C@H]1CS[C@H](C)C1 840957843 GKJPUTWIOZGMQQ-NXEZZACHSA-N 253.367 2.384 10 20 CECD N[C@@H]1CCCCCN(Cc2ccc(F)c(F)c2O)C1 1580182172 FLGRORGHUMFCDT-LLVKDONJSA-N 270.323 2.374 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1C[C@H]1C(=O)O 1593297847 ARTPTRXPRLCVAX-ZMLRMANQSA-N 280.343 2.091 10 20 CECD CCOc1cccc(CN2CC[C@@H](C(=O)O)[C@H]2C)c1O 252605699 PVMOALMNGRYNOU-ZYHUDNBSSA-N 279.336 2.086 10 20 CECD CC(C)N1CC[C@H](CNCc2ccc3c(c2)CCO3)C1 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GEUNBQHEINBZPA-UHFFFAOYSA-N 286.331 2.270 10 20 CECD C[C@H](N[C@@H]1CC(=O)N(C(C)(C)C)C1)c1ccccc1O 183613905 HFQRZEQSBQQIEK-NWDGAFQWSA-N 276.380 2.442 10 20 CECD COC(=O)[C@@H](NCc1ccccc1O)C(C)(C)C 136868613 ZQQGSKXYYJWDPA-GFCCVEGCSA-N 251.326 2.070 10 20 CECD CC(C)NC(=O)[C@H](C)N[C@@H](C)c1ccc(F)cc1O 228946144 YCBJWIVHPPPCPR-UWVGGRQHSA-N 268.332 2.095 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C[C@H]2CCCN2C)c1O 92632641 AVRLDMFSCDNYNR-CQSZACIVSA-N 294.370 2.260 10 20 CECD CCN(C)C[C@H]1CCN(Cc2cc(OC)ccc2O)C1 180550394 JFBNIOQVCYOINZ-CYBMUJFWSA-N 278.396 2.174 10 20 CECD C[C@H](CC[S@](C)=O)N[C@H](C)c1ccccc1O 252819196 MTLSXTRHMBKFLG-AGKHESDQSA-N 255.383 2.200 10 20 CECD COc1cc(N(C)CCCC(=O)O)cc(OC)c1OC 266009505 LQDUOMUGZRWFDT-UHFFFAOYSA-N 283.324 2.013 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H]2CCCCO2)c1 273422118 SLVCIJVRSVKYPT-DGCLKSJQSA-N 293.363 2.399 10 20 CECD CSC1(CNC(=O)NCc2ccccc2O)CCC1 279522823 PROQBCOCEAAORB-UHFFFAOYSA-N 280.393 2.477 10 20 CECD CCN(CC)Cc1ccc([N+](=O)[O-])c(OC)c1O 278274771 SAYCXIDQRUZHQB-UHFFFAOYSA-N 254.286 2.151 10 20 CECD CO[C@H]1COC[C@@H]1NCc1ccc(N2CCCCC2)cc1 289410989 AGFJBNKHYOHORB-IRXDYDNUSA-N 290.407 2.180 10 20 CECD C[C@H]1C[C@@H](CO)CCN1Cc1cccc(F)c1O 290287121 ZTZCRQWHQPTNIC-QWRGUYRKSA-N 253.317 2.124 10 20 CECD COc1cc(O)c(CN[C@H](C)C(F)(F)F)cc1OC 290117141 IOTCYPUOPKYAPZ-SSDOTTSWSA-N 279.258 2.450 10 20 CECD Nc1ccc(CCN[C@H]2CCC23CCOCC3)cc1 817958721 XPTYYBNODZMNHV-HNNXBMFYSA-N 260.381 2.360 10 20 CECD CC[C@H](N[C@@H]1CCNC1)c1cccc(Cl)c1O 817945340 ZTPKLTVXYOYTIB-SKDRFNHKSA-N 254.761 2.448 10 20 CECD CCOc1cccc(CN[C@@H](C)C(=O)OC(C)C)c1O 825117675 JOTJYMPXBDTEOC-NSHDSACASA-N 281.352 2.221 10 20 CECD CCN(C)c1ccc(Cn2cc(CNC(C)C)nn2)cc1 905801447 FIVRIJPHRHBVRS-UHFFFAOYSA-N 287.411 2.281 10 20 CECD C[C@@H](NC(=O)c1cn(C)nc1C1CC1)c1ccccc1O 827946957 VVNPZLLUCKOCOS-SNVBAGLBSA-N 285.347 2.494 10 20 CECD C[C@@H](OC(=O)c1cc(O)cs1)C(=O)N1CCCCCC1 731910875 VORMGHLMNHBUDZ-SNVBAGLBSA-N 297.376 2.402 10 20 CECD CCN1C[C@@H](N[C@H](C)c2cc(Cl)ccc2O)CC1=O 834889844 KJARNAGQNIVOOI-KOLCDFICSA-N 282.771 2.317 10 20 CECD CN(CC1CCOCC1)c1ccc(OCC(=O)O)cc1 846279885 PJEKZXSWRZETJO-UHFFFAOYSA-N 279.336 2.013 10 20 CECD Cc1cnc(NC(=O)NCc2ccccc2O)s1 748326051 WVDMPMZCQSFMGG-UHFFFAOYSA-N 263.322 2.479 10 20 CECD C[C@H]1CN(Cc2cccc(Cl)c2O)C[C@H](C)N1 843049383 MOBILTUDXAGZNC-UWVGGRQHSA-N 254.761 2.228 10 20 CECD CS[C@@H](C)CC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 844163328 YZIXQPUVHOVVDC-SMDDNHRTSA-N 295.452 2.010 10 20 CECD CC[C@H]1CN(Cc2cccc(F)c2O)CC[C@@H]1N 843052741 SHKFXQWVRZXZSE-GWCFXTLKSA-N 252.333 2.091 10 20 CECD CNC(=O)CCCN(Cc1ccc(N(C)C)cc1)C1CC1 846775862 DALIYVUETIXNJO-UHFFFAOYSA-N 289.423 2.243 10 20 CECD CN1CCC2(CCCN(C(=O)c3cc(O)cs3)C2)CC1 847099684 ZSDBPXMMVJKAGN-UHFFFAOYSA-N 294.420 2.402 10 20 CECD COc1cccc([C@@H](C)N[C@H](C)C(=O)NC(C)(C)C)c1O 846141264 HEQXJJMHCBHBDA-GHMZBOCLSA-N 294.395 2.355 10 20 CECD N[C@@H]1CN(Cc2cccc(F)c2O)C[C@H]1c1ccccc1 843116575 ZYUJVRRIEQWYAO-GOEBONIOSA-N 286.350 2.458 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C(=O)O)[C@H]2C)cc1 846283366 DRQBKNOSBVVEDA-DOMZBBRYSA-N 276.380 2.438 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H]1[C@@H]1CCCOC1 843929515 VKNMBCOYEVQIPM-YPMHNXCESA-N 291.347 2.129 10 20 CECD CC(C)(CNCc1ccccc1O)[C@@]1(O)CCCOC1 850401036 TWMHBKUNFGKOHM-MRXNPFEDSA-N 279.380 2.050 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H]2CCO[C@@H](C)C2)c1 858340805 OGBUEFGGQIQKHV-WCQYABFASA-N 278.352 2.067 10 20 CECD C[C@H](NCC1(O)CCC1)c1cc(F)cc(F)c1O 756565673 XTJXUEFAIUPBOO-QMMMGPOBSA-N 257.280 2.236 10 20 CECD C[C@@H](NC[C@@H](O)COc1ccccc1)c1ccccc1O 775131820 WKFMYZQGNFPONS-ZIAGYGMSSA-N 287.359 2.483 10 20 CECD C[C@@H](CCC(=O)O)NCc1cc(F)c(N(C)C)cc1F 1118920288 OOEPHXZKVWEPNJ-VIFPVBQESA-N 286.322 2.374 10 20 CECD CC(C)c1nocc1C(=O)NCCc1ccc(N)cc1 876528034 PSEJWLSFLRXRPI-UHFFFAOYSA-N 273.336 2.353 10 20 CECD CC(=O)OC(C)(C)C(=O)NCc1ccc(N(C)C)cc1C 779778788 PTASQFFFJMOTMH-UHFFFAOYSA-N 292.379 2.019 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc(C(C)=O)o2)c1 772405416 KKHUSAMGMXTYNQ-UHFFFAOYSA-N 289.287 2.126 10 20 CECD C[C@@H]1CCc2n[nH]cc2[C@H]1C(=O)N(C)Cc1ccccc1O 878277300 QXSUUOIVUJSTLY-BZNIZROVSA-N 299.374 2.440 10 20 CECD COc1c([N+](=O)[O-])ccc(CNc2ccc(F)nc2)c1O 775058001 QYNFENYAQIZEEY-UHFFFAOYSA-N 293.254 2.455 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCCON 1120255702 LXQVHAAPRGTCTF-WDEREUQCSA-N 250.342 2.119 10 20 CECD COc1cc(N2C[C@H]3C=C[C@H]2C3)c([N+](=O)[O-])cc1OC 882948265 MFWORCUGKSEVDM-UWVGGRQHSA-N 276.292 2.377 10 20 CECD O=C(COC(=O)/C=C/c1ccc(O)c(O)c1)CC1CC1 784285503 AOJDFEDDUQBFTA-GQCTYLIASA-N 276.288 2.023 10 20 CECD CCOc1ccc(CN2CC[C@@H](O)C(C)(C)C2)c(O)c1 783728980 KMVPGXPXNWFCDZ-OAHLLOKOSA-N 279.380 2.384 10 20 CECD C[C@@H]1CN(Cc2ccc(N3CCCCC3)cc2)C[C@@H]1O 897685589 OPIFTRBYZGVTAF-PBHICJAKSA-N 274.408 2.490 10 20 CECD CCOc1ccc(CN2C[C@H](C)O[C@H](COC)C2)c(O)c1 784666888 CASHMWALOQFWDR-WFASDCNBSA-N 295.379 2.027 10 20 CECD CN(CCCF)Cc1ccc(N2CCC(O)CC2)cc1 895896628 XNKFVTDIDHUVIN-UHFFFAOYSA-N 280.387 2.439 10 20 CECD CCn1cnc2c1CCN(Cc1ccccc1O)C2 897336292 CAKCALWECWLVQW-UHFFFAOYSA-N 257.337 2.167 10 20 CECD Oc1cc2c(cc1CN1CCC(F)(F)CC1)[C@@H](O)CO2 794686433 QBGUTFUUUCVGSD-LBPRGKRZSA-N 285.290 2.049 10 20 CECD CC(C)CC(=O)N1CCN(Cc2ccccc2O)CC1 1203556931 WVKZMBIDFZXCIB-UHFFFAOYSA-N 276.380 2.083 10 20 CECD CCC(=O)NCCC1=CCN(c2cccc(F)n2)CC1 1089794170 BHBIEHPTTLTKPO-UHFFFAOYSA-N 277.343 2.274 10 20 CECD Nc1ccc(CNC(=O)NCC2CC(F)(F)C2)cc1 1336100030 LZMULKZEQULCKL-UHFFFAOYSA-N 269.295 2.113 10 20 CECD CCOC[C@H]1CCCN(C(=O)NCc2ccc(N)cc2)C1 1335737259 NRQXWOOKLUNFLG-AWEZNQCLSA-N 291.395 2.227 10 20 CECD Cc1noc(Cl)c1CCC(=O)NCc1ccc(N)cc1 1343568001 VMYXWQZGRVSWSA-UHFFFAOYSA-N 293.754 2.468 10 20 CECD Nc1ccc(CCNC(=O)NC[C@H]2C[C@H]3C=C[C@H]2C3)cc1 1357463979 QHRFWINUEUAMSG-SOUVJXGZSA-N 285.391 2.323 10 20 CECD CC[C@@H](F)C(=O)NC[C@@H](C)NCc1ccc(OC)c(C)c1 1752892002 UPLQBNKNJQCIGP-TZMCWYRMSA-N 296.386 2.346 10 20 CECD COc1c(NC(=O)c2cc(O)cs2)cccc1C(=O)O 1599341524 CHFBAJHUXMAYDV-UHFFFAOYSA-N 293.300 2.413 10 20 CECD CCN(C)c1ccc(CNC[C@@H](CC(=O)O)OC)c(C)c1 1776856891 UPDICWZYACBDMB-OAHLLOKOSA-N 294.395 2.030 10 20 CECD COc1ccc(N2CCC(NC[C@H]3CCCO3)CC2)cc1 153098430 WEQXMFIHPCPXJM-QGZVFWFLSA-N 290.407 2.433 10 20 CECD CO[C@@H]1CCC[C@H]1NC(=O)N(C)Cc1ccccc1O 156446147 LDINIKKNCMSVEZ-TZMCWYRMSA-N 278.352 2.101 10 20 CECD COc1cc(O)c(CN2CCOC(C)(C)C2)cc1OC 159807061 BIUHNYBXZOQQFG-UHFFFAOYSA-N 281.352 2.020 10 20 CECD COc1ccc(CN[C@H]2CCN3CCC[C@@H]3C2)c(O)c1 112017209 KPODXWJHSJXVKY-UONOGXRCSA-N 276.380 2.117 10 20 CECD CCOC[C@@H]1CCCN(C(=O)Cc2ccc(N)cc2)C1 158535142 XYLBYONDVKIMJF-CQSZACIVSA-N 276.380 2.086 10 20 CECD CCOc1cccc(CN[C@H](C)Cn2ccnc2)c1O 37157869 XFHGQOMYLOJQBN-GFCCVEGCSA-N 275.352 2.166 10 20 CECD COC1CCC(NCc2cc3c(cc2O)OCO3)CC1 703786481 FIFAOUDWTUREBB-UHFFFAOYSA-N 279.336 2.168 10 20 CECD C[C@H]1c2cccn2CCN1Cc1cc2c(cc1O)OCO2 179568541 LODDRWCGEMCUIR-NSHDSACASA-N 286.331 2.499 10 20 CECD CN(C)c1ccc(CNCCCOC[C@H]2CCCO2)cc1 20146502 RUHQBSXNWZYZGW-QGZVFWFLSA-N 292.423 2.428 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCc1cccnc1 115641605 BDVRMJMUPOFAPT-UHFFFAOYSA-N 298.390 2.455 10 20 CECD CCO[C@H]1C[C@](CO)(NCc2cc(F)ccc2O)C1(C)C 188906166 YNZBOCBONNPOPV-GOEBONIOSA-N 297.370 2.187 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)c2nnnn2C2CC2)c(O)c1 189114216 VBIDRMAAWCUABO-WDEREUQCSA-N 287.367 2.434 10 20 CECD CC1(C)[C@H](O)C[C@H]1NCc1cccc(Cl)c1O 128179610 LAPNKKFRBOQTLP-GHMZBOCLSA-N 255.745 2.295 10 20 CECD C[C@](O)(CNCc1cccc(Cl)c1O)C1CC1 383759931 DOCGYTSIWLQICN-ZDUSSCGKSA-N 255.745 2.296 10 20 CECD O=C(NCc1ccc(N2CCSCC2)cc1)C(F)F 194296737 JCHSWXPOWDAPEC-UHFFFAOYSA-N 286.347 2.121 10 20 CECD C[C@H](NC[C@H](C)CCO)c1ccc(N(C)C)cc1 97436155 NZZXUXNTTYJURT-OLZOCXBDSA-N 250.386 2.422 10 20 CECD Cc1c(CNC(=O)c2cnn(C)c2C)n(C)c2ccccc12 348633770 KPISPKNJGTUGQE-UHFFFAOYSA-N 296.374 2.459 10 20 CECD CO[C@@H]1CCCC[C@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 272721479 ZNRQJLQVFQMVLR-DERGHVRDSA-N 291.347 2.185 10 20 CECD C[C@@H](NCC1(C(N)=O)CCCC1)c1ccc(F)c(F)c1O 276877347 FPTRWMOEZXSFAK-SECBINFHSA-N 298.333 2.367 10 20 CECD CCN(C[C@@H](O)CSC)c1ccc(OC)c(OC)c1 275478067 WVJQIHGGPHJWEX-GFCCVEGCSA-N 285.409 2.254 10 20 CECD COCCN1CCC(N[C@@H]2CCc3cccc(O)c32)CC1 296224419 ZYDBFXKJJGOWGL-OAHLLOKOSA-N 290.407 2.080 10 20 CECD CCN(C)c1ccc([C@@H](C)NC[C@H]2CC[C@@H](CO)O2)cc1 294528018 ZTEHUIMCCSXQJQ-XYPHTWIQSA-N 292.423 2.333 10 20 CECD CC[C@@H](N[C@@H](C)c1cc(C(=O)OC)ccc1O)C(C)(C)O 294982596 KSTKVORORXLEND-IINYFYTJSA-N 295.379 2.379 10 20 CECD CO[C@@](C)(CNCc1cc([N+](=O)[O-])ccc1O)C1CC1 291073542 SIUKQYGBFYNDJZ-AWEZNQCLSA-N 280.324 2.205 10 20 CECD CC[C@H](NCCC(=O)O)c1ccc(N(C)C)cc1 818143581 CQUIZGOJJQPBRH-ZDUSSCGKSA-N 250.342 2.268 10 20 CECD CCn1cc(NC(=S)N(C)Cc2ccccc2O)cn1 726125816 GUNWCGRVNZOOBZ-UHFFFAOYSA-N 290.392 2.437 10 20 CECD Cc1ncc(CN2CCOc3cc(N(C)C)ccc32)n1C 825525318 BBLQYMMYOGZPNJ-UHFFFAOYSA-N 286.379 2.194 10 20 CECD COC(=O)c1cnc(SCCC[C@@H](C)O)s1 829677498 AGDYPOYHOUESDP-SSDOTTSWSA-N 261.368 2.183 10 20 CECD CN(Cc1ccco1)C(=O)/C=C\c1ccc(O)c(O)c1 588403779 OWANCFWJKMNFRJ-ALCCZGGFSA-N 273.288 2.363 10 20 CECD CSCC[C@@H](C)NC(=O)c1c(F)ccc(O)c1O 825944624 BVPDBKBBHFSDIJ-SSDOTTSWSA-N 273.329 2.108 10 20 CECD COc1cccc([C@H](C)N[C@H]2COC[C@@H]2C)c1O 903393586 PQQDTCRKZLSGNI-NHCYSSNCSA-N 251.326 2.086 10 20 CECD Oc1cccc(Cl)c1CN1CC(OC(F)F)C1 839146088 ZVFQWTJVPNQNLU-UHFFFAOYSA-N 263.671 2.469 10 20 CECD CC1(C)C[C@H]1CNCc1cc([N+](=O)[O-])ccc1O 732819802 AKOYONHQBZWDNZ-JTQLQIEISA-N 250.298 2.436 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCCOCC2)c1 903226517 GNSODLIPIUNGGA-CQSZACIVSA-N 278.396 2.074 10 20 CECD O=C(NCCc1nc2c(s1)CCC2)c1cc(O)cs1 831086101 ZOHWOXHQDVKXTE-UHFFFAOYSA-N 294.401 2.371 10 20 CECD CCOc1ccc(O)c(CN2CC(OCC(F)F)C2)c1 839138897 WRDFQUFZQZGODK-UHFFFAOYSA-N 287.306 2.257 10 20 CECD C[C@@H](NC(=O)NCc1ccncn1)c1ccc(N(C)C)cc1 838558535 GNBUUQICDCKYRB-GFCCVEGCSA-N 299.378 2.103 10 20 CECD CC1(CN(Cc2ccccc2O)C[C@H]2CCCO2)COC1 744402322 MUZHMUZGWUDHFH-OAHLLOKOSA-N 291.391 2.410 10 20 CECD C[C@H](N[C@H]1CO[C@H](C)C1)c1ccc(N2CCOCC2)cc1 842674454 PIYADFCZDMCMRO-IJEWVQPXSA-N 290.407 2.351 10 20 CECD CSCC1(CC(=O)NCc2ccc(O)cc2O)CC1 910944080 QYXYIDJGHVVEKM-UHFFFAOYSA-N 281.377 2.247 10 20 CECD C[C@H](N)[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)C1 843058674 VSJXVTDCYSQTPM-WCQYABFASA-N 265.376 2.061 10 20 CECD Cn1ncc2c1CCCN(Cc1ccccc1O)C2 840954015 BKUISIFBIMRVIK-UHFFFAOYSA-N 257.337 2.074 10 20 CECD CC(C)O[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 846661017 ZYEULCKMQBPWNC-LLVKDONJSA-N 269.366 2.483 10 20 CECD N[C@H]1CCO[C@H](C2CCN(Cc3ccccc3O)CC2)C1 841103871 LMWPGFOOTLPAJI-RDJZCZTQSA-N 290.407 2.111 10 20 CECD CN(C)c1ccc(CN2CCC(CN)CC2)cc1F 843047674 VAUVDPCDSANAFE-UHFFFAOYSA-N 265.376 2.062 10 20 CECD C[C@]1(CN)CCN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C1 843117267 OARRMJAGJLOHDH-CYBMUJFWSA-N 299.758 2.125 10 20 CECD COc1cccc(O)c1CNC[C@@H](N)c1ccccc1 841034323 CKBJMSVZMKVFFG-CQSZACIVSA-N 272.348 2.190 10 20 CECD C[C@H](CNC(=O)NCCc1ccc(N)cc1)C1CC1 841737255 RTHATWMXDXSRLZ-LLVKDONJSA-N 261.369 2.157 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](C)[C@H](CO)C2)c1O 856792236 LOTUOEOQUJTUAY-GWCFXTLKSA-N 295.354 2.184 10 20 CECD CO[C@@]1(CNCc2cc(Cl)cc(F)c2O)CCOC1 764680842 BYPTYAYRVAAJMB-CYBMUJFWSA-N 289.734 2.080 10 20 CECD CCCN(C(=O)/C=C/c1cn(C)cn1)c1cccnc1 934247864 QDFNGZIKRMIMKH-VOTSOKGWSA-N 270.336 2.272 10 20 CECD Cc1ccc(CN2CCOC[C@@H]2[C@@H]2CCCO2)c(O)c1 877516147 BPNDSLXQLVCEHR-ZBFHGGJFSA-N 277.364 2.080 10 20 CECD COc1cccnc1CNCc1c(C)cccc1O 877574145 BJBWUYHNXBFAPH-UHFFFAOYSA-N 258.321 2.394 10 20 CECD C[C@@H]1CCCN(C(=O)CN[C@H](C)c2ccccc2O)C1 879648103 YMUBGQLQYIXVEP-CHWSQXEVSA-N 276.380 2.301 10 20 CECD C[C@H](O)CCN(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 776250284 UBDUUFYPHTWCOJ-QWHCGFSZSA-N 293.411 2.226 10 20 CECD C[C@@H](NCCCC(=O)N(C)C)c1c(O)cccc1F 886515505 JPOHTSQMMZKFMF-SNVBAGLBSA-N 268.332 2.050 10 20 CECD O=C(N[C@H](CO)c1cccc(F)c1)c1cc(O)cs1 778510727 MMMWENWZEQLBBT-LLVKDONJSA-N 281.308 2.056 10 20 CECD Cc1ccc(C(=O)NCCC(F)(F)F)c(O)c1O 780952003 IDIAGJPRRWIQFH-UHFFFAOYSA-N 263.215 2.088 10 20 CECD O=C(C=C1CCCC1)OCC(=O)c1ccc(O)c(O)c1 783097751 LVSOOTAZRKPMBA-UHFFFAOYSA-N 276.288 2.324 10 20 CECD Cc1nc([C@H](C)NCc2ccc(N(C)C)c(F)c2)n[nH]1 894772497 LWKRKWHWUFMHFP-VIFPVBQESA-N 277.347 2.169 10 20 CECD C[C@H](N[C@@H](C)c1ncnn1C)c1ccc(N(C)C)cc1 276592869 JKYVVSXEUHZQDE-RYUDHWBXSA-N 273.384 2.293 10 20 CECD CC(C)[C@H]1CN(Cc2cc(Cl)ccc2O)CCN1 83511802 GJOQVSBSMMDVFY-CYBMUJFWSA-N 268.788 2.475 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCC[C@@H]1CCOC1 1324664777 ALWXELQHZXSDGE-KMOQFTEPSA-N 278.304 2.081 10 20 CECD CCOC(=O)[C@H](NCc1ccc(N(C)C)cc1)C1CC1 1321803952 NXLZTNZCTJHUOQ-OAHLLOKOSA-N 276.380 2.184 10 20 CECD CO[C@H]1CCN(C(=O)c2cc(O)cs2)CC1(C)C 1328310775 ZGTGXIZRUTXDLV-NSHDSACASA-N 269.366 2.341 10 20 CECD C[C@@H](N)[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 70171806 KMYLCFWXEKEZOZ-UKRRQHHQSA-N 261.413 2.312 10 20 CECD C/C=C/C[C@H](CO)NCc1cc(F)c(N(C)C)cc1F 1261787927 FZIJIQUSLNMKRL-ZYOFXKKJSA-N 284.350 2.448 10 20 CECD CC(C)[C@H](C)CC(=O)NCc1ccc(O)c(O)c1 158993193 XYQLAEVRNDZQQN-SNVBAGLBSA-N 251.326 2.396 10 20 CECD COC(=O)[C@@]1(F)CCN(Cc2cc(C)cc(C)c2O)C1 164440053 VJWBILPMTKJVOG-OAHLLOKOSA-N 281.327 2.096 10 20 CECD COCCCN[C@@H](C)c1ccc(N2CCOCC2)cc1 151634032 FKQNNPSNQDXZEJ-AWEZNQCLSA-N 278.396 2.210 10 20 CECD COc1cc(Cl)cc(CN2CC[C@](C)(C(=O)O)C2)c1O 229118752 YHTDLCULFKPHJL-AWEZNQCLSA-N 299.754 2.351 10 20 CECD Cc1ccc(O)c(CN2C[C@H]3[C@@H](N)CCC[C@H]3C2)c1 130590356 SPCVDHPUDCHZKK-CFVMTHIKSA-N 260.381 2.260 10 20 CECD Cc1ccc(S(=O)(=O)NCc2ccccc2O)cc1 158572813 DKCKYZNJVCMGQE-UHFFFAOYSA-N 277.345 2.179 10 20 CECD COc1ccc(CNCCN2CC=CCC2)cc1C 279934169 YIANROIYJPLLHZ-UHFFFAOYSA-N 260.381 2.355 10 20 CECD C[C@H](NCCC1(O)CCC1)c1ccc(F)cc1O 284222629 CXCZMZJKPUERKV-JTQLQIEISA-N 253.317 2.487 10 20 CECD CCOC(=O)[C@H](C)N[C@@H](C)c1cc(OC)ccc1O 49368147 WDZZJJUFHLWWDS-UWVGGRQHSA-N 267.325 2.003 10 20 CECD C[C@H](N)[C@H]1CCCCN1Cc1ccc(N(C)C)cc1 63191472 SRSSVXUOTVFAAC-XJKSGUPXSA-N 261.413 2.454 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)[C@H](C)CO1 708423568 STFRECNRUKHWBE-RKDXNWHRSA-N 257.280 2.280 10 20 CECD CCN(Cc1cnn(C)c1)Cc1cccc(C)c1O 179838830 XUUYWEBDZOBQBU-UHFFFAOYSA-N 259.353 2.456 10 20 CECD Cc1[nH]ccc1C(=O)NCc1ccc(N(C)C)cc1 175048608 OEKXYXFKLXOEFI-UHFFFAOYSA-N 257.337 2.319 10 20 CECD O=C(CCC1CCC1)NCCc1ccc(O)c(O)c1 122657760 FPVDDAQGEHHKTE-UHFFFAOYSA-N 263.337 2.337 10 20 CECD CN(Cc1cc(Cl)ccc1O)[C@@H]1CCCCNC1=O 123894039 IQNHRNGXEUZUEM-GFCCVEGCSA-N 282.771 2.146 10 20 CECD CCCCOC(=O)CN[C@H](C)c1cc(OC)ccc1O 182431138 GMVTXBFARFMHCJ-LLVKDONJSA-N 281.352 2.395 10 20 CECD C[C@@H](CN(C)C(=O)c1cccc(O)c1O)c1nccs1 193161868 TZWLWPAOSYDKAD-VIFPVBQESA-N 292.360 2.430 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cncnc2)cc1 273670485 XOEKOAMJFGWVIT-UHFFFAOYSA-N 284.363 2.253 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCC1CC1 274885704 BTGCHYRRSREDRQ-SNVBAGLBSA-N 263.337 2.335 10 20 CECD CN1CC[C@@H]2CCN(Cc3cc(F)ccc3O)[C@H]2C1 272611758 KMDFKDDCTRXLOP-RISCZKNCSA-N 264.344 2.057 10 20 CECD CCCN1CC(=O)N(Cc2ccc(N(C)C)c(F)c2)C1=O 278095743 YVUFXNFMYXFDPD-UHFFFAOYSA-N 293.342 2.066 10 20 CECD CC[C@@H](NCc1nncn1CC)c1ccc(F)cc1O 285687695 OFXAXUHBDQFBEB-GFCCVEGCSA-N 278.331 2.384 10 20 CECD NC(=O)c1cccc(CCN[C@@H]2CCc3cccc(O)c32)c1 296847786 NBZQOARVIHZRSP-OAHLLOKOSA-N 296.370 2.311 10 20 CECD CCOCC(=O)N(Cc1ccc(N(C)C)cc1)C1CC1 298362571 LHJXGNJJUWDGII-UHFFFAOYSA-N 276.380 2.280 10 20 CECD CCc1nnc(CSc2ncc(C(=O)OC)s2)o1 295306257 MSZBATVDYDRYTR-UHFFFAOYSA-N 285.350 2.167 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)N[C@H]1CCOC1 802261608 SZDFGWONTWTTRK-AWEZNQCLSA-N 292.379 2.493 10 20 CECD O=C(NCc1ccccc1O)Nc1cc2ccccn2n1 806645688 DRYWLSLIGGEIAI-UHFFFAOYSA-N 282.303 2.362 10 20 CECD C[C@@H]1C[C@@H](CO)CN(Cc2cc(Cl)ccc2O)C1 817412872 PYLOVZPLEBUADB-GHMZBOCLSA-N 269.772 2.496 10 20 CECD Oc1cc(F)c(Cl)cc1CN[C@@H]1CCn2ccnc2C1 816574573 MNSNAXSLJYOWAU-SNVBAGLBSA-N 295.745 2.486 10 20 CECD Cc1cccc(CN[C@@H](C2CC2)[C@@]2(CO)CCCO2)c1O 816667177 FQOONMXMEVGLQZ-IRXDYDNUSA-N 291.391 2.110 10 20 CECD C[C@@H]1C[C@@H](N[C@H](CN)C2CC2)c2c(O)ccc(F)c21 817961314 XCSPGXHTZJNTHN-GGZOMVNGSA-N 264.344 2.407 10 20 CECD Cc1nnc([C@H](C)OC(=O)c2ccc(C)c(O)c2O)o1 727004864 XIKMALHBXSKFTP-ZETCQYMHSA-N 278.264 2.016 10 20 CECD COc1cccc(CNCc2c(C)nn(C)c2Cl)c1O 733900907 PHOFVEDKXSYXTL-UHFFFAOYSA-N 295.770 2.386 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccncn1 839922255 SOUVSTRRDBQSLK-ZDUSSCGKSA-N 298.390 2.212 10 20 CECD Nc1ccc(CCNC(=O)[C@@H]2CCCc3cccnc32)cc1 832659239 WAVIZXREIICVJX-MRXNPFEDSA-N 295.386 2.443 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NC(CF)CF)c1 836529869 NPOSDYWYXZJNGQ-QMMMGPOBSA-N 288.294 2.069 10 20 CECD Cc1cnc(CCN[C@@H](C)c2ccccc2O)cn1 834908123 HAASDHJDDIFJNS-LBPRGKRZSA-N 257.337 2.384 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)N1CC(F)C1 840482274 VNAKZOSJLVPKFL-GFCCVEGCSA-N 293.386 2.355 10 20 CECD CCn1nc(C)c(CNC(=O)Nc2ccc(N)cc2)c1C 841301562 UNYNJZCZASQXPX-UHFFFAOYSA-N 287.367 2.424 10 20 CECD CCOc1cccc(CNCC2(C)CCNCC2)c1O 841056336 FHSHPBKMVLJNLL-UHFFFAOYSA-N 278.396 2.270 10 20 CECD Nc1ccc(Cc2noc(CC[C@@H]3CCOC3)n2)cc1 843159304 ORSUEBIFJMHJEE-GFCCVEGCSA-N 273.336 2.212 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C)[C@@H]1CO 840938479 GJRBAUYTKMJQGW-LRDDRELGSA-N 262.397 2.264 10 20 CECD CC(=O)c1ccc(CC(=O)NCc2ccccc2O)cc1 748344823 CRJYKKHXBLVKHI-UHFFFAOYSA-N 283.327 2.454 10 20 CECD C[C@@H]1CCCC[C@H]1CNC(=O)C(=O)Nc1ccc(N)cc1 841021270 SXHFYGRTKSTBBE-NEPJUHHUSA-N 289.379 2.150 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@@H]2NCC[C@H]2C1 843127532 SIYWXYIARAGREP-GWCFXTLKSA-N 266.772 2.229 10 20 CECD C[C@H](NC(=O)NCc1cc(Cl)ccc1O)[C@H]1CCOC1 845009270 CYFNZKVTXSJMPV-UWVGGRQHSA-N 298.770 2.270 10 20 CECD CCc1cccc(CNCCc2cccc(C(N)=O)c2)c1O 848891617 VQTGADZCAFCLDN-UHFFFAOYSA-N 298.386 2.386 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)COC(F)(F)F 929527618 SXVAMKOIJAOMJA-UHFFFAOYSA-N 290.285 2.247 10 20 CECD COc1cc(Cl)cc(CNCC[C@@H](C)N(C)C)c1O 697925925 FXDSCIPOVUDLJT-SNVBAGLBSA-N 286.803 2.484 10 20 CECD COc1cc(CN2CCCO[C@@H](C)C2)c(O)cc1C 768446403 NRJRKKRNLCNMIJ-LBPRGKRZSA-N 265.353 2.320 10 20 CECD COC[C@@H]1CCN(Cc2cc(OC)c(C)cc2O)C1 768444799 CUPWDHUKEUNGAJ-GFCCVEGCSA-N 265.353 2.178 10 20 CECD Cc1ccc(CN2C[C@H](C)S(=O)[C@@H](C)C2)c(O)c1 877473622 NWHFMBHXZOGYPS-RYUDHWBXSA-N 267.394 2.042 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCCC(C)(C)O 773689267 QSLQCAQDNYWEFE-UHFFFAOYSA-N 293.411 2.021 10 20 CECD CN(Cc1ccc(N2CCCC2)cc1)C[C@H](O)C1CC1 1117637661 HDRVWHGMYSQUCP-KRWDZBQOSA-N 274.408 2.490 10 20 CECD C[C@@H](NC(=O)[C@H]1CCCO1)c1ccc(N(C)C)cc1 772994935 AAVURCBFSBLNTC-BXUZGUMPSA-N 262.353 2.109 10 20 CECD Cc1cc(Br)cc(CNC[C@H]2CCN2C)c1O 896595655 WPODQGNWOFPAPS-GFCCVEGCSA-N 299.212 2.257 10 20 CECD C/C=C\C[C@H](CO)NCc1cc(C)cc(OC)c1O 894480159 MIPYCZHIGGVOQA-DSYXLKISSA-N 265.353 2.126 10 20 CECD Oc1ccc(Cl)c(F)c1CNCC[C@H](O)C1CC1 898204086 NUEJMNUPSQKMNW-NSHDSACASA-N 273.735 2.435 10 20 CECD COc1cc(C)cc(CN[C@H]2CCO[C@@H](C)C2)c1O 894359415 ODYRMWLOQDKZJW-AAEUAGOBSA-N 265.353 2.366 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCOC[C@@H]2C)c1O 37323451 NDJVUPUHLWPHPR-VIFPVBQESA-N 283.755 2.469 10 20 CECD C[C@@H](N[C@H](C)c1ncnn1C)c1ccc(F)cc1O 276642055 OWOAHINPMHRDGC-RKDXNWHRSA-N 264.304 2.072 10 20 CECD CN1CCN(c2ccc(CN[C@@H]3C=CCC3)cc2F)CC1 1327253679 GWCUWSVHBWKJEO-OAHLLOKOSA-N 289.398 2.386 10 20 CECD COc1cc(C)cc(CN2CCc3ncncc3C2)c1O 1331538261 YEOIQCXGFKLKJA-UHFFFAOYSA-N 285.347 2.058 10 20 CECD CN(C)c1cc(F)c(CN[C@@H]2C=C[C@H](C(=O)O)C2)cc1F 1330275632 VPMPELAUOYLTFD-GXSJLCMTSA-N 296.317 2.150 10 20 CECD Cc1c[nH]cc([N+](=O)[O-])c1=NCc1ccc(N(C)C)cc1 1338681048 IVNWAKQPWLMVRI-UHFFFAOYSA-N 286.335 2.398 10 20 CECD CO[C@H]1CC[C@@H](NC(=O)NCc2cc(C)ccc2O)C1 1332649063 ATQYWIGHLRGLDK-OLZOCXBDSA-N 278.352 2.067 10 20 CECD CCOc1cccc(CN(CC(=O)O)CC2CC2)c1O 86734890 CEJJQUXHBGYXOQ-UHFFFAOYSA-N 279.336 2.088 10 20 CECD C[C@H](Cc1cnn(C)c1)NCc1ccc(N(C)C)cc1 768400980 IONISHODGFYKCB-CYBMUJFWSA-N 272.396 2.207 10 20 CECD COCC1CCN(Cc2ccc(OC)c(OC)c2O)CC1 1334138671 FAXSGVVMCDFQKT-UHFFFAOYSA-N 295.379 2.268 10 20 CECD CSCC(C)(C)NC(=O)NCc1ccc(N)cc1 1353531529 IDYNATKIKRARJF-UHFFFAOYSA-N 267.398 2.210 10 20 CECD O=C(O)c1cncc(NCc2ccc3cccnc3c2O)n1 1602540152 MMEDGWWOPVWGNT-UHFFFAOYSA-N 296.286 2.041 10 20 CECD CC[C@@H](CC(=O)O)NCc1cc(F)c(N(C)C)cc1F 1776952261 BGBODIMYGORBPH-JTQLQIEISA-N 286.322 2.374 10 20 CECD CCN(C)c1ccc(CN[C@@H](C(=O)O)C2CC2)c(C)c1 1776856075 IONCPQNEDQDFJK-OAHLLOKOSA-N 276.380 2.404 10 20 CECD C[C@H](Cn1cccn1)NCc1ccc2c(c1)CCCO2 921524616 HEVDLWYQDXIXCN-CYBMUJFWSA-N 271.364 2.386 10 20 CECD Cc1ccc(CN2CCCN3CCC[C@@H]3C2)c(O)c1 1119295172 DWIGSWFOXGZBPR-OAHLLOKOSA-N 260.381 2.371 10 20 CECD CCCN1CCC(NC(=O)Nc2ccc(N)cc2)CC1 49560544 OLAAKLRMWUQJTF-UHFFFAOYSA-N 276.384 2.265 10 20 CECD CC(C)N(C)C[C@@H](C)NC(=O)Nc1ccc(N)cc1 311444522 QIXMXZALJRGYAK-LLVKDONJSA-N 264.373 2.119 10 20 CECD CC(C)N(C)C(=O)[C@H](C)N(C)Cc1ccccc1O 177676281 RHZVYSYXWARPKK-LBPRGKRZSA-N 264.369 2.079 10 20 CECD CC[C@@H](C)[C@](C)(O)CNCc1cc(OC)ccc1O 305756998 APSCCYZAHNFYCM-IAQYHMDHSA-N 267.369 2.288 10 20 CECD CCC[C@]1(C)C(=O)NCCN1Cc1cc(C)c(C)cc1O 189034212 WWFQDCSKZYFHDD-QGZVFWFLSA-N 290.407 2.500 10 20 CECD C[C@@H](NCC(C)(C)C(N)=O)c1cc(Cl)ccc1O 186220162 OAZPOXWLKGUMDC-MRVPVSSYSA-N 270.760 2.208 10 20 CECD C[C@H]1CCCCN1C(=O)CN(C)Cc1ccccc1O 174854036 KLJMFVKLFPRRSM-ZDUSSCGKSA-N 276.380 2.225 10 20 CECD C[C@H](CCc1cccn1C)NC(=O)c1cccc(O)c1O 187138703 FAYSRYQJTHMXKK-LLVKDONJSA-N 288.347 2.187 10 20 CECD CCCN(CC(=O)OC)Cc1cc(C)c(C)cc1O 194244541 KXDKRCQOTQYVJN-UHFFFAOYSA-N 265.353 2.394 10 20 CECD COCCOC1CCN(Cc2cccc(C)c2O)CC1 180201038 YVQNTWSFILCUKC-UHFFFAOYSA-N 279.380 2.328 10 20 CECD CC(C)[C@H](CCO)NCc1ccc(N2CCOCC2)cc1 230688145 BMZSXGINGPUOIF-KRWDZBQOSA-N 292.423 2.020 10 20 CECD CN(Cc1ccccc1O)C[C@H](O)COc1ccccc1 264695636 IHRSGELUUGZSKG-HNNXBMFYSA-N 287.359 2.264 10 20 CECD Cc1cccc(CN2CCC3(CC2)CCN(C)C3=O)c1O 369799177 KUVDWEKZVANOAC-UHFFFAOYSA-N 288.391 2.145 10 20 CECD Cc1cc(O)c(CN2CCC[C@H](S(C)(=O)=O)C2)cc1C 273904382 GDXPODJEXLYXCQ-AWEZNQCLSA-N 297.420 2.018 10 20 CECD Cc1cccc(CN2CCOC[C@H]2[C@H]2CCCO2)c1O 377706858 ZHRJAIVLNYIQDY-LSDHHAIUSA-N 277.364 2.080 10 20 CECD CC(=O)N1CCC[C@H](CN[C@H](C)c2cc(F)ccc2O)C1 280939603 IRVILVLIDOQSGH-DGCLKSJQSA-N 294.370 2.440 10 20 CECD C[C@H](CCCCO)NC(=O)NCc1ccc(N(C)C)cc1 296129983 BZZLEGPNZPKIHI-CYBMUJFWSA-N 293.411 2.103 10 20 CECD O=C(Nc1cc2ccccn2n1)c1cc(O)cs1 807701769 KYAOYCRZKJXUJM-UHFFFAOYSA-N 259.290 2.354 10 20 CECD CCOc1ccc(CNCc2nnc(CC)s2)c(O)c1 810176705 RTXNNFCLWBQAOX-UHFFFAOYSA-N 293.392 2.495 10 20 CECD C[C@@H]1C[C@H](N[C@H](C)c2cc(F)cc(F)c2O)CCN1 817972655 ZHJVJGDTMADSBO-FXPVBKGRSA-N 270.323 2.462 10 20 CECD CN(C)c1ccc(/C=C\CNC(C)(C)C(=O)O)cc1 901488357 IQPGEEDGSMBRLJ-WAYWQWQTSA-N 262.353 2.219 10 20 CECD CC[C@@H](N[C@@H](C)CC(=O)NC)c1ccc(F)cc1O 834901413 UTKCCROPHCWPSK-JOYOIKCWSA-N 268.332 2.097 10 20 CECD C[C@H]1CCC[C@H](OCC(=O)NCc2ccc(N)cc2)C1 837303371 JSWZRAWFIWJNEY-WFASDCNBSA-N 276.380 2.480 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)c2ccsc2)cc1 832293264 SPLPJUKTZGXXAY-CQSZACIVSA-N 289.404 2.244 10 20 CECD CN(Cc1ccccc1O)C(=O)NCCC[C@H]1CCOC1 838714950 CVGYDMKUWWSWEC-ZDUSSCGKSA-N 292.379 2.350 10 20 CECD CCCCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832284024 GHWOQQWYFZNFDM-CQSZACIVSA-N 263.385 2.059 10 20 CECD C[C@H]1[C@@H](C)NCCN1Cc1cccc(Cl)c1O 843058255 QKGHBANQQHJBJI-ZJUUUORDSA-N 254.761 2.228 10 20 CECD CCOc1ncccc1C(=O)NCc1ccccc1O 748354220 WUXWCYSCPYUYRX-UHFFFAOYSA-N 272.304 2.116 10 20 CECD CCNC(=O)[C@@H](NCc1ccc(N(C)C)cc1C)C(C)C 840948190 BEOAPZVOOPUZCG-INIZCTEOSA-N 291.439 2.311 10 20 CECD COc1ccc2c(c1)CCCN2C[C@]1(C)CCNC1 843070679 WTOIPQCKTQBLIC-MRXNPFEDSA-N 260.381 2.447 10 20 CECD CCn1ccc(CNCc2ccc(N(C)C)c(F)c2)n1 840956035 HOLGEXQKOQDZRO-UHFFFAOYSA-N 276.359 2.398 10 20 CECD CCOCc1cc(CNC[C@H]2CCCN2)ccc1OC 841035135 HTLJFEYZCAXGES-OAHLLOKOSA-N 278.396 2.073 10 20 CECD CC(C)(C)c1cc(C(=O)NCc2ccc(O)cc2O)[nH]n1 910951639 JXGQDGWFIJGMPL-UHFFFAOYSA-N 289.335 2.048 10 20 CECD CC(C)O[C@@H]1CCN(C(=O)c2cc(O)cs2)C1 844147698 YLUYHXCGWKYMKO-SNVBAGLBSA-N 255.339 2.093 10 20 CECD CC[C@@H](O)CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 850529758 SRANUMIRXQFOQA-NGZCFLSTSA-N 253.317 2.440 10 20 CECD C[C@@H]1C[C@@H](NC[C@H]2C[C@@H](O)C2)c2c(O)ccc(F)c21 858545807 VHCGOZYDJTZSCO-MWGHHZFTSA-N 265.328 2.440 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cccnc1C1CC1 752600219 LVTZHFWWMGYUCS-UHFFFAOYSA-N 284.315 2.300 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H](N(C)C)C2)c1O 754732638 RNMRLJYHZFLJBX-CQSZACIVSA-N 278.396 2.235 10 20 CECD CCOc1ccc(O)c(CN[C@@H](CO)CC(F)(F)F)c1 756994629 UVSJPPWGNHPIEX-SNVBAGLBSA-N 293.285 2.194 10 20 CECD CCOC[C@H]1CN(Cc2ccc(N(C)CC)cc2)CCO1 859771814 LFHAGNLFJIWFEO-QGZVFWFLSA-N 292.423 2.380 10 20 CECD CCOc1ccc(N(C)CC2(CS(C)(=O)=O)CC2)cc1 757657565 VTDSTFUHENAKFV-UHFFFAOYSA-N 297.420 2.346 10 20 CECD C[C@@H](N[C@H](CCO)C1CC1)c1cc([N+](=O)[O-])ccc1O 756740780 UHRQBLJSJVFNQQ-NOZJJQNGSA-N 280.324 2.112 10 20 CECD COc1cccc(O)c1CN(C)[C@H]1CCSC1 768261316 BGDPMJDDWAWHES-JTQLQIEISA-N 253.367 2.338 10 20 CECD Oc1cccc(Br)c1CN1CCC[C@@H](O)C1 862211392 IJSBESMPHANZAY-SECBINFHSA-N 286.169 2.111 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(OC)CCCC1 935949183 UVICYUUSOHFDRH-UHFFFAOYSA-N 298.379 2.453 10 20 CECD O=C1[C@H]2CCCN2C(=O)N1CCCSc1nccs1 761301780 UBNWRLSZSXTWLY-SECBINFHSA-N 297.405 2.052 10 20 CECD CC[C@@H](NCc1cccc(OC)c1O)[C@@H](O)C(F)(F)F 765785706 CRXVBHNQZJMXNA-BXKDBHETSA-N 293.285 2.192 10 20 CECD Cc1cnc(CN2CCOc3cc(N(C)C)ccc32)cn1 774750230 IDGWGXFFEVPSTM-UHFFFAOYSA-N 284.363 2.250 10 20 CECD CC(=O)c1cc(F)cc(CN2CCN(C)[C@H](C)[C@H]2C)c1O 771467639 UPKGXCBAHSKFIT-GHMZBOCLSA-N 294.370 2.258 10 20 CECD CCN(C)c1ccc(CN2CCOC[C@@H]2C[C@H](C)O)cc1 773849921 SPBZIJPKJCWRST-YOEHRIQHSA-N 292.423 2.114 10 20 CECD CN(C(=O)CC[C@@H]1CCCNC1)c1ccc(N)cc1 877074260 DYZSYYMFZBRKQF-LBPRGKRZSA-N 261.369 2.011 10 20 CECD Cc1ccnc(NC(=O)c2c(F)ccc(O)c2O)c1 789957256 MATQFUKUDHVBTJ-UHFFFAOYSA-N 262.240 2.193 10 20 CECD CN(C)CCOc1ccc(N(C)CC[C@@H]2CCOC2)cc1 783667714 JJMZDTOVHDVHOI-OAHLLOKOSA-N 292.423 2.490 10 20 CECD Cc1cccc(O)c1CN1CCC2(CC1)C[C@H](O)CCO2 897257971 FNBYNVVDGUPYAW-CQSZACIVSA-N 291.391 2.207 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)S(=O)[C@H](C)C2)c1O 894553143 YDVIFUFTPPUAHT-VXGBXAGGSA-N 297.420 2.051 10 20 CECD CC(C)c1cc(NC(=O)c2c(F)ccc(O)c2O)n[nH]1 790068838 DVWRXLZGPNTESE-UHFFFAOYSA-N 279.271 2.336 10 20 CECD C[C@@](CO)(NCc1c(O)ccc(Cl)c1F)C1CC1 790974291 RAUARFNRCOJGIX-ZDUSSCGKSA-N 273.735 2.435 10 20 CECD CC(=O)N1CCC[C@@H](CNCc2cc(Cl)ccc2O)C1 793287293 XXDOOUPPVQGSHD-LBPRGKRZSA-N 296.798 2.394 10 20 CECD CCN(CC)c1ccc(CN[C@H](C)C[S@@](C)=O)cc1 168215994 GLUYKHMCAPUWFL-YJYMSZOUSA-N 282.453 2.389 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C[C@@H](N)C(C)(C)C 1263101384 QOUIWMKNLYFTBN-OAHLLOKOSA-N 291.439 2.441 10 20 CECD Nc1ccc(CN2C[C@@H](N)[C@H](c3ccccc3F)C2)cc1 1356083562 SOBUOEWOGWZOFK-DOTOQJQBSA-N 285.366 2.335 10 20 CECD CC[C@@H](C)[C@@H](C(=O)O)N(C)Cc1ccccc1O 1604921932 CXNDKCQOKOTKJJ-MFKMUULPSA-N 251.326 2.323 10 20 CECD COc1cccc(CNC[C@H](CC(C)C)N(C)C)c1O 20201395 BCQJSYLFBGMZAC-AWEZNQCLSA-N 280.412 2.467 10 20 CECD Nc1ccc(NC(=O)COCCc2ccccc2)cc1 20507951 GTFJMMASMOKLCY-UHFFFAOYSA-N 270.332 2.467 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@H](C)c1ccc(N(C)C)cc1 228929764 ILNVPJBTZVLAEC-CHWSQXEVSA-N 277.412 2.316 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2COC(C)(C)O2)c1 230206461 RBGIZOVBYZLWAR-PWSUYJOCSA-N 281.352 2.203 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(CC)C1)c1ccccc1O 391464457 BMYHGXNTUHXPSM-WCQYABFASA-N 262.353 2.054 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc(C)nn1C 109621529 GOXGKEOOEQBNAO-UHFFFAOYSA-N 287.363 2.487 10 20 CECD Oc1ccc(Cl)cc1CNC[C@H]1CC[C@H](O)C1 188831453 KYQGWEAAYZBLKK-CABZTGNLSA-N 255.745 2.296 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCCOCCO)cc1 180244764 YTYDAYJWGWZEBY-CQSZACIVSA-N 280.412 2.192 10 20 CECD CN(Cc1ccc(C(N)=O)cc1)c1ccc2c(c1)OCO2 121246141 AIHASJOIZMDTAG-UHFFFAOYSA-N 284.315 2.151 10 20 CECD CN(CC(F)F)c1ccc(/C=C\C(=O)O)cc1[N+](=O)[O-] 312178015 KBYUBHCLTIVEDB-HYXAFXHYSA-N 286.234 2.394 10 20 CECD CCN(CC)c1ccc(CN(CCO)CCOC)cc1F 93005768 PITODXFYTVKYTH-UHFFFAOYSA-N 298.402 2.113 10 20 CECD CC[C@H](NCc1cnnn1CC)c1ccc(F)cc1O 527915755 MSBLNYNGEXADCH-ZDUSSCGKSA-N 278.331 2.384 10 20 CECD COc1cccc(CN2CCOCC3(CCC3)C2)c1O 368100977 XBYLFCAJCCNMSJ-UHFFFAOYSA-N 277.364 2.403 10 20 CECD Nc1ccc(NC(=O)c2cccn2C2CCNCC2)cc1 376692801 AYMATBBPPRBUPB-UHFFFAOYSA-N 284.363 2.247 10 20 CECD CC[C@H](NCc1cnnn1C)c1ccc(N(C)C)cc1 287495510 YDPVBRKDWUYJGR-HNNXBMFYSA-N 273.384 2.122 10 20 CECD CC[C@@H](NCCCC(=O)N(C)C)c1ccc(F)cc1O 286009836 JEDFPDOPUOLIBS-CYBMUJFWSA-N 282.359 2.440 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN1CC[C@@H]2CNC[C@@H]21 385374808 LXBWUEZHJMXXLN-PELKAZGASA-N 287.190 2.493 10 20 CECD Cc1cc(CNCc2ccccc2O)nc(N2CCCC2)n1 292882728 XYRZQQYKGIPBBJ-UHFFFAOYSA-N 298.390 2.381 10 20 CECD CCOc1ccc(CN(C)[C@@H]2CC(C)(C)OC2=O)c(O)c1 814181130 WBLIKEDTRAOJMX-CYBMUJFWSA-N 293.363 2.317 10 20 CECD Cc1cc(C)c(-c2nn[nH]n2)c(NCc2ccccc2O)n1 826263006 HUQRWKGDVQODIG-UHFFFAOYSA-N 296.334 2.196 10 20 CECD Cc1cc(O)c(CNCCN2CCC2)cc1Cl 825366050 QSPOUEXVPFRVMS-UHFFFAOYSA-N 254.761 2.149 10 20 CECD Cc1nc([C@@H]2CCN(Cc3ccc(N(C)C)cc3)C2)n[nH]1 839658196 DKRIFVBMIMALRA-CQSZACIVSA-N 285.395 2.169 10 20 CECD CN1C(=O)/C(=C/c2ccc([N+](=O)[O-])s2)SC1=S 588421521 PLYLGQMVMGWHBA-XQRVVYSFSA-N 286.359 2.487 10 20 CECD O=C(NCc1ccc([N+](=O)[O-])cc1)c1cc(O)cs1 731870503 JZJOAVNPEUYBJW-UHFFFAOYSA-N 278.289 2.292 10 20 CECD C[C@H](N[C@@H]1COC[C@H]1O)c1ccc(N2CCCCC2)cc1 834898154 ZWULAFDTGHWKSX-IAOVAPTHSA-N 290.407 2.087 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](C)CC(=O)O)c1 911343663 SBXLFZGMFOFKRI-ZJUUUORDSA-N 295.335 2.079 10 20 CECD Cc1ccc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)nn1 839727916 FMKFUWGJRRYXIN-GFCCVEGCSA-N 284.363 2.342 10 20 CECD C[C@@H](N)[C@H]1CCN(Cc2cccc(Cl)c2O)C1 843058487 UIAHEKIYZLQXAF-ZJUUUORDSA-N 254.761 2.215 10 20 CECD CN(Cc1ccccc1O)c1cc(NC2CC2)ncn1 840279557 BQNFIYLAWSIMAX-UHFFFAOYSA-N 270.336 2.393 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@]1(O)CCSC1 840935355 MYBBSIUNTZECBZ-HNNXBMFYSA-N 280.437 2.019 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CO[C@@H](C)C2)c1 842926698 AZPJHMXIDSULDZ-NHCYSSNCSA-N 279.336 2.007 10 20 CECD CCOc1cccc(CN[C@@H]2CCCN[C@@H]2C)c1O 841064745 INTPZVITDXENPK-DGCLKSJQSA-N 264.369 2.021 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)NC[C@@H](C)N 841988442 RKQCFIQVLSTTJX-CYBMUJFWSA-N 292.427 2.020 10 20 CECD C[C@@H](c1cnn(C)c1)c1nc(Cc2ccc(N)cc2)no1 843160796 JCOVQRYRFAXIAC-JTQLQIEISA-N 283.335 2.128 10 20 CECD CCOc1cccc(CN[C@H]2CC[C@H](CN)C2)c1O 841084549 KQASXBZLPFYHSK-AAEUAGOBSA-N 264.369 2.008 10 20 CECD CO[C@@H](CNC(=O)NCc1cc(Cl)ccc1O)C1CC1 845220218 FSVAJAWXTPPUAV-ZDUSSCGKSA-N 298.770 2.270 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1C[C@]12CCOC2 846472644 CXAFOZRLYWOPJB-RISCZKNCSA-N 281.739 2.088 10 20 CECD Cc1cnc(CNC(=O)c2cc(O)cs2)s1 743712568 UQDXEBORTOSOKY-UHFFFAOYSA-N 254.336 2.149 10 20 CECD CCOCC(=O)Nc1c(-c2ccccn2)nc2ccccn12 751301662 GDTJSFPXMQTRJE-UHFFFAOYSA-N 296.330 2.371 10 20 CECD C[C@@H](NCC1(CO)CC1)c1cc(Cl)ccc1O 756638004 PWJUEBNQSXDABU-SECBINFHSA-N 255.745 2.469 10 20 CECD CCOCc1cc(CNC[C@H]2C[C@@H](O)C2)ccc1OC 858296368 NOTJRRPQMFUGGY-OTVXOJSOSA-N 279.380 2.092 10 20 CECD O=C(O)c1occc1CNCc1ccc2c(c1)CCO2 833785345 QFESTZGEKHNOBB-UHFFFAOYSA-N 273.288 2.203 10 20 CECD C[C@H](N[C@H]1CCN(C)C1)c1cc(Cl)ccc1O 756533548 IOMJWCFLJDVCFQ-ONGXEEELSA-N 254.761 2.400 10 20 CECD COC[C@](C)(O)CN[C@H](C)c1cc2c(cc1O)CCCC2 756579495 ZZNPZBKCOPVONT-SJKOYZFVSA-N 293.407 2.319 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)CC[C@H]1C 768466022 VNYTTXSUWUSDTR-HFAKWTLXSA-N 277.364 2.296 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@@H](C)c1c(O)cccc1F 886558931 WFOSUTQMKXYTHE-HOSYDEDBSA-N 280.343 2.097 10 20 CECD CN1CCN(c2ccc(CNC(=O)C3CC=CC3)cc2)CC1 881850709 CWCVDYFUIVXYOJ-UHFFFAOYSA-N 299.418 2.021 10 20 CECD COc1cc(C)cc(CNc2cnn(C)c2C)c1O 894372705 MTELKWWSXCYHBM-UHFFFAOYSA-N 261.325 2.363 10 20 CECD CCc1cccc(CN2CC[C@@H](c3n[nH]c(C)n3)C2)c1O 895012015 JGMZUXBOIQHIRF-CQSZACIVSA-N 286.379 2.371 10 20 CECD CCn1cccc(CNCc2cc(F)ccc2O)c1=O 789751386 CALJYNXDUKUVKO-UHFFFAOYSA-N 276.311 2.003 10 20 CECD CCc1ccnc(CNC(=O)NCc2ccccc2O)c1 798108222 MDORCDNMHVTNAZ-UHFFFAOYSA-N 285.347 2.349 10 20 CECD CCOCCN(Cc1ccccc1O)C[C@H]1CCCO1 72952752 YXMMQCPYXJWQGB-OAHLLOKOSA-N 279.380 2.410 10 20 CECD OC[C@H](NCc1cc(F)ccc1O)c1ccccc1 83445578 ILSBBFJTYODUHU-AWEZNQCLSA-N 261.296 2.355 10 20 CECD O[C@@]1(CNCc2ccc(N3CCCC3)cc2)CCSC1 702306944 BFKLQFRMXVQINP-MRXNPFEDSA-N 292.448 2.244 10 20 CECD CCCCN(CCOC)C(=O)NCc1ccc(N)cc1 1335737747 UEHUUROWSXIPLN-UHFFFAOYSA-N 279.384 2.227 10 20 CECD CN[C@H](C)CCNCc1cc(Br)ccc1O 1345099668 JGNNFIJIKRVQGM-SECBINFHSA-N 287.201 2.242 10 20 CECD Cc1ccc(CN2C[C@@H]3CCC[C@@H]3[C@@H]2C(=O)O)c(O)c1 1600413667 VTGFUSQWIFXYIW-CORIIIEPSA-N 275.348 2.386 10 20 CECD C[C@H](NC(=O)NCC(C)(C)CC(=O)O)c1ccccc1O 1607456259 GEVMHDXBMWBAST-JTQLQIEISA-N 294.351 2.253 10 20 CECD C[C@@H](NC(=O)[C@@H](C(=O)O)C1CC1)c1ccc(N(C)C)cc1 1589088165 IJXVZNMQZBFJNK-YGRLFVJLSA-N 290.363 2.041 10 20 CECD C[C@H]1CCCCN1CCCNC(=O)Cc1ccc(N)cc1 19271024 LGOXKATXYDDPJD-AWEZNQCLSA-N 289.423 2.192 10 20 CECD COc1ccsc1C(=O)NCc1ccc(O)c(O)c1 158887418 GYVJLAMBUQAITA-UHFFFAOYSA-N 279.317 2.098 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1cccc(Br)c1O 164498913 JRKIYGVWWQLXSL-RKDXNWHRSA-N 288.185 2.404 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)Nc2cccnn2)c1 152096284 NNZVGSDLEWOWAD-VIFPVBQESA-N 288.307 2.074 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)Nc1ccncc1 152988223 VKNUUIWWSJFPCT-SNVBAGLBSA-N 287.319 2.246 10 20 CECD COc1ccc(O)c(CN2CC[C@H]3[C@@H](CCCN3C)C2)c1 156093796 CGXRPGNODYLISG-BBRMVZONSA-N 290.407 2.317 10 20 CECD CN(C)c1ccc(CNC(=O)C(C)(C)F)cc1F 154949664 AWDDDWSPLMGCDX-UHFFFAOYSA-N 256.296 2.256 10 20 CECD CCS(=O)(=O)CCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 230660583 VRDYBWGYNGEUEW-NWDGAFQWSA-N 297.420 2.273 10 20 CECD C[C@H](NCC1([S@@](C)=O)CC1)c1cc(F)ccc1O 282191894 GGPDPOONOBVHNC-NIVTXAMTSA-N 271.357 2.093 10 20 CECD COc1cccc(CNC[C@](C)(OC)C2CC2)c1O 291053180 NOUGGVKPWJASQR-HNNXBMFYSA-N 265.353 2.306 10 20 CECD CCOc1cccc(CN[C@@H](C)CCOC)c1O 112018223 IDAVTXABASAIRT-NSHDSACASA-N 253.342 2.306 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1ccncc1 53510762 NIJFALUJOPCGPR-UHFFFAOYSA-N 298.390 2.489 10 20 CECD CCCCN1CC(=O)N[C@H]1c1cccc(OCC)c1O 77475183 ZRKSRKCCEPYMGQ-OAHLLOKOSA-N 278.352 2.021 10 20 CECD CCSCCN(C)c1ccc(OCC(=O)OC)cc1 183790474 BNSCLZMHBVUDFE-UHFFFAOYSA-N 283.393 2.428 10 20 CECD C[C@H](N[C@@H]1C=C[C@H](CO)C1)c1cc(F)ccc1O 185831131 YQPQYKJILNBUSH-JBLDHEPKSA-N 251.301 2.119 10 20 CECD CO[C@]1(C)C[C@@H](NC(=O)c2cccc(O)c2O)C1(C)C 185778362 RPWXRIDWDSBCER-IAQYHMDHSA-N 279.336 2.031 10 20 CECD CC(C)Oc1ccc(N(C)CC2OCCO2)cc1 191595549 NRVICCYOAUIOLA-UHFFFAOYSA-N 251.326 2.283 10 20 CECD CCOc1cccc(CN(CC(N)=O)C2CCCC2)c1O 132991165 WGUMSXMRGPTVGQ-UHFFFAOYSA-N 292.379 2.021 10 20 CECD CN(C)c1ccc(CN2CC[C@H](CC(=O)O)C2)cc1 89716059 GFFVHLGGSXINKQ-CYBMUJFWSA-N 262.353 2.049 10 20 CECD COc1cccc(CNC(=O)Nc2cccc(F)n2)c1O 134323164 NATDPAAGSDNANI-UHFFFAOYSA-N 291.282 2.257 10 20 CECD COc1ccc(O)c(CN(C)[C@H]2CCN(C)C[C@H]2C)c1 290626961 XOWGWACDBOMLPG-DOMZBBRYSA-N 278.396 2.173 10 20 CECD CC[C@H](NC[C@H]1COCCN1)c1cc(Cl)ccc1O 530223913 IXPUBWKDZYKBMV-AAEUAGOBSA-N 284.787 2.075 10 20 CECD CO[C@H](C(=O)NCc1ccc2c(c1)CCCN2C)C1CC1 279337336 PIMSABRJJBIUKX-INIZCTEOSA-N 288.391 2.110 10 20 CECD Cc1cc(O)c(CN2CC(=O)N(CC3CC3)C2)cc1C 279494771 VGTVLPINQZBVMI-UHFFFAOYSA-N 274.364 2.021 10 20 CECD CCNC(=O)[C@@H](C)N[C@H](CC)c1ccc(F)cc1O 285606843 KCHXWWNEWGEAON-BXKDBHETSA-N 268.332 2.097 10 20 CECD Cc1cc(O)c(CNCCC2(O)CCOCC2)cc1C 285655881 YRPPCCZHADDHGG-UHFFFAOYSA-N 279.380 2.030 10 20 CECD Cc1cc(C(=O)NCCO)c(C)n1-c1ccc(Cl)cc1 298875563 XPZGEDJSWYCCHZ-UHFFFAOYSA-N 292.766 2.470 10 20 CECD Cn1c(-c2ccccc2)cnc1SC[C@H]1CNC(=O)O1 298853577 BUOCZJLWIJKNHO-LLVKDONJSA-N 289.360 2.288 10 20 CECD CCN(C)C(=O)CN(CC)c1ccc(OC)c(OC)c1 299296430 WGYGPEQRJFCAJS-UHFFFAOYSA-N 280.368 2.008 10 20 CECD CCOc1cccc(CNCCC(C)(C)C(=O)O)c1O 818629108 PRVUTUHIFKCWFY-UHFFFAOYSA-N 281.352 2.381 10 20 CECD CCC(=O)N1CC[C@@H](NCc2cc(Cl)c(C)cc2O)C1 825341778 RUIMRKNHNUWRON-GFCCVEGCSA-N 296.798 2.455 10 20 CECD Cc1cc(O)c(CNCc2cc[nH]n2)cc1Cl 825089674 HLOXQNSPWYOTTL-UHFFFAOYSA-N 251.717 2.367 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)C[C@@H]1COCCO1 827141558 UKNXCXWXBKELKG-LLVKDONJSA-N 289.734 2.032 10 20 CECD CC(C)COC[C@@H](O)CN[C@@H]1CCc2cccc(O)c21 834531207 SDLRSQUFPAHPMZ-UONOGXRCSA-N 279.380 2.003 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@](C)(C(=O)O)C1 901513176 OTLMVNRHRONRLZ-INIZCTEOSA-N 276.380 2.358 10 20 CECD CCc1nocc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 831925624 ZXBDWQBVYSXYAV-SECBINFHSA-N 290.319 2.009 10 20 CECD CCC(C)(C)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832281970 WNEBHPCCMSTDAA-AWEZNQCLSA-N 277.412 2.305 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@@]3(C(=O)O)C2)cc1 846282769 DJUNMXXNKXNCOM-WMLDXEAASA-N 288.391 2.439 10 20 CECD CCCCCN(CCO)C(=O)Nc1ccc(N)cc1 841299655 HKVTTZRVCKIEPK-UHFFFAOYSA-N 265.357 2.285 10 20 CECD CCOc1ccc(CN[C@@H]2CCCN[C@@H]2C)c(O)c1 841066232 YNNFRMSEQBRDNT-BXUZGUMPSA-N 264.369 2.021 10 20 CECD CC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)[C@H](C)CO1 844733767 XKZOQMQLTPQQKZ-YPMHNXCESA-N 295.379 2.409 10 20 CECD C[C@H]1C[C@@H](NCC2(CO)CC2)c2c(O)ccc(F)c21 756638140 RSXCFCWHAIGNDF-GXSJLCMTSA-N 265.328 2.442 10 20 CECD COCCC1(CNC(=O)NCc2cc(C)ccc2O)CC1 858304885 KDTGMDHPBCPAIY-UHFFFAOYSA-N 292.379 2.317 10 20 CECD C[C@H](NC[C@H](O)CN(C)C)c1ccc2ccccc2c1O 756557843 WQQGIXCHHBKDPL-JSGCOSHPSA-N 288.391 2.119 10 20 CECD CCO[C@H]1C[C@@H](NC(=O)NCc2cc(C)ccc2O)C1 858532568 LSHIDDFSYUENRF-BETUJISGSA-N 278.352 2.067 10 20 CECD Cc1ccc(O)c(CNC(=O)CC2CCN(C)CC2)c1 862757425 TXKFBEGFCUZEHQ-UHFFFAOYSA-N 276.380 2.049 10 20 CECD C[C@H]1CCN(Cc2cc(Cl)ccc2O)CC[S@@]1=O 763488833 FHIHVIYVTUNPMY-YPMLDQLKSA-N 287.812 2.389 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CCC(=O)[C@@H](C)C2)c1 764265804 SZMKQPQFEVJREU-QWRGUYRKSA-N 291.347 2.022 10 20 CECD CC[C@@](C)(CO)NCc1cccc(Br)c1O 70898805 UESPEZQGAHKVRB-LBPRGKRZSA-N 288.185 2.405 10 20 CECD CC[C@@H](CNCc1ccc(N2CCCC2)cc1)C(=O)O 1119544408 ASBYWHQYSIJKCW-AWEZNQCLSA-N 276.380 2.487 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C)NCC 876633829 YCQTZLDFDBKSLE-LBPRGKRZSA-N 264.369 2.129 10 20 CECD c1nc2n(n1)CCN(Cc1ccc(N3CCCCC3)cc1)C2 770663433 CXQCQFIJZSVVNY-UHFFFAOYSA-N 297.406 2.284 10 20 CECD CC(=O)C1=NN(c2ccccc2OC(F)(F)F)C(=O)C1 871960235 WIEFKKSMWKYJNR-UHFFFAOYSA-N 286.209 2.267 10 20 CECD COc1cccc(CNC(=O)c2nc(C)c(C)s2)c1O 770404560 TYMGKGMQQOZMCS-UHFFFAOYSA-N 292.360 2.404 10 20 CECD C[C@@H](C(=O)N[C@H](C)Cc1ccc(O)c(O)c1)C(F)(F)F 773764277 ZRHHNSYHCQUPJC-SFYZADRCSA-N 291.269 2.343 10 20 CECD COC(=O)CC(C)(C)NCc1cc(F)cc(F)c1O 883016720 JJLYDFIBJBZUJE-UHFFFAOYSA-N 273.279 2.102 10 20 CECD Cc1cc(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)ccc1N(C)C 887040046 XTBBJQHGDCMVQZ-XIRDDKMYSA-N 274.408 2.406 10 20 CECD Cc1cc(NC(=O)N(C)Cc2ccccc2O)nc(C)n1 880311570 JEZRNLHSEVSLOL-UHFFFAOYSA-N 286.335 2.463 10 20 CECD C[C@H](C(=O)O)N(C)Cc1c(O)ccc2ccccc12 86756416 KCMFSNGFSVLBLA-SNVBAGLBSA-N 259.305 2.450 10 20 CECD COc1ccc(O)c(CN[C@H]2CCC[C@H]2CCO)c1 190304516 MDAQKAMPHHCNAZ-FZMZJTMJSA-N 265.353 2.042 10 20 CECD COc1ccc(O)c([C@H](C)Nc2cc(C)nc(CO)n2)c1 1323107938 VWYINIJGCPZTSJ-JTQLQIEISA-N 289.335 2.165 10 20 CECD CCOc1cccc(CN2CCO[C@@H](C)[C@@H]2C)c1O 93418098 ZXYYXRRXVCHLMX-RYUDHWBXSA-N 265.353 2.400 10 20 CECD C[C@@H](N[C@@H](CO)CC(F)(F)F)c1c(O)cccc1F 1262077943 URJCVEUQRWOHPA-HTQZYQBOSA-N 281.249 2.495 10 20 CECD CC(C)CONC(=O)N[C@H](C)c1ccccc1O 1349132148 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Cc1cccc(CNCC2([S@](C)=O)CCC2)c1O 281873173 UVQTWUAKJKKZTH-SFHVURJKSA-N 267.394 2.091 10 20 CECD CCCN1CC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1 389205088 ATUONIACFVAWCX-ZIAGYGMSSA-N 260.381 2.453 10 20 CECD CNC(=O)[C@@H]1CCCCN1Cc1cc(C)c(C)cc1O 179335567 VJTKONLUYOSGDY-AWEZNQCLSA-N 276.380 2.110 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NC[C@H]1CCCO1 115780472 KFAXGTDCQLBKHZ-OAHLLOKOSA-N 291.395 2.039 10 20 CECD COc1ccc(O)c(CNc2cccc(C(N)=O)c2C)c1 36995934 DKPPZINQWZDZFX-UHFFFAOYSA-N 286.331 2.420 10 20 CECD CC(C)CCSCC(=O)NCc1ccc(O)c(O)c1 182549835 ODCQCWSGYBCBFP-UHFFFAOYSA-N 283.393 2.493 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H](C)C(=O)N(C)C)cc1 189005738 RCBPVKKTCPCSON-OLZOCXBDSA-N 277.412 2.270 10 20 CECD CC[C@@H](N)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 40855914 LQTPVDCOTBIFSM-MRXNPFEDSA-N 289.423 2.373 10 20 CECD CCNC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 46906149 YZCNDQCILZKTBL-CYBMUJFWSA-N 278.352 2.103 10 20 CECD COc1ccc(O)c([C@H](C)NCC[C@@H](C)CCO)c1 295106741 LBHJMICZHBFLJH-NEPJUHHUSA-N 267.369 2.460 10 20 CECD Cc1ccc(O)c(CN2CCS[C@H]3COCC[C@@H]32)c1 91856601 OSMDVLATOFAECT-ZFWWWQNUSA-N 279.405 2.407 10 20 CECD CC1(C(=O)O)CCN(Cc2cc(F)ccc2O)CC1 232844293 KLQKYDPFQQSBFS-UHFFFAOYSA-N 267.300 2.218 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](C)C[C@@H](C)O)c1 273556263 GXADQPZMGDCAAN-UTUOFQBUSA-N 295.379 2.236 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCO[C@]3(CCOC3)C2)cc1C 374268297 FRTYETOKRYBSBP-NVXWUHKLSA-N 291.391 2.437 10 20 CECD CCCCN(CCN1CCNC1=O)Cc1ccccc1O 289525328 VVNNXSZZSKYRKT-UHFFFAOYSA-N 291.395 2.020 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)n(C)n1 298787074 OFHCJAJGYZMVAJ-UHFFFAOYSA-N 286.379 2.067 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCCCF 803401137 TWXQDMRLVQVRSH-GQCTYLIASA-N 254.257 2.404 10 20 CECD CN(CCC1CCOCC1)C(=O)c1c(F)ccc(O)c1O 295167585 RGHHDUJNVGWDAJ-UHFFFAOYSA-N 297.326 2.126 10 20 CECD C[C@@H](CCO)CCNCc1ccc(N(C)C)c(F)c1 295024278 COUPBZJTUMHIBJ-GFCCVEGCSA-N 268.376 2.390 10 20 CECD COc1cc(Cl)cc(CN2CC3(CCOC3)C2)c1O 294188756 XFCSDPIQONLYEP-UHFFFAOYSA-N 283.755 2.277 10 20 CECD CC[C@@H](NCCO)c1ccc(C(F)(F)F)cc1O 810206655 BGJCRIPMHCHUJJ-SNVBAGLBSA-N 263.259 2.444 10 20 CECD NC(=O)[C@@H]1CC[C@H](NCc2ccc3ccccc3c2O)C1 825284520 NJFBAJKOLYWQSX-OCCSQVGLSA-N 284.359 2.289 10 20 CECD C[C@@H]1C[C@H](O)CN(Cc2ccc(N(C)C)c(F)c2)C1 825312964 ZQSWTXRAJYKZEM-YPMHNXCESA-N 266.360 2.094 10 20 CECD CC[C@H]1CCCCN1C(=O)COC(=O)c1cc(O)cs1 731910479 RVHYRIMOMOAMEP-JTQLQIEISA-N 297.376 2.402 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@@H]2COCCO2)cc1 827336120 AIHMRCBCNLCMRU-QGZVFWFLSA-N 292.423 2.380 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1[C@H]2CCC(=O)[C@@H]21 906995235 XXSMMVPMLLPBHL-APHBMKBZSA-N 287.359 2.356 10 20 CECD CN(C)c1ccc(CNCCCON)c(C(F)(F)F)c1 904458595 ZQSNFBCLLRLSFL-UHFFFAOYSA-N 291.317 2.141 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCC[C@H]1C3)[C@@H](O)CO2 902661502 ZKVIRSWJEMBLJK-WBIUFABUSA-N 275.348 2.192 10 20 CECD Cc1cc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)ccc1N(C)C 831632524 VJZJFSWQGAGWCL-CYGHRXIMSA-N 284.403 2.446 10 20 CECD COc1cccc(CNCCCCN(C)C2CC2)c1O 835061000 FGJBZGRRCPSFSG-UHFFFAOYSA-N 278.396 2.365 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1cnsn1 743715702 CARWXFYTVYGBFZ-UHFFFAOYSA-N 289.360 2.053 10 20 CECD Cc1cc(N(C)C)ccc1[C@H]1NC2(CCCC2)C(=O)N1C 840820345 USRFDNLFMOTPEC-HNNXBMFYSA-N 287.407 2.434 10 20 CECD CSCC[C@H](C)NC(=O)NCCc1ccc(N)cc1 841829124 NNYRTAMLRHYSMB-NSHDSACASA-N 281.425 2.252 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](N)CC(F)F 843413524 ROVRJJZDXRHNEZ-LLVKDONJSA-N 286.322 2.113 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)COC(C)C)cc1 844853391 HDBGROUUUKNNIP-UHFFFAOYSA-N 294.395 2.015 10 20 CECD C[C@]1(CN)CCN(Cc2cc(Cl)cc(F)c2O)C1 843116938 NLROUEGTWGMUPB-CYBMUJFWSA-N 272.751 2.355 10 20 CECD CN1CCCc2cc(CNC(=O)CC3CC3)ccc21 746811448 FZYGDFWSQYQNDC-UHFFFAOYSA-N 258.365 2.485 10 20 CECD CCN[C@H](C)CNC1CCN(c2ccc(OC)cc2)CC1 841066336 SFMFZRNVRUPTHC-CQSZACIVSA-N 291.439 2.252 10 20 CECD CO[C@@H]1COC[C@H]1N[C@H](C)c1ccc(Cl)cc1O 842912063 PLJPHZIXRMCLBL-XTWCZFFVSA-N 271.744 2.110 10 20 CECD Cc1cc(CN(C[C@H](C)O)C2CC2)ccc1N(C)C 847103878 GMVZUXPWIYOZPL-ZDUSSCGKSA-N 262.397 2.406 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2C)[C@@H]1C 840942214 VPAOFGRSNZJORA-CZUORRHYSA-N 290.407 2.444 10 20 CECD CO[C@@H]1[C@@H](C)[C@H](NC(=O)Nc2ccc(N)cc2)C1(C)C 841296841 ZTORSGNBAVXYGX-TVYUQYBPSA-N 277.368 2.450 10 20 CECD C[C@H]1C[C@H](NCc2cc(F)c(N(C)C)cc2F)CO1 858185166 RNRNHHOBHUQEEV-ONGXEEELSA-N 270.323 2.298 10 20 CECD CN(C[C@H]1CC1(C)C)C(=O)c1c(F)ccc(O)c1O 857339995 ONSZINCZEPAYGN-MRVPVSSYSA-N 267.300 2.355 10 20 CECD CC(C)C1(C(=O)N(C)Cc2ccccc2O)COC1 934704918 KUYXVFYORDALKQ-UHFFFAOYSA-N 263.337 2.023 10 20 CECD C[C@@H](NC(=O)NCc1ccccc1O)c1ccc[nH]1 760348640 NEONKUYXFGFCDY-SNVBAGLBSA-N 259.309 2.281 10 20 CECD CN(C)C[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862243382 HWJXTBSHBHDHEM-GFCCVEGCSA-N 297.393 2.414 10 20 CECD C[C@@H]1CCCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768444582 MNJANGOANKXSCW-ABAIWWIYSA-N 277.364 2.440 10 20 CECD C[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C[C@H]1CO 862425495 YEBQUKAOYPJWKF-AAEUAGOBSA-N 298.377 2.481 10 20 CECD O=C1NC(=O)/C(=C/c2cc(F)c(F)c(F)c2)S1 874927494 IIXKWSSTCCKESQ-CLTKARDFSA-N 259.208 2.428 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@@H]1CCCN(C)C1=O 1118797355 HMSVCAJKRZYEDZ-JHJVBQTASA-N 288.391 2.459 10 20 CECD CCCOc1ccc(CNC[C@@](C)(O)CN(C)C)cc1C 873094420 IFORINOWPCEWQK-QGZVFWFLSA-N 294.439 2.186 10 20 CECD Cc1cccc(O)c1CN[C@@H]1CCc2n[nH]cc2C1 877053713 XGOZUBWJJMDYSF-GFCCVEGCSA-N 257.337 2.071 10 20 CECD CO[C@H](C)CS(=O)(=O)Nc1ccc(O)c(C(C)C)c1 882799198 SWLAKXTZNZIHLG-SNVBAGLBSA-N 287.381 2.292 10 20 CECD O=C(c1cc(O)cs1)N1CC[C@H](C(F)(F)F)C1 888021123 NAUROOMCEIMPRG-LURJTMIESA-N 265.256 2.478 10 20 CECD COc1ccc(CN[C@@]2(C)CCO[C@H]2C)c(O)c1OC 893521417 NJTISQLLBCVIBI-BONVTDFDSA-N 281.352 2.067 10 20 CECD CN(C)c1ccc([C@H](CN[C@@H]2CCSC2)N(C)C)cc1 898451353 YCKGEXWUAOYKAK-ZBFHGGJFSA-N 293.480 2.450 10 20 CECD COc1ccc(CN(C)Cc2cscn2)c(O)c1OC 891814612 OGKGOEAQXCVDAN-UHFFFAOYSA-N 294.376 2.498 10 20 CECD COc1cc(C)cc(CN(C)Cc2ncc[nH]2)c1O 894586907 LSQLIWPLSLMZJO-UHFFFAOYSA-N 261.325 2.064 10 20 CECD CC(=O)CCC(=O)N(C)Cc1ccc(N(C)C)cc1 201703483 UCVJYJXNMXAESZ-UHFFFAOYSA-N 262.353 2.080 10 20 CECD CCn1cc(CNCc2cc(OC)ccc2O)c(C)n1 1351999335 XZEXNTRMZJAYES-UHFFFAOYSA-N 275.352 2.215 10 20 CECD CNC(=O)CC1CCN(Cc2cc(Cl)ccc2O)CC1 93588051 GFUSLXRTZABJNM-UHFFFAOYSA-N 296.798 2.394 10 20 CECD COCCNCCN[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 1329025219 ZPTNVTHXFHHASR-OLZOCXBDSA-N 278.396 2.075 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H]3[C@@H](C2)C3(F)F)c1O 715518051 ZISORVSGFCYDHZ-VXGBXAGGSA-N 285.265 2.431 10 20 CECD Cc1ccc([C@@H](C)N[C@H](CO)CC(F)F)c(O)c1 717751431 UYWUOXXNKMQHMS-ZJUUUORDSA-N 259.296 2.367 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCC[C@H]3OCC[C@@H]23)cc1 1337016680 UNCLVQXNWWVPSQ-RRFJBIMHSA-N 289.379 2.026 10 20 CECD Nc1ccc(CNC(=O)NCCC[C@@H]2CCCCO2)cc1 1335666340 QAVRVLKSHNRLSZ-HNNXBMFYSA-N 291.395 2.417 10 20 CECD CC(C)[C@H](C(=O)O)[C@H](C)NCc1cc([N+](=O)[O-])ccc1O 1348958257 QXIKTRORMYAHHE-ZANVPECISA-N 296.323 2.135 10 20 CECD Nc1ccc(CNC(=O)C2(c3ccccc3)CC(=O)C2)cc1 1580443633 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271197314 RZOAOKSCVCXDEI-UHFFFAOYSA-N 266.360 2.239 10 20 CECD Cc1ccc([C@@H](C)NCC(C)(C)C(N)=O)c(O)c1C 273477856 LHJGMRGMVQXSCB-LLVKDONJSA-N 264.369 2.171 10 20 CECD Cc1cc(C)c([C@@H](C)N[C@@H](C)C(=O)NCCF)c(O)c1 285366485 VUMKVGLTAOAZOP-NEPJUHHUSA-N 282.359 2.134 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](O)C(C)C)cc1 285070850 KAFOJFDJWYNAQQ-OAHLLOKOSA-N 278.396 2.166 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cc2ccccn2n1 804377843 RBNMDRPKXIIHHL-ALCCZGGFSA-N 295.298 2.397 10 20 CECD Cc1cc(Cl)cc([C@H](C)N[C@@H]2CC(=O)N(C)C2)c1O 808689169 ZLTFJSLXCLUFBV-GXSJLCMTSA-N 282.771 2.235 10 20 CECD CCC[C@@H](C)N1C(=O)CN(Cc2ccccc2O)C1=O 819165864 FTXPAIRKHURMPL-LLVKDONJSA-N 276.336 2.345 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H]1CC[C@@H](CC)O1 819761488 RWANCBURSXDRHB-DGCLKSJQSA-N 298.379 2.452 10 20 CECD COCC1(C)CCN(C(=O)c2c(F)ccc(O)c2O)CC1 827794633 PEPGTXKNMQMZGE-UHFFFAOYSA-N 297.326 2.126 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)cc1F 824839441 ZDUVXRIQPUYDSM-BQGCOEIASA-N 288.366 2.277 10 20 CECD CC[C@H](NCCCON)c1cc(Cl)ccc1O 902426128 RDECFABIKKPIMB-NSHDSACASA-N 258.749 2.367 10 20 CECD CC(C)[C@@](C)(O)CNCc1ccc(N(C)C)c(F)c1 733326755 YAGJWWVLJDEFJL-HNNXBMFYSA-N 268.376 2.388 10 20 CECD Cc1cnc(CCNCc2cc(C)c(C)cc2O)cn1 835062124 RNHGNOZXCOQMSM-UHFFFAOYSA-N 271.364 2.440 10 20 CECD CCCC1(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)CC1 832266503 GRKZNTSCNHTSFK-OAHLLOKOSA-N 289.423 2.449 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@@H]2C2CCOCC2)cc1 831522457 MUTOAZXZTCXTCD-MRXNPFEDSA-N 288.391 2.229 10 20 CECD CCN(CC)c1ccc(CN(C)S(=O)(=O)C2CC2)cc1 742273067 FFERUUSLRNKJCZ-UHFFFAOYSA-N 296.436 2.457 10 20 CECD CO[C@@H]1CCC[C@@H]1CNC(=O)Nc1ccc(N)cc1 841295621 CSMRETHOACJJSY-ZWNOBZJWSA-N 263.341 2.205 10 20 CECD O=C(Nc1ccn(CC(F)(F)F)n1)c1cc(O)cs1 746300271 BPOVOUWXUPSQFY-UHFFFAOYSA-N 291.254 2.465 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H]2C[C@@H](O)C2(C)C)c1O 846961691 QZMOVVMPZVUMSD-CHWSQXEVSA-N 297.782 2.497 10 20 CECD COC[C@@](C)(O)CN[C@H](C)c1ccc(Cl)cc1O 841762699 JSMFFSQWGMNZGK-RNCFNFMXSA-N 273.760 2.094 10 20 CECD O=C(NCc1cc(Cl)ccc1O)OC1CCOCC1 845997039 WQVXAGDHLYSJLA-UHFFFAOYSA-N 285.727 2.451 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2c(C)noc2C)c1 858158434 FJIDNVFOJMATAS-UHFFFAOYSA-N 289.335 2.305 10 20 CECD CC(C)N(C)C[C@@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 851951561 YUDZSYZVWRDYOU-PBHICJAKSA-N 293.455 2.104 10 20 CECD CN(Cc1ccccc1O)C(=S)NCC(F)(F)F 750996183 ROGWYCFLMGUROA-UHFFFAOYSA-N 278.299 2.261 10 20 CECD CC(C)[S@](C)(=O)=NC(=O)/C=C\c1ccc(O)c(O)c1 926053710 FTDTZRNVVNWZDZ-WPGJWXSHSA-N 283.349 2.144 10 20 CECD Cc1ncc(CNCc2ccc(N(C)C)c(F)c2)n1C 850099454 LJBRTDWJXDBUBG-UHFFFAOYSA-N 276.359 2.223 10 20 CECD CSCC1(CCNC(=O)c2cccc(O)c2O)CC1 855397783 IULHCYFCEXGUTM-UHFFFAOYSA-N 281.377 2.361 10 20 CECD C[C@H](O)C[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 757654150 CCJGQAMFOMALLM-LPEHRKFASA-N 268.313 2.110 10 20 CECD Cc1cccc(O)c1CN[C@@H](CO)Cc1ccccc1 877409311 PVJVCJOLFUOMEB-OAHLLOKOSA-N 271.360 2.394 10 20 CECD C[C@@H]1C[C@@H](NC(=O)N[C@H](C)c2ccccc2O)CCO1 868469663 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CC[C@@H]1CN(Cc2cc(Cl)cc(C(C)=O)c2O)C[C@@H]1O 270835116 DDYJJRNICYVRPI-YGRLFVJLSA-N 297.782 2.451 10 20 CECD CON1CCC(N[C@@H](C)c2ccc(N(C)C)cc2)CC1 692122711 DQLVIOADGAMTKN-ZDUSSCGKSA-N 277.412 2.429 10 20 CECD CC(C)COC[C@@H](O)CN[C@H](C)c1ccccc1O 179873570 JRLLXVLDAGLQHK-OLZOCXBDSA-N 267.369 2.076 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)CCC1CC1 310301362 NPODABSDAHFKHP-UHFFFAOYSA-N 255.339 2.242 10 20 CECD O=C1NC(=S)S/C1=C/c1cc(F)c(O)c(F)c1 175315733 FMOXPNURWJZUOX-XVNBXDOJSA-N 273.285 2.159 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccc[nH]1 115490193 QTJZFBKEKTYJQD-UHFFFAOYSA-N 257.337 2.319 10 20 CECD O=C(Nc1ccc2c(c1)OCCO2)c1cccc(O)c1O 126214888 JPWBVUFHCUKVKJ-UHFFFAOYSA-N 287.271 2.121 10 20 CECD CCOC(=O)[C@@H](C)[C@H](C)NCc1cc(F)ccc1O 184569005 LMUCOYQKLYPMFG-UWVGGRQHSA-N 269.316 2.209 10 20 CECD CCOc1cccc(CN2CCC[C@@](C)(C(=O)O)C2)c1O 86783752 NEMPMVXEEPBNJL-MRXNPFEDSA-N 293.363 2.478 10 20 CECD CSC1(CNC(=O)NCc2ccc(N(C)C)cc2)CC1 193694470 LVAJPCXOIVJOBS-UHFFFAOYSA-N 293.436 2.447 10 20 CECD CC[C@@H](NCc1cc(C)ccc1O)[C@H](O)C(F)(F)F 271015702 TVQPGSWEULOLKB-PWSUYJOCSA-N 277.286 2.492 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCC[C@H](C)CO)c1 273458019 HMOCWVUVROLPPV-NWDGAFQWSA-N 295.379 2.238 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H](CCO)C(C)C)c1 273462192 CXCWJHKHCYRTCL-FZMZJTMJSA-N 295.379 2.236 10 20 CECD COc1ccc(N2CCC(NC3(CO)CCC3)CC2)cc1 373199133 WKFKIXGKJBTADQ-UHFFFAOYSA-N 290.407 2.169 10 20 CECD CCCCN(CCC(=O)NC)Cc1ccccc1O 282486872 PJLYLWPJLKWUCY-UHFFFAOYSA-N 264.369 2.130 10 20 CECD O=C(NC[C@@H]1CC=CCC1)c1c(F)ccc(O)c1O 295038569 JBIRORJKSMFXRC-SECBINFHSA-N 265.284 2.323 10 20 CECD CCCCN1CC(=O)N[C@H]1c1cc(OCC)ccc1O 298772312 FSCXCYDZOBZPTQ-OAHLLOKOSA-N 278.352 2.021 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1cc2ccccn2n1 804377844 RBNMDRPKXIIHHL-FNORWQNLSA-N 295.298 2.397 10 20 CECD Oc1cccc(Cl)c1CN1CCC[C@@H](O)CC1 294243256 ZZHZFHNQHCGBPF-SNVBAGLBSA-N 255.745 2.392 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CN2CCOCC23CC3)c1O 802658927 UIKWXUNHHRTHDR-UHFFFAOYSA-N 298.726 2.319 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2OC)C[C@H](C)[S@@]1=O 809699235 LZUVTJYITZRZLD-ZBUHCNDUSA-N 297.420 2.132 10 20 CECD Cc1cc(CN2CC[C@@H](C)[S@](=O)CC2)ccc1N(C)C 815103729 XRLJRZJFQAOQAS-JLTOFOAXSA-N 294.464 2.404 10 20 CECD COC(=O)c1cc(C(C)(C)NCc2ccccc2O)no1 810165914 HLLVDWQUQXGAPU-UHFFFAOYSA-N 290.319 2.192 10 20 CECD Cc1cc(O)c(CN2C[C@@H](CO)C[C@@H](C)C2)cc1C 817413086 SWGOSUCSOFMMOP-RISCZKNCSA-N 263.381 2.459 10 20 CECD CC[C@@H](NC(=O)NCc1cccc(OC)c1O)C1CC1 822568072 ZJLMAOXLDLSXAV-GFCCVEGCSA-N 278.352 2.389 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](N)CC(F)F)cc1 827340733 JLHYIYDULSERFN-ZDUSSCGKSA-N 299.365 2.132 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1NCc1cc(Cl)c(C)cc1O 825384892 LIBKUUGZPQZSGF-DGCLKSJQSA-N 296.798 2.358 10 20 CECD COC1CCC(N(C)C(=O)c2cc(O)cs2)CC1 734555415 RXCFLPPYMUAEHM-UHFFFAOYSA-N 269.366 2.483 10 20 CECD CC1(NCc2ccc3c(c2)CCCO3)CCNCC1 904355512 OKVBWPRRIXFIQT-UHFFFAOYSA-N 260.381 2.243 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@H](C)C(=O)O 738265400 PZZFHBRJRKQTME-SNVBAGLBSA-N 292.360 2.359 10 20 CECD COC(=O)/C=C(/C)CSc1ncc(C(=O)OC)s1 917777515 JCVLYYWFNCMENU-DAXSKMNVSA-N 287.362 2.141 10 20 CECD CCC(C)(C)OCCNC(=O)/C=C/c1ccc(O)c(O)c1 837280806 JHIKGZZBAIMFBU-SOFGYWHQSA-N 293.363 2.432 10 20 CECD COCCC(C)(C)NCc1cc([N+](=O)[O-])ccc1O 747100493 ISFZQLWRYZWDQR-UHFFFAOYSA-N 268.313 2.205 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1cc(Br)ccc1O 841065570 QORIYQIMYJUYFN-CABZTGNLSA-N 299.212 2.385 10 20 CECD CCC(N)(CC)CNCc1cccc(OC)c1O 841030992 NDYAUFVPSDQYMC-UHFFFAOYSA-N 252.358 2.008 10 20 CECD Oc1ccc(Cl)cc1CNC(=S)NCC1CC1 849265824 STQBSZUTVXPAOQ-UHFFFAOYSA-N 270.785 2.420 10 20 CECD CCN(CC)c1ccc(CN2CCC[C@@H](N)C2)cc1 843043827 JKXMCXAXBJJRGH-OAHLLOKOSA-N 261.413 2.456 10 20 CECD CCOc1ccc(CN2CCC3(CCNC3)CC2)c(O)c1 843126915 NHGZRTAYLTVWCR-UHFFFAOYSA-N 290.407 2.366 10 20 CECD COc1cccc([C@H](C)NCCc2cnn(C)c2)c1O 846145319 PHVDHVLQBKJAMX-NSHDSACASA-N 275.352 2.028 10 20 CECD CCCNC(=O)CN[C@@H](C)c1ccc(Cl)cc1O 841744178 MQBPCWMEHAXHAQ-VIFPVBQESA-N 270.760 2.222 10 20 CECD CC[C@H](CN1CCOCC1)NCc1ccc(OC)c(C)c1 922588888 DHGPMIPKXHTSRU-MRXNPFEDSA-N 292.423 2.204 10 20 CECD COc1ccc(CNCCN(C)CC(F)F)cc1C 858336790 TVXNPUPWWKTGAE-UHFFFAOYSA-N 272.339 2.290 10 20 CECD C[C@H](NC1CCN(C)CC1)c1cc(F)cc(F)c1O 756360231 GMXVKHADTRQXAF-VIFPVBQESA-N 270.323 2.415 10 20 CECD Cc1cc(CN2CC[C@@]3(CCNC3)C2)ccc1N(C)C 923330654 BVDUALNLVMQQCG-QGZVFWFLSA-N 273.424 2.246 10 20 CECD CC[C@@H](NC)C(=O)N(C)Cc1ccc(N(CC)CC)cc1 852776164 LHWJLCNBHJGZPK-MRXNPFEDSA-N 291.439 2.489 10 20 CECD CO[C@@]1(C)C[C@H]1N[C@@H](C)c1cc(F)cc(F)c1O 850572014 XZEXPJWUVHOJRC-CQOUMUIBSA-N 257.280 2.498 10 20 CECD Cc1ccc([C@@H](C)NCCCn2cncn2)c(O)c1C 756829145 CWANXEXFHXVVHZ-CYBMUJFWSA-N 274.368 2.341 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)Cc2cnccn2)c1 756493447 FBIBUSJDCNPMLP-NEPJUHHUSA-N 287.363 2.473 10 20 CECD C[C@@H](NC(=O)N[C@@H]1CCN(C)[C@H](C)C1)c1ccccc1O 868374390 RBMHRNRPSHHQQW-JHJVBQTASA-N 291.395 2.235 10 20 CECD Nc1ccc(OCc2cn(C[C@H]3CCCCO3)nn2)cc1 864645093 TYIBLZDJQXDIDY-OAHLLOKOSA-N 288.351 2.008 10 20 CECD CC(C)[C@H]1CCCN1Cc1cc2c(cc1O)OC[C@H]2O 768441715 GPDILEMOADUJQJ-UKRRQHHQSA-N 277.364 2.438 10 20 CECD C[C@@H](NC1CCN(C(=O)N(C)C)CC1)c1ccccc1O 877756292 FMQPXHHMDRWOKI-GFCCVEGCSA-N 291.395 2.189 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CC23CCC3)c1O 876428917 QPLBODJGNAEUFI-LBPRGKRZSA-N 276.336 2.143 10 20 CECD Cc1ccc(CN2CCCC[C@H]2C2OCCO2)c(O)c1 876680297 ZFAXEFMKAYNDEM-AWEZNQCLSA-N 277.364 2.428 10 20 CECD C[C@H](NC(=O)c1ncccc1O)c1ccc(N(C)C)cc1 776270468 UCXPDQRHIKKWGI-NSHDSACASA-N 285.347 2.344 10 20 CECD CCOC(=O)CCN(Cc1cc(OC)ccc1O)C1CC1 775665017 WPMPOZXNSPJBHQ-UHFFFAOYSA-N 293.363 2.318 10 20 CECD CCCN1C[C@@H](CN[C@H](C)c2c(O)cccc2F)CC1=O 886628617 XIFZNOLIJZLSEX-VXGBXAGGSA-N 294.370 2.440 10 20 CECD CC(C)(C(=O)NCc1cccc(O)c1O)C1CCOCC1 1123890239 VXJMBYKVEUACIJ-UHFFFAOYSA-N 293.363 2.167 10 20 CECD CCC(O)(CC)CCNCc1ccc(OC)c(OC)c1O 893951305 TUPDACCPJVGGPL-UHFFFAOYSA-N 297.395 2.440 10 20 CECD Cc1cccc(CN2[C@H](C)C(=O)N(C)[C@H](C)[C@H]2C)c1O 895919261 DZTKFHKSXWQRBO-JHJVBQTASA-N 276.380 2.140 10 20 CECD CN(C)C1CCC(NCc2cc([N+](=O)[O-])ccc2O)CC1 796740856 CZFYGGHASXCSED-UHFFFAOYSA-N 293.367 2.263 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 89636715 OSRWJNDJKVYKHV-STQMWFEESA-N 298.452 2.226 10 20 CECD C[C@H](NC[C@H]1CC[C@H](O)C1)c1ccc(F)cc1O 189307780 UCGPYFQZAAQSGT-NHCYSSNCSA-N 253.317 2.343 10 20 CECD Nc1ccc(CNC(=O)NC[C@@H]2CC=CCC2)cc1 1335424724 AKZCDSAKXNOPDQ-GFCCVEGCSA-N 259.353 2.424 10 20 CECD Nc1ccc(CNC(=O)NCC2Cc3ccccc3C2)cc1 1336975540 PWWOFLLKUGONGO-UHFFFAOYSA-N 295.386 2.483 10 20 CECD O=C(NCc1ccccc1O)c1cccc2[nH]ncc12 769363001 DHXFWFPUZSATFK-UHFFFAOYSA-N 267.288 2.199 10 20 CECD CCOC[C@H]1CCN(Cc2c(O)cccc2OC)C1 769531922 FWVBUFOPKGXQBO-LBPRGKRZSA-N 265.353 2.259 10 20 CECD CC(C)c1oncc1C(=O)NCCc1ccc(O)c(O)c1 1351667633 YEACIBJDGGSUSP-UHFFFAOYSA-N 290.319 2.182 10 20 CECD CCC(N)(CC)CN[C@@H](C)c1cc(C(=O)O)ccc1O 1609927056 RTQFQRSNSMXCLF-JTQLQIEISA-N 280.368 2.259 10 20 CECD CN(C)c1ccc(CNc2cc(CC(=O)O)ccn2)cc1 1606055373 GKGPKIIWYGDDLJ-UHFFFAOYSA-N 285.347 2.387 10 20 CECD CCN(C)c1ccc(CN(CC)[C@H](C)C(=O)O)cc1 1573875607 VKLAHTZILKHESL-GFCCVEGCSA-N 264.369 2.438 10 20 CECD CCN1C(=O)/C(=C\c2ccc(C(=O)O)nc2)SC1=S 1776874042 JFUJLQCGPWRPON-WEVVVXLNSA-N 294.357 2.001 10 20 CECD Nc1ccc(NC(=O)NC[C@H]2CCCS2)cc1 150025352 HIFFPEBRVRDEAG-LLVKDONJSA-N 251.355 2.286 10 20 CECD COCC(C)(C)C(=O)NCc1ccc(N(C)C)cc1C 152098169 YRMVADYNXJYSEQ-UHFFFAOYSA-N 278.396 2.350 10 20 CECD O=C(COc1ccc(N2CCCC2)cc1)NCC1CC1 154443885 ZSDMSUKKSJLLQP-UHFFFAOYSA-N 274.364 2.192 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)c1cccs1 159641371 KQTCFMIOTRUKHQ-UHFFFAOYSA-N 283.374 2.274 10 20 CECD CN1CC[C@@H]1CNCc1ccc(N2CCCC2)cc1 712572001 LCSXVZXSSVECPF-MRXNPFEDSA-N 259.397 2.081 10 20 CECD OC[C@H](NCc1cc(F)ccc1O)C1CCCC1 386259055 MHHOOVYGCRBVBK-ZDUSSCGKSA-N 253.317 2.172 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)c1csnn1 398252500 ONDKZUTUNLGIOA-SECBINFHSA-N 261.350 2.324 10 20 CECD Cc1oc(C(=O)O)cc1COc1ccccc1CO 110992314 BFYXFUMWULSOIE-UHFFFAOYSA-N 262.261 2.358 10 20 CECD Cc1cccnc1CNC(=O)c1ccc(C)c(O)c1O 179482543 ISLOQCJPSRXYDT-UHFFFAOYSA-N 272.304 2.040 10 20 CECD CCCOc1ccc(CNC[C@@](C)(O)CC)c(O)c1 111384889 CNZQYCWUYQMFCK-HNNXBMFYSA-N 267.369 2.432 10 20 CECD CCCC(O)(CCC)CNC(=O)c1ccc(C)c(O)c1O 179510426 NDMUNDRGAKOKNL-UHFFFAOYSA-N 295.379 2.467 10 20 CECD CC[C@@](C)(CCO)NC(=O)NCc1ccc(N(C)C)cc1 305089235 WBZFWKVXQPYLKK-INIZCTEOSA-N 293.411 2.103 10 20 CECD COCc1nsc(NCc2ccc(N(C)C)cc2)n1 301444701 OWVYUTCJQPANLS-UHFFFAOYSA-N 278.381 2.363 10 20 CECD Cc1ccc(C(=O)NCC(=O)c2cccs2)c(O)c1O 182948269 UNLMNYZZZPYISJ-UHFFFAOYSA-N 291.328 2.080 10 20 CECD OC[C@H]1CC[C@H](NCc2ccc3c(c2)CCO3)CC1 153144813 DJQHGGZADDOKKX-JNSHFYNHSA-N 261.365 2.262 10 20 CECD C[C@H](O)CC(C)(C)CNC(=O)N(C)Cc1ccccc1O 74547972 AFFFJVRCXVXSRE-LBPRGKRZSA-N 294.395 2.331 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H](CO)C2)c1O 184669895 UVGDCDNXMBAMST-JTQLQIEISA-N 285.771 2.259 10 20 CECD CCOC(=O)N1CC[C@H](N[C@H](C)c2ccccc2O)C1 186443166 IIUHGQFNEBRJST-NEPJUHHUSA-N 278.352 2.274 10 20 CECD Cc1ccc(C(=O)N2CCS[C@H](C)CC2)c(O)c1O 191945912 NDNJWHVIQDELQA-SNVBAGLBSA-N 281.377 2.374 10 20 CECD O=S(=O)(Nc1ccc(O)cc1Cl)N1CCCCC1 85205208 BJXSCFDVTXPOBW-UHFFFAOYSA-N 290.772 2.188 10 20 CECD COc1cccc(CN(C)CC2(O)CCCC2)c1O 93503164 LEVOLUDXJROJRZ-UHFFFAOYSA-N 265.353 2.138 10 20 CECD CC[C@H](O)CN(Cc1ccccc1O)C[C@H]1CCCO1 268573878 RQSUQNCUCJUYMU-LSDHHAIUSA-N 279.380 2.144 10 20 CECD C[C@@H](NCCC1(C)OCCO1)c1ccc(F)cc1O 183885887 QPSGFTQMNFFYBY-SNVBAGLBSA-N 269.316 2.335 10 20 CECD O=C(NCc1ccccc1O)N[C@H]1CCCSC1 267301606 KRDANAGVLNBWOW-NSHDSACASA-N 266.366 2.087 10 20 CECD CC[C@H](C)[C@@H]1NC(=O)N(Cc2ccc(N(C)C)cc2)C1=O 272127330 RGNFNCLGRACORA-FZMZJTMJSA-N 289.379 2.219 10 20 CECD Cc1n[nH]c(C)c1[C@H]1COCCN1Cc1ccccc1O 368461529 JEJWTSKKHFZQOF-CQSZACIVSA-N 287.363 2.306 10 20 CECD CCCc1nnc(NC(=O)c2ccc(C)c(O)c2O)s1 272760496 LIXHTDKUIQGQCL-UHFFFAOYSA-N 293.348 2.463 10 20 CECD CC(C)N1C[C@@H](N[C@H](C)c2ccc(F)cc2O)CC1=O 273461804 IHDAUCQFXPGTEF-PWSUYJOCSA-N 280.343 2.191 10 20 CECD 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756762406 ZMYIJZGFVORLBC-QMMMGPOBSA-N 259.296 2.340 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C[C@H]1COC(C)(C)O1 851880577 DOORTYZVCBEUOE-ZDUSSCGKSA-N 292.379 2.103 10 20 CECD CC[C@H](NC[C@H]1COCCO1)c1ccc(N(C)C)cc1 765250306 JCCMBIGQXUVDHI-HOTGVXAUSA-N 278.396 2.209 10 20 CECD C[C@H]1C[C@@H](N[C@H]2C[C@@H](CO)C2)c2c(O)ccc(F)c21 866415922 IKSAVTGBIUBVEL-UXCLJVHYSA-N 265.328 2.440 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)C2(CO)CC2)c1 696063726 PDHNDDBKTYQRIL-QWRGUYRKSA-N 265.353 2.212 10 20 CECD CCN(CC)c1ccc(CNC(=O)/C=C\COC)cc1 864927744 ZBJLHMKYJSJTMV-SREVYHEPSA-N 276.380 2.352 10 20 CECD CN(C)c1ccc(CN[C@H](CCO)C2CCOCC2)cc1 763467822 TUEXCPYLBCCWIQ-QGZVFWFLSA-N 292.423 2.020 10 20 CECD CCCOc1ccc(CNC[C@@H]2CNC(=O)C2)cc1C 873131709 XOPIAAWWESFPBD-CQSZACIVSA-N 276.380 2.010 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H](N)CCC(C)C 876767476 KGRYSJVJHZBWMR-MRXNPFEDSA-N 291.439 2.441 10 20 CECD CCCOc1ccc(CNC[C@@H](F)C(=O)O)cc1C 871874065 DHDBIWNDERWIOQ-GFCCVEGCSA-N 269.316 2.296 10 20 CECD c1nc2cncc(NCc3ccc(N4CCCC4)cc3)n2n1 782949188 ZTOGMLMUFCEMOF-UHFFFAOYSA-N 294.362 2.337 10 20 CECD CCOc1ccc(O)c(CN[C@]2(CC)CCOC2)c1 791005217 QGTRGHVWPCFTEG-OAHLLOKOSA-N 265.353 2.450 10 20 CECD CC(=O)NCCC1=CCN(c2ccc([N+](=O)[O-])cc2)CC1 1089801955 BQTZHJUNKGAFJY-UHFFFAOYSA-N 289.335 2.258 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H]1CN(C)C(=O)O1 1343890522 UQGSBFKPSMSUBZ-ZDUSSCGKSA-N 278.352 2.055 10 20 CECD COC[C@@H](C)N1CCCN(c2ccc(OC)cc2)CC1 75643588 OVSHETRLXUDSEI-CQSZACIVSA-N 278.396 2.242 10 20 CECD C[C@H](NCCC1CC(O)C1)c1ccc(F)cc1O 702450171 KRNRIBHWKOOZQP-BMQDGWLCSA-N 253.317 2.343 10 20 CECD CC(C)[C@@H](N)CNCc1ccc(N2CCCC2)cc1 1325610227 GVNVMRNJQRUDAV-INIZCTEOSA-N 261.413 2.360 10 20 CECD CN(C)c1ccc(CNCc2cnn(C)c2Cl)cc1 712402910 UVNMHCKOADFLPE-UHFFFAOYSA-N 278.787 2.429 10 20 CECD Cc1noc(C)c1CN(C)C(=O)NCc1ccc(N)cc1 1335738153 WQZDWYWHWMMQCV-UHFFFAOYSA-N 288.351 2.215 10 20 CECD Oc1cccc(Cl)c1CN1CCO[C@@H]([C@@H]2CCCO2)C1 770304373 MLNIWOYNVCCFIS-LSDHHAIUSA-N 297.782 2.425 10 20 CECD CC(C)(C(=O)NCc1cccc(O)c1O)c1cccnc1 1347235818 XIXBIOANCDSBRQ-UHFFFAOYSA-N 286.331 2.087 10 20 CECD CS[C@@H]1CC[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 1344100349 YYZQSDGYQVMOFM-JGVFFNPUSA-N 285.340 2.251 10 20 CECD CC(C)[C@@H](C)NC(=O)CSc1ncc(C(=O)O)s1 1603720961 GPFKWKPUMHLZIJ-SSDOTTSWSA-N 288.394 2.094 10 20 CECD CC[C@H](C)C[C@H](NCc1cc(OC)ccc1O)C(=O)O 1604952175 OXVUMPKHWMSAPL-GWCFXTLKSA-N 281.352 2.380 10 20 CECD CO[C@H]1CCN(Cc2cc(C)c(C)cc2O)[C@@H](C(=O)O)C1 1610237948 QWMZEHBDPHYWKV-UONOGXRCSA-N 293.363 2.073 10 20 CECD O=C1CC[C@@H]2CN(C(=O)C3=CCCNCC3)c3cccc1c32 1580844212 WNRIPPMJYZDYES-CYBMUJFWSA-N 296.370 2.403 10 20 CECD CCO[C@@H]1C[C@@H](NC(=O)Cc2ccc(N)cc2)C12CCC2 160990516 KUAWBPOWLANSNN-HUUCEWRRSA-N 288.391 2.275 10 20 CECD CC(C)(C)n1cc(C(=O)NCCc2ccc(N)cc2)cn1 152483547 UTJWAHHAYKUDMA-UHFFFAOYSA-N 286.379 2.193 10 20 CECD CN1CCCc2cc(CNCc3ccon3)ccc21 148743730 ODZLHBQBEGDMCU-UHFFFAOYSA-N 257.337 2.347 10 20 CECD CCNC(=O)[C@H](C)NCc1ccc(N(CC)CC)cc1 35134264 ZMBBXKXCEPERIW-ZDUSSCGKSA-N 277.412 2.147 10 20 CECD Nc1ccc(CC(=O)NCCOc2ccccc2)cc1 42894414 IPBZFLNQOMLSCH-UHFFFAOYSA-N 270.332 2.007 10 20 CECD CC[C@H](NCC(C)(C)OCCO)c1ccccc1O 287520123 ZOYPTLLSENGVSP-ZDUSSCGKSA-N 267.369 2.220 10 20 CECD Cc1nnsc1CNCc1ccc2c(c1)CCO2 291677721 HHYLMIOPMOGIMP-UHFFFAOYSA-N 261.350 2.071 10 20 CECD CCOc1cccc(CNC[C@H](C)CCCO)c1O 294777109 KRZTUVBABOQEQE-GFCCVEGCSA-N 267.369 2.289 10 20 CECD Cc1ccc([C@H](C)NCCCC(=O)N(C)C)c(O)c1 185194368 FCJLHLQTPWNDEP-LBPRGKRZSA-N 264.369 2.220 10 20 CECD CCCOCCOC(=O)NCc1ccccc1O 385754795 SLXKSFLXFYLIKK-UHFFFAOYSA-N 253.298 2.045 10 20 CECD Oc1ccc(F)cc1CN1CC[C@@H]2OCC[C@@H]2C1 724814796 VPLBGMNMGHCRQS-YGRLFVJLSA-N 251.301 2.142 10 20 CECD COc1ccc(N(C)Cc2cc(=O)c(O)co2)cc1F 121745502 TXYXFMWITPAKPM-UHFFFAOYSA-N 279.267 2.130 10 20 CECD Cc1ccc2c(c1)OCCN2C(=O)/C=C/c1cnn(C)c1C 123935637 UHOAWWDHLRIIRD-FNORWQNLSA-N 297.358 2.476 10 20 CECD Cc1ncccc1C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183440428 YMFOXNVRRWEBIX-JTQLQIEISA-N 286.331 2.162 10 20 CECD CC[C@H](NC[C@@H](O)C(F)(F)F)c1ccccc1O 121940045 APXWNDPNLGESII-GXSJLCMTSA-N 263.259 2.356 10 20 CECD Cc1ccc([C@@H](C)NCCC(=O)NC(C)C)c(O)c1 181270199 YZGGXOZHFBTXAW-GFCCVEGCSA-N 264.369 2.266 10 20 CECD CS[C@H](CO)[C@H](C)N[C@@H](C)c1cc(F)ccc1O 185512169 RZFVVKSISSIFOP-MWODSPESSA-N 273.373 2.294 10 20 CECD Cc1ccc(CCNC(=O)c2ccc(C)c(O)c2O)cn1 182424487 PJWVPRACZLCMMV-UHFFFAOYSA-N 286.331 2.082 10 20 CECD CCCCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 183474673 UZLBBSZUFDUSBU-JTQLQIEISA-N 251.326 2.335 10 20 CECD CCC[C@H]1C[C@@H](C(=O)NCc2ccc(O)c(O)c2)CCO1 182838317 KYRLZJOZSPLBSX-STQMWFEESA-N 293.363 2.309 10 20 CECD CCOc1cccc(CN2CCCO[C@H](C)C2)c1O 134158983 FLNNXAHQNAQPFG-GFCCVEGCSA-N 265.353 2.402 10 20 CECD Nc1ccc(CCNC(=O)CCC(F)(F)F)cc1 88832479 NGSULIYRIIZKLM-UHFFFAOYSA-N 260.259 2.270 10 20 CECD COc1ccccc1N(C)C(=O)/C=C\c1cnn(C)c1 48656367 AUGJLMDABFXPBG-HJWRWDBZSA-N 271.320 2.105 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccc(Cl)cn1 95995282 XHFHZEOMSORYQC-UHFFFAOYSA-N 278.695 2.076 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](CO)C2)cc1F 92763697 MBKHIGRXPYCJTA-CQSZACIVSA-N 280.387 2.486 10 20 CECD C[C@H](CC(=O)Nc1ccc(N)cc1)[C@@H]1CCCNC1 237468171 FKDRRVDWCAYFNR-VXGBXAGGSA-N 261.369 2.233 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCOC2(CCC2)C1 269287830 SZWLSAJVLVTRIS-CYBMUJFWSA-N 290.363 2.293 10 20 CECD CSc1ccccc1C(=O)N1CC[S@](=O)[C@H](C)[C@@H]1C 265493018 ILSLUNIBBRVORK-QQKBFRNYSA-N 297.445 2.390 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C(C)(C)F 271056451 TXKUWULLGKHDIV-UHFFFAOYSA-N 252.333 2.459 10 20 CECD Cc1cccc2c1OC[C@H](NC(=O)c1cccc(O)c1O)C2 366288711 QTCHZVTZCHQUFB-GFCCVEGCSA-N 299.326 2.140 10 20 CECD CCCN(CCC)c1ccc(CN[C@@H](CO)COC)cc1 279927610 XWGCVQYOUNABEJ-INIZCTEOSA-N 294.439 2.410 10 20 CECD COCCCCN[C@H](C)c1cc(C(=O)OC)ccc1O 273444804 ZSVVLTUHBYAIAF-LLVKDONJSA-N 281.352 2.256 10 20 CECD Cc1cc(O)c(CN2CCOCC(F)(F)C2)cc1C 288453900 FXCQWBYZSIKILD-UHFFFAOYSA-N 271.307 2.477 10 20 CECD Cc1noc(C)c1C(C)(C)NC(=O)c1cccc(O)c1O 286277878 DUUMETUBLGJXGP-UHFFFAOYSA-N 290.319 2.368 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H](CO)C(C)C)c1 806168902 DWQAJQSXXOUADN-DGCLKSJQSA-N 295.379 2.094 10 20 CECD C[C@@H](NCc1ccc(N2CCCC2)cc1)c1ncn(C)n1 391937835 LPSSFGDXOLDGTP-CYBMUJFWSA-N 285.395 2.266 10 20 CECD CC[C@@H](NCCCc1cnn(C)n1)c1ccccc1O 293766529 RSGLUZGWUJSXIC-CQSZACIVSA-N 274.368 2.194 10 20 CECD CC[C@H](NCCc1ccc(N)cc1)c1nccn1C 817957455 MGOWFDYEDOEIGJ-AWEZNQCLSA-N 258.369 2.286 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H]3CCO[C@H]3C)C2)cc1 818221458 MUFAEKODGHTQQA-JJRVBVJISA-N 290.407 2.289 10 20 CECD OCCOCCN(Cc1cc(Cl)ccc1O)C1CCC1 827210901 SVSDSNJWVJKHMI-UHFFFAOYSA-N 299.798 2.409 10 20 CECD C[C@@H](NC(=O)c1cc2n(n1)CCC2)c1ccc(N(C)C)cc1 828863145 ZSORPYJDYFLUJN-GFCCVEGCSA-N 298.390 2.386 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H](N)C(C)C)cc1 826020024 NXIDUDDCDOMRQQ-INIZCTEOSA-N 291.439 2.475 10 20 CECD CCOc1ccc(O)c(CN(CC(=O)O)C(C)C)c1 820387506 RTZXPASMCXFUCK-UHFFFAOYSA-N 267.325 2.086 10 20 CECD CCCN(C)CC(=O)NCCCSc1nccs1 736680503 MPIGNKWZFNNXKK-UHFFFAOYSA-N 287.454 2.083 10 20 CECD CCN(C)c1ccc(CN[C@@](C)(C(N)=O)C(C)C)cc1 839007331 GNZVZWNYSLAWMM-MRXNPFEDSA-N 277.412 2.132 10 20 CECD CCN(CC)c1ccc(CNCCCON)cc1F 904458217 VNJAUPRJGQOEAB-UHFFFAOYSA-N 269.364 2.042 10 20 CECD COc1ccc(O)c([C@@H](C)NC/C=C(\C)C(=O)O)c1 833733170 AXPGVAXJJFCZMA-OLKPEBQYSA-N 265.309 2.082 10 20 CECD CC(C)[C@@H](C)C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 832272294 DUZCMNIMNRMUPT-DOMZBBRYSA-N 277.412 2.161 10 20 CECD Oc1cccc2c1[C@H](NCCOc1cccnc1)CC2 834585156 HLOYGSFZFNMPDX-CQSZACIVSA-N 270.332 2.443 10 20 CECD C[C@H]1CCCCN1NC(=O)/C=C/c1ccc(O)c(O)c1 912147764 NWACGTGRBNPTNY-IOCXFXADSA-N 276.336 2.017 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H]2NCC[C@@H]2C1 843125915 CLJWJPXDSSWJEJ-NVXWUHKLSA-N 273.424 2.245 10 20 CECD CCN1CC[C@@H](CN[C@H](C)c2cccc(OC)c2O)C1 846142286 ZVKIHDFJTONYLT-OLZOCXBDSA-N 278.396 2.393 10 20 CECD CN(C)c1ccc(CN2CCO[C@H](CF)C2)cc1F 840955172 RPJWMBADTIFVNK-GFCCVEGCSA-N 270.323 2.062 10 20 CECD Oc1cccc(Cl)c1CNC[C@H]1CCCNC1 841033404 SZLYSKDTCDOBFN-JTQLQIEISA-N 254.761 2.135 10 20 CECD O=C(NCc1ccccc1O)c1c[nH]c2ccccc2c1=O 748345628 FVCCXSHENTUDOZ-UHFFFAOYSA-N 294.310 2.164 10 20 CECD Cc1ccc(O)c(CN2CCNC[C@@H]2c2ccncc2)c1 843120473 MFKSOCUWHCPQRN-MRXNPFEDSA-N 283.375 2.242 10 20 CECD CO[C@@]1(C)C[C@H]1NC(=O)c1cc(C)n(-c2ccccn2)c1C 856270421 NHSBTNGBXGBAJZ-PBHICJAKSA-N 299.374 2.396 10 20 CECD CCN(C)c1ccc(CN2Cc3nc(C)nc(O)c3C2)cc1 931313589 MJWVYLJWIRMBMR-UHFFFAOYSA-N 298.390 2.463 10 20 CECD CN1C(=O)N(Cc2ccc(N3CC=CC3)cc2)C(=O)C1(C)C 761361466 MTVRPXZQRGMFHW-UHFFFAOYSA-N 299.374 2.235 10 20 CECD CC(C)[C@@H]1NC(=O)N([C@@H](C)c2ccc(N(C)C)cc2)C1=O 761582047 ZCYYAUULYMBQNK-FZMZJTMJSA-N 289.379 2.390 10 20 CECD O=C(c1cccc(O)c1O)N1CCO[C@@H](c2ccccc2)C1 776355598 OWYBRCBNBRRYGL-OAHLLOKOSA-N 299.326 2.312 10 20 CECD OCCN(Cc1cc(F)ccc1O)C1CCCC1 778988293 GGDLBIUGPAOGHH-UHFFFAOYSA-N 253.317 2.268 10 20 CECD CCCOc1ccc(CN[C@@H]2COC[C@@H]2OC)cc1C 873130794 LCJJUUXLJBCIDG-ZBFHGGJFSA-N 279.380 2.287 10 20 CECD O=S(=O)(NCc1ccc(N2CCCC2)cc1)C1CCC1 881786743 ZEQVOJRNKKJDPK-UHFFFAOYSA-N 294.420 2.259 10 20 CECD CCOC(=O)CCN(Cc1ccc(N)cc1)C(C)C 1120371819 RIOKFXGPSAANFV-UHFFFAOYSA-N 264.369 2.432 10 20 CECD COc1cc(Cl)cc(CN2C[C@H](O)C[C@H]2C)c1O 788268593 GKOWXGAKLVDDLX-LDYMZIIASA-N 271.744 2.009 10 20 CECD CCOc1ccc(CN[C@H](C)C[C@@H](C)O)c(O)c1 782977133 BYRIHBZSDVLKOB-GHMZBOCLSA-N 253.342 2.040 10 20 CECD Cc1cc(C)c([C@H](C)NCCN2CCOC[C@@H]2C)c(O)c1 788586604 DQHDVJVOQPFDCE-GJZGRUSLSA-N 292.423 2.380 10 20 CECD COc1cc(O)c(CNC/C=C\Cl)cc1OC 898434295 VCUNLUKKQFMHQU-ARJAWSKDSA-N 257.717 2.252 10 20 CECD COc1cc(C)cc(CNC[C@@]2(O)CCC[C@@H]2C)c1O 894865129 MRJNXHJMXKNKFD-LRDDRELGSA-N 279.380 2.350 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1cccc2c1OCO2 782829457 VRFGFSLTGSOIBR-ALCCZGGFSA-N 299.282 2.478 10 20 CECD CCC1(O)CCN(Cc2ccc(OC)c(OC)c2O)CC1 892105679 NREQKEMOUUOFSF-UHFFFAOYSA-N 295.379 2.146 10 20 CECD C/C=C\C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C 891247712 UMGMOJLKGICFPP-XHPSBEMXSA-N 275.396 2.048 10 20 CECD COc1cc(C)cc(CN2CCCCC[C@H]2CO)c1O 895151310 SKYAXBZWXDIKCC-AWEZNQCLSA-N 279.380 2.446 10 20 CECD O=C(OCc1cnc(Cl)cn1)c1cc(O)cs1 798615433 JVVCFIGJPVVITL-UHFFFAOYSA-N 270.697 2.254 10 20 CECD Cc1nc2c(C(=O)NCc3ccc(O)c(O)c3)cccc2o1 792237432 DKTQMJVGSWCAIC-UHFFFAOYSA-N 298.298 2.477 10 20 CECD O=C(NCc1ccccc1O)Nc1cncc(F)c1 799235255 BPGMOPHVGRFSFW-UHFFFAOYSA-N 261.256 2.248 10 20 CECD CN(C)c1ccc(CN2CC[C@H](CCC(=O)O)C2)cc1 134704537 WKJCZTPHRUTZDB-AWEZNQCLSA-N 276.380 2.439 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1ccc(F)cc1O 186029890 OAINZQAJJNTLQL-NXEZZACHSA-N 289.372 2.005 10 20 CECD CC(C)(C)OCCCNC(=O)c1cccc(O)c1O 709853242 ITCJWIYPUIMNGF-UHFFFAOYSA-N 267.325 2.033 10 20 CECD CC(C)C[C@H]1COCCN1C(=O)NCc1ccc(N)cc1 1262603774 UTAYYJIVMWLWRG-HNNXBMFYSA-N 291.395 2.225 10 20 CECD CC[C@H](NC(=O)NCc1ccc(N)cc1)[C@@H]1CCCO1 1346406606 ZOELNQNNTMLDID-KBPBESRZSA-N 277.368 2.026 10 20 CECD CON(C)C(=O)[C@H](C)N[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 1351353566 RQEZRTWEWXDNLC-WOPDTQHZSA-N 292.379 2.247 10 20 CECD CN(C)c1ccc(/C=C\CN2CC[C@H]3CNC[C@H]32)cc1 1578425770 LVYRUDABAKCAIR-OEQZANGBSA-N 271.408 2.060 10 20 CECD CC[C@]1(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CCCN1 1577195979 OOPWVIVEDKICKV-SUMWQHHRSA-N 289.423 2.462 10 20 CECD COC[C@H](C)CN[C@H](C)c1cc(C(=O)O)ccc1O 1599157331 RCWOGXVSMJPVNF-NXEZZACHSA-N 267.325 2.024 10 20 CECD CCN(CC)c1ccc(CN[C@H](CCO)COC)cc1 219132080 KNVPDXBVQAWVBC-OAHLLOKOSA-N 280.412 2.020 10 20 CECD CN(C)c1ccc(CN[C@]2(C(=O)O)CCC[C@@H]3C[C@H]32)cc1 1777039916 AQZCOQULOZBCJG-FRFSOERESA-N 288.391 2.486 10 20 CECD COc1cc(CN(C)[C@H](C)C(=O)OC(C)C)c(O)cc1C 160409743 QAXFWRMQFZCMHB-GFCCVEGCSA-N 295.379 2.481 10 20 CECD C[C@H](NC[C@H]1CCOC1)c1ccc(N2CCOCC2)cc1 153088448 HGVYOCIHPALRCV-LSDHHAIUSA-N 290.407 2.210 10 20 CECD CCn1nccc1C(=O)N[C@H](C)c1ccccc1O 827940686 HTIROAMLCPWBRO-SNVBAGLBSA-N 259.309 2.100 10 20 CECD CC(C)NC(=O)CCN[C@@H](C)c1ccc(F)cc1O 181270516 NMLCLKQQWWGBBO-JTQLQIEISA-N 268.332 2.097 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CO[C@@H](C)C2)c1O 402008575 RIYOXBRVZOEFBJ-KWQFWETISA-N 271.744 2.321 10 20 CECD C[C@@H](NC1CCC(N)CC1)c1ccc(F)cc1O 62748446 IRYCZULIEDQAHY-OIKLOGQESA-N 252.333 2.452 10 20 CECD CCC[C@](C)(O)C(=O)NCCCSc1nccs1 125882246 KLRZISNWYNAUER-LBPRGKRZSA-N 288.438 2.293 10 20 CECD Cc1cccc(NC(=O)/C=C/c2ccc(O)c(O)c2)n1 180937108 PWSJRUSAXZWJEZ-SOFGYWHQSA-N 270.288 2.453 10 20 CECD COC[C@@H]1CN(Cc2cc(C)cc(C)c2O)C[C@H](C)O1 190214107 PNOUJDFXCMUURG-ZFWWWQNUSA-N 279.380 2.245 10 20 CECD COc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1 98074438 FAKHLFHAZMTVEI-UHFFFAOYSA-N 287.315 2.079 10 20 CECD Cc1c(CNC(=O)c2cnns2)n(C)c2ccccc12 342358215 ICOBJSXEAKTPCQ-UHFFFAOYSA-N 286.360 2.268 10 20 CECD CCN1CCCC[C@H]1CNC(=O)NCc1ccccc1O 264733216 HASJNBWXGDOYKQ-AWEZNQCLSA-N 291.395 2.066 10 20 CECD Cc1cccc(CN[C@@H]2COc3ccccc3[C@H]2O)c1O 368133455 URJYARALXSUHDQ-RHSMWYFYSA-N 285.343 2.285 10 20 CECD CC1CCN(C(=O)c2c(F)ccc(O)c2O)CC1 276675555 OECOQRDMPFLVDY-UHFFFAOYSA-N 253.273 2.109 10 20 CECD COC(=O)C[C@@H]1CC[C@@H](NCc2ccccc2O)[C@@H]1C 280901008 OLBXEXJWSOVKNL-MBNYWOFBSA-N 277.364 2.460 10 20 CECD Cc1cccc(CN2CCC[C@H](S(C)(=O)=O)CC2)c1O 800534162 XHFNDGWBMWDILT-AWEZNQCLSA-N 297.420 2.100 10 20 CECD CCOCCCCNC(=O)NCc1ccccc1O 299546636 WMNDLTUPAVIOJV-UHFFFAOYSA-N 266.341 2.008 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2sccc2C)o1 808021620 UECXFZDMVJBNMA-UHFFFAOYSA-N 282.346 2.357 10 20 CECD CC(=O)C(=O)CSc1n[nH]c(/C=C\c2ccc(C)o2)n1 808020173 ASLZZBISMNYPAO-WAYWQWQTSA-N 291.332 2.127 10 20 CECD COc1ccc(CN[C@H](C)c2ccc(N(C)C)cc2)nn1 801544754 UGTMVLHDZMRQEF-GFCCVEGCSA-N 286.379 2.402 10 20 CECD CCCCC(=O)N(CC(=O)OCC)Cc1ccccc1O 819693394 OPSNCHWCZIPLGI-UHFFFAOYSA-N 293.363 2.474 10 20 CECD CC[C@@H](NC[C@]1(COC)CCCN1)c1ccccc1O 817973369 DSFRTBPRJLBPTI-ZBFHGGJFSA-N 278.396 2.202 10 20 CECD Nc1ccc(CCN[C@H]2CCN3CCC[C@@H]3C2)cc1 817956215 TZCPJOUWFIERLR-JKSUJKDBSA-N 259.397 2.028 10 20 CECD CCOc1ccc(CN[C@H](CC)[C@@H](C)O)c(O)c1 824921747 PQVHBLCLROEXSJ-ZWNOBZJWSA-N 253.342 2.040 10 20 CECD Cc1cc(CCC(=O)N[C@H](C)c2ccccc2O)no1 828539336 MNCDMONZBXFIHA-LLVKDONJSA-N 274.320 2.499 10 20 CECD COc1ncc(/C=C\C(=O)N(C)c2ccccc2F)cn1 492741713 UAPORZIGIIEEOT-FPLPWBNLSA-N 287.294 2.301 10 20 CECD CNC(=O)[C@@H]1CCCCN1Cc1cc(Cl)c(C)cc1O 824560983 NSQFUWVIFRKDLZ-ZDUSSCGKSA-N 296.798 2.455 10 20 CECD CO[C@H]1CN(Cc2cc(Cl)c(C)cc2O)C[C@H]1OC 825693025 RLJXETUWJXWTMX-OKILXGFUSA-N 285.771 2.200 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C3OCCO3)C2)cc1C 905693786 DCFYTFHLMYDACL-ZDUSSCGKSA-N 277.364 2.204 10 20 CECD CC(C)OC[C@H](C(=O)O)N(C)Cc1ccc(N(C)C)cc1 833504537 CTUBDWFHXHCMQL-OAHLLOKOSA-N 294.395 2.063 10 20 CECD CCOc1cccc(CN[C@@H](C)[C@H](O)C(F)(F)F)c1O 865711405 NKEZEXMQLFENII-UFBFGSQYSA-N 293.285 2.192 10 20 CECD NCCc1ccc(CNCc2cccc(F)c2O)cc1 841032594 UIHRIIHEBPYMJR-UHFFFAOYSA-N 274.339 2.322 10 20 CECD CC1(NCc2cccc(Br)c2O)CCNCC1 841065333 OCCDELVVGJBDMU-UHFFFAOYSA-N 299.212 2.386 10 20 CECD C[C@H](NCC[C@@]1(O)CCCOC1)c1cc(F)ccc1O 846214134 SKEUTHVDMOFDAV-NHYWBVRUSA-N 283.343 2.114 10 20 CECD C[C@@]1(CNC(=O)Nc2ccc(N)cc2)CCCC[C@H]1O 841298441 AANZZFVESZDMQQ-HIFRSBDPSA-N 277.368 2.332 10 20 CECD Oc1ccc(Cl)c(F)c1CNC1CCNCC1 841031279 ZUKKHSCSJUQBDA-UHFFFAOYSA-N 258.724 2.026 10 20 CECD COc1cccc([C@H](C)NCC2CC3(C2)OCCO3)c1O 926998578 DNTXQDDRYCOGLB-NSHDSACASA-N 293.363 2.205 10 20 CECD COC(=O)N1CC(N[C@H]2C[C@H](C)c3c(F)ccc(O)c32)C1 756757807 DPYHNOBYUDUHCY-KWQFWETISA-N 294.326 2.120 10 20 CECD C[C@]1(C(=O)O)CCC[C@@H]1NCc1ccc2c(c1)CCO2 756388561 PHTGUDLROVSNNV-HOCLYGCPSA-N 275.348 2.355 10 20 CECD Oc1ccc(-c2ccccc2)cc1CN[C@@H]1CCOC[C@H]1O 858300058 FKBAFLPOCIRDHZ-SJLPKXTDSA-N 299.370 2.299 10 20 CECD Cc1cc(Br)c(O)c(CN(C)C[C@H](C)N)c1 863651378 HEGQVKUFLHMJMB-VIFPVBQESA-N 287.201 2.242 10 20 CECD COCCCNCc1ccc(OC)c(Cn2cccn2)c1 873007627 XFTPLKSCAPQRDU-UHFFFAOYSA-N 289.379 2.066 10 20 CECD Cc1cccc(O)c1CNCCC(C)(C)S(C)(=O)=O 877590048 WMBUNBOTGHACOY-UHFFFAOYSA-N 285.409 2.004 10 20 CECD Cc1noc(C)c1C(=O)COC(=O)c1cc(O)cs1 772112225 FHZZJVUNPCHZDL-UHFFFAOYSA-N 281.289 2.098 10 20 CECD C[C@H](COCC(F)(F)F)NCc1ccc(N)cc1 1120269229 OWAHGJDUGYCPDK-SECBINFHSA-N 262.275 2.326 10 20 CECD COc1cc(O)c(CN[C@@H]2C[C@H](OC)C2(C)C)cc1OC 776231886 PSBQBCSHOKBXAW-CABCVRRESA-N 295.379 2.313 10 20 CECD C[C@@H](Cc1cnccn1)N[C@H](C)c1ccccc1O 783506583 YMDXVPKJKNECDE-NWDGAFQWSA-N 257.337 2.464 10 20 CECD CCN1CCC(NCc2cc(C)cc(OC)c2O)CC1 894148646 CJTYTQMIDMVXAV-UHFFFAOYSA-N 278.396 2.283 10 20 CECD Cc1cc(C)c([C@H](C)NCc2nnc(C)n2C)c(O)c1 1324239089 BKDYEUDPBKRMTK-NSHDSACASA-N 274.368 2.297 10 20 CECD C[C@@H](O)CCCNCc1c(O)cccc1Br 706883718 XHPXAUVHHLQZRK-SECBINFHSA-N 288.185 2.405 10 20 CECD Oc1c(F)cc(F)cc1CN[C@@H]1CCN2CCCC[C@@H]12 708481628 RWSXYHXSFWCBFA-KGLIPLIRSA-N 282.334 2.387 10 20 CECD C[C@@H](O)[C@@H](C)NCc1ccc(N2CCSCC2)cc1 1325840486 MUQXNLJXWOBCFD-CHWSQXEVSA-N 280.437 2.099 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2COC[C@@H]2C)c1 699834568 ITQWYBAWCRTVTA-OUJBWJOFSA-N 251.326 2.086 10 20 CECD Nc1ccc(CNC(=O)CSC[C@@H]2CCCCO2)cc1 1346210497 SZURCZOOJQOFJY-AWEZNQCLSA-N 294.420 2.187 10 20 CECD COC[C@@H]1CCCN1Cc1cc(C)cc(OC)c1O 164455582 OUBNISKLAPZYOT-ZDUSSCGKSA-N 265.353 2.320 10 20 CECD COc1ccc(CN[C@H](C)C(=O)OC(C)(C)C)c(O)c1 123305827 MDAQRAPTVXXHEA-SNVBAGLBSA-N 281.352 2.221 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc(N)c1 37823735 PCJLPCVHRJMOMN-UHFFFAOYSA-N 256.305 2.247 10 20 CECD COCCOCCCN[C@@H](C)c1ccccc1O 20192034 ZNXFLOOXPWFFCT-LBPRGKRZSA-N 253.342 2.096 10 20 CECD CC[C@@H](O)CNCc1ccc(N(CC)CC)cc1 124387520 HVEJLXGNMPRSQI-OAHLLOKOSA-N 250.386 2.393 10 20 CECD CC[C@H](C)NC(=O)CCN[C@@H](C)c1cc(OC)ccc1O 38013624 YKRZPQFRVKIPIC-RYUDHWBXSA-N 294.395 2.356 10 20 CECD O=C(NC[C@@H]1CCCCS1)c1cccc(O)c1O 126489831 XLCXAAOREVPIJN-VIFPVBQESA-N 267.350 2.113 10 20 CECD COc1ccc(N(C)CC(=O)NC2CC2)cc1Cl 121950609 KTZRIHYYYQLVAA-UHFFFAOYSA-N 268.744 2.063 10 20 CECD CCOCCCC(=O)NCc1ccc(N(C)C)cc1 47059553 UXZGLHCROBLRPT-UHFFFAOYSA-N 264.369 2.186 10 20 CECD CCOc1cccc(CN2CCN(CC)C[C@H]2C)c1O 289747132 QLOJIVKIGBKBJM-CYBMUJFWSA-N 278.396 2.317 10 20 CECD C[C@@H](CO)CNCc1cc(Cl)cc(Cl)c1O 82367476 MEIZGFBQVHLLOC-SSDOTTSWSA-N 264.152 2.417 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@@H](C)OC)c1 290036110 DEIUVXCYWVSRCT-OUAUKWLOSA-N 253.342 2.475 10 20 CECD CN(CC[C@@H]1CCCCN1C)C(=O)Cc1ccc(N)cc1 237078442 XAYDWVKAGBFPOB-INIZCTEOSA-N 289.423 2.144 10 20 CECD Cc1ccccc1OCCNC(=O)Cc1ccc(N)cc1 237562600 VKXGRCSVONDQGO-UHFFFAOYSA-N 284.359 2.315 10 20 CECD CCn1nncc1CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 527918870 FJWAXRJOBBWWJW-SKDRFNHKSA-N 290.342 2.481 10 20 CECD CC(=O)Nc1ccc(CNCc2cc(C)ccc2O)cn1 278740412 VKKQPSTYBMWGST-UHFFFAOYSA-N 285.347 2.344 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H]2CCc3c[nH]nc3C2)c1 370395860 JOERGYOFTLGWFX-ZYHUDNBSSA-N 287.363 2.332 10 20 CECD c1cc2c(cc1CNC[C@@H]1COC3(CCCC3)O1)CCO2 376803208 FGMVHCBBTZATOR-OAHLLOKOSA-N 289.375 2.397 10 20 CECD CCN1C(=O)/C(=C\c2ncc(Cl)n2C)SC1=S 296027644 UXMXXNKNGVVODH-GQCTYLIASA-N 287.797 2.295 10 20 CECD Cc1cncc(CCC(=O)NCc2ccc(O)c(O)c2)c1 293770276 SOSQHUSJPFXFNH-UHFFFAOYSA-N 286.331 2.050 10 20 CECD CCN1CCC(NC(=O)N(C)Cc2ccccc2O)CC1 298673440 WSYOJPQECYISGW-UHFFFAOYSA-N 291.395 2.018 10 20 CECD C[C@@H](NCc1nc(C2CC2)n[nH]1)c1ccc(F)cc1O 296365742 IYNXREODYXLYKX-MRVPVSSYSA-N 276.315 2.378 10 20 CECD COC(=O)[C@H]1CC[C@@H](N[C@H]2CCc3cccc(O)c32)C1 296258696 BNUZYGDGHGSDHP-XQQFMLRXSA-N 275.348 2.311 10 20 CECD C[C@@H](C[C@@H](C)N)NCc1ccc(N2CCSCC2)cc1 817887684 CDBBDTVYTMWYMY-KGLIPLIRSA-N 293.480 2.455 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H]2CCCC[C@H]2N)c1O 818340174 JIRDPMPRAYZIRP-ZIAGYGMSSA-N 280.343 2.093 10 20 CECD C[C@H](N[C@H]1CC12CCNCC2)c1ccc(F)cc1O 817976849 VMJRDQGTOOGJOC-HZMBPMFUSA-N 264.344 2.324 10 20 CECD CC[C@H](N[C@@H]1CCCNC1)c1ccc(F)cc1O 817942397 YFRLBPLKIPSKOJ-YPMHNXCESA-N 252.333 2.324 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCCNC(C)C)c1 817954279 WZHBNZARHRYDIX-GFCCVEGCSA-N 294.395 2.218 10 20 CECD OCC1(CNCc2cc(Cl)c(F)cc2O)CCC1 816567495 CDABIYOQJGUTCD-UHFFFAOYSA-N 273.735 2.437 10 20 CECD Cc1ccc(/C=C\C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cn1 493305778 STFPCVXEBZUGOF-YVMONPNESA-N 298.302 2.369 10 20 CECD C[C@@H]1C[C@H](NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)CO1 826532220 STCKQVCXNBNAFX-BZPMIXESSA-N 291.395 2.290 10 20 CECD Cc1cc(O)c(CN2C[C@H](O)C[C@H]2C)cc1Cl 825666087 GWCKXIWNWMVLBU-MWLCHTKSSA-N 255.745 2.309 10 20 CECD Nc1ccc(CNC(=O)CCCOc2cccnc2)cc1 837303517 URTUZBUUCNXIED-UHFFFAOYSA-N 285.347 2.139 10 20 CECD O=C(c1cc(O)cs1)N1CCn2nc(C3CC3)cc2C1 834441031 XMZCPOGATCUHFA-UHFFFAOYSA-N 289.360 2.184 10 20 CECD CCC[C@H](O)CC(=O)N1CCOc2cc(N(C)C)ccc21 676759152 ZACOYGKBGURNHQ-ZDUSSCGKSA-N 292.379 2.029 10 20 CECD CCOC1CN(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)C1 838559551 NYVMAJXDSKRKBK-GFCCVEGCSA-N 291.395 2.244 10 20 CECD Cc1cc(O)c(CN[C@H](CCN)C(F)(F)F)cc1C 841090745 MRCSQRXLXHOLPZ-GFCCVEGCSA-N 276.302 2.378 10 20 CECD COc1ccc(N2CC[C@H](CN[C@@H]3CO[C@H](C)C3)C2)cc1 842713887 JYQPDLKOCCQTQD-KFWWJZLASA-N 290.407 2.289 10 20 CECD C[C@H]1CCCCN1[C@@H](C)CNC(=O)Cc1ccc(N)cc1 844171217 HABVOROWJKVLDT-KBPBESRZSA-N 289.423 2.190 10 20 CECD C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)CS1 840276684 MVWDCKJAXUJFKS-MWLCHTKSSA-N 266.366 2.085 10 20 CECD CC[S@@](=O)CCN[C@@H](C)c1ccc(Cl)cc1O 841762980 LFNJDBAZXOAWDZ-HUTHGQBESA-N 275.801 2.465 10 20 CECD C[C@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)CC(C)(C)C1 841087308 UJMNOJPCXVPHJJ-LLVKDONJSA-N 289.379 2.102 10 20 CECD CCOc1cccc(CN2CCC[C@@H](CO)[C@H]2C)c1O 840980356 XHJROWMCZUYIHR-OCCSQVGLSA-N 279.380 2.384 10 20 CECD CN(Cc1ccco1)C(=O)COc1ccc(N(C)C)cc1 842043188 HJPLFRUFJHDPHI-UHFFFAOYSA-N 288.347 2.383 10 20 CECD O=C(NCc1ccccc1O)c1scnc1Cl 748345995 UCPWHFXYMIHENF-UHFFFAOYSA-N 268.725 2.432 10 20 CECD CCc1cccc(CN(C)[C@@H]2CC(C)(C)OC2=O)c1O 848914039 HDPQEHASYZZVAW-CYBMUJFWSA-N 277.364 2.481 10 20 CECD Cc1cc(N(C)C)ccc1CN1[C@H]2CCNC[C@H]1CC2 843058354 PQWHXXUOJODGLT-NVXWUHKLSA-N 273.424 2.387 10 20 CECD C[C@]1(C(=O)NCc2c(O)ccc3c2CCCC3)CCOC1 755529831 KCYAZEFDQDVYQX-KRWDZBQOSA-N 289.375 2.314 10 20 CECD CC[C@@H](N[C@H](C)C(=O)N(C)OC)c1ccc(C)cc1O 858586551 FHVCGGWWPUGEFJ-DGCLKSJQSA-N 280.368 2.150 10 20 CECD COC(=O)/C=C(\C)CN(C)c1ccc(OC)cc1OC 930076957 NDFXYKXJEPTUTF-DHZHZOJOSA-N 279.336 2.259 10 20 CECD OCCOC1CCN(Cc2cc(Cl)ccc2O)CC1 769538822 XISIWTFRSMWGHM-UHFFFAOYSA-N 285.771 2.019 10 20 CECD C[C@@H]1SCCN(Cc2cc3c(cc2O)OC[C@H]3O)[C@H]1C 768447253 NSLHLZGKBNIORS-PKFCDNJMSA-N 295.404 2.144 10 20 CECD COc1cc(CN(C)c2ccc3c(c2)OCO3)ccn1 762927328 PIRDZWILOQFLIX-UHFFFAOYSA-N 272.304 2.455 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)Cc1cn(C)nn1 761657823 ZLQMVVPNTZRDHL-UHFFFAOYSA-N 287.411 2.292 10 20 CECD CC[C@@H](N[C@@H](C)CC(N)=O)c1ccc(N(C)C)cc1 763396988 GQYVNCFJGOHHBO-SMDDNHRTSA-N 263.385 2.057 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2N[C@H]1[C@@H]2CNC[C@@H]21 1118122294 STWSSBJNESLAFU-GBNBPPIOSA-N 258.365 2.056 10 20 CECD Cc1cccc(O)c1CN1CCC[C@@H](CCC(N)=O)C1 876650434 SGDHKGRCBJGYEM-ZDUSSCGKSA-N 276.380 2.178 10 20 CECD Cc1ccc(CN2CCC[C@H](OC(=O)N(C)C)C2)c(O)c1 877560462 RGVBLJACNSKOEV-AWEZNQCLSA-N 292.379 2.363 10 20 CECD COc1cc(CN(C)C(=O)c2cc(O)cs2)ccc1O 770969979 WHJYGSVVSXEXLF-UHFFFAOYSA-N 293.344 2.440 10 20 CECD CCO[C@@H]1C[C@@H](NCc2cc(Cl)ccc2O)[C@@H]1OC 775977396 CFSHQXZTERUFKK-BNOWGMLFSA-N 285.771 2.328 10 20 CECD CSC[C@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 778149014 BVXJPWFCYWSGNH-BXUZGUMPSA-N 268.426 2.127 10 20 CECD CCCCSCC(=O)NCc1ccc(O)c(O)c1 778914901 OCAHEQURMANDPY-UHFFFAOYSA-N 269.366 2.247 10 20 CECD C[C@H](NCc1cnc(N(C)C)nc1)c1ccc(N(C)C)cc1 775365129 UIQRWARZZMNBDR-ZDUSSCGKSA-N 299.422 2.459 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@H](C)c1c(O)cccc1F 886598574 FMJCOEZPEQBLEX-NXEZZACHSA-N 268.332 2.049 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@@H]1C=CCC1 883834195 ZEDORKSBFRJZKB-GFCCVEGCSA-N 260.337 2.500 10 20 CECD COc1ccc(CN2CCC[C@H]2C)c(O)c1OC 892020623 ZSUGGZLYTBOHHN-SNVBAGLBSA-N 251.326 2.394 10 20 CECD COc1ccc(CN2CC[C@@H](C)C2)c(O)c1OC 891799324 VLIBNQXMHWGMGO-SNVBAGLBSA-N 251.326 2.251 10 20 CECD COc1cc(C)cc(CNC2CCN(C3CC3)CC2)c1O 894163122 JDGOVRVPQYGDCT-UHFFFAOYSA-N 290.407 2.426 10 20 CECD C[C@H](NCc1nncs1)c1ccc(N(C)C)cc1 1332897649 NMXNHKAVBCOOTE-JTQLQIEISA-N 262.382 2.455 10 20 CECD CC1(C)CO[C@H](CC(=O)NCCc2ccc(N)cc2)C1 717151098 OFSFYHXEDWKWRH-CQSZACIVSA-N 276.380 2.133 10 20 CECD O=C(NCc1ccc(N2CCSCC2)cc1)[C@H]1C[C@H]1F 1350909765 ZHVTXORUSYXZQR-UONOGXRCSA-N 294.395 2.214 10 20 CECD C[C@H](NCCOC1CCC1)c1cc(C(=O)O)ccc1O 1604342948 NWZHDLVNKRAEGX-JTQLQIEISA-N 279.336 2.310 10 20 CECD CCOc1ccc(CN[C@@H](C(=O)O)C(C)(C)C)c(O)c1 1597101477 VQNSEEWLQILADX-ZDUSSCGKSA-N 281.352 2.380 10 20 CECD C[C@H](N[C@@H]1CCn2ccnc21)c1cc(C(=O)O)ccc1O 1593232110 MHCUYNPZGOLOKA-JOYOIKCWSA-N 287.319 2.083 10 20 CECD O=C(O)[C@]1(NCc2ccc3c(c2)CCO3)CCC[C@@H]2C[C@@H]21 1777600225 XLJCRYNNIASPCO-IFIJOSMWSA-N 287.359 2.355 10 20 CECD C[C@@H](CC(C)(C)NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 1776404210 CLBNSLHWHLGJBR-VIFPVBQESA-N 296.323 2.279 10 20 CECD Cc1cccc(CN[C@@H](CC(C)C)C(=O)O)c1O 158742638 BNXVOOBMBHBWMQ-LBPRGKRZSA-N 251.326 2.290 10 20 CECD COc1cccc(O)c1CNC1CCC(N(C)C)CC1 817416100 IOWVNESAEAFBFV-UHFFFAOYSA-N 278.396 2.363 10 20 CECD CN(C)C(=O)O[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 824576584 PFONXVOQPWROIX-LBPRGKRZSA-N 298.770 2.318 10 20 CECD COC(=O)c1cnc(SC[C@H]2CCCOC2)s1 829680555 AWNJHDIBIPIFTL-QMMMGPOBSA-N 273.379 2.448 10 20 CECD CC[C@@H](N[C@@H](C)CN1CCOCC1)c1ccccc1O 36932890 RSRDIOIWMBTULR-DZGCQCFKSA-N 278.396 2.154 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCC[C@H]2O)c1O 323671999 MRAPXKHQNVPINI-GHMZBOCLSA-N 271.744 2.057 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](OC)CC2)c1 378629534 DTORVONDRJNJRP-CYBMUJFWSA-N 265.353 2.402 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCCCS(C)(=O)=O)c1 710303221 OQPODIPXYKWZGW-GFCCVEGCSA-N 285.409 2.176 10 20 CECD Cc1[nH]c(CNCc2ccccc2O)cc1C(=O)O 388681673 RWBVBWDJCCNKHW-UHFFFAOYSA-N 260.293 2.017 10 20 CECD Cc1ccc([C@H](C)N[C@@H](CO)C[C@@H]2CCCO2)c(O)c1 886669902 GNJTVUUTIOELTP-MJBXVCDLSA-N 279.380 2.281 10 20 CECD CN(Cc1ccccc1O)C(=O)CN(C)c1ccccc1 66046893 BVHBNDXKZQLHCC-UHFFFAOYSA-N 284.359 2.487 10 20 CECD CSC1CCN(C(=O)c2cccc(O)c2O)CC1 302372290 RUFLTTWFLKMPIM-UHFFFAOYSA-N 267.350 2.065 10 20 CECD CCN(CC)c1ccc(CNCCNC(=O)C2CC2)cc1 72670682 HAYAXCBRFMBBCP-UHFFFAOYSA-N 289.423 2.149 10 20 CECD CCO[C@@H]1C[C@](CO)(NCc2cc(F)ccc2O)C1(C)C 188906144 YNZBOCBONNPOPV-GDBMZVCRSA-N 297.370 2.187 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@]23CCOC3=O)c1 190040656 WDAQPSLIRBWMGJ-MRXNPFEDSA-N 291.347 2.072 10 20 CECD Cc1nnc([C@@H](C)NC(=O)NCc2ccccc2O)s1 273696819 OGPPGTPEIASNTQ-MRVPVSSYSA-N 292.364 2.113 10 20 CECD C[C@@H](NC[C@@H](O)C(F)(F)F)c1ccc(F)c(F)c1O 276947809 QJPSZPUQWBWUON-SVGQVSJJSA-N 285.212 2.244 10 20 CECD CC(=O)NCCCN[C@H](C)c1ccc(C)c(C)c1O 273435734 WYHMMRWEEUZLEO-GFCCVEGCSA-N 264.369 2.186 10 20 CECD CC[C@H](NCC1(CO)COC1)c1cccc(Cl)c1O 287725014 OUALMVRFYZLNPD-LBPRGKRZSA-N 285.771 2.095 10 20 CECD CCCCN(Cc1ccccc1O)[C@@H](CC)C(N)=O 282379712 FXBYTITVXWUXGO-ZDUSSCGKSA-N 264.369 2.258 10 20 CECD COc1cccc(CNCc2cn(C(C)(C)C)nn2)c1O 289461861 OKZNGKZVCYBDOZ-UHFFFAOYSA-N 290.367 2.037 10 20 CECD COc1ccc(CNCc2cc(F)ccc2O)c(OC)n1 290790805 DODMZHHWHSJVCY-UHFFFAOYSA-N 292.310 2.233 10 20 CECD COC[C@@H](CCO)N[C@H](C)c1cc(Cl)cc(C)c1O 808697837 WTCKVEBFYYLOHK-ZYHUDNBSSA-N 287.787 2.402 10 20 CECD Cc1cc(O)c(CN2CC[C@H](C(=O)N(C)C)C2)cc1Cl 826122206 YVPSYJOSHUBVRD-NSHDSACASA-N 296.798 2.264 10 20 CECD CCOC(=O)[C@@H]1CCC[C@@H]1NCc1cc(OC)ccc1O 825040854 VWKXXFHAZKOAMS-KGLIPLIRSA-N 293.363 2.222 10 20 CECD Cc1cc(O)c(CN2CCNC(=O)[C@H]2C(C)C)cc1Cl 824709914 QRNWTTDHUBDZLK-CQSZACIVSA-N 296.798 2.310 10 20 CECD O=C(/C=C/[C@H]1CCOC1)NCCCSc1nccs1 823298080 NLTPZFXXHGOKOB-VUDBWIFFSA-N 298.433 2.334 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(O)cs2)c1 734018934 PEZDAQDJQXGKSN-UHFFFAOYSA-N 279.317 2.098 10 20 CECD N[C@@H]1c2ccccc2C[C@H]1NCc1ccccc1O 904462629 XTVGOVJOYCPDQS-GDBMZVCRSA-N 254.333 2.107 10 20 CECD CO[C@@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)C12CCC2 839182688 PAXABGJZFBMALA-HUUCEWRRSA-N 291.347 2.168 10 20 CECD O=C(NCCCSc1nccs1)N1CC[C@@H](F)C1 838513385 IJXNXHQQSQOSFK-SECBINFHSA-N 289.401 2.379 10 20 CECD C[C@@H](CC(C)(C)C)NC(=O)C(=O)Nc1ccc(N)cc1 841139472 GTWWYJJALVUNHS-JTQLQIEISA-N 277.368 2.148 10 20 CECD CC[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)CCS1 841957999 MZDUAAJNGSHVRK-CQSZACIVSA-N 293.436 2.348 10 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COc1cccc(O)c1CN1CC[C@H]2OCCC[C@H]2C1 1116444088 QDYJVIYBEUIIAG-SWLSCSKDSA-N 277.364 2.402 10 20 CECD Nc1ccc(CCNC(=O)C(C2CC2)C2CC2)cc1 261581428 FZJDABVVJPDMGC-UHFFFAOYSA-N 258.365 2.364 10 20 CECD CN1CC[C@@]2(CCN(Cc3cc(F)ccc3O)C2)C1 292791783 MNLFQDMETFZCNK-OAHLLOKOSA-N 264.344 2.059 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1CCCCO1 708558332 FQJCCHWUUOHPEX-LLVKDONJSA-N 257.280 2.329 10 20 CECD C[C@@H](N[C@@H]1CC[C@H](C(N)=O)C1)c1ccc(N(C)C)cc1 834907037 LHYQXIHMPUXGRD-KWCYVHTRSA-N 275.396 2.057 10 20 CECD CN1CCC[C@@H]1CNCc1cc(Br)ccc1O 227440364 IZJBHNMCOACHHM-GFCCVEGCSA-N 299.212 2.339 10 20 CECD CCOc1cccc(CNCc2ccc(OC)nc2)c1O 20186189 HPWNHLMLYFQCND-UHFFFAOYSA-N 288.347 2.484 10 20 CECD O=C(/C=C/c1ccc(N2CCOCC2)cc1)NCC1CC1 108771402 DQYUMNJRZRVTMF-VMPITWQZSA-N 286.375 2.063 10 20 CECD C[C@@H]1CSCCN1Cc1ccc(N2CCOCC2)cc1 179663257 RSAHLVXYDFOGSD-CQSZACIVSA-N 292.448 2.461 10 20 CECD CCOc1cccc(CN2CC[C@@H](C(=O)O)[C@H](C)C2)c1O 313741016 CABODUFKWLMYNB-DGCLKSJQSA-N 293.363 2.334 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ncccc1C#N 183599427 LTKAVTARFARARN-JTQLQIEISA-N 269.304 2.408 10 20 CECD CCN(C)C(=O)[C@H](C)NCc1cccc(Cl)c1O 188486232 KSDOEVQREDAPBJ-VIFPVBQESA-N 270.760 2.002 10 20 CECD COc1ccc(CNC[C@H]2CCSC2)c(O)c1 228554910 TWYQFEFNLJKUHL-SNVBAGLBSA-N 253.367 2.244 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)C(=O)N2CCCC2)c1 228089679 LQJBFODDOCXRIV-NEPJUHHUSA-N 292.379 2.062 10 20 CECD CCOc1cccc(CN2CCO[C@@H](C)C2)c1O 131955380 XGQVMKXCQURNQU-NSHDSACASA-N 251.326 2.012 10 20 CECD C[C@@H]1C[C@@H](C(=O)NCc2ccc(N(C)C)c(F)c2)CCO1 271888832 JLJPZKSIWORXNF-YPMHNXCESA-N 294.370 2.323 10 20 CECD CCNC(=O)C[C@@H]1CCCCN1Cc1ccccc1O 285216165 RMQJKMISFOPILS-AWEZNQCLSA-N 276.380 2.273 10 20 CECD Cc1cc(CN2CC[S@@](=O)C[C@H](C)C2)ccc1N(C)C 294121172 NIBXQJUDRCDAGG-ZUOKHONESA-N 294.464 2.261 10 20 CECD CCS(=O)(=O)NCc1cc(Cl)cc(Cl)c1O 805134530 BTZJCBVCUOUBQK-UHFFFAOYSA-N 284.164 2.138 10 20 CECD COCCOC[C@@H](C)NCc1cc(Cl)c(F)cc1O 816554473 ZMSRKWXWRSMTPV-SECBINFHSA-N 291.750 2.326 10 20 CECD CC(C)c1cc(C(=O)NCCc2ccc(N)cc2)cc(O)n1 818545107 IHUVEWMBTFTPMH-UHFFFAOYSA-N 299.374 2.465 10 20 CECD COc1ccc2c(c1)C[C@@H](C(C)C)CN2CCOCCO 817299391 ZCWWEPGFIXOYPA-OAHLLOKOSA-N 293.407 2.339 10 20 CECD Cc1cc(Cl)cc(CN2CC[C@H](C(=O)O)C2)c1O 820976962 YEWPDENRTBNJFZ-VIFPVBQESA-N 269.728 2.261 10 20 CECD C[C@@H]1C[C@@H](O)CN1Cc1ccc(Br)cc1O 825666420 IUKKPVABAHZUOT-LDYMZIIASA-N 286.169 2.110 10 20 CECD CCOc1ccc(CNc2c(C)ccn(C)c2=O)c(O)c1 902256655 ULZKZJSTFCEBKV-UHFFFAOYSA-N 288.347 2.410 10 20 CECD O=C(N[C@@H]1COc2ccccc2C1)c1cc(O)cs1 732270782 KAZHZMZZYGXDCF-JTQLQIEISA-N 275.329 2.187 10 20 CECD O=C(c1cc(O)cs1)N1CCOC[C@@H](C2CCC2)C1 832811017 PBAHEGOPVWTOQF-NSHDSACASA-N 281.377 2.342 10 20 CECD COC1CCC(NC(=O)N(C)Cc2ccccc2O)CC1 838759000 WBQVWRDRVNXHRX-UHFFFAOYSA-N 292.379 2.491 10 20 CECD CN(C)c1ccc(CN[C@@H]2CC[C@H]3CNC[C@@H]3C2)cc1F 843342791 ONWQFGIGBYGQFR-SOUVJXGZSA-N 291.414 2.369 10 20 CECD CCN1C[C@H](CN[C@@H](C)c2ccc(C)cc2O)CC1=O 846207828 GHOOPGDEBHWPOF-STQMWFEESA-N 276.380 2.220 10 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293.367 2.293 10 20 CECD COc1ccc(O)c(CNC(=O)NCCC(C)(C)F)c1 853736916 SUEQNANQMHVFTQ-UHFFFAOYSA-N 284.331 2.338 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756732039 GATRKNBTKQTKMJ-MNOVXSKESA-N 298.339 2.003 10 20 CECD C[C@@H]1C[C@H](CCNC(=O)c2cc(O)cs2)CCO1 753507915 QKOYZSWSSLWGAU-NXEZZACHSA-N 269.366 2.389 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@H](C(C)C)N(C)C 935946658 KSUYEHTWEFSNLD-AWEZNQCLSA-N 299.411 2.080 10 20 CECD CC(C)CC[C@@H](CO)NC(=O)/C=C/c1ccc(O)c(O)c1 862778065 DKQVNMJHHOFYDR-LJLILKBBSA-N 293.363 2.024 10 20 CECD Cc1cccc(O)c1CN1CC[C@]2(CCN(C)C2)C1 877545962 NDHJRPZMJWXDPI-INIZCTEOSA-N 260.381 2.228 10 20 CECD COC(=O)[C@@H]1CC12CCN(Cc1ccc(C)cc1O)CC2 876739622 DQLMPTPWKIEOOR-AWEZNQCLSA-N 289.375 2.476 10 20 CECD COC(=O)CC1(NCc2ccc3c(c2)CCO3)CCC1 777440735 KMTJDJGORGVFLL-UHFFFAOYSA-N 275.348 2.197 10 20 CECD C[C@@H](N[C@@H](CCO)C1CC1)c1c(O)cccc1F 886549121 BUFWXAJNNKMBTD-SKDRFNHKSA-N 253.317 2.343 10 20 CECD C[C@H]1C[C@@H](C(=O)NCc2ccc3c(c2)CCCN3C)CO1 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CCc1cccc(CNC[C@@](C)(O)C(C)C)c1O 691494839 PDZPJYLJPMDEDA-OAHLLOKOSA-N 251.370 2.451 10 20 CECD CCCN(CC(=O)N(C)CC)Cc1ccccc1O 727830519 AATYRLRUQFTIKP-UHFFFAOYSA-N 264.369 2.083 10 20 CECD C[C@@]1(CNC(=O)NCc2ccc(N)cc2)CCCC[C@H]1O 1337017661 AUVRSMAITXOAQF-ZBFHGGJFSA-N 291.395 2.009 10 20 CECD O=C(C[C@@H]1CCOC1)Nc1c(Cl)ccc2nonc12 1342950679 ILDZPLFHMBQKSF-ZETCQYMHSA-N 281.699 2.241 10 20 CECD CCOC(=O)[C@H]1CCCCN1Cc1ccc(N)cc1 1356082719 DNKBLMMKZHWNBD-CQSZACIVSA-N 262.353 2.186 10 20 CECD COc1ccc(CN[C@H](C)[C@H](C)NC(=O)C2CC2)cc1C 1755223524 KNWAGFQORGLXKJ-OLZOCXBDSA-N 290.407 2.396 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1c(F)cc(F)cc1F 158899077 WWXNMYDZGLKTQP-UHFFFAOYSA-N 297.232 2.445 10 20 CECD Cc1nn(C)cc1CN1CCCc2cc(CN)ccc21 843058599 WLAHPUAODMCVHB-UHFFFAOYSA-N 270.380 2.140 10 20 CECD CN(C)c1ccc(CNC[C@@H]2CCN(C3CC3)C2)cc1 37408222 SLPSOCJEXKAUMG-HNNXBMFYSA-N 273.424 2.327 10 20 CECD CCN(CC(=O)OC)Cc1cc(Cl)ccc1O 109779847 KIQLWBHHAYDZKA-UHFFFAOYSA-N 257.717 2.041 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cnn(C)c1C 115281854 IKWXUVAGFREHLK-UHFFFAOYSA-N 286.379 2.033 10 20 CECD CC[C@@H](CCO)NC1CCN(c2ccc(OC)cc2)CC1 305198173 ZTMNQNBKNUMNHC-AWEZNQCLSA-N 292.423 2.415 10 20 CECD C[C@H](N[C@@H]1CC(=O)N(C2CC2)C1)c1ccc(F)c(F)c1O 187792154 HWIKALZSQHLJEG-DTWKUNHWSA-N 296.317 2.084 10 20 CECD Cc1cnn(C)c1C(=O)NCc1c(C)c2ccccc2n1C 412306227 PBRVTZPGIRAMOS-UHFFFAOYSA-N 296.374 2.459 10 20 CECD O=C(CCc1cccs1)NCCc1ccc(O)c(O)c1 178423544 GKXMUEMPGUIIDV-UHFFFAOYSA-N 291.372 2.451 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)c1cnn(C(C)C)c1 266394218 CREPMMSKIBSNLW-UHFFFAOYSA-N 295.364 2.279 10 20 CECD CC(F)(F)CC(=O)NCc1ccc(N2CCOCC2)cc1 277135390 BOGIPRDWSFIDTE-UHFFFAOYSA-N 298.333 2.185 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@@H](OCC2CC2)C1 366152614 RQWCYCMGUAUACP-GFCCVEGCSA-N 291.347 2.129 10 20 CECD CCN1CC(=O)N(c2cc(Cl)c(N)c(Cl)c2)C1=O 278232022 VHYHBDUXBHZQSU-UHFFFAOYSA-N 288.134 2.364 10 20 CECD Cc1cc(O)c(CN(C)CCc2cnccn2)cc1C 271288357 SJWGQDMFAHTYIX-UHFFFAOYSA-N 271.364 2.474 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@H]3CC[C@H]2CC(=O)C3)c1O 275243156 NUNBTXFFXSOLHF-STQMWFEESA-N 291.322 2.430 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273599571 RPDPJSXIZMSEPF-RWSFTLGLSA-N 295.379 2.236 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@@H]2[C@@H]2CCCC2=O)c1 372756988 ICHRQMRYFAFHJI-LSDHHAIUSA-N 289.375 2.271 10 20 CECD CN(CCCn1ccnc1)Cc1cc(F)ccc1O 290625215 XNZNQTSQQWBITL-UHFFFAOYSA-N 263.316 2.250 10 20 CECD C[C@H](NC[C@@H]1C[C@H](F)CN1)c1cc(Cl)ccc1O 817976657 QNVHPTBIBJDPOS-LSJOCFKGSA-N 272.751 2.396 10 20 CECD CCNC(=O)[C@@H](C)NCc1ccc2ccccc2c1O 816561268 QUUOBANLUKRNRW-LLVKDONJSA-N 272.348 2.160 10 20 CECD C[C@H](N[C@H]1CC[C@@H](CN)C1)c1cc([N+](=O)[O-])ccc1O 817981675 MIJGVPSZPHRYOB-AXFHLTTASA-N 279.340 2.078 10 20 CECD CC[C@@H](NCCc1ccc(N)cc1)c1cnn(C)c1 817955668 DVIUXHMOCBYTEN-OAHLLOKOSA-N 258.369 2.286 10 20 CECD C[C@@H]1OCC[C@]1(O)CNCc1ccc2ccccc2c1O 816593870 HEYKCSKSDSIXEY-SJCJKPOMSA-N 287.359 2.175 10 20 CECD CC[C@@H](CO)N(C)Cc1ccc(N(C)C)c(F)c1 824533867 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CCC[C@]1(C)C(=O)NCCN1Cc1ccc(C)cc1O 877461730 GGBKCKRUCNNDPT-MRXNPFEDSA-N 276.380 2.191 10 20 CECD C[C@@]1(NCc2cc(Cl)cc(F)c2O)CCOC1 776252891 RHMXJGBWJZPJPK-GFCCVEGCSA-N 259.708 2.453 10 20 CECD COC(=O)Cc1cccc(NCc2c(C)cccc2O)n1 877472189 MENSXOJAELTIFX-UHFFFAOYSA-N 286.331 2.423 10 20 CECD CCOC(=O)C1=NN(c2cccc3cnccc23)C(=O)[C@@H]1C 871959590 OCVDZFZRXFDVQA-SNVBAGLBSA-N 297.314 2.137 10 20 CECD Cc1nnc([C@H](C)OC(=O)c2cccc(O)c2O)s1 784788481 UMRZLZCFLIAFKB-LURJTMIESA-N 280.305 2.176 10 20 CECD CS[C@H]1CC[C@H](NC(=O)c2ccc(C)c(O)c2O)C1 780955025 PZOLSOIYEHOQKF-UWVGGRQHSA-N 281.377 2.420 10 20 CECD CCN(CC)c1ccc(CN2C[C@H](O)C[C@@H]2C)cc1 788270937 XHBFETXFRURZQS-XJKSGUPXSA-N 262.397 2.488 10 20 CECD COc1cccc(CNCc2cn(C)nc2C2CC2)c1O 894457814 IHDZFZIDCNNQCB-UHFFFAOYSA-N 287.363 2.302 10 20 CECD COc1ccc(O)c(CN(CCO)[C@@H]2C[C@H]3CC[C@H]2C3)c1 793324834 WDGYOLIFWGCIBW-HEHGZKQESA-N 291.391 2.384 10 20 CECD C[C@H]1CN(Cc2cc(Cl)ccc2O)CC[C@@H]1N 94339178 HHVLUBIWWPDUAK-CABZTGNLSA-N 254.761 2.215 10 20 CECD Cn1cc(COC(=O)c2cccc(O)c2O)c(C(F)F)n1 1326341962 ANVNLMUQFKWEKG-UHFFFAOYSA-N 298.245 2.126 10 20 CECD CC(C)[C@](C)(O)CNCc1cc(F)cc(F)c1O 708455121 TZABDEQCAIJTHC-CYBMUJFWSA-N 259.296 2.167 10 20 CECD CCn1ncnc1CN[C@@H](C)c1cc(C)ccc1O 794840308 IGJVUSMTZQPBFW-NSHDSACASA-N 260.341 2.163 10 20 CECD C[C@H]1OCC[C@H]1CSc1ncc(C(=O)O)s1 1604833340 CQOWFZRBHLUPRJ-RQJHMYQMSA-N 259.352 2.358 10 20 CECD Cc1cc(CNCC2CNC2)c(C)n1-c1ccccc1 1579601005 GRDQZHOANMLVFF-UHFFFAOYSA-N 269.392 2.403 10 20 CECD O=C(O)[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@H]1C1CC1 1595191619 YRKRTNHTJAVSEG-NWDGAFQWSA-N 297.301 2.213 10 20 CECD CC(C)(NCc1ccccc1O)c1cc(C(=O)O)on1 1590872798 UAEMEPREUDVYQA-UHFFFAOYSA-N 276.292 2.103 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@H]1c1ccco1 159019182 LUINHBFHRGMCJE-GHMZBOCLSA-N 273.288 2.111 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)N2CCCC2)c1 228093727 MCXGQESLBHNQGV-STQMWFEESA-N 276.380 2.362 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCN3CCC[C@@H]3C2)c1 128093989 KPYGUAVDDCEKSU-ZIAGYGMSSA-N 276.380 2.117 10 20 CECD CN1CCC[C@H]2CN(Cc3ccccc3O)CC[C@@H]21 156093017 QLPCLSCAAFVWKM-ZFWWWQNUSA-N 260.381 2.308 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)c2ncn(C)n2)c1 275726728 OLTQNXVOBFZMKX-GHMZBOCLSA-N 260.341 2.241 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)c2n[nH]c(C)n2)c1O 392456918 KXMWLJVXUFZRIJ-ZETCQYMHSA-N 296.758 2.332 10 20 CECD CC(C)[C@@H](CO)CNCc1cccc(Cl)c1O 394070620 JUJUVUXKSLGLHV-LLVKDONJSA-N 257.761 2.400 10 20 CECD CCCCN(Cc1ccccc1O)[C@H]1CCS(=O)(=O)C1 179553094 AZKUDQCVAGPEOM-AWEZNQCLSA-N 297.420 2.181 10 20 CECD CN(Cc1nc(CC(F)(F)F)no1)c1ccc(N)cc1 863557066 HKJPDYUMPODGKK-UHFFFAOYSA-N 286.257 2.393 10 20 CECD Cc1ccc(C(=O)Nc2cnn(CC3CC3)c2)c(O)c1O 182530878 WYWAXIJTRAJPFC-UHFFFAOYSA-N 287.319 2.265 10 20 CECD CN(C)c1ccc(CNc2ccc(OCC(N)=O)cc2)cc1 121943146 ACVHTXQQJPZBNJ-UHFFFAOYSA-N 299.374 2.229 10 20 CECD COc1cccc(CN2CCC(OC)CC2)c1O 132145798 HEIDFGOMIPVNBD-UHFFFAOYSA-N 251.326 2.012 10 20 CECD CCC(CC)(CNCc1cc2c(cc1O)OCO2)OC 291753916 QNGZOUCMAPHRDA-UHFFFAOYSA-N 281.352 2.416 10 20 CECD C[C@@H](NCC1(O)CCCC1)c1ccc(F)cc1O 87015754 GWTVDQPBLWWIHV-SNVBAGLBSA-N 253.317 2.487 10 20 CECD O=C(O)c1ccc(CNCc2ccccc2O)s1 236471483 MFCUFNIRSNCGPF-UHFFFAOYSA-N 263.318 2.442 10 20 CECD Cc1ccc(O)c(CN2CCSC[C@H]2CC(=O)O)c1 91133644 BXYFNANULRIXDZ-GFCCVEGCSA-N 281.377 2.093 10 20 CECD CC(C)(C)[C@H]1C[C@@H](NC(=O)c2cccc(O)c2O)CCO1 279833108 NLPJMUYKDWDPCR-GXFFZTMASA-N 293.363 2.421 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cncnc1 274075967 VOHPUOKXTNALOL-UHFFFAOYSA-N 271.320 2.235 10 20 CECD Cc1ccc([C@H](C)NCCCN2CCOCC2)c(O)c1C 273431172 VSPOLYJWTXYKER-HNNXBMFYSA-N 292.423 2.382 10 20 CECD CCCCN(CCC(=O)N(C)C)Cc1ccccc1O 282547330 WRHBQOSBPBOSTO-UHFFFAOYSA-N 278.396 2.473 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)C(=O)NCCF)c(O)c1C 282773578 PAUWIEZEIWBBKN-VXGBXAGGSA-N 282.359 2.134 10 20 CECD CC[C@@H](N[C@H]1CCCCNC1=O)c1ccc(F)cc1O 285489987 CBGIPHRMMODYDU-OLZOCXBDSA-N 280.343 2.241 10 20 CECD COc1ccc2c(c1)CCCCN2Cc1nc(C)n[nH]1 293281106 TVTMMBYPLCRCOW-UHFFFAOYSA-N 272.352 2.465 10 20 CECD COCC[C@]1(NCc2ccc(N(C)C)c(C)c2)CCOC1 815103649 XVSRFJIFOHQERH-KRWDZBQOSA-N 292.423 2.346 10 20 CECD COc1cccc(CNCCO[C@H]2CCCCO2)c1O 813334041 VLIJYPQQEZMSMA-AWEZNQCLSA-N 281.352 2.034 10 20 CECD COc1ccc(O)c(CN2CC3(CCNCC3)C[C@@H]2C)c1 818431622 QEMZNAGYVOCSSG-ZDUSSCGKSA-N 290.407 2.365 10 20 CECD Cc1ccc2c(c1)/C(=C/c1cnccn1)C(=O)N2C 811700645 NQZCWQXDGXZCSE-JYRVWZFOSA-N 251.289 2.302 10 20 CECD COC1(CCOC(=O)c2cccc(O)c2O)CCC1 815233846 DKSUMAQNYGPNSH-UHFFFAOYSA-N 266.293 2.214 10 20 CECD CC[C@H](NC[C@]1(COC)CCCN1)c1ccc(F)cc1O 817973987 HXUAYHGURKGTMC-HOCLYGCPSA-N 296.386 2.341 10 20 CECD CC(=O)N[C@](C)(C(=O)N[C@H](C)c1ccccc1O)C(C)C 828538832 AZWFCNJTJYTGGL-BZNIZROVSA-N 292.379 2.120 10 20 CECD O=C(CCCc1ccccn1)NCc1ccccc1O 729529761 GYTKRKOZYAZAMK-UHFFFAOYSA-N 270.332 2.426 10 20 CECD COc1cc(Cl)cc(CN(C)Cc2cnc[nH]2)c1O 826769614 OROCYDLJINOZKY-UHFFFAOYSA-N 281.743 2.409 10 20 CECD CCOc1ccc(O)c(CN[C@H](CC)[C@@H](C)O)c1 824921632 OGKPWJUAWNVUQG-ZWNOBZJWSA-N 253.342 2.040 10 20 CECD C[C@H](N[C@H]1COC[C@@H]1C)c1cc(F)cc(F)c1O 903395077 JFYUCULZKFNJLM-UBJUHAIHSA-N 257.280 2.356 10 20 CECD CC(C)n1nccc1NC(=O)c1cc(O)cs1 731867866 ZFJNQMSZIJHNEI-UHFFFAOYSA-N 251.311 2.483 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1C[C@H]1C1CCC1 910942538 DROUNODDTSFKFR-QWHCGFSZSA-N 261.321 2.150 10 20 CECD CCCNC(=O)CCNCc1ccc(N(C)C)cc1C 840930477 XAFDGSKDAOMTQH-UHFFFAOYSA-N 277.412 2.067 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)C1CCC1 840951871 KTGDSPSVJIGWCP-MRXNPFEDSA-N 262.397 2.312 10 20 CECD C[C@H](N[C@H](CO)CCF)c1cc(F)cc(F)c1O 846208280 HMNPJLREAHKUCR-CBAPKCEASA-N 263.259 2.042 10 20 CECD CCN1CC[C@@H](NCc2ccc3c(c2)CCO3)[C@H](C)C1 742207086 OXKYVENEXZNXQK-CZUORRHYSA-N 274.408 2.441 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](C)C(=O)NC(C)C 840974521 JZCTYPCLFKWSIH-CYBMUJFWSA-N 277.412 2.064 10 20 CECD CC[C@H]1CN(C(=O)c2ccc(C)c(O)c2O)[C@H](CC)CO1 846373846 FYPCBRCAESRBBO-NEPJUHHUSA-N 293.363 2.436 10 20 CECD C[C@H]1C[C@H](N[C@H]2C[C@H](CO)C2)c2c(O)ccc(F)c21 927147015 IKSAVTGBIUBVEL-GMOBBJLQSA-N 265.328 2.440 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCCN[C@@H]2C)c1O 841064606 ZOGDIARXPYCDTJ-BXKDBHETSA-N 284.787 2.284 10 20 CECD CO[C@@H]1C[C@H](NC(=O)NCc2cc(C)ccc2O)C1(C)C 858273833 IIHBOKHKUHDZCC-UONOGXRCSA-N 292.379 2.313 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)NCc2ccccc2O)C1(C)C 753343507 NIELIRQVTVVAQF-CHWSQXEVSA-N 278.352 2.005 10 20 CECD O=C(NCc1cc(Cl)ccc1O)c1ccc(O)nc1 857546355 AJJYAXBENMNEIY-UHFFFAOYSA-N 278.695 2.076 10 20 CECD CCC[C@@H](OCC)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 860696801 ZUMVEBAEYGXDTR-IAQYHMDHSA-N 295.379 2.350 10 20 CECD CCc1cccc(CN(C)C[C@H]2CCCN2C)c1O 692129053 HZNBUIFSGUJAIR-OAHLLOKOSA-N 262.397 2.481 10 20 CECD O=C(NC[C@H](CO)Cc1ccccc1)c1cc(O)cs1 761571517 FGIDSEJVASKKRW-GFCCVEGCSA-N 291.372 2.035 10 20 CECD COc1cc(CN2CC[C@H](CN(C)C)C2)c(O)cc1C 768444721 BQJSRIWWOBJDFB-CYBMUJFWSA-N 278.396 2.093 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NC[C@@H]1CNCCCO1 1118122138 PUSYVMWWCQJUSB-HZSPNIEDSA-N 290.407 2.217 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C)[C@@H]2CO)cc1 773887130 BJBAGRDBZWTGLL-BBRMVZONSA-N 262.397 2.345 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)C2(O)CCC2)cc1 771951162 QNLJJQHNJMZBFX-UHFFFAOYSA-N 290.407 2.406 10 20 CECD CC(C)[C@@H](N)c1cn(Cc2ccc(N(C)C)cc2)nn1 881270846 CCMYYJIYWRQRAM-OAHLLOKOSA-N 273.384 2.048 10 20 CECD CCOC(=O)[C@@H](C)[C@@H](C)NCc1cc(C)cc(OC)c1O 894453543 HLXUNLWBOCWVCU-NWDGAFQWSA-N 295.379 2.387 10 20 CECD Oc1c(F)cc(F)cc1CN1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 894904446 OSMWKPTTYKVSJH-ZMJPVWNMSA-N 279.286 2.056 10 20 CECD CC(=O)NCCC1=CCN(c2cc(Cl)nc(C)n2)CC1 1089802422 NDGVPXGVXHQVGP-UHFFFAOYSA-N 294.786 2.101 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@H]1CCSC1 74820916 JCPKZSSBYZZXAQ-NSHDSACASA-N 266.366 2.039 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H](N)C1CCCCC1 1326277089 IJDPHDJTUIJXJQ-HNNXBMFYSA-N 276.380 2.258 10 20 CECD COCCOC1CCN(Cc2cc(C)ccc2O)CC1 93339653 CPKRKMAKNCHBNI-UHFFFAOYSA-N 279.380 2.328 10 20 CECD Cc1noc([C@@H]2CCCN(Cc3ccc(N)cc3)C2)n1 1335285485 ODQDWLZOMBDDTH-CYBMUJFWSA-N 272.352 2.340 10 20 CECD Cc1ncccc1NCc1cc2c(cc1O)OCO2 91496114 FRLHVVZLPKDXIS-UHFFFAOYSA-N 258.277 2.436 10 20 CECD COc1cccc(CN(C)C[C@H]2CCCN(C)C2)c1O 92253759 BHCUGGIDTIDXLM-ZDUSSCGKSA-N 278.396 2.174 10 20 CECD Cn1cc(C[C@H]2CCN(Cc3ccc(N)cc3)C2)cn1 1336284905 DNWWVJLFWPBZLO-CQSZACIVSA-N 270.380 2.067 10 20 CECD COc1cc(C)cc(CN[C@H](C)c2noc(C)n2)c1O 1350319011 AYWVQHWYSYHUEJ-SECBINFHSA-N 277.324 2.251 10 20 CECD CC[C@H](C)n1nccc1C(=O)NCc1ccccc1O 1528038287 WUYWIHDULXRUDW-NSHDSACASA-N 273.336 2.490 10 20 CECD CC(C)NCCCN[C@H](C)c1cc(C(=O)O)ccc1O 1609707370 DFFOTUQWXFDCPX-LLVKDONJSA-N 280.368 2.129 10 20 CECD C[C@@H](N)[C@@H](C)C(=O)NCc1c(O)ccc2ccccc12 1576088907 UVPXHDRWAMBNCG-GHMZBOCLSA-N 272.348 2.145 10 20 CECD Cc1ccoc1CNCc1ccc(C(=O)O)cc1O 1777476934 JZKDDQBYUZBWSD-UHFFFAOYSA-N 261.277 2.282 10 20 CECD CN(C)c1ccc(CN[C@@H]2C[C@H]3CC[C@@H]2O3)cc1F 152988681 QGDQJVVYWWFWNK-KYOSRNDESA-N 264.344 2.301 10 20 CECD C[C@@H](NCCCN1CCCC1=O)c1ccc(N(C)C)cc1 159495963 YELRKPYFRKZOMG-CQSZACIVSA-N 289.423 2.416 10 20 CECD CCc1cccc(CN(C)[C@H](C)[C@H](C)S(C)(=O)=O)c1O 848886415 FGROLYTUMQTHSD-NEPJUHHUSA-N 299.436 2.208 10 20 CECD COC(=O)c1cnc(SCCOC2CC2)s1 917777226 AJIIENKKAGARKU-UHFFFAOYSA-N 259.352 2.201 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@H](C)O1 111167886 KAVPXYZNWDPPPX-JQWIXIFHSA-N 279.336 2.120 10 20 CECD Cc1cc(C(=O)O)nc(Sc2nccs2)n1 231958224 APWQFCRVMOTUHR-UHFFFAOYSA-N 253.308 2.091 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](C)[C@H]2CCN)c1 404415930 GATCFBRPGRAQID-SWLSCSKDSA-N 278.396 2.350 10 20 CECD CN(C)c1ccc(CN[C@H](C(=O)O)C(C)(C)C)cc1 756340692 UQDHRHNMGINYQE-CYBMUJFWSA-N 264.369 2.342 10 20 CECD Cc1cc(O)c(CN2CCC[C@H]2C(=O)NC2CC2)cc1C 52086461 GJCNYLFJDXTQSP-HNNXBMFYSA-N 288.391 2.252 10 20 CECD CC[C@@H](C)OCC(=O)NCc1ccc(N(C)C)c(F)c1 119562956 VYJVSFUJWAEWJH-LLVKDONJSA-N 282.359 2.323 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cnccn1 52851232 LRBMYZFKAIXTBC-UHFFFAOYSA-N 284.363 2.205 10 20 CECD COc1ccc(O)c(CNC(=O)COC2CCCCC2)c1 114543596 NCQLUPOABWQRTL-UHFFFAOYSA-N 293.363 2.366 10 20 CECD CN(C)C(=O)c1cccc(NC(=O)Cc2ccc(N)cc2)c1 66153969 FGVYJUBOBZULAX-UHFFFAOYSA-N 297.358 2.152 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](O)c1ccccc1 179652750 IZKAQGSTJONTJO-KRWDZBQOSA-N 298.386 2.445 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](O)COCC(C)C)c1 182316544 JPOQTBSSIIEDJQ-CHWSQXEVSA-N 297.395 2.085 10 20 CECD C[C@H]1CC[C@H](CCC(=O)NCc2ccc(O)c(O)c2)O1 182547994 AFCZRTJNWLPFJZ-CMPLNLGQSA-N 279.336 2.062 10 20 CECD CS[C@H](C)CC(=O)N(C)Cc1ccccc1O 128693674 XHWFFYNRAMBGBD-SNVBAGLBSA-N 253.367 2.492 10 20 CECD COC(=O)C1CCN(Cc2cccc(C)c2O)CC1 183486557 NWRPOWDDMPRRPL-UHFFFAOYSA-N 263.337 2.086 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC2(CCO)CCCC2)c1 72925876 LDAPMNMQFMKXJN-UHFFFAOYSA-N 294.351 2.333 10 20 CECD Oc1ccc(Cl)cc1CN1C[C@@H]2CCCN[C@@H]2C1 219798892 PRKRPGQKKLJBNS-GXFFZTMASA-N 266.772 2.229 10 20 CECD COC(=O)C1(NCc2ccc(N(C)C)cc2)CCCC1 180033223 IVAPIRQXHQBODW-UHFFFAOYSA-N 276.380 2.328 10 20 CECD C[C@@H]1C[C@@H](N)CCN1Cc1cc(Cl)ccc1O 131512636 VEINKGLCXFLPLA-SKDRFNHKSA-N 254.761 2.357 10 20 CECD Cc1cnn(C)c1CN(C)Cc1ccc(N(C)C)cc1 289152631 QIVZABNHRWBYCK-UHFFFAOYSA-N 272.396 2.427 10 20 CECD C[C@@H](O)CCCNCc1cc(Br)ccc1O 227952891 MPJHYXUIRNNSEK-SECBINFHSA-N 288.185 2.405 10 20 CECD Oc1ccccc1CN=c1[nH]nc(C(F)F)s1 383439401 GHEFVDWOYYQHOC-UHFFFAOYSA-N 257.265 2.215 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@]12CCOC2 368096224 CWXZHOOIXKDDNL-WBVHZDCISA-N 288.391 2.138 10 20 CECD CC[C@H]1CN(C(=O)c2c(F)ccc(O)c2O)CCS1 276510857 DVISZKDBZOGWSH-QMMMGPOBSA-N 285.340 2.205 10 20 CECD CCN(Cc1cc(Br)ccc1O)[C@@H](C)CO 293612094 KCFKJZWRBYZAKF-VIFPVBQESA-N 288.185 2.357 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC2=CCNCC2)c1 817987132 WODYMFHQWIDXOG-GFCCVEGCSA-N 276.380 2.361 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1ccsc1 714377230 ADEXXHLPIKIUQN-UHFFFAOYSA-N 255.320 2.255 10 20 CECD CNCCc1ccccc1C(=O)NCCc1ccc(N)cc1 817859150 VQOBFBAMBCLSEY-UHFFFAOYSA-N 297.402 2.003 10 20 CECD CC[C@@H](NCC1(COC)CCNCC1)c1ccccc1O 817974452 MELCRDMYMBATBL-OAHLLOKOSA-N 292.423 2.449 10 20 CECD Oc1c(CN2CCn3ncnc3C2)ccc2ccccc12 816571508 GTVXLAPMNDPWAN-UHFFFAOYSA-N 280.331 2.153 10 20 CECD COC(=O)[C@@H](CNCc1ccccc1O)CC(C)C 813332621 DFMCUMSHHFJSEI-CYBMUJFWSA-N 265.353 2.317 10 20 CECD COc1ccc(N2CC[C@H](CNc3nnc(C)o3)C2)cc1 819934046 GOUKAJPMKOBRRU-GFCCVEGCSA-N 288.351 2.325 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H]2CCCNC2)c1 817946132 RZMKOSFYZXUJIB-VXGBXAGGSA-N 264.369 2.051 10 20 CECD COC(=O)c1cnc(S[C@@H]2CCCOC2)s1 829681402 VZLODCUCTWFWHR-SSDOTTSWSA-N 259.352 2.201 10 20 CECD Cc1ncc(C(=O)NCCCSc2nccs2)n1C 900683706 PEJMLJJCMWCFKE-UHFFFAOYSA-N 296.421 2.097 10 20 CECD COc1ccc(CN[C@H]2C[C@@H]3CCCCN3C2=O)cc1C 835072273 DZEUVLCEQDWVMP-GJZGRUSLSA-N 288.391 2.247 10 20 CECD O=C(NCc1cn2ccccc2n1)c1cc(O)cs1 732262296 UDTXPTHZXUPFRB-UHFFFAOYSA-N 273.317 2.031 10 20 CECD CC[C@H](OC1CCCC1)C(=O)NCc1ccc(O)cc1O 910951565 UECXVBYSQQOBAC-HNNXBMFYSA-N 293.363 2.452 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](N)C[C@@H]2C)c1O 846707863 ZRNNCBRWFJIJLB-ZANVPECISA-N 280.343 2.046 10 20 CECD CC[C@H](C[C@@H](C)CO)NCc1cccc(OC)c1O 743499639 LKMNZKXEPWSJTC-DGCLKSJQSA-N 267.369 2.288 10 20 CECD C[C@H](C(=O)NC(C)(C)C)N(C)Cc1ccc(N(C)C)cc1 741447813 PXDZVCIWVBTZPY-CYBMUJFWSA-N 291.439 2.488 10 20 CECD CCOc1ccc(CN[C@H]2CCC[C@@H](N)C2)c(O)c1 841054625 FVRRXICRXYJECQ-OLZOCXBDSA-N 264.369 2.150 10 20 CECD C[C@H]1CC(C)(C)CN1Cc1cc2c(cc1O)OC[C@H]2O 840179322 ALEDMKATFAEJNE-IINYFYTJSA-N 277.364 2.438 10 20 CECD CCOCCC1(C(=O)NCc2ccc(O)cc2O)CCC1 910950568 WURWKAHSDWQFQP-UHFFFAOYSA-N 293.363 2.311 10 20 CECD COc1cccc([C@H](C)N[C@H](C)C(=O)NC(C)(C)C)c1O 846141267 HEQXJJMHCBHBDA-WDEREUQCSA-N 294.395 2.355 10 20 CECD COc1cccc(CN2CCC[C@H]([C@H]3CCNC3)C2)c1O 843124843 JCJJIAVCWCKWFX-KBPBESRZSA-N 290.407 2.222 10 20 CECD COc1cccc([C@@H](C)N[C@@H](C)C(=O)NC(C)(C)C)c1O 846141265 HEQXJJMHCBHBDA-MNOVXSKESA-N 294.395 2.355 10 20 CECD COc1cccc(CN(C)[C@@H](C)c2nc(C)no2)c1O 848926441 XTVSLIHQTLKBCF-VIFPVBQESA-N 277.324 2.285 10 20 CECD COCC[C@H](CO)N[C@H](C)c1ccc(Cl)cc1O 841751637 IIZZJGHCFJJQLO-MWLCHTKSSA-N 273.760 2.094 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2cccc(OC)c2O)C1 846144308 CDWHGHDNLPQIRU-NEPJUHHUSA-N 292.379 2.062 10 20 CECD N[C@@]12CCC[C@@H]1CN(Cc1cc(Cl)cc(F)c1O)C2 857225950 BOTLBDKHQQBFFF-QMTHXVAHSA-N 284.762 2.498 10 20 CECD CCOc1cccc(CN2C[C@@H]3CCC[C@]3(N)C2)c1O 857226152 GARGZGROZNAPFC-BBRMVZONSA-N 276.380 2.104 10 20 CECD COc1ccc(N(Cc2nncn2C)CC(C)C)cc1 750521547 STRXCRPSAMABIS-UHFFFAOYSA-N 274.368 2.486 10 20 CECD Cc1cc(O)c(CN(C)[C@@H]2CCC(=O)N(C)C2)cc1C 862428176 MNOITPLHNDEEGH-CQSZACIVSA-N 276.380 2.062 10 20 CECD COc1ccc2c(c1)CCCN2CN1CCCC1=O 766340455 LQJNWGZEHQBOCN-UHFFFAOYSA-N 260.337 2.028 10 20 CECD C/C=C/C[C@@H](CO)NCc1ccc(N(C)C)c(F)c1 769935725 PZVCAEINNFBMQK-IHVVCDCBSA-N 266.360 2.308 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1cc(F)c(N(C)C)cc1F 864379729 QKLBTPIPHWWPHR-HNNXBMFYSA-N 297.349 2.261 10 20 CECD CCCN(CC(=O)OCC)Cc1ccc(C)cc1O 876631882 YFCDCZDPLZYHRV-UHFFFAOYSA-N 265.353 2.476 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](n3cncn3)C2)c1 776774628 MGNOGWFODNLRLI-AWEZNQCLSA-N 272.352 2.048 10 20 CECD Cc1cc(C(=O)N2C[C@H](N)C[C@H]2C)c(C)n1-c1ccccn1 877175406 JNFDBKXHJUSZEO-BXUZGUMPSA-N 298.390 2.051 10 20 CECD CN1CCN(c2ccc(/C=C\c3nccc(O)n3)cc2)CC1 771527072 ZPOQGVKSDCMFIM-DAXSKMNVSA-N 296.374 2.104 10 20 CECD CCOc1ccc(CN[C@@H](CCO)C(F)(F)F)c(O)c1 886371523 NYUHBPFUKXHEOF-LBPRGKRZSA-N 293.285 2.194 10 20 CECD C[C@H](NC[C@H]1CC[C@H](C(N)=O)CC1)c1c(O)cccc1F 886628443 QQXFGASGENGBEH-SRVKXCTJSA-N 294.370 2.474 10 20 CECD CCOC[C@H](NC(=O)c1cc(O)cs1)C(C)C 789918243 PCOHYOZQOBUYME-JTQLQIEISA-N 257.355 2.245 10 20 CECD COc1cccc(CN2CC[C@H](C)C[C@@H]2[C@H](C)O)c1O 785988847 PLKQVJOIMRGUDQ-SGMGOOAPSA-N 279.380 2.382 10 20 CECD O=C(O)[C@@]1(NCc2ccc3c(c2)CCCO3)CCSC1 900033011 LAKXSUICAHFADN-OAHLLOKOSA-N 293.388 2.062 10 20 CECD Cc1cc(Br)cc([C@@H](C)NCCCO)c1O 186912823 ZGXVEGROUCDTEX-SECBINFHSA-N 288.185 2.496 10 20 CECD CCc1cccc(CNC[C@@H](C)CCCO)c1O 691523007 NOXAHXMDQQJOGU-LBPRGKRZSA-N 251.370 2.453 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cccnc2O)c1 714983874 GGGXARIGSSFMRG-JTQLQIEISA-N 274.320 2.352 10 20 CECD CC[C@H](NC[C@H]1CCCCS1(=O)=O)c1ccccc1O 694591865 WUQZTIWNNVJSTO-OCCSQVGLSA-N 297.420 2.400 10 20 CECD CN(C)[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1O 1320161969 ULOFAQRLEYEJHJ-ZIAGYGMSSA-N 266.360 2.494 10 20 CECD CCCN(CC(=O)O)Cc1cc(C)cc(C)c1O 1595856135 GYLWLEPOATXPBH-UHFFFAOYSA-N 251.326 2.306 10 20 CECD C[C@@H](Nc1ncccc1-c1nn[nH]n1)c1ccccc1O 1591731761 NHFBQPNLZVKBCF-SECBINFHSA-N 282.307 2.140 10 20 CECD COc1ccc(N(C)C/C(C)=C/C(=O)O)cc1F 1599584491 UPQYHHXYGXLATN-RMKNXTFCSA-N 253.273 2.301 10 20 CECD CC(=O)N[C@@H]1CCCN(Cc2cc(Cl)ccc2O)C1 158064922 ATDCNNDJSJGMFQ-CYBMUJFWSA-N 282.771 2.146 10 20 CECD COCCOC[C@@H]1CCN(Cc2cc(C)cc(C)c2O)C1 164420064 RJTOSHFBVOLVDC-OAHLLOKOSA-N 293.407 2.494 10 20 CECD CN(C)c1ccc(CNc2cccc(C(N)=O)c2)cc1 20124782 WLEHMVSACHRFBH-UHFFFAOYSA-N 269.348 2.464 10 20 CECD CCC[C@@H](CNCc1c(O)cccc1OC)OC 824543188 FZMFEMIESTYHHX-NSHDSACASA-N 253.342 2.306 10 20 CECD CC(C)C[C@H](NCc1cc(F)ccc1O)C(=O)O 232615274 AQKMBJJFMMAHAQ-NSHDSACASA-N 255.289 2.120 10 20 CECD O=C(O)[C@@H]1CCC[C@H](NCc2cc(F)cc(F)c2O)C1 708089779 MKNNEPIVVJAXFL-KCJUWKMLSA-N 285.290 2.403 10 20 CECD Cc1nc(CNCc2ccc(N(C)C)cc2)[nH]c1C 709028570 AEXOPMUICYVETD-UHFFFAOYSA-N 258.369 2.382 10 20 CECD C[C@@H](NC[C@@H]1CCCCS1(=O)=O)c1ccccc1O 694515734 QUEGGZPVRODAIP-NEPJUHHUSA-N 283.393 2.010 10 20 CECD O=c1cccc2n1C[C@H]1C[C@@H]2CN(Cc2ccccc2O)C1 245139 BGTJGEQBHLWNGX-DZGCQCFKSA-N 296.370 2.173 10 20 CECD Oc1ccc(Cl)cc1CNC[C@H](O)c1ccco1 304498863 FRENAVJCQXPUSC-LBPRGKRZSA-N 267.712 2.462 10 20 CECD C[C@]1(NCc2cc(Br)ccc2O)CCOC1 120127494 IEAUNXYFIXWOAM-LBPRGKRZSA-N 286.169 2.423 10 20 CECD CCCN(CC(=O)OC)Cc1cccc(C)c1O 183377284 YOQRGRZUKIIHQX-UHFFFAOYSA-N 251.326 2.086 10 20 CECD CCCSCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183466807 KBOFXCOLPDFAGL-SNVBAGLBSA-N 283.393 2.288 10 20 CECD CN(C)C(=O)CC1CCN(Cc2ccccc2O)CC1 180333416 REGYLWKRNOYTOZ-UHFFFAOYSA-N 276.380 2.083 10 20 CECD COc1ccc(O)c(CNCc2c(Cl)cnn2C)c1 131577540 GHJYJXTXUBYPOL-UHFFFAOYSA-N 281.743 2.078 10 20 CECD C[C@H](NCCCCO)c1ccc(N2CCOCC2)c(F)c1 194223391 SYPMOSNFLUTOMB-ZDUSSCGKSA-N 296.386 2.085 10 20 CECD CN(Cc1cn(C(C)(C)C)nn1)c1ccc2c(c1)OCO2 191469205 WWFXMLQKRWBZGK-UHFFFAOYSA-N 288.351 2.398 10 20 CECD COc1cc(Cl)cc(CNCc2ccno2)c1O 231883169 YEPQUGOBSUNERM-UHFFFAOYSA-N 268.700 2.332 10 20 CECD CN(C)c1ccc(CNC(=O)NOC2CCCC2)cc1 91534810 QFSFQHDWGHISQA-UHFFFAOYSA-N 277.368 2.426 10 20 CECD C[C@H](NCCC1(C)OCCO1)c1ccccc1O 183906520 JXMPCFPYVLRORM-NSHDSACASA-N 251.326 2.196 10 20 CECD COCCC1(CNC(=O)NCc2ccccc2O)CCC1 268597178 WUYVVJWQCRJQCS-UHFFFAOYSA-N 292.379 2.398 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(O)CCC1 273195081 ITJKGEFOXZZTLF-UHFFFAOYSA-N 276.380 2.016 10 20 CECD Cc1cccc(CN2CCCC[C@H](S(C)(=O)=O)C2)c1O 278819554 ZGRUFBSOPUOBOH-AWEZNQCLSA-N 297.420 2.100 10 20 CECD CC[C@@H](NCCCN1CCOCC1)c1ccc(C)cc1O 280272605 YAMOBBPEIGBZOE-MRXNPFEDSA-N 292.423 2.464 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCCC(C)(F)F)c1O 295929901 FQVMUVDRODDYRG-UHFFFAOYSA-N 290.266 2.444 10 20 CECD CC(C)c1cc(C(=O)NCc2ccc(N)cc2)on1 297353438 ZJUYUHLPWJAMEN-UHFFFAOYSA-N 259.309 2.310 10 20 CECD CCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)C[C@H](C)OC 291105867 SCVCCTFNHRRPPQ-JTQLQIEISA-N 298.339 2.166 10 20 CECD Cc1cc(CN2C[C@H](C)[S@@](=O)[C@H](C)C2)ccc1N(C)C 815100070 BXDAEJGITCJHQE-IKDJWVMYSA-N 294.464 2.402 10 20 CECD C[C@@H](NC[C@H]1CCCCN1)c1cc(F)cc(F)c1O 817948931 FLVNHHVVQQNSLP-MWLCHTKSSA-N 270.323 2.463 10 20 CECD C[C@@H](NC(=O)[C@@H]1CSCCS1)c1ccccc1O 827937151 MAYZXBHXELWNBK-SKDRFNHKSA-N 283.418 2.418 10 20 CECD COc1ccc(CNCc2cccc(C(=O)O)c2)c(O)c1 820837099 NUPHLHCQSGAXAB-UHFFFAOYSA-N 287.315 2.389 10 20 CECD CC[C@@](C)(CC(=O)O)NCc1cc(F)cc(C(C)=O)c1O 828664623 DCGHVWMBOFNOOL-HNNXBMFYSA-N 297.326 2.467 10 20 CECD Cc1ccc(O)c(CN2CCC[C@@H](n3ccnn3)C2)c1 822503989 NZPGIXOWXIXYFF-CQSZACIVSA-N 272.352 2.129 10 20 CECD CCN(CCC1CC1)C(=O)c1c(F)ccc(O)c1O 828480153 MSCJRTLJCBTLSC-UHFFFAOYSA-N 267.300 2.499 10 20 CECD COc1ccc(OCCNC(=O)c2cc(O)cs2)cc1 731865197 IJLHGZKTFXQWGY-UHFFFAOYSA-N 293.344 2.271 10 20 CECD Cc1ccc(NC(=O)/C=C\c2ccc(O)c(O)c2)cn1 588407306 MAJDVGRWSWHKCP-DAXSKMNVSA-N 270.288 2.453 10 20 CECD CCn1cnc(C(=O)N[C@H](C)c2cc(OC)ccc2O)c1 830541395 XINUHVSABBZHHC-SNVBAGLBSA-N 289.335 2.108 10 20 CECD CCc1cccc(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)c1O 848887721 CKPQMATXDSPTBS-ZKTNFTSUSA-N 281.421 2.296 10 20 CECD CCN(C)c1ccc(CN(C)[C@H](C)C(=O)O)cc1 846224227 HZRLNLWLCRSWDB-LLVKDONJSA-N 250.342 2.048 10 20 CECD CCOc1ccc(CNCCN2CC[C@@H](C)C2)c(O)c1 744450041 JPICRHACBLDCMR-CYBMUJFWSA-N 278.396 2.222 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN[C@H](C)[C@@H]2C)c1O 843376860 FGAJQTWYHRFXRO-ZJUUUORDSA-N 296.798 2.430 10 20 CECD COC(=O)[C@@H]1CCN(Cc2ccc(N(C)C)cc2C)[C@H]1C 840942215 VPAOFGRSNZJORA-XJKSGUPXSA-N 290.407 2.444 10 20 CECD CCCCOCC(=O)NCc1cc(Cl)ccc1O 846474972 DAICJSKEVCBTBQ-UHFFFAOYSA-N 271.744 2.479 10 20 CECD Nc1ccc(NC(=O)CCC(=O)NC2CCCC2)cc1 843294213 WFQZTGDWXVRZRW-UHFFFAOYSA-N 275.352 2.046 10 20 CECD C[C@@H]1COC[C@H]1NCc1cc(F)c(N(C)C)cc1F 922641296 ZZWFCFBONVZIKH-NOZJJQNGSA-N 270.323 2.155 10 20 CECD CCOc1ccc(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)c(O)c1 769465539 HCWIHTXLNDEAIQ-PVUDRZGPSA-N 297.420 2.132 10 20 CECD Cc1ccc(O)c(CNC(=O)CCCn2ccnc2C)c1 862758647 FMPYEFNTFAMEGH-UHFFFAOYSA-N 287.363 2.302 10 20 CECD C[C@@H](NC(=O)NCC1=CCCOC1)c1ccccc1O 868612793 NLLOXDJSRJSVKK-LLVKDONJSA-N 276.336 2.099 10 20 CECD O=C(Nc1ccnn1CC1CC1)c1cc(O)cs1 764343956 YDISAYMPCSOXJG-UHFFFAOYSA-N 263.322 2.313 10 20 CECD CC(C)C(=O)NCc1cccc(Br)c1O 765766887 DIZIPRABCRXHHJ-UHFFFAOYSA-N 272.142 2.427 10 20 CECD C[C@@H]1C[C@@H](NCCOCCN(C)C)c2c(O)ccc(F)c21 774375630 DETWSCQTBCWJOE-DGCLKSJQSA-N 296.386 2.247 10 20 CECD CCc1nc(COC(=O)c2cccc(O)c2O)cs1 776282542 SVHLLERXYCRWSW-UHFFFAOYSA-N 279.317 2.474 10 20 CECD COC(=O)CC1(NCc2ccc(N(C)C)cc2)CCC1 777440574 HMNVFQVSBCSFTN-UHFFFAOYSA-N 276.380 2.328 10 20 CECD Cc1cccc(CN2CCC(O[C@@H]3CCOC3)CC2)c1O 775727049 GOXHEUKEYCQTMB-MRXNPFEDSA-N 291.391 2.471 10 20 CECD CC[C@@H](NCCCS(=O)(=O)CC)c1ccccc1O 775411333 DJWXLRZGETWWKJ-CYBMUJFWSA-N 285.409 2.258 10 20 CECD COCC1(S(=O)(=O)Nc2ccc(O)c(C(C)C)c2)CC1 882799991 WRUCOESXAUTXNO-UHFFFAOYSA-N 299.392 2.436 10 20 CECD Nc1ccc(CNC(=O)c2ccc(NC3CC3)nc2)cc1 1122445449 SKVHATZEHTUUJO-UHFFFAOYSA-N 282.347 2.168 10 20 CECD C[C@H]1C[C@@H](O)CN1Cc1cccc(Br)c1O 788269424 NOUQDWOFXMRTLC-WCBMZHEXSA-N 286.169 2.110 10 20 CECD O=C1NCC2(CCN(Cc3cc(Cl)ccc3O)CC2)O1 783721747 MPYYENDTLFIOAX-UHFFFAOYSA-N 296.754 2.120 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCO[C@@H](C)C2)c1O 894359417 ODYRMWLOQDKZJW-WCQYABFASA-N 265.353 2.366 10 20 CECD COc1ccc(CN[C@H]2CCOC(C)(C)C2)c(O)c1OC 893238983 XASMHSIMWUHYAV-LBPRGKRZSA-N 295.379 2.457 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)C[C@H]2CCCO2)cc1Cl 895750189 XXDXXFZQFZSNLU-CHWSQXEVSA-N 299.798 2.374 10 20 CECD COc1cccc(CN2CCO[C@@H]3CCC[C@@H]32)c1O 132770236 YHKJPXVBHSRNLB-QWHCGFSZSA-N 263.337 2.154 10 20 CECD CC[C@@H](NCc1cc(C)cc(OC)c1O)C(C)(C)O 894863761 REOFEBUIPAXUJT-CYBMUJFWSA-N 267.369 2.348 10 20 CECD OCCn1cc(NCc2ccc(N3CCCC3)cc2)cn1 1319839737 OSTDNCIAAKBWHQ-UHFFFAOYSA-N 286.379 2.088 10 20 CECD CCOC(=O)C1(NC(=O)c2cc(O)cs2)CCCC1 1328182605 CCGKDGQTTUUEOO-UHFFFAOYSA-N 283.349 2.059 10 20 CECD Cc1csc(=O)n1CCN(C)Cc1ccccc1O 109771731 DFMCNJBAICRPKU-UHFFFAOYSA-N 278.377 2.056 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCCC1CCOCC1 1325049729 AJEFEGAIPWLURD-DUXPYHPUSA-N 291.347 2.044 10 20 CECD CCCN(Cc1ccccc1O)[C@@H]1CCCN(C)C1=O 778945456 GRQKXUHBFMUNQQ-CQSZACIVSA-N 276.380 2.225 10 20 CECD O=C(NCCc1ccccc1C(=O)O)c1cc(O)cs1 1601514179 SNLUXOBXXGHBHU-UHFFFAOYSA-N 291.328 2.124 10 20 CECD O=C(O)[C@H]1CCC[C@@H]1NCc1cccc(Cl)c1O 1610742180 OHQOCUKZIVNAGL-ONGXEEELSA-N 269.728 2.389 10 20 CECD O=C(O)c1cccc(COC(=O)c2cccc(O)c2O)c1 1610846626 SGOTWHSQWBWBLO-UHFFFAOYSA-N 288.255 2.153 10 20 CECD C[C@H](NCCCSc1nccs1)[C@@H]1C[C@H]1C(=O)O 1593267170 MHNMLMVTZIAQDT-LPEHRKFASA-N 286.422 2.324 10 20 CECD CCN(CCC(=O)OC)Cc1cc(C)c(C)cc1O 151971424 KLDCBZPQMQBQMR-UHFFFAOYSA-N 265.353 2.394 10 20 CECD CCOc1ccccc1C(=O)NCc1ccc(O)c(O)c1 159035161 KTTOEJCYEMRJNI-UHFFFAOYSA-N 287.315 2.427 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)CCN1 904356310 VPVSDZWSUMAVKI-DOMZBBRYSA-N 260.381 2.242 10 20 CECD COc1ccc(O)c(CN[C@H]2CCS[C@@H]2C)c1 310528701 YQQRPEAOPOZIPA-SKDRFNHKSA-N 253.367 2.384 10 20 CECD CC1(O)CCC(NCc2ccc3c(c2)CCO3)CC1 703541819 BHJYUMDUOMMXIE-UHFFFAOYSA-N 261.365 2.405 10 20 CECD COc1cccc(CNCCc2ccc(C)cn2)c1O 689506963 XPGNXCKYMODBCB-UHFFFAOYSA-N 272.348 2.437 10 20 CECD COc1cccc(CN[C@H]2C[C@@H](OC)C23CCC3)c1O 713480296 FSRPMKAYZFINLI-UONOGXRCSA-N 277.364 2.448 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCc1cnnn1C 394940368 BXHZQADGECTUBV-ZYHUDNBSSA-N 272.352 2.167 10 20 CECD C[C@@H](NCC1(N(C)C)CC1)c1cc(F)ccc1O 397848865 GHRNNDBUCIBZBD-SNVBAGLBSA-N 252.333 2.276 10 20 CECD CC(C)N(C)C[C@H](C)NC(=O)Nc1ccc(N)cc1 311444524 QIXMXZALJRGYAK-NSHDSACASA-N 264.373 2.119 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)c2cccnc2)c(O)c1O 179393036 WENQFNQEZJYLLL-JTQLQIEISA-N 272.304 2.292 10 20 CECD COc1cccc(CNC(=O)[C@H]2COc3ccccc32)c1O 175928289 NZGPWCDULFFRJY-ZDUSSCGKSA-N 299.326 2.193 10 20 CECD C[C@H](NCCCNC(=O)C1CCC1)c1cc(F)ccc1O 186092150 SHOXPDOYLSMGAL-NSHDSACASA-N 294.370 2.488 10 20 CECD CC(C)NC(=O)N(Cc1ccccc1O)C[C@H]1CCCO1 42839788 ZPDKXZDWSNJUMK-CQSZACIVSA-N 292.379 2.491 10 20 CECD Nc1ccc(CC(=O)NC[C@@H]2CCOc3ccccc32)cc1 237903407 XWZQHOSIOMELNI-AWEZNQCLSA-N 296.370 2.494 10 20 CECD CCOc1cccc(CN[C@H](C)CCCO)c1O 94941580 IDKWQDVCTNWIKN-LLVKDONJSA-N 253.342 2.042 10 20 CECD Cc1ccc(O)c(C(=O)NCCc2ccc(O)c(O)c2)c1 98074677 RTLVWZJFPGWDKE-UHFFFAOYSA-N 287.315 2.084 10 20 CECD Cc1cc(O)c(CN(C)Cc2nccn2C)cc1C 264700983 ANUVLZOAWWTIJG-UHFFFAOYSA-N 259.353 2.375 10 20 CECD Cc1cccc(CN[C@H]2COc3ccccc3[C@H]2O)c1O 368133456 URJYARALXSUHDQ-WMLDXEAASA-N 285.343 2.285 10 20 CECD COc1ccc(N(C)Cc2cnn(C)n2)cc1Cl 289283149 ADJAXMHOMTXHIZ-UHFFFAOYSA-N 266.732 2.114 10 20 CECD CCCCN(CC(=O)N(C)CC)Cc1ccccc1O 282549022 WXUPRANLTDHQRO-UHFFFAOYSA-N 278.396 2.473 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCC2=CCCOC2)c1 286918822 FMHFHBLEAZZVMT-LLVKDONJSA-N 291.347 2.176 10 20 CECD Cc1ccc([C@@H](C)N[C@H]2CCCN(CCCO)C2)c(O)c1 297385139 RKLJQYVQGIUJOI-CABCVRRESA-N 292.423 2.198 10 20 CECD CCN(CC(=O)NCC1CC1)c1ccc(OC)c(OC)c1 299280532 OCZYVAIOLREERL-UHFFFAOYSA-N 292.379 2.056 10 20 CECD C/C=C(\C)C(=O)N(CC(=O)OCC)Cc1ccccc1O 819695821 ADTYNINWVIHGJF-UUILKARUSA-N 291.347 2.250 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H](C)CC(=O)O 829718700 ODWUEEBKSXLDIN-GFCCVEGCSA-N 292.379 2.212 10 20 CECD CN(C)c1ccc(CN(C[C@H]2COCCO2)C2CC2)cc1 827443199 ZGYLIIJRJAXRDR-KRWDZBQOSA-N 290.407 2.132 10 20 CECD CCN(CC)c1ccc(CN(C)CC[S@](C)=O)cc1 827336583 JUFNBKQLGNDLBU-IBGZPJMESA-N 282.453 2.343 10 20 CECD Cc1cc(Cl)cc(CN2CC[C@@H](C(=O)O)C2)c1O 820976961 YEWPDENRTBNJFZ-SECBINFHSA-N 269.728 2.261 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1cccs1 588403238 BPOXQJVYKLTVKB-XQRVVYSFSA-N 275.329 2.489 10 20 CECD CC(C)(N)CCNCc1c(O)ccc(Cl)c1F 903940140 YLQFJXFHUHAHAW-UHFFFAOYSA-N 260.740 2.402 10 20 CECD CN(C)c1ccc(/C=C/CN2CC[C@@](F)(C(=O)O)C2)cc1 901513755 CVCIMGFNRPRNFE-CWDCEQMOSA-N 292.354 2.264 10 20 CECD Cc1cc(C(=O)NCc2ccc(N(C)C)cc2C)n[nH]1 734468188 PPRYPHNWZMEODK-UHFFFAOYSA-N 272.352 2.023 10 20 CECD C[C@H](N[C@@H]1COC[C@@H]1C)c1ccc(N2CCOCC2)cc1 903400230 NJSRZTPBDVTWIP-GRDNDAEWSA-N 290.407 2.209 10 20 CECD CCCc1nc(C)c(C(=O)NCc2ccc(O)cc2O)o1 910943381 BDLWQTQLLYSFEM-UHFFFAOYSA-N 290.319 2.277 10 20 CECD C[C@@H]1CC[C@@H](NC(=O)NCCc2ccc(N)cc2)C1 841886133 YMJYUHYZODFFJC-BXUZGUMPSA-N 261.369 2.299 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H](C)[C@@H](CN)C1 841099571 MEQGGSQAESGADI-CJNGLKHVSA-N 275.440 2.478 10 20 CECD CN(C)c1ccc(/C=C\CNCCCC(=O)O)cc1 843041532 ROVRVUMBXQFWPJ-HYXAFXHYSA-N 262.353 2.220 10 20 CECD COc1ccc(N(C)CCN(C)CC2CCNCC2)cc1 844839836 YDWKVHRZTPZQEK-UHFFFAOYSA-N 291.439 2.063 10 20 CECD CC(C)OCCc1nc(Cc2ccc(N)cc2)no1 843158392 CIYQXGJAEMCNTD-UHFFFAOYSA-N 261.325 2.210 10 20 CECD COC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840558426 YCBILBHJNZISAK-NSHDSACASA-N 250.342 2.348 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H]2CCCNC2=O)c(O)c1 840824926 AWJXHLAPYPEYKF-STQMWFEESA-N 276.380 2.186 10 20 CECD Cc1ccc([C@@H](C)NC[C@H]2CC(=O)N(C3CC3)C2)c(O)c1 846204639 AGNYHRXPPZXHBT-CHWSQXEVSA-N 288.391 2.362 10 20 CECD CCOCc1cc(CN[C@H]2C[C@H](OC)C2)ccc1OC 858322537 ZLMWOQKCWGRHRZ-SHTZXODSSA-N 279.380 2.499 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)Cc2cnccn2)c1 756493448 FBIBUSJDCNPMLP-NWDGAFQWSA-N 287.363 2.473 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2cccc(C)n2)c1 858408565 QTLXSSRYNOSSDA-UHFFFAOYSA-N 299.374 2.446 10 20 CECD CCOc1ccccc1N(C)C(=O)/C=C/c1cn(C)cn1 935082071 FEEDGUPWLYASGV-MDZDMXLPSA-N 285.347 2.495 10 20 CECD C[C@H](C[S@](C)=O)N[C@H](C)c1cc(F)cc(F)c1O 757654367 ASJRBSFPSUVQLQ-FWMBLBRJSA-N 277.336 2.088 10 20 CECD Cc1cnc([C@H](C)OC(=O)c2cccc(O)c2O)o1 758560155 VELWMLVAQKFNED-QMMMGPOBSA-N 263.249 2.312 10 20 CECD Cc1nc(CCNC(=O)c2cc(O)cs2)sc1C 764335365 UFIVUSINRSHEAA-UHFFFAOYSA-N 282.390 2.500 10 20 CECD CC[C@](C)(CO)NCc1cccc(Br)c1O 70898812 UESPEZQGAHKVRB-GFCCVEGCSA-N 288.185 2.405 10 20 CECD CN(C)c1cc(F)c(CNCCc2cnccn2)cc1F 1118858841 WWLHLSUYJLVWOS-UHFFFAOYSA-N 292.333 2.153 10 20 CECD CCCOc1ccc(CNC[C@@](C)(O)COC)cc1C 873052188 SBPOVSIDOZUCGD-MRXNPFEDSA-N 281.396 2.271 10 20 CECD Cc1ccc(CN2CC(OCC(F)F)C2)c(O)c1 877580503 MJKCILZICQHXKB-UHFFFAOYSA-N 257.280 2.167 10 20 CECD COCC1(C)CCN(Cc2cc3c(cc2O)OCO3)CC1 773272359 OSODIYMEFQMTEC-UHFFFAOYSA-N 293.363 2.369 10 20 CECD Cc1cccc(O)c1CNC[C@H](C(C)C)N1CCOCC1 876909321 XJSZWBKSLKMGGD-MRXNPFEDSA-N 292.423 2.147 10 20 CECD CC[C@H](NCc1ccnc(N(C)C)n1)c1ccccc1O 775531639 KBISUSMOUJVJPG-AWEZNQCLSA-N 286.379 2.489 10 20 CECD Cc1ccc(CN2CCC3(CC2)OCCO3)c(O)c1 876559732 APJJASQXJVYDBH-UHFFFAOYSA-N 263.337 2.040 10 20 CECD C[C@H](NCc1cc([N+](=O)[O-])ccc1O)[C@H]1CCCOC1 779985464 FUKOUJZKQSJRFT-QWRGUYRKSA-N 280.324 2.205 10 20 CECD OCCOC1CCN(Cc2cccc(Cl)c2O)CC1 775732242 MNPQKOQAYZYLGD-UHFFFAOYSA-N 285.771 2.019 10 20 CECD Nc1ccc(CN2C[C@H](N)Cc3ccccc32)cc1 1120371746 PNJQRGNOGJUBHJ-OAHLLOKOSA-N 253.349 2.159 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CC[C@H]2C[C@@H]2C1 1121366944 VPMPNEYOTVPACE-DTWKUNHWSA-N 276.365 2.095 10 20 CECD COc1cc(O)c(CN2CC(C(F)(F)F)C2)cc1OC 894891863 QOAJHAAFFSBAJB-UHFFFAOYSA-N 291.269 2.404 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2cc(F)cc(F)c2O)C[C@@H]1C 895417638 DHTLGGYHTMSTJY-VFZGTOFNSA-N 299.317 2.301 10 20 CECD CCOC(=O)CN(Cc1cc(F)cc(F)c1O)C1CC1 893960098 RVHKKCMOFKGCNW-UHFFFAOYSA-N 285.290 2.198 10 20 CECD Cc1cc(C)c(O)c(CN2CCO[C@@]3(CCO[C@@H]3C)C2)c1 794657543 BGXPSEDQKSTCAO-PBHICJAKSA-N 291.391 2.389 10 20 CECD CCCN(Cc1ccccc1O)C[C@H]1CN(C)C(=O)O1 1343890521 UQGSBFKPSMSUBZ-CYBMUJFWSA-N 278.352 2.055 10 20 CECD CN[C@@H](C)CCN[C@H](C)c1cc(OC)ccc1O 1326038113 YHQVOBXMMAZZAC-WDEREUQCSA-N 252.358 2.049 10 20 CECD CC(C)[C@H](O)CNCc1c(O)cccc1Br 706871988 VENHIQYOMIZWBG-GFCCVEGCSA-N 288.185 2.261 10 20 CECD C[C@@H]1COC[C@H]1NCc1ccc(Br)cc1O 691469705 ZPRJTWIFBUVRQY-LDYMZIIASA-N 286.169 2.279 10 20 CECD Cn1nc(C(=O)Oc2ccc(N)cc2)c2ccccc21 1579989603 JJLUTIVBEZHTDQ-UHFFFAOYSA-N 267.288 2.375 10 20 CECD CC1(C)CNCC[C@@H]1NCc1cc(F)c(F)cc1O 1576481750 AMADXKPONHFBLL-ZDUSSCGKSA-N 270.323 2.148 10 20 CECD CCN(CC)c1ccc(CNC[C@H](CC(=O)O)OC)cc1 1776861373 IUMUALYNNPTTHZ-HNNXBMFYSA-N 294.395 2.112 10 20 CECD OC[C@H]1CCCN(Cc2cc(Cl)ccc2O)C1 154610400 YQPRQICFKCGCTN-JTQLQIEISA-N 255.745 2.250 10 20 CECD Oc1cccc2c1[C@@H](NCCN1CCCCC1)CC2 296113951 UZKDFYPBIZBMAP-AWEZNQCLSA-N 260.381 2.455 10 20 CECD CC[C@@H](N[C@@H](C)c1cc(OC)ccc1O)C(=O)OC 182430696 WUINJJQZCNAYPK-JOYOIKCWSA-N 267.325 2.003 10 20 CECD Oc1cc2c(cc1CNCCC[C@H]1CCOC1)OCO2 402102503 QUGDXPFVNBFKMI-NSHDSACASA-N 279.336 2.027 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(CC)C1)c1ccccc1O 391464453 BMYHGXNTUHXPSM-DGCLKSJQSA-N 262.353 2.054 10 20 CECD O=C1C(=O)c2ccc(Br)nc2-c2ncccc21 2090658129 AIQZZIVCEZTHPW-UHFFFAOYSA-N 289.088 2.285 10 20 CECD CC(C)COC[C@@H](O)CN[C@@H](C)c1ccccc1O 179873540 JRLLXVLDAGLQHK-STQMWFEESA-N 267.369 2.076 10 20 CECD CN(CCOCCO)Cc1ccc(N2CCCCC2)cc1 172365387 MRAIECHOBLNYTA-UHFFFAOYSA-N 292.423 2.118 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cc[n+]([O-])cc1 66096736 SCFJYJKVZNRARL-UHFFFAOYSA-N 286.331 2.078 10 20 CECD COCCN(C)CCCN[C@@H](C)c1ccc(C)cc1O 185008873 XKJGCELCPGDFKY-AWEZNQCLSA-N 280.412 2.320 10 20 CECD CCC(=O)CCN1CCN(c2ccc(OC)c(F)c2)CC1 190273092 BYLOHBBESZFTRJ-UHFFFAOYSA-N 294.370 2.326 10 20 CECD CCN1CCCC[C@@H]1CNC(=O)NCc1ccccc1O 264733219 HASJNBWXGDOYKQ-CQSZACIVSA-N 291.395 2.066 10 20 CECD CCOc1nc(C)ccc1C(=O)NCc1ccccc1O 276844544 WXPHSFMAXHPBOO-UHFFFAOYSA-N 286.331 2.424 10 20 CECD CC[C@@H](C)CN(C)C(=O)c1c(F)ccc(O)c1O 276548010 HCTSHIQROSLDBQ-MRVPVSSYSA-N 255.289 2.355 10 20 CECD CN(C)c1ccc(CN(CCC2OCCO2)C2CC2)cc1 274333976 JOHSUFWQRLLOGQ-UHFFFAOYSA-N 290.407 2.480 10 20 CECD Oc1ccccc1CN1CCC(OC[C@H]2CCOC2)CC1 374917367 YBBQKHLZYMPJLS-AWEZNQCLSA-N 291.391 2.410 10 20 CECD CCCN(Cc1ccccc1O)[C@H](C)c1nncn1C 287821689 PRDYKWADMWVEEX-GFCCVEGCSA-N 274.368 2.494 10 20 CECD Cc1cccc(CN2CCC[C@@H](S(C)(=O)=O)CC2)c1O 800534163 XHFNDGWBMWDILT-CQSZACIVSA-N 297.420 2.100 10 20 CECD CCn1cc([C@H](C)NC(=O)NCc2ccccc2O)cn1 297468554 RWKVEUCDTUGCMV-NSHDSACASA-N 288.351 2.169 10 20 CECD CC1(C)CN(Cc2c(O)cccc2Cl)C[C@H](CO)O1 817413248 UTVDXHXAEJKVQW-SNVBAGLBSA-N 285.771 2.017 10 20 CECD COCC[C@H]1COCCN1Cc1cc(C)cc(C)c1O 812299619 ODASZFGSPKFJOE-HNNXBMFYSA-N 279.380 2.246 10 20 CECD C[C@@H]1CC[C@H](N2C(=O)CN(Cc3ccccc3O)C2=O)C1 819168523 QBNSPSUVHZLOSX-YPMHNXCESA-N 288.347 2.345 10 20 CECD COc1cc(CN2CC[C@H]2CO)c(O)c(C(C)(C)C)c1 902629443 DKFNVOHNVPPSFX-LBPRGKRZSA-N 279.380 2.265 10 20 CECD O=C1CC[C@@H](CN2CCCc3cc(OC(F)F)ccc32)N1 844307030 ZCOCTVRLJNKJMR-NSHDSACASA-N 296.317 2.319 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](N)C[C@H]1C 846703815 QLINSTAQXHMYMC-HIFRSBDPSA-N 261.413 2.373 10 20 CECD C[C@@H](NC[C@@H]1CCCNC1=O)c1cc(Cl)ccc1O 840825314 DURUSNQEEXTTFL-ZJUUUORDSA-N 282.771 2.222 10 20 CECD COc1cc(CN2CC[C@@H]3OCC[C@@H]3C2)c(O)cc1C 842627234 UNKWOAPALWCQIZ-DOMZBBRYSA-N 277.364 2.320 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)c2cc[nH]c2)cc1 846448191 ZURRLZZMFSZAIF-UHFFFAOYSA-N 287.363 2.232 10 20 CECD CCN(CC)c1ccc(CN(C)[C@@H]2CCNC2)cc1F 843049149 GTNDEQYXBIUNMN-CQSZACIVSA-N 279.403 2.466 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@H]1CN 841028520 AKLMIUAEZYZEEJ-BBRMVZONSA-N 261.413 2.278 10 20 CECD COc1ccc(O)c(CN2C[C@H]3[C@H](C2)C3(F)F)c1 846112852 TVPNERYWZNWJQG-QWRGUYRKSA-N 255.264 2.098 10 20 CECD COc1cccc([C@@H](C)NC[C@]2(C)CCOC2)c1O 846143405 FKEDIWGEIAXHON-ABAIWWIYSA-N 265.353 2.478 10 20 CECD C[C@H](NC[C@H](CO)[C@H]1CCOC1)c1ccc(Cl)cc1O 841754068 YSWRIPQNIYDVLS-SDDRHHMPSA-N 299.798 2.341 10 20 CECD C[C@@H]1NCCC[C@H]1NCc1ccc2c(c1)CCCN2C 925530905 HPJJBTVRUIKOJV-XJKSGUPXSA-N 273.424 2.299 10 20 CECD COCC[C@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850566146 KBFAAHCFJIINBE-AWEZNQCLSA-N 292.423 2.162 10 20 CECD O=C1NC(=S)S/C1=C\c1nc(Cl)cs1 759071792 GORYPZTZVQJRQF-IWQZZHSRSA-N 262.768 2.285 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1c[nH]nc1CC 935947387 WXSUNNBULXAWKZ-UHFFFAOYSA-N 294.351 2.093 10 20 CECD CC(C)n1[nH]cnc1=NCc1cc(F)c(N(C)C)cc1F 865293426 KLPONOPUQJQRRI-UHFFFAOYSA-N 295.337 2.237 10 20 CECD COCC[C@@]1(NCc2cc(Cl)ccc2O)CCOC1 775035258 YEYRZCALURZOOR-CQSZACIVSA-N 285.771 2.331 10 20 CECD C[C@H](NCC[C@H]1CCOC1=O)c1ccc(N(C)C)cc1 775834280 MUAZSSHDCVXCCT-JSGCOSHPSA-N 276.380 2.356 10 20 CECD CC[C@]1(O)CCCN(Cc2cc(F)cc(C(C)=O)c2O)C1 879310654 LFUIRTKCYUZDAC-INIZCTEOSA-N 295.354 2.471 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)NCc1c(C)cccc1O 877147673 ZIBMZWJXLFCKPX-NEPJUHHUSA-N 264.369 2.093 10 20 CECD CCOC(=O)[C@H](C)[C@@H](C)NCc1c(C)cccc1O 877322716 CCHBKYJHWDKALZ-VXGBXAGGSA-N 265.353 2.378 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1ccc(C)cc1O 877415979 FNZYRKQRPCDCCQ-OCCSQVGLSA-N 277.364 2.474 10 20 CECD CCN(C)c1ccc(CN(C)CCS(=O)(=O)CC)cc1 773808693 LSQFQUTZCVJBFC-UHFFFAOYSA-N 298.452 2.009 10 20 CECD Oc1c(F)cc(F)cc1CN1CCC[C@@H](C2OCCO2)C1 893995354 VJWHXIKYBZAKFA-SNVBAGLBSA-N 299.317 2.255 10 20 CECD COc1cc(C)cc(CN2CCC[C@H](CO)CC2)c1O 894866034 FDPPAKLHFHGLBN-ZDUSSCGKSA-N 279.380 2.304 10 20 CECD CCC[C@@H](NCc1cc(F)cc(F)c1O)C(=O)OC 897833317 FAWZNIRYBXGPLN-LLVKDONJSA-N 273.279 2.102 10 20 CECD C[C@@H]1CCN(Cc2cc(F)cc(F)c2O)CC[S@]1=O 894567038 PHGVUGFMUGIYKP-AYLIAGHASA-N 289.347 2.013 10 20 CECD CCCN1CC[C@@H](NCc2cc(F)cc(F)c2O)C1 708516730 KXAGALSYMMIXNF-GFCCVEGCSA-N 270.323 2.244 10 20 CECD CCN1CCC[C@H](N[C@@H](C)c2ccc(C)cc2O)C1=O 722361527 MUQVIBMPDBLDLI-JSGCOSHPSA-N 276.380 2.362 10 20 CECD CCN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 34837393 UUYRQJRGLNIDFD-LLVKDONJSA-N 252.333 2.333 10 20 CECD Nc1ccc(CC(=O)NC[C@H]2C[C@H]3C=C[C@H]2C3)cc1 1122427783 DJSGYYLLIQEVJV-MELADBBJSA-N 256.349 2.140 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCNC1 841032871 GPABYYXFIZNBHE-IUODEOHRSA-N 260.381 2.099 10 20 CECD CCn1cnnc1CN[C@H](C)c1ccc(C)cc1O 230658865 AFNPACMXWDRCHT-LLVKDONJSA-N 260.341 2.163 10 20 CECD C[C@@H](NCc1c(O)cccc1Cl)c1nnc2n1CCC2 83551783 VFDNEJNHKPCRPK-SECBINFHSA-N 292.770 2.434 10 20 CECD C[C@@H](N[C@@H](CCO)C(F)(F)F)c1ccc(F)cc1O 886800670 ANRXUXOXKKDKTJ-HQJQHLMTSA-N 281.249 2.495 10 20 CECD C[C@@H](NCCCO[C@@H]1CCOC1)c1ccccc1O 179888250 UQXQFSRBVAZHAM-CHWSQXEVSA-N 265.353 2.238 10 20 CECD CCn1nccc1CN1CCOc2cc(N(C)C)ccc21 184945232 CVBSOFYKLHRLDA-UHFFFAOYSA-N 286.379 2.368 10 20 CECD COCc1nc(CNCc2cc(F)ccc2O)cs1 291507503 HZJHOIWBURTYDX-UHFFFAOYSA-N 282.340 2.424 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](C)[C@H]2CO)c1O 191179266 UNQSUJMMOIHUGU-JOYOIKCWSA-N 285.771 2.257 10 20 CECD COC[C@H]1CN(Cc2c(O)ccc(Cl)c2F)CCO1 191381076 JOKLGXRMIVOUQD-SECBINFHSA-N 289.734 2.032 10 20 CECD CCOc1ccc(N2CCN(CCCC(=O)O)CC2)cc1 98149218 VQAUMAPKWXKWCC-UHFFFAOYSA-N 292.379 2.072 10 20 CECD CCC(CC)(CN)C(=O)NCc1ccc(N(C)C)c(F)c1 236682972 FPQONYRSKYTBRV-UHFFFAOYSA-N 295.402 2.273 10 20 CECD CC(=O)NCC1CCN(Cc2ccc(N(C)C)cc2)CC1 271152223 UXJJMJZWQDTWNM-UHFFFAOYSA-N 289.423 2.101 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](CO)C(C)(C)C)c1O 278822115 PUCYGXWKTMTJKJ-ZDUSSCGKSA-N 283.343 2.231 10 20 CECD CC(C)[C@H](CO)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 806169246 JPVRVGNYWHNNRB-MNOVXSKESA-N 282.340 2.216 10 20 CECD Cc1ncncc1C(=O)N(C)Cc1ccc(N(C)C)cc1 298644388 GJIDLHCVDQALRN-UHFFFAOYSA-N 284.363 2.123 10 20 CECD CC(C)N(CC(=O)NCc1ccc(N(C)C)cc1)C1CC1 297962707 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CECD COC(=O)N1CCC[C@H](N[C@@H](C)c2cc(F)ccc2O)C1 756526101 FMDMJGYQXFWVBZ-JQWIXIFHSA-N 296.342 2.413 10 20 CECD Cc1nn(C)cc1C(=O)NCc1cc(Cl)ccc1O 857547808 UXWUUIWYDBANEE-UHFFFAOYSA-N 279.727 2.018 10 20 CECD CC[C@H](O)CCNCc1ccc(Br)cc1O 701016888 ZYSINOSQJIPYSP-NSHDSACASA-N 288.185 2.405 10 20 CECD C[C@H](NC[C@]1(C)CCOC1)c1cc([N+](=O)[O-])ccc1O 756575994 SJVIFNCGDIPUCI-HZMBPMFUSA-N 280.324 2.378 10 20 CECD CC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C1CC1 855856962 FTMNPSMNPAJMRH-LDJOOVGUSA-N 261.321 2.416 10 20 CECD CC(C)(NCc1c(O)cccc1Br)C(=O)O 864509727 QBGLPKDJDIBJTM-UHFFFAOYSA-N 288.141 2.108 10 20 CECD Cc1cc(O)c(CN(CC(N)=O)C2CCCC2)cc1C 768256358 CZJCIFXHTARQGD-UHFFFAOYSA-N 276.380 2.239 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)Nc1ncnc2c1CCC2 762800482 QOJONPWFPRLSNX-JTQLQIEISA-N 285.347 2.420 10 20 CECD c1cc(N2CCCC2)ccc1CN1CC[C@@H]2NCC[C@@H]2C1 1118180540 KEDWNINYEMMZGN-AEFFLSMTSA-N 285.435 2.471 10 20 CECD C[C@H](Cn1ccnc1)N[C@H](C)c1c(O)cccc1F 886503034 ZHSRCODBOIORME-GHMZBOCLSA-N 263.316 2.467 10 20 CECD CC(C)[C@H](CO)CN[C@@H](C)c1c(O)cccc1F 886609630 YCRPSDWDQDLQEH-QWRGUYRKSA-N 255.333 2.446 10 20 CECD CC(C)[C@H](F)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 784464208 ZJAJRUKBNJJJFN-RNCFNFMXSA-N 269.316 2.139 10 20 CECD Cc1ccc(C(=O)N[C@H](CO)C2CCCCC2)c(O)c1O 781012329 DMOUICNTZUFVCQ-CYBMUJFWSA-N 293.363 2.077 10 20 CECD CC[C@]1(O)CCCN(Cc2cc(C)cc(OC)c2O)C1 895444107 PFUJVPGPVQGFCQ-INIZCTEOSA-N 279.380 2.446 10 20 CECD CC(C)OC(=O)[C@H](C)NCc1cc(F)cc(F)c1O 894918058 TWXHETXREQKOSI-QMMMGPOBSA-N 273.279 2.100 10 20 CECD CC1(C)[C@@H](O)C[C@H]1NCc1c(O)ccc(Cl)c1F 790989143 YJADRLPQSZFCEC-MNOVXSKESA-N 273.735 2.434 10 20 CECD CCOc1cccc(CNCCCn2cccn2)c1O 134479874 OILFVNIRXQPJDA-UHFFFAOYSA-N 275.352 2.167 10 20 CECD CCOCCOCCCC(=O)Nc1ccc(N)cc1 19272257 DULYNDSOQUCRIG-UHFFFAOYSA-N 266.341 2.041 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@H](C)c1cc(F)ccc1O 186030526 IYGPEZYADKMXMO-NXEZZACHSA-N 289.372 2.005 10 20 CECD CC[C@@H](F)C(=O)NCc1ccc(N(C)C)c(F)c1 1335760138 WIIGTDIZNYHXRN-SNVBAGLBSA-N 256.296 2.256 10 20 CECD CCOc1ccc(N2CCN([C@@H](C)COC)CC2)cc1 1255583540 OEZQJTHDZRXQQZ-AWEZNQCLSA-N 278.396 2.242 10 20 CECD CCCC(=O)NC[C@H](C)NCc1ccc(OC)c(C)c1 1752857189 YZUKXFPIJAQITR-ZDUSSCGKSA-N 278.396 2.398 10 20 CECD C[C@@H](NCc1ccon1)c1ccc(N2CCOCC2)cc1 158322933 IFPVPTOKDNWMAF-CYBMUJFWSA-N 287.363 2.362 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCN3CCC[C@H]3C2)cc1 252674582 SMFTVGVRZVSDKK-WBVHZDCISA-N 273.424 2.469 10 20 CECD COc1ccc(O)c([C@H](C)NCCc2cnn(C)c2)c1 148785231 SPGYYTCWGBRCGG-NSHDSACASA-N 275.352 2.028 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCN(C3CC3)C2)c1 44684591 KKJKXXVIDBPJAT-NWDGAFQWSA-N 276.380 2.288 10 20 CECD COCCOCCN[C@H](C)c1ccc(N(C)C)cc1 44694216 AFRSKFIYZANDOE-CYBMUJFWSA-N 266.385 2.066 10 20 CECD CC[C@@H](CN[C@@H](C)c1cc(OC)ccc1O)OC 290036189 DFJISMDBSDWOHG-QWRGUYRKSA-N 253.342 2.476 10 20 CECD CCOc1cccc(CN(C)[C@H]2CCCOC2)c1O 401621916 QXFKYMMSSXIOMJ-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD CCN1C[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 391552896 UUYHGPAROUKKCV-GXTWGEPZSA-N 275.396 2.024 10 20 CECD CN(C)c1ccc(CN2CCN(c3ccncc3)CC2)cc1 112119172 ZBTQTNZIJBLSKU-UHFFFAOYSA-N 296.418 2.470 10 20 CECD COc1cc(O)c(CN2CCCO[C@H](C)C2)cc1OC 179443875 PVFCWCDHFHUHCZ-LLVKDONJSA-N 281.352 2.020 10 20 CECD CC[C@@H](COC)NCc1ccc(N(C)C)c(F)c1 120225108 PCOIYSVESNAODR-LBPRGKRZSA-N 254.349 2.406 10 20 CECD CN(C)C(=O)[C@@H]1CCCN1Cc1c(O)cccc1Cl 122696292 FAUNYSQYESKHJU-LBPRGKRZSA-N 282.771 2.098 10 20 CECD NC(=O)CCOc1ccc(NCc2ccccc2O)cc1 36934215 USTCUDWYOWVBHQ-UHFFFAOYSA-N 286.331 2.259 10 20 CECD CC(=O)c1cc(F)cc(CN(C)CC(F)F)c1O 135834536 BNWQKQCMBZFYAD-UHFFFAOYSA-N 261.243 2.431 10 20 CECD COc1ccc(N2CCN(C(=O)C=C3CCC3)CC2)cc1 86978431 JVAQIYHCVDEDJH-UHFFFAOYSA-N 286.375 2.454 10 20 CECD CCCOc1ccc(CN(CCO)C(C)C)c(O)c1 271018858 APJONFVKSSBGRY-UHFFFAOYSA-N 267.369 2.384 10 20 CECD CCOC1CC(O)(CN[C@H](CC)c2ccccc2O)C1 278472662 NYMCXCCLLQSHOV-CXOJTPOUSA-N 279.380 2.363 10 20 CECD C[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)c1cnn(C)c1 273620689 YZIQLTDDYXBBLV-NXEZZACHSA-N 290.323 2.446 10 20 CECD CC(C)(C)[C@H]1C[C@H](NC(=O)c2cccc(O)c2O)CCO1 279833122 NLPJMUYKDWDPCR-ZWNOBZJWSA-N 293.363 2.421 10 20 CECD O=C1COc2c(NCc3cc(F)ccc3O)cccc2N1 367967013 SJIPCZIAWYNUAV-UHFFFAOYSA-N 288.278 2.474 10 20 CECD CC(C)C(=O)NCCN(C)Cc1ccc(N(C)C)c(F)c1 271412316 XWQPDLXGVUGSKW-UHFFFAOYSA-N 295.402 2.096 10 20 CECD COc1cccc(CNCc2cccc(O)c2OC)c1O 289176325 AAIWJLAALIOQOY-UHFFFAOYSA-N 289.331 2.405 10 20 CECD COCCn1cc(CN[C@H](C)c2ccccc2O)cn1 281912998 ACYQZNGRUKBCOG-GFCCVEGCSA-N 275.352 2.086 10 20 CECD COC(=O)[C@]1(C)CN(Cc2ccccc2O)C[C@H]1C 282750617 OBUDPJSUPKIBEY-IAQYHMDHSA-N 263.337 2.023 10 20 CECD O=C(CCN[C@H]1CCc2cccc(O)c21)N1CCCCC1 296143935 WHMUMQURQOHKDX-AWEZNQCLSA-N 288.391 2.372 10 20 CECD C[C@H]1C[C@H](NCC(C)(C)OCCO)c2c(O)ccc(F)c21 806664425 PZZWUMKNMZRMRQ-JQWIXIFHSA-N 297.370 2.457 10 20 CECD CC[C@@H](C)CONC(=O)NCc1cccc(OC)c1O 291777840 NMHOOWHBJKPVHA-SNVBAGLBSA-N 282.340 2.178 10 20 CECD C[S@@](=O)CCCNCc1ccc2ccccc2c1O 816552807 XQWLMBSAXWDLQD-LJQANCHMSA-N 277.389 2.404 10 20 CECD CO[C@H](CC(C)C)CS(=O)(=O)Nc1ccc(O)cc1 817347973 DEOJUNKAIRPXGQ-CYBMUJFWSA-N 287.381 2.195 10 20 CECD CC[C@H](C)CONC(=O)NCc1ccc(OC)cc1O 813826566 PRWOIIYGYIRGEX-JTQLQIEISA-N 282.340 2.178 10 20 CECD CCOc1ccc(CN[C@H](CC)C(C)(C)O)c(O)c1 815154477 CXPQKHWKZFRHES-CQSZACIVSA-N 267.369 2.430 10 20 CECD Cc1ncccc1NC(=O)[C@H](C)NCc1ccccc1O 835069559 BOIYKKOSKQFPGQ-LBPRGKRZSA-N 285.347 2.212 10 20 CECD Cc1cnn(C)c1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 839727694 BXTFEFVRCBUJHG-LBPRGKRZSA-N 286.379 2.286 10 20 CECD CC(C)c1[nH]ccc1C(=O)NCc1ccc(O)cc1O 910946543 PNAQYWMFGIGILL-UHFFFAOYSA-N 274.320 2.479 10 20 CECD CCc1nc([C@H](C)N[C@@H](C)c2cccc(OC)c2O)n[nH]1 846157387 MEMZANKEZUTMHL-UWVGGRQHSA-N 290.367 2.493 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1cc(C)c(C)cc1O 742442717 NCXWUNMHWSOOKS-HNNXBMFYSA-N 262.353 2.240 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H]2CCCS2)c1 743334606 BSEUXUJGHWOTGP-TVQRCGJNSA-N 281.377 2.474 10 20 CECD Nc1ccc(CC(=O)N2CC[C@H](c3cccnc3)C2)cc1 843503268 AXKGIIIDJPBENT-HNNXBMFYSA-N 281.359 2.222 10 20 CECD NC1(CNCc2cccc(Br)c2O)CCC1 841052051 UOEIVHSGLDLMPZ-UHFFFAOYSA-N 285.185 2.126 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2CNCCCO2)cc1 841085597 IEJHEUVOUPQPHV-KRWDZBQOSA-N 291.439 2.001 10 20 CECD COc1ccc(CNC(=N)NCCC(C)C)c(O)c1 849024981 IBBQOMMCTOEGML-UHFFFAOYSA-N 265.357 2.061 10 20 CECD NC1(CNCc2cc(Cl)ccc2O)CCCC1 849349575 ANHLACMNERVUFG-UHFFFAOYSA-N 254.761 2.407 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](N)[C@@H](CC)C2)c1 843053624 OXNQUOXCSBFAHT-WFASDCNBSA-N 278.396 2.350 10 20 CECD CCOc1cccc(CN[C@H]2CCCNCC2)c1O 841058658 UXHUFAKONRKDOE-ZDUSSCGKSA-N 264.369 2.023 10 20 CECD C[C@@H](NC[C@H]1COCCO1)c1cc(Cl)ccc1O 756434958 RXLKDBZFEPZWGB-KOLCDFICSA-N 271.744 2.112 10 20 CECD CCCN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CC1 768451031 LLRITDQHUCUULT-AWEZNQCLSA-N 263.337 2.192 10 20 CECD Cc1[nH]nc(C(F)(F)F)c1C(=O)NCc1ccccc1O 769362357 IURMWGCSYNNVGF-UHFFFAOYSA-N 299.252 2.373 10 20 CECD C[C@H](OCc1ccncc1)C(=O)NCc1ccccc1O 866756652 ZIUZRGUCJDPWGT-LBPRGKRZSA-N 286.331 2.009 10 20 CECD CCC1CCN(Cc2cc3c(cc2O)OC[C@@H]3O)CC1 768443094 OVGUVATZLFBQCT-HNNXBMFYSA-N 277.364 2.440 10 20 CECD O=Cc1cccc(OCCC(=O)NCc2ccccc2O)c1 769359781 HDPABEATOOEFKD-UHFFFAOYSA-N 299.326 2.290 10 20 CECD CCN(C)c1ccc(CN(CC(N)=O)C(C)(C)C)cc1 773765400 JBVIVULDWLSGJG-UHFFFAOYSA-N 277.412 2.229 10 20 CECD CCOc1ccc(O)c(CNCCCCC(=O)O)c1 874043250 RYRQCEBIDZWUQD-UHFFFAOYSA-N 267.325 2.135 10 20 CECD C[C@H](NC[C@@H]1CCCN1CCCO)c1c(O)cccc1F 886615677 LGSPZKZVWSRAPQ-STQMWFEESA-N 296.386 2.029 10 20 CECD COc1cc(N2CC[C@@H](CF)C2)c([N+](=O)[O-])cc1OC 882840740 DALWYBZLWKALCL-VIFPVBQESA-N 284.287 2.408 10 20 CECD C=C/C=C/CCNC(=O)NCc1cc(OC)ccc1O 883411547 AXCZBDSIWIYKAK-SNAWJCMRSA-N 276.336 2.332 10 20 CECD CN(Cc1ncc[nH]1)Cc1cc(F)cc(F)c1O 894586935 MZMLTYOQGBYZHA-UHFFFAOYSA-N 253.252 2.026 10 20 CECD CCc1cccc(CN2[C@@H](C)[C@H](C)NC(=O)[C@H]2C)c1O 895123761 ZCHTXGGXVAKGFY-SDDRHHMPSA-N 276.380 2.052 10 20 CECD CN(CCO)Cc1cc(Cl)cc(Br)c1O 893871035 JURXBTSXNFCENY-UHFFFAOYSA-N 294.576 2.232 10 20 CECD CC(=O)N1CCCN(Cc2c(O)cccc2Cl)CC1 133280350 ICOGKYLFBWQJGC-UHFFFAOYSA-N 282.771 2.100 10 20 CECD COCCOCCCN[C@@H](C)c1cc(OC)ccc1O 20192273 DWAXDNZPTDWLGM-LBPRGKRZSA-N 283.368 2.105 10 20 CECD CCC1CN(Cc2ccc(N3CCN(C)CC3)c(F)c2)C1 1347940524 JXMFXYGRPNPTNQ-UHFFFAOYSA-N 291.414 2.419 10 20 CECD Cc1ccc(CN[C@H](CC2CCOCC2)C(=O)O)c(O)c1 1600419958 SVBDLVNCFWTTSF-CQSZACIVSA-N 293.363 2.060 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H](C)C(=O)N(C)C 218320790 GVCYOPSCDPAFQH-UTUOFQBUSA-N 276.380 2.315 10 20 CECD COc1cccc(O)c1CN[C@H]1CCS[C@@H]1C 842779914 SUPGQCLCSWXSHT-KOLCDFICSA-N 253.367 2.384 10 20 CECD N[C@H]1C[C@@H](NCc2ccc3c(c2)CCCO3)C12CCC2 1580162685 DBSWMAQZDNAAJU-JKSUJKDBSA-N 272.392 2.371 10 20 CECD CN(C)c1ccc(CNC(=O)CCNC(C)(C)C)cc1 40825935 ODWFNARGLDXBHX-UHFFFAOYSA-N 277.412 2.147 10 20 CECD Oc1cccc2c1[C@@H](NCCN1CC=CCC1)CC2 296616741 YXIAQQOMAGNHKO-AWEZNQCLSA-N 258.365 2.231 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)O)c1 300001705 QMBSZTUGPQVNNS-WHOFXGATSA-N 275.348 2.386 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H]2CCO)c1O 312765360 CWBDCUAZWPINSR-ZDUSSCGKSA-N 281.327 2.081 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)c2n[nH]c(C)n2)c1 392461492 OZHSZDLZLHHZGM-IUCAKERBSA-N 276.340 2.239 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](O)C[C@@H]2C)c1O 384957726 RCWKPYKVBCRYOH-UFBFGSQYSA-N 283.755 2.203 10 20 CECD CCCNC(=O)NCc1ccc(N(C)C)c(F)c1 58482939 SDVKKYVTTNEBDN-UHFFFAOYSA-N 253.321 2.101 10 20 CECD CCCOc1ccc(CNC2(CO)CCC2)c(O)c1 178638670 LSSRSGUSRNPMQI-UHFFFAOYSA-N 265.353 2.186 10 20 CECD C[C@H](NCCCO[C@H]1CCOC1)c1ccccc1O 179888264 UQXQFSRBVAZHAM-STQMWFEESA-N 265.353 2.238 10 20 CECD Nc1ccc(CCNC(=O)[C@H]2CCOc3ccccc32)cc1 237946201 CATICWMGMGOGQT-INIZCTEOSA-N 296.370 2.494 10 20 CECD CC[C@@H]1CC[C@@H](C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)O1 274949046 REJMGKCNHIDFTP-HCKVZZMMSA-N 293.363 2.103 10 20 CECD Cc1cccc(CNCCCN2CCCO[C@@H](C)C2)c1O 277577977 TUJPWHJOAUFURD-HNNXBMFYSA-N 292.423 2.291 10 20 CECD C[C@H]1C[C@H](CCNCc2cc3c(cc2O)OCO3)CCO1 273076499 PPSPDNFXPXACHD-NWDGAFQWSA-N 293.363 2.416 10 20 CECD Cc1cc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)ns1 278306002 CENLMJATHFLMSQ-QMMMGPOBSA-N 292.360 2.224 10 20 CECD CC[C@@H](COC)N[C@@H](C)c1cc(C(=O)OC)ccc1O 273553345 GJGVLHOXIAFZAH-JQWIXIFHSA-N 281.352 2.254 10 20 CECD COC(=O)c1cnc(SCC(=O)C(C)(C)OC)s1 295164515 HJNRRSTWHBDYGV-UHFFFAOYSA-N 289.378 2.016 10 20 CECD COC(=O)N1CC(N[C@H](C)c2cc(Cl)cc(C)c2O)C1 808706744 SPZGDKQMFLFXPN-SECBINFHSA-N 298.770 2.455 10 20 CECD CO[C@@H]1CCN(C(=O)c2c(F)ccc(O)c2O)CC1(C)C 296220693 VFFCBBVQWYWQFN-LLVKDONJSA-N 297.326 2.124 10 20 CECD C[C@@H](NC1CC1)C(=O)NCc1c(O)ccc2c1CCCC2 295186484 NLPOFOUWRXRDLL-LLVKDONJSA-N 288.391 2.028 10 20 CECD CC[C@H](NCCNCCOC)c1cccc(Cl)c1O 817965523 WNHMECGEFMVOEI-ZDUSSCGKSA-N 286.803 2.322 10 20 CECD CN(C)c1ccc([C@H](N)CN[C@H]2CCCCC[C@@H]2N)cc1 817942117 MLTFTXUKFXQRFW-BBWFWOEESA-N 290.455 2.002 10 20 CECD Cc1cc(O)c(CN(C)CCNC(=O)N(C)C)cc1Cl 825411981 ANRZLYAPEHZQSN-UHFFFAOYSA-N 299.802 2.057 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H](C)SC)c1 728977796 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CCCNC(=N)NC[C@H]1CCN(c2ccc(OC)cc2)C1 849043409 BZKZEIIJUKZOJY-CYBMUJFWSA-N 290.411 2.045 10 20 CECD COc1cccc([C@H](C)N[C@H]2C[C@H](O)C2(C)C)c1O 846165576 VVKAFHAGAADCTI-XDTLVQLUSA-N 265.353 2.211 10 20 CECD C[C@H]1C[C@@H](NCC(C)(C)C(N)=O)c2c(O)ccc(F)c21 756782957 XAJUINANMLSZLO-WCBMZHEXSA-N 280.343 2.181 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(F)c[nH]1 935945699 HJLVZFZEQVAEAJ-UHFFFAOYSA-N 283.299 2.275 10 20 CECD CN(C)c1ccc(CNC(=O)CCC2(O)CCC2)cc1 864575285 MYHJYVRHLQQLES-UHFFFAOYSA-N 276.380 2.064 10 20 CECD Cc1cccc(O)c1CNC[C@@](C)(O)C(F)(F)F 877120485 SWNRWCJEZYJUGE-LLVKDONJSA-N 263.259 2.104 10 20 CECD COCC(C)(C)N1CCN(Cc2ccc(C)cc2O)CC1 877597215 DKDOPQNMKJOTOP-UHFFFAOYSA-N 292.423 2.243 10 20 CECD COc1ccc2c(c1)CCN2C(=O)/C=C/[C@H]1CCCNC1 876630792 KUTYWPAGVHMOLO-WXJAXGNASA-N 286.375 2.140 10 20 CECD COCC1(C(=O)N[C@H](C)c2cc(OC)ccc2O)CC1 778914944 OYIPTWKFBHFOJK-SNVBAGLBSA-N 279.336 2.005 10 20 CECD C[C@H](Cc1ccncc1)NC(=O)/C=C/c1ccc(O)c(O)c1 779529409 PPGBBCBOCNTAAS-OGOUPESXSA-N 298.342 2.253 10 20 CECD C[C@@H]1CCN(Cc2ccc(N3CCC(O)CC3)cc2)C1 876636940 NQXNHBGWVVZJRG-CQSZACIVSA-N 274.408 2.490 10 20 CECD CC[C@@H](N[C@@H](CCO)COC)c1cc(Cl)ccc1O 775509669 OGAZRLRUMZKZDR-WCQYABFASA-N 287.787 2.484 10 20 CECD CC[C@]1(CO)CCCN(Cc2c(O)cccc2OC)C1 779216159 ALYMVAMQEWGOCS-INIZCTEOSA-N 279.380 2.385 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CC[C@@H]2CO)cc1 889125606 CLUGLOURXNUESX-MRXNPFEDSA-N 284.359 2.301 10 20 CECD COC1CCN(CCN[C@@H](C)c2c(O)cccc2F)CC1 886536220 DFVHZRGJFCOLOZ-LBPRGKRZSA-N 296.386 2.293 10 20 CECD COC[C@H](NCc1cc(C)cc(OC)c1O)C(C)C 894268448 DYQGJEMEYSAMKX-ZDUSSCGKSA-N 267.369 2.470 10 20 CECD Cc1nnsc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 788004382 URKZDZFQYNJDBB-VIFPVBQESA-N 290.392 2.404 10 20 CECD CCN(CCNCc1ccc(OC)c(OC)c1O)C(C)C 892801599 OXAFISHMNDFOCV-UHFFFAOYSA-N 296.411 2.229 10 20 CECD C[C@@H](CN1CCOCC1)N(C)Cc1cc(Cl)ccc1O 789762920 BCABCYACEZDXOV-LBPRGKRZSA-N 298.814 2.198 10 20 CECD Cc1onc(-c2cccnc2)c1C(=O)N(C)c1cn[nH]c1 796872950 MFSQMPBTKMYPDI-UHFFFAOYSA-N 283.291 2.045 10 20 CECD OC[C@@H](CC(F)(F)F)NCc1ccc2c(c1)CCCO2 1354169866 IENGFDBGPCILJV-GFCCVEGCSA-N 289.297 2.415 10 20 CECD C[C@H](NCc1cc2c(cc1O)OCO2)C1CCOCC1 134496367 WJOLQRCWTJZLBY-JTQLQIEISA-N 279.336 2.026 10 20 CECD COc1cccc(CNC(=O)N[C@H]2CCC[C@@H](F)C2)c1O 1329252239 GMIBMBHXDAYHGQ-NEPJUHHUSA-N 296.342 2.481 10 20 CECD CN[C@H](C)CCN[C@@H](C)c1cc(OC)ccc1O 1326037805 YHQVOBXMMAZZAC-MNOVXSKESA-N 252.358 2.049 10 20 CECD CCc1cccc(S(=O)(=O)NCc2ccccc2O)c1 751149353 SSCYCFFPGXHXTR-UHFFFAOYSA-N 291.372 2.433 10 20 CECD CO[C@@H]1CCN(Cc2cccc(Cl)c2O)[C@H](C(=O)O)C1 1606757247 PKFLNZRFGJUZJX-PWSUYJOCSA-N 299.754 2.110 10 20 CECD COCC[C@H](C)CNCc1cccc(OC)c1O 840955851 YLBVBVSPRUOAQB-NSHDSACASA-N 253.342 2.163 10 20 CECD C[C@H]1CN(Cc2cc(F)c(F)cc2O)CC[C@H]1C(=O)O 1589399471 QZLYUTXYPBYLLK-WCBMZHEXSA-N 285.290 2.213 10 20 CECD CC[C@@H](N[C@H](C)c1cc(F)cc(F)c1O)C(=O)O 1593607199 OJEUFWFHNCDICL-LHLIQPBNSA-N 259.252 2.184 10 20 CECD CN(C)c1ccc(CN2CCC(F)(F)[C@@H]2C(=O)O)cc1 1777039459 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AVUNFNNXAHZHFI-LBPRGKRZSA-N 276.380 2.110 10 20 CECD COc1ccc(N(CCN2CCOCC2)C(C)C)cc1F 264676983 AXMHBOHZYIKACA-UHFFFAOYSA-N 296.386 2.381 10 20 CECD CCN(CC(=O)N1CCCC1)c1ccc(OC)cc1 269600022 KQXJMYYBOYJPOV-UHFFFAOYSA-N 262.353 2.144 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2ccc(N(C)C)cc2)CCO1 271890309 OGVKWRSOEWJIIC-TZMCWYRMSA-N 276.380 2.184 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H](CO)CC(C)C)c1 273408981 PDDZRWCXZNRKOV-AAEUAGOBSA-N 295.379 2.236 10 20 CECD CC(C)[C@@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)CCO1 271464227 GNCIECKXRJVTSX-JSGCOSHPSA-N 293.363 2.414 10 20 CECD C[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)C(F)(F)F 291710104 HJTHSCLOFYWCTC-MZTFZBDOSA-N 275.226 2.178 10 20 CECD CN(Cc1cc2c(cc1O)OCO2)C1CCC(CO)CC1 290583767 UTDQCXPHPHOXDL-UHFFFAOYSA-N 293.363 2.104 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCc2cn(C)nn2)c1O 808712084 ATRTXYQOUKVYEU-SECBINFHSA-N 280.759 2.333 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCCC1CCOCC1 814460812 BTIGSAOFORWZAP-DUXPYHPUSA-N 292.331 2.471 10 20 CECD CCNCCN[C@@H](C)c1cc(Br)ccc1O 817952167 OJFPKPNZPDZVLO-VIFPVBQESA-N 287.201 2.415 10 20 CECD COC(=O)C(C)(C)NCc1cc(Cl)c(C)cc1O 825406192 PIEAHCXHVVKASJ-UHFFFAOYSA-N 271.744 2.395 10 20 CECD C[C@@H]1CN(Cc2cc3c(cc2O)CCC3)C[C@@H]1C(=O)O 828456692 NAWPPQNXQWABOC-YGRLFVJLSA-N 275.348 2.033 10 20 CECD CC[C@](C)(CNCc1cc([N+](=O)[O-])ccc1O)OC 824743468 CRDZGHGZPHNXRM-CYBMUJFWSA-N 268.313 2.205 10 20 CECD CC[C@@H](CSC)NC(=O)/C=C\c1ccc(O)c(O)c1 588407255 MEMGOGNAYBXPPR-XOIDGJRKSA-N 281.377 2.369 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)c1cc[nH]n1 839916266 QMXXWYHXFZOKFA-GFCCVEGCSA-N 286.379 2.145 10 20 CECD O=C(C[C@@H]1CC[C@H]2C[C@H]12)OCC(=O)c1ccc(O)c(O)c1 838122585 FHELNVGVGAPENC-NHCYSSNCSA-N 290.315 2.260 10 20 CECD COc1ccc2c(c1)CCCN2Cc1ccc(N)nn1 904328465 FDJDCLMVOJOUOE-UHFFFAOYSA-N 270.336 2.020 10 20 CECD CN(C)c1ccc([C@@H](N)CNC(=O)CC2CCCC2)cc1 832292166 BWAIITGBPCDUJI-INIZCTEOSA-N 289.423 2.449 10 20 CECD O=C(c1cc(O)cs1)N1CCC[C@@H]1[C@H]1CCC[C@@H]1O 833767143 BOPPMYLNQYFIDF-UTUOFQBUSA-N 281.377 2.219 10 20 CECD 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CS/C=C/C(=O)NCc1ccc(N(C)C)cc1 751457029 BBKSGDSNACKWHU-CMDGGOBGSA-N 250.367 2.246 10 20 CECD CCOc1cccc(CN[C@H]2CCOC[C@H]2OCC)c1O 759172220 DRASEBJLHSPZQV-DZGCQCFKSA-N 295.379 2.075 10 20 CECD C[C@H](N[C@H]1CCC[C@@H]1O)c1cc(F)cc(F)c1O 866489866 XYXVDEOYZUZFSF-QILRFPOHSA-N 257.280 2.234 10 20 CECD CC1(C)CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)CCN1 769191965 VFNMTBPXEMISDC-UHFFFAOYSA-N 299.758 2.138 10 20 CECD C[C@@H]1CCN(Cc2cc(Cl)ccc2O)CC[S@@]1=O 763488832 FHIHVIYVTUNPMY-MGNBDDOMSA-N 287.812 2.389 10 20 CECD CCOc1ccc(CN(CCCO)C2CC2)c(O)c1 769405818 YPEZDGBDQHWSSH-UHFFFAOYSA-N 265.353 2.138 10 20 CECD COC(=O)[C@H]1CCN(Cc2c(C)cccc2O)[C@@H]1C 877467002 VDZYZJHKKPOWBW-NEPJUHHUSA-N 263.337 2.084 10 20 CECD CN(C(=O)[C@H](O)C1CCCCC1)c1ccc(N)cc1 877075205 ACFFSEPMUBCNSC-CQSZACIVSA-N 262.353 2.173 10 20 CECD CCC1(CC)[C@@H](OC)C[C@H]1NC(=O)c1cccc(O)c1O 776678316 SQGPWJOCDHNRRY-OLZOCXBDSA-N 293.363 2.421 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CC12CCC2 773745694 QSKPMZNZBIZJFM-CMPLNLGQSA-N 275.348 2.335 10 20 CECD OC[C@H]1CSCCN1Cc1cc(Cl)cc(F)c1O 877780369 NXPJGNDWGLYYPG-JTQLQIEISA-N 291.775 2.094 10 20 CECD Cc1cccc(O)c1CN1CCN(Cc2cccnc2)CC1 877169054 DWVYPDLKACUAMX-UHFFFAOYSA-N 297.402 2.413 10 20 CECD C[C@H](NCCC(=O)NC(C)(C)C)c1c(O)cccc1F 886546018 XBTREKJMOUEYPS-JTQLQIEISA-N 282.359 2.487 10 20 CECD COc1ccc(CN[C@@H]2CCO[C@@H](C)C2)c(O)c1OC 893219441 GYFPUSPFDZIJEW-CMPLNLGQSA-N 281.352 2.067 10 20 CECD CCC[C@@H](NCc1c(O)cccc1Cl)C(=O)OC 897835466 HPDIVTOSBPMVKC-LLVKDONJSA-N 271.744 2.477 10 20 CECD CC(=O)c1cc(O)ccc1NS(=O)(=O)c1ccsc1 795345836 QUBNFVKIFGTBLJ-UHFFFAOYSA-N 297.357 2.457 10 20 CECD CN(Cc1ccccc1O)c1cc(Cl)nc(N)n1 89635458 BLRHGOKNHNEVEJ-UHFFFAOYSA-N 264.716 2.054 10 20 CECD CCO[C@H]1COCC[C@@H]1NCc1ccc(N(C)C)cc1 686595599 GKJNLRWMOJATMI-HOTGVXAUSA-N 278.396 2.036 10 20 CECD NCc1ccc2c(c1)CCCN2Cc1cc(C(=O)O)co1 1601190211 DJICJTAEFXDBFY-UHFFFAOYSA-N 286.331 2.389 10 20 CECD Cc1cccc([C@@H](O)CNC(=O)NCc2ccc(N)cc2)c1 1579755588 WDWNTOVZNSYSNG-INIZCTEOSA-N 299.374 2.110 10 20 CECD CCOCCN[C@H](C)c1ccc(N2CCOCC2)c(F)c1 161907191 DJXVLNPYTUXVRP-CYBMUJFWSA-N 296.386 2.349 10 20 CECD CCOC[C@@H]1CCN(Cc2cc(OC)c(OC)cc2O)C1 160349700 MDNLEJLOZXNYSD-GFCCVEGCSA-N 295.379 2.268 10 20 CECD Cc1cc(C(=O)NCCCN)c(C)n1-c1ccccc1 159980791 QTCPSRXJIPTQMM-UHFFFAOYSA-N 271.364 2.173 10 20 CECD CCOC(=O)[C@@](C)(O)CN(CC)c1ccc(OCC)cc1 274595327 LDPCUJLZVLZTEO-INIZCTEOSA-N 295.379 2.226 10 20 CECD CC[C@@H]1C[C@@H](NCc2cc(OC)ccc2O)CCO1 823871923 RPICZBHKWONUSS-QWHCGFSZSA-N 265.353 2.448 10 20 CECD CCOc1cccc(CN[C@H]2C[C@@H](OCC)C2)c1O 839148010 TXVSLKZQXPRUNP-BETUJISGSA-N 265.353 2.448 10 20 CECD Cc1ccc(O)c([C@H](C)NCCc2cncn2C)c1 401718732 IGJGFEGUYWJWRY-LBPRGKRZSA-N 259.353 2.327 10 20 CECD CC(C)(C)NC(=O)CCNCc1cc(F)cc(F)c1O 708394287 VELLDKSIZAHJQA-UHFFFAOYSA-N 286.322 2.065 10 20 CECD COc1ccc(O)c(CN[C@H]2CSC[C@@H]2C)c1 397880777 KGZYWSXCCOTDQN-CABZTGNLSA-N 253.367 2.242 10 20 CECD COc1cc(Cl)cc(CNCc2cocn2)c1O 398006249 VYZCHTYRTLSYGJ-UHFFFAOYSA-N 268.700 2.332 10 20 CECD CN(C)Cc1cccc(NC(=O)c2cccc(O)c2O)c1 188171815 MGAVLONRHRHLCC-UHFFFAOYSA-N 286.331 2.412 10 20 CECD COC(=O)[C@H]1CCN(Cc2cccc(C)c2O)C[C@H]1C 188112890 ZSOKAMGKIZTMFK-OCCSQVGLSA-N 277.364 2.332 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)CN2CCCC2=O)c1 37782156 VZEANOFGAXEAJX-RYUDHWBXSA-N 292.379 2.062 10 20 CECD CN(C(=O)/C=C\c1cnn(C)c1)c1ccc(F)c(F)c1 48974080 XEYXZLGURKDJBF-UTCJRWHESA-N 277.274 2.375 10 20 CECD C[C@H](O)CN1CCCc2cc(OC(F)F)ccc21 192752564 OBFDUFXXWRFZTF-VIFPVBQESA-N 257.280 2.421 10 20 CECD Cc1ccc(O)c(CN2CCN(CCOC(C)C)CC2)c1 93586756 LYRXSZFOUNACSK-UHFFFAOYSA-N 292.423 2.243 10 20 CECD COc1ccc(CNCCOCC(F)F)cc1C 231677556 YVMJGTIOQNLITA-UHFFFAOYSA-N 259.296 2.375 10 20 CECD CC[C@@](C)(O)CNCc1cc(Cl)cc(OC)c1O 184705980 KIIJXCXVYWGDEP-CYBMUJFWSA-N 273.760 2.305 10 20 CECD CCCCN(C)S(=O)(=O)Nc1ccc(O)c(C)c1 182476199 ZRGXMYYBTYJXMO-UHFFFAOYSA-N 272.370 2.089 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@H](C)[C@H]2C2CC2)c(O)c1 529225746 AHMQRFKYDWBQNB-TURNYIBQSA-N 275.348 2.309 10 20 CECD 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2.061 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CN)cc1F 841063517 KZVFTFQMVQWQRF-NSHDSACASA-N 253.365 2.109 10 20 CECD CCc1cccc(CN(C)CCN2CCCC2=O)c1O 848884406 LANWQPCKBPRSNU-UHFFFAOYSA-N 276.380 2.009 10 20 CECD Oc1c(F)cccc1CN[C@@H]1CCNC2(CCC2)C1 841089346 LSVCGJRMGSKCHG-GFCCVEGCSA-N 264.344 2.296 10 20 CECD C[C@H](Cc1cnn(C)c1)NCc1ccc2c(c1)CCCO2 922161592 DSLHSRAEOLWHSA-CYBMUJFWSA-N 285.391 2.466 10 20 CECD CC(C)COC[C@@H](O)CNCc1ccc2c(c1)CCCO2 921587105 POVOYJSZKKZGAL-INIZCTEOSA-N 293.407 2.135 10 20 CECD CN(C)c1ccc(CN(C[C@@H]2CCC(=O)O2)C2CC2)cc1 851732238 MGKGXKUAYXAONX-INIZCTEOSA-N 288.391 2.423 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)C[C@H]2CCOC2)c1 858299173 QHENSZKHGVUNHY-QWHCGFSZSA-N 292.379 2.315 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)[C@@H]2CN(C)CCO2)c(O)c1C 756757864 FWCCERPFHNHHBV-LZWOXQAQSA-N 292.423 2.379 10 20 CECD COc1cccc(CNC(=O)CC(C)(F)F)c1O 760456265 XYEGXJALULNBNB-UHFFFAOYSA-N 259.252 2.062 10 20 CECD C[C@H]1C[C@@H](NC[C@H]2C[C@H](O)C2)c2c(O)ccc(F)c21 872127364 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CC[C@@H](NCCn1ccnc1)c1ccc(F)cc1O 285694349 OOTSBTGOSPFMLS-CYBMUJFWSA-N 263.316 2.469 10 20 CECD CCCCO[C@@H](C)C(=O)NCc1ccc(N)cc1 297278062 TWLGNJVEZRVWOT-NSHDSACASA-N 250.342 2.090 10 20 CECD CCCOc1ccc(CN2CC(OCC)C2)c(O)c1 297540278 YLGHAPNKXZFBSQ-UHFFFAOYSA-N 265.353 2.402 10 20 CECD Cn1cc(/C=C/C(=O)N2CCc3cc(F)ccc32)cn1 801075998 TXFNICZTKLJXMK-GORDUTHDSA-N 271.295 2.162 10 20 CECD CN(C)c1ccc(CNc2ccc(CCO)nc2)cc1F 806671472 YQKCIWDNUYTILR-UHFFFAOYSA-N 289.354 2.434 10 20 CECD COCC[C@@H](CO)N[C@H](C)c1cc(Cl)cc(C)c1O 808717600 FVRMRDNFTKJKKK-PWSUYJOCSA-N 287.787 2.402 10 20 CECD CC(F)(F)CNCc1ccc(N2CCOCC2)c(F)c1 815146927 MHEARYPIOYVKJF-UHFFFAOYSA-N 288.313 2.407 10 20 CECD C[C@H]1C[C@H](N[C@@H]2CCCNC2)c2c(O)ccc(F)c21 817969573 XMPJMWMKSLIYNG-UMNHJUIQSA-N 264.344 2.421 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@H]3CNC[C@H]3C2)c1 817987590 UNMIOBBGBFSKIH-IGQOVBAYSA-N 290.407 2.440 10 20 CECD CCCN1C[C@@H](CN[C@H](C)c2ccccc2O)CC1=O 817590158 UYYSORBSIZSHAG-CHWSQXEVSA-N 276.380 2.301 10 20 CECD Cc1cc(CN2CCSC[C@@H]2CCO)ccc1N(C)C 815061440 VEAZGTUEFMLWRN-HNNXBMFYSA-N 294.464 2.361 10 20 CECD C[C@H](N[C@@H]1CC12CCNCC2)c1cc(F)cc(F)c1O 817976582 OGDVTOLMXNWHRQ-TVQRCGJNSA-N 282.334 2.463 10 20 CECD C[C@H](NC(=O)CCCF)c1ccc(N2CCOCC2)cc1 823835192 WBVJIQZFUSQUPT-ZDUSSCGKSA-N 294.370 2.450 10 20 CECD C[C@@H](Oc1ccccn1)C(=O)N[C@H](C)c1ccccc1O 827952232 KOETVAVBLBQMHP-VXGBXAGGSA-N 286.331 2.432 10 20 CECD Cc1ncc(C(=O)NCc2ccc(N3CCCC3)cc2)n1C 828197650 IJPSZTRIAVCJCL-UHFFFAOYSA-N 298.390 2.259 10 20 CECD CO[C@@]1(C)C[C@@H](NC(=O)c2cc(O)cs2)C1(C)C 829414583 CYVLMEWVJCZMCF-MFKMUULPSA-N 269.366 2.387 10 20 CECD Cc1cc(C)c(O)c(CN2CC[C@H](C3OCCO3)C2)c1 905694830 JINHKXWOROHPNC-ZDUSSCGKSA-N 277.364 2.204 10 20 CECD Cc1cc(CN2CC(F)(F)C[C@H]2C(=O)O)ccc1N(C)C 903615122 NYDWMFWZPPEPLU-ZDUSSCGKSA-N 298.333 2.355 10 20 CECD CCc1noc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n1 902667183 AELGBQARSCFWGV-SNVBAGLBSA-N 288.351 2.189 10 20 CECD CCc1cc(NCc2ccc(N3CCOCC3)cc2)ncn1 733187920 FTCKGMPNIAOOQG-UHFFFAOYSA-N 298.390 2.488 10 20 CECD COC(=O)C1(N(C)C(=O)c2cc(O)cs2)CCCCC1 831335957 HMPZMPXDCLWNQM-UHFFFAOYSA-N 297.376 2.402 10 20 CECD CCN1C[C@H](N[C@@H](C)c2ccc(N(C)CC)cc2)CC1=O 834892461 VLDAIOJPGWQWFU-DZGCQCFKSA-N 289.423 2.414 10 20 CECD CO[C@@H](C1CC1)[C@H](C)NC(=O)NCc1ccccc1O 836642883 WATMPYOMROLONS-IINYFYTJSA-N 278.352 2.005 10 20 CECD C[C@@H]1[C@@H](NC(=O)C(=O)Nc2ccc(N)cc2)CCC[C@H]1C 840999924 RBLVBELSIPVSLJ-SUNKGSAMSA-N 289.379 2.148 10 20 CECD CCN(CCCNC)c1ccc(OC)c(OC)c1 843357755 SYWVZTBPTLXRNH-UHFFFAOYSA-N 252.358 2.140 10 20 CECD CCc1cccc(CN2CC[C@@H](C)[S@](=O)CC2)c1O 848905698 LFHNILJNSCQYHG-CWTRNNRKSA-N 281.421 2.298 10 20 CECD C[C@H]1CN(C(=O)Nc2ccc(N)cc2)C[C@H](C2CC2)O1 841294344 ACNLJNLJEGNVGU-IINYFYTJSA-N 275.352 2.300 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC(C)(C)N 841950580 MSDZUZKVUKAHJQ-UHFFFAOYSA-N 292.427 2.021 10 20 CECD COc1cc(O)c(CNC[C@@H]2C[C@H](C)O[C@@H]2C)cc1OC 840963974 PSINRNLSTQPAPH-TUAOUCFPSA-N 295.379 2.313 10 20 CECD CN1CCCc2cc(CNC[C@@H](O)c3ccccn3)ccc21 853098585 OAPWHAIOTKVUDU-GOSISDBHSA-N 297.402 2.287 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCN(C)C(C)C)c1 756524646 MGNRTFBTJKYZCW-GFCCVEGCSA-N 294.395 2.170 10 20 CECD C[S@](=O)[C@@H]1CCC[C@@H](NCc2ccc3c(c2)CCO3)C1 850356132 NKIYFLVIUAACNS-SXGZJXTBSA-N 293.432 2.401 10 20 CECD C[C@@H](NC[C@H]1CCCN1C)c1cc(F)cc(F)c1O 756459818 XNNIFJYWJQSJJG-MWLCHTKSSA-N 270.323 2.415 10 20 CECD Cc1cc(CN(C)Cc2ncc[nH]2)ccc1N(C)C 851873900 SOKGREDBAIZRSU-UHFFFAOYSA-N 258.369 2.416 10 20 CECD C[C@@H](NCCOC[C@@H]1CCOC1)c1ccc(N(C)C)cc1 765898622 IPILAPGGFYNFKZ-HUUCEWRRSA-N 292.423 2.456 10 20 CECD Cc1ccc(CN[C@H](CO)Cc2ccccc2)c(O)c1 877036733 ICEZCZHWKKXMLU-INIZCTEOSA-N 271.360 2.394 10 20 CECD Cc1cccc(O)c1CNC1C[C@@H]2CC[C@H](C1)N2C 877570434 NBRGFRIAQIUODM-AGUYFDCRSA-N 260.381 2.415 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1CCCOC1 1116836980 NFPZYAMHBNLBDL-ZETCQYMHSA-N 281.699 2.241 10 20 CECD CCC1CN(Cc2ccc(N3CCC(O)CC3)cc2)C1 877579165 NIDYHOYHHTUMGG-UHFFFAOYSA-N 274.408 2.490 10 20 CECD Cc1cc(C)c(O)c(CN(C)[C@@H](C)CN2CCOCC2)c1 788379169 UDLZGMXAUFUWMD-HNNXBMFYSA-N 292.423 2.162 10 20 CECD Cc1nc([C@@H](C)NCc2c(O)ccc(Cl)c2F)n[nH]1 894774454 SMPZZLKXGUZBQV-ZCFIWIBFSA-N 284.722 2.462 10 20 CECD COc1ccc(CNC(=O)Nc2cccc(C)n2)c(O)c1 794760549 SJXUDMLLNMBCOV-UHFFFAOYSA-N 287.319 2.426 10 20 CECD Oc1ccccc1CN1CC[C@@H](N2CCCCC2)C1 134116724 XDPDRODSVOIEAB-OAHLLOKOSA-N 260.381 2.452 10 20 CECD COc1cccc(CNCc2cccnc2N(C)C)c1O 1323972799 OMDTVSJSCIRWTP-UHFFFAOYSA-N 287.363 2.152 10 20 CECD CCOc1cccc(CN[C@H](C)c2noc(C)n2)c1O 1323766679 CSHONMVYSQBDFS-SECBINFHSA-N 277.324 2.333 10 20 CECD CCOc1cccc(CN2CCC(C)(N)CC2)c1O 704545264 FWZMDVOFDYKANZ-UHFFFAOYSA-N 264.369 2.104 10 20 CECD COc1ccc(O)c([C@H](C)NCc2ncc(C)[nH]2)c1 693511383 IRGFHFUUEKRKCL-JTQLQIEISA-N 261.325 2.283 10 20 CECD CC[C@H]1CN(Cc2c(O)cccc2OC)C[C@@H](C)O1 769104679 JFXRILSZGVRNPA-NEPJUHHUSA-N 265.353 2.400 10 20 CECD CCO[C@@H](C)C(=O)Nc1c(Cl)ccc2nonc12 1344042767 OYMOGIWXQLGKLE-LURJTMIESA-N 269.688 2.240 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H]1C[C@@H]1F 1346681147 LMFXRMLSSZDURC-RYUDHWBXSA-N 251.301 2.489 10 20 CECD C[C@@H](NC(=O)N1CC(F)(F)C1)c1ccc(N(C)C)cc1 1345856589 BROKLYKGHGSBFC-SNVBAGLBSA-N 283.322 2.474 10 20 CECD CC[C@H](C(=O)O)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1594749983 YSTSGFGQZWGXLF-GWCFXTLKSA-N 278.352 2.041 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCCCC2)cc1 813533912 VZDHRCOKVHJYBD-UHFFFAOYSA-N 261.369 2.448 10 20 CECD Cc1ccc(O)c(CN2C[C@H]3[C@H](N)CCC[C@H]3C2)c1 228536381 SPCVDHPUDCHZKK-NWANDNLSSA-N 260.381 2.260 10 20 CECD CC[C@@H](N[C@@H](C)CN1CCCC1=O)c1ccccc1O 37782113 WGCDHYYFCQWVOX-GXTWGEPZSA-N 276.380 2.444 10 20 CECD COC[C@@H]1CCCN(Cc2cc(OC)ccc2O)C1 180198847 SCYIPJXREOGVIC-GFCCVEGCSA-N 265.353 2.259 10 20 CECD O=C(O)[C@@H]1CC12CCN(Cc1cc(F)ccc1O)CC2 405314552 HXZOPDRXDFLEFB-LBPRGKRZSA-N 279.311 2.218 10 20 CECD CN1CCC[C@@H]1CNCc1ccc2c(c1)CCCO2 921594972 YACXRVDLMIYANG-OAHLLOKOSA-N 260.381 2.195 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCOC1 171026312 ICFIZUWXVHFCKG-AWEZNQCLSA-N 276.380 2.138 10 20 CECD COc1ccc(O)c([C@H](C)NC2CCN(C(C)=O)CC2)c1 37138392 IJBUBSVJLBAXDC-NSHDSACASA-N 292.379 2.062 10 20 CECD CN(Cc1ccc(N2CCCCC2)cc1)S(C)(=O)=O 70247565 ZBDOBNQWXMAESK-UHFFFAOYSA-N 282.409 2.068 10 20 CECD CSc1ccc(C(=O)NCc2ccc(O)c(O)c2)o1 182540587 PCFNACMQMIUOEW-UHFFFAOYSA-N 279.317 2.343 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C(F)F 233477431 NEFDPLTWYJGQMP-UHFFFAOYSA-N 256.296 2.366 10 20 CECD COC(=O)c1ccc(CNCc2cc(C)ccc2O)o1 265189396 OHRNFEBANPNHBQ-UHFFFAOYSA-N 275.304 2.370 10 20 CECD C[C@H]1CCCN([C@H](C)CNC(=O)Cc2ccc(N)cc2)C1 262076003 AEQDWMSFTBERDZ-UONOGXRCSA-N 289.423 2.048 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](O)C(C)(C)C2)c1O 275450838 LUSPCBUZRUVSFJ-CQSZACIVSA-N 295.354 2.327 10 20 CECD CC[C@H](NC[C@@H](O)COC)c1cccc(Cl)c1O 287212035 WYYXHHFUTZBPCL-SKDRFNHKSA-N 273.760 2.094 10 20 CECD CC[C@H](NCC[C@H](O)COC)c1ccc(C)cc1O 280151581 QGAKUUUVVMTLBK-JSGCOSHPSA-N 267.369 2.139 10 20 CECD COc1cc(O)c(CN[C@@H]2CSC[C@H]2C)cc1OC 809702970 KUKPTVQOXKQUQH-MWLCHTKSSA-N 283.393 2.251 10 20 CECD CC1(C)CN(CCN[C@@H]2CCc3cccc(O)c32)CCO1 297640433 JSVQYTSHQIKCLB-CQSZACIVSA-N 290.407 2.080 10 20 CECD CC[C@H](CO)NCc1cc(Br)cc(F)c1O 715724244 ZQMMZWQPFANRAN-SECBINFHSA-N 292.148 2.154 10 20 CECD CCCN(CC)C[C@H](C)NC(=O)NCc1ccccc1O 811980132 XXAOARMUQVRWRC-ZDUSSCGKSA-N 293.411 2.312 10 20 CECD OC[C@H](CC1CC1)NCc1cc(Cl)c(F)cc1O 816558758 KRVUTRPVKMLYPD-JTQLQIEISA-N 273.735 2.435 10 20 CECD C[S@](=O)CCCNCc1cc(Cl)c(F)cc1O 816552674 SJJRPATXOWLYBC-KRWDZBQOSA-N 279.764 2.043 10 20 CECD Cc1noc([C@H](C)NCc2ccc3c(c2)CCO3)n1 725843071 QTBHECKQBJJBHP-VIFPVBQESA-N 259.309 2.164 10 20 CECD CCC[C@@H](CNCc1ccc([N+](=O)[O-])c(OC)c1O)OC 824543202 GOXSCXMMVZYPOB-NSHDSACASA-N 298.339 2.214 10 20 CECD CC[C@@H](NCc1cc(Cl)cc([N+](=O)[O-])c1O)[C@H](C)O 824921553 NDUWEYRCTSFXAM-OIBJUYFYSA-N 288.731 2.203 10 20 CECD Cc1ccc(O)c(CN(CCO)C2CCSCC2)c1 825130076 LTVSOZBISYUTNS-UHFFFAOYSA-N 281.421 2.391 10 20 CECD Cc1cc(O)c(CN[C@@H](CO)CCF)cc1Cl 826142536 DUMFLMNRTGNOHB-SNVBAGLBSA-N 261.724 2.164 10 20 CECD COc1cccc(O)c1CN1CC(C(=O)OC(C)(C)C)C1 839133953 ZXBQCNMWAJQBOZ-UHFFFAOYSA-N 293.363 2.174 10 20 CECD Cc1nnc2c(NCc3ccc(N(C)C)cc3)nccn12 735918059 HEQSDCQMIZVSQB-UHFFFAOYSA-N 282.351 2.111 10 20 CECD CNC(=O)C[C@H](C)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 834901176 QRZIYUUBQPGPIZ-WCABBAIRSA-N 280.343 2.194 10 20 CECD CCc1cccc(CN2CC[C@](C)(C(=O)OC)C2)c1O 848890323 SHKAAGZVHPIRPB-INIZCTEOSA-N 277.364 2.340 10 20 CECD CC(C)[C@@H](C(=O)NCc1cc(Cl)ccc1O)N(C)C 846474773 BGJKVRBVJKKSIP-ZDUSSCGKSA-N 284.787 2.248 10 20 CECD CCN(CC)C(=O)CNCc1ccc(N(C)C)cc1C 840933324 NCZVNEAEYRRGPG-UHFFFAOYSA-N 277.412 2.019 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1cccc(OC)c1O 846155995 RKDQTBBVVCOCAY-NEPJUHHUSA-N 283.368 2.103 10 20 CECD COc1cccc([C@@H](C)N[C@@H](CCO)C(C)C)c1O 846149430 ZJDSCKZRVMVWIQ-YPMHNXCESA-N 267.369 2.458 10 20 CECD COc1ccc(O)c(CN2CCC([C@H](C)CO)CC2)c1 846059140 YVTYHKPPIGPDKL-GFCCVEGCSA-N 279.380 2.241 10 20 CECD CN(C)c1ccc(CN2CCCC[C@H]2C(=O)O)cc1F 840997825 QGTZLIYWAPQCDM-AWEZNQCLSA-N 280.343 2.331 10 20 CECD CCC[C@@H]1CNCCN1Cc1cccc(F)c1O 843058663 ZWWCCXHKYZTLRO-GFCCVEGCSA-N 252.333 2.105 10 20 CECD CO[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)C1 858321628 BCQTXVXPZKIPHR-ZKCHVHJHSA-N 259.708 2.452 10 20 CECD C[C@H](NCCCN(C)C)c1cc(F)cc(F)c1O 756341689 JEUGQJCXTPNICW-VIFPVBQESA-N 258.312 2.273 10 20 CECD COC[C@@H](NC(=O)NCc1cc(C)ccc1O)C(C)C 858247164 RCNZZVZUJQTYQV-CYBMUJFWSA-N 280.368 2.171 10 20 CECD C[C@H](NC(=O)c1cc(O)cs1)c1noc(C(F)F)n1 854920992 HOCRRQBRHCSLON-BYPYZUCNSA-N 289.263 2.265 10 20 CECD CCn1cnnc1CCN[C@@H](C)c1ccc(C)cc1O 756733304 OLWGVLRBQIUQAB-LBPRGKRZSA-N 274.368 2.205 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@@H](S(C)(=O)=O)C2)c1 763381870 JEAJSAPLAOLLJI-CQSZACIVSA-N 297.420 2.018 10 20 CECD C[C@@H](NC(=O)OC1CCOCC1)c1ccccc1O 867834861 PYBARKHHZVXABA-SNVBAGLBSA-N 265.309 2.358 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCc3cnc(C)n3C2)c1 862755021 ASUYLLFAVDLPQL-ZDUSSCGKSA-N 299.374 2.084 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc3cccnn23)cc1 777792343 ZNELGBRLETZFTR-UHFFFAOYSA-N 294.358 2.330 10 20 CECD CCCOc1ccc(CNCCC(=O)O)cc1C 871872198 KNBFKNIWCFSATF-UHFFFAOYSA-N 251.326 2.348 10 20 CECD CC[C@H](C)[C@@](C)(O)CNCc1cc(OC)c(OC)cc1O 776173871 BXPMDJMVAZCXNZ-ZBEGNZNMSA-N 297.395 2.296 10 20 CECD Cc1cccc(O)c1CN[C@H]1C[C@@H](C)N(C2CC2)C1 877094160 NRNNIQPPLJLADC-OLZOCXBDSA-N 260.381 2.415 10 20 CECD C[C@H](NCc1ccn(C)c(=O)c1)c1ccc(N(C)C)cc1 775835623 VMVGAGRYMJMPHO-ZDUSSCGKSA-N 285.391 2.302 10 20 CECD CN(CCOC(C)(C)C)C(=O)/C=C/c1ccc(O)c(O)c1 779533858 CGBWMOMMQTUYBS-SOFGYWHQSA-N 293.363 2.385 10 20 CECD C[C@@H](CN[C@@H](C)c1c(O)cccc1F)CN1CCOCC1 886530363 ISQFJEWTSVUYEC-STQMWFEESA-N 296.386 2.150 10 20 CECD COc1cc(CN[C@H]2CCOC2=O)c(O)c(C(C)(C)C)c1 895808333 FQYKLPUOXXGVIS-ZDUSSCGKSA-N 293.363 2.103 10 20 CECD CN(CCC(=O)Nc1cccnc1)Cc1ccccc1O 792250601 WOTZUAVZWSTFQI-UHFFFAOYSA-N 285.347 2.248 10 20 CECD CCn1cnnc1CCNCc1c(O)ccc(Cl)c1F 790966718 TXXVDDVLOKPHPB-UHFFFAOYSA-N 298.749 2.128 10 20 CECD CC[C@@H](O)CCNCc1cc(F)c(N(C)C)cc1F 1334890106 FRLXGCUAWUCWOW-LLVKDONJSA-N 272.339 2.281 10 20 CECD Cc1ccc(O)c(CN(C)[C@H](COC(C)C)C(=O)O)c1 1610509253 CMESFBSSPZWNAX-CYBMUJFWSA-N 281.352 2.011 10 20 CECD CC1(C)CNC[C@@H]1C(=O)NCc1c(O)ccc2ccccc12 1576472646 CWRSOKWEFNECFM-OAHLLOKOSA-N 298.386 2.407 10 20 CECD COC[C@@H](C)CN[C@H](C)c1cc(C(=O)O)ccc1O 1599157333 RCWOGXVSMJPVNF-VHSXEESVSA-N 267.325 2.024 10 20 CECD C[C@@H](NC/C=C\Cl)c1cc(C(=O)O)ccc1O 1593256463 IAGLOEPIRJJPOY-ZTHSNPKKSA-N 255.701 2.494 10 20 CECD C[C@H]1[C@@H](C(=O)O)CCN1Cc1c(O)ccc2ccncc12 1594165478 CTJHIQCFUIINSN-JQWIXIFHSA-N 286.331 2.235 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C(=O)O)[C@H](F)C2)cc1 1776856154 WDPXHZZEHSSXNV-HUUCEWRRSA-N 294.370 2.387 10 20 CECD CCOCCOCCN[C@H](C)c1cc(C)ccc1O 927087889 QHTMLBWFEQUFAI-CYBMUJFWSA-N 267.369 2.404 10 20 CECD CCOC(=O)[C@H](C)N[C@@H](C)c1ccc(N(C)C)cc1 49371335 AGBMHPRWZHELNE-RYUDHWBXSA-N 264.369 2.355 10 20 CECD CC(C)[C@@H](CO)CNCc1cc(Cl)ccc1O 394067746 HKIQSIFCHGCZAY-LLVKDONJSA-N 257.761 2.400 10 20 CECD COc1cccc(CNC[C@H]2CC[C@@H](C)O2)c1O 398174453 VJEYAUXHGJBKFV-ZYHUDNBSSA-N 251.326 2.058 10 20 CECD Cc1cc(C(=O)N[C@H](C)c2ccccc2O)c(C)nn1 827941674 VSFQYMHQNNFKFX-SNVBAGLBSA-N 271.320 2.290 10 20 CECD CCN(Cc1cnn(C)c1)Cc1cc(F)ccc1O 179978384 HQRWRMSWDCHXFE-UHFFFAOYSA-N 263.316 2.287 10 20 CECD C[C@@H](NC(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 58556809 WFBBQJLDWOSEJF-SNVBAGLBSA-N 279.359 2.489 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cnn(C)c1 129940982 HQBBUSRDSYRVNB-UHFFFAOYSA-N 273.336 2.178 10 20 CECD Cc1nc2n(n1)C[C@H](N[C@H](C)c1cc(F)ccc1O)CC2 185318317 XUBWENHTKWTETL-BXKDBHETSA-N 290.342 2.097 10 20 CECD COc1ncccc1NC(=O)c1ccc(C)c(O)c1O 182082088 KHJKYQURHDWAMP-UHFFFAOYSA-N 274.276 2.062 10 20 CECD C[C@@H](O)CN[C@H](C)c1cc(Br)c(F)cc1O 134899531 NRRYCENOMWBXJN-RNFRBKRXSA-N 292.148 2.325 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC[C@@H](C)O)c1 228044675 WMACOPKNVDSJBC-GHMZBOCLSA-N 253.342 2.212 10 20 CECD O=Cc1c[nH]nc1/C=C/c1ccc(N2CCOCC2)cc1 98125517 KPQPFUMGYKVLCK-ZZXKWVIFSA-N 283.331 2.229 10 20 CECD O=C1CN(Cc2cc(Cl)ccc2O)[C@@H]2CCCC[C@@H]2N1 245561186 NLLGOJXZPDVVPD-QWHCGFSZSA-N 294.782 2.289 10 20 CECD C[C@H](NCCCN1CCCC1)c1cc([N+](=O)[O-])ccc1O 273425934 UCIDPLQMHOAHJX-LBPRGKRZSA-N 293.367 2.437 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H]1CCCO1 297612302 AHAMEUDXGBSQBN-CQSZACIVSA-N 292.379 2.493 10 20 CECD C[C@H]1C[C@@H](CO)CCN1Cc1ccc(N(C)C)c(F)c1 290286721 ZQZXDWOZNPADSQ-JSGCOSHPSA-N 280.387 2.485 10 20 CECD C[C@@]1(CCCO)CCCN1Cc1cc2c(cc1O)OCO2 290447298 MDLVDIYCGNXUMM-INIZCTEOSA-N 293.363 2.248 10 20 CECD CC[C@@](C)(NCc1ccc(N(C)C)cc1)C(=O)OC 293105818 JMDSPJKQKDEDLA-OAHLLOKOSA-N 264.369 2.184 10 20 CECD COc1cc(Cl)cc(CN(C)C[C@@H](O)C2CC2)c1O 809752725 WASCWFAILKWRRN-GFCCVEGCSA-N 285.771 2.257 10 20 CECD CSC[C@@H](O)CNc1ccccc1OCCF 819488536 MGLQRGQMBKEJIP-JTQLQIEISA-N 259.346 2.171 10 20 CECD C[C@H](NCc1cc(F)ccc1O)c1ccnc(O)c1 816639049 GBBJRDMSYNQWNM-VIFPVBQESA-N 262.284 2.483 10 20 CECD CCCOc1ccccc1NC[C@@H](O)Cn1cccn1 819399806 YLWUFTQFEXVLOP-CYBMUJFWSA-N 275.352 2.145 10 20 CECD CCO[C@@H]1CCC[C@H]1NCc1cc(OC)ccc1O 825284334 LHBUDOKNMQRSRC-UKRRQHHQSA-N 265.353 2.448 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCN1C1CCCC1 821055303 KPBQHGQZMSODHX-AWEZNQCLSA-N 274.364 2.025 10 20 CECD CC(C)[C@@H](C(=O)N[C@H](C)c1ccccc1O)N(C)C 827937295 QVVGPYDZIXDCEA-RISCZKNCSA-N 264.369 2.156 10 20 CECD Cc1cc(O)c(CN[C@H](CO)C(C)C)cc1Cl 825326033 LCBAUJXRWBHCFE-GFCCVEGCSA-N 257.761 2.461 10 20 CECD CC(C)N(C(=O)COC(=O)c1cc(O)cs1)C(C)C 731909830 LLGMABHHITZFSY-UHFFFAOYSA-N 285.365 2.256 10 20 CECD CCOc1cccc(CN2CC(C(F)F)C2)c1O 839140818 IFZDHVFOBYZSQF-UHFFFAOYSA-N 257.280 2.488 10 20 CECD C[C@@H]1SCCN(C(=O)c2cc(O)cs2)[C@@H]1C 735703791 LCPMQBCVHTZGOD-SFYZADRCSA-N 257.380 2.420 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NC2CCC2)c1 730584414 XMELZZLNEVBFTL-SECBINFHSA-N 264.325 2.314 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(NC(N)=O)cc1 917310063 KDHRVORNVQNKDK-UHFFFAOYSA-N 299.330 2.155 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1([S@](C)=O)CC1 840942379 FNSIRXURJMZZBZ-IBGZPJMESA-N 280.437 2.062 10 20 CECD CCNC(=O)CN(CC)Cc1ccc(N(C)C)cc1C 840910655 VTLHZXIEFJKQJG-UHFFFAOYSA-N 277.412 2.019 10 20 CECD CCOc1ccc(CN2C[C@@H]3CCC[C@H](N)[C@H]3C2)c(O)c1 843059726 RBAODYCQKLEMRJ-RCBQFDQVSA-N 290.407 2.350 10 20 CECD CN(C)c1ccc(CN[C@H]2[C@@H]3CNC[C@@H]32)c(C(F)(F)F)c1 841079995 MOWVUMIQVKWJTF-IMRBUKKESA-N 299.340 2.079 10 20 CECD Oc1cc2c(cc1CN1CCO[C@H](CF)C1)CCCC2 840172094 MCEFSELCTOYNEB-OAHLLOKOSA-N 279.355 2.441 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CCc3c(nnn3C)C2)c(O)c1 848564420 NDFNKNCBLHAHFJ-NWDGAFQWSA-N 286.379 2.037 10 20 CECD O=C1C[C@H](CN(Cc2ccccc2O)C2CCCC2)CN1 851771602 JZFJWXYFHLNHLL-ZDUSSCGKSA-N 288.391 2.273 10 20 CECD CCN(CC)c1ccc(CNCc2cnnn2C)cc1F 751146952 NLTFGKGVLDYKKC-UHFFFAOYSA-N 291.374 2.090 10 20 CECD COC(=O)CCCCN[C@H](C)c1cc(OC)ccc1O 859233283 PZDPUOTUFBTSFW-LLVKDONJSA-N 281.352 2.395 10 20 CECD Oc1cc2c(cc1CN1[C@H]3CCC[C@H]1CC3)[C@H](O)CO2 768465287 ZGEQUAKAGVCSDZ-SLEUVZQESA-N 275.348 2.335 10 20 CECD CNC(=O)C1(NCc2cc(Cl)ccc2O)CCCC1 779175376 FCAZMMNDLDXFQG-UHFFFAOYSA-N 282.771 2.194 10 20 CECD CCOc1cccc(CNC2(CC(=O)OC)CCC2)c1O 777439293 CORUCZKJLNSJAQ-UHFFFAOYSA-N 293.363 2.366 10 20 CECD C[C@@H](CCn1cccn1)NCc1ccc2c(c1)CCO2 779399141 HJIMGHFOYNCJRZ-ZDUSSCGKSA-N 271.364 2.386 10 20 CECD Oc1c(F)cc(F)cc1CN[C@H]1CCN(CC(F)F)C1 883147453 VUXARQNEUBHQAJ-JTQLQIEISA-N 292.276 2.099 10 20 CECD COc1ccc(CNC[C@H]2C=CCC2)c(O)c1OC 895993292 ANQKRERGTYUPHK-NSHDSACASA-N 263.337 2.465 10 20 CECD COCC1(NCc2ccc(OC)c(OC)c2O)CCC1 894306001 TZRMLYVRHWTHJZ-UHFFFAOYSA-N 281.352 2.068 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1F 895784734 KDQIHOZRGGGFGT-ZENOOKHLSA-N 278.371 2.094 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc3cncn3c2)cc1 785704527 ADOSUWODSGHOKT-UHFFFAOYSA-N 294.358 2.330 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H](O)COCC(C)C 797722268 JBGOUVYWEOJOCC-OAHLLOKOSA-N 293.407 2.481 10 20 CECD C[C@H]1CN(Cc2ccc(N3CCCC3)cc2)[C@H](C)CN1 1235440381 HINMFBDXNNGTRR-LSDHHAIUSA-N 273.424 2.469 10 20 CECD CC[C@H](F)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1337183123 LNAAHVQKJSPGPT-LBPRGKRZSA-N 298.333 2.231 10 20 CECD C[C@H](Sc1ncc(C(=O)O)s1)c1nccc(N)n1 1604456498 GWIIFKNERUPHDZ-YFKPBYRVSA-N 282.350 2.067 10 20 CECD O=C(O)c1cc2ccccc2c(CN2CCO[C@@H]3C[C@@H]32)c1O 1608866059 URCLPXYJYMWADY-LSDHHAIUSA-N 299.326 2.217 10 20 CECD Cc1cc(O)c(CNc2cnn(CC(=O)O)c2C)cc1C 1610476171 XOZNROVQJDQVQB-UHFFFAOYSA-N 289.335 2.211 10 20 CECD CCN1CCc2cc(CN[C@@](C)(C(=O)O)C3CC3)ccc21 1776884794 XQSXTJJQLUYHOG-QGZVFWFLSA-N 288.391 2.412 10 20 CECD CCOC(=O)[C@H](C)NCc1cccc(Cl)c1O 158736939 FIFUHXSBHPOEDI-QMMMGPOBSA-N 257.717 2.087 10 20 CECD CCCNC(=S)NCc1ccc(N(C)C)cc1 18165323 RNLNEGDGTFZNQZ-UHFFFAOYSA-N 251.399 2.127 10 20 CECD Oc1ccc(F)cc1CNC[C@H](O)c1ccccc1 226582553 DAZLYYQZOURPFP-HNNXBMFYSA-N 261.296 2.355 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)cc1O)C(=O)N1CCCC1 228093797 YITPEAXFEDBNAT-MNOVXSKESA-N 280.343 2.193 10 20 CECD COC[C@H](CCO)N[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 230663314 PTGGMHIRDFUQMJ-AGIUHOORSA-N 279.380 2.236 10 20 CECD CCCN(CC(=O)N(C)C)Cc1cccc(C)c1O 124564360 VZBBULUGYWAJRI-UHFFFAOYSA-N 264.369 2.001 10 20 CECD CC(C)NC(=O)[C@H](C)NCc1cccc(Cl)c1O 228938877 IXNAETFYOJTDNK-VIFPVBQESA-N 270.760 2.048 10 20 CECD CCNC(=O)c1ccccc1NC(=O)Cc1ccc(N)cc1 66153882 DLKRHZQZMRJNTO-UHFFFAOYSA-N 297.358 2.200 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C2=CCCCO2)c1 178745126 OPOVZYSBQUXFFW-SNVBAGLBSA-N 277.320 2.272 10 20 CECD COc1cccc(CN[C@@H](CO)Cc2ccccc2)c1O 63218262 KLTPEWAMGLCSOO-OAHLLOKOSA-N 287.359 2.094 10 20 CECD CCCc1nc(CN(C)c2ccc3c(c2)OCO3)no1 121401531 KDKPYCKZGPTXBK-UHFFFAOYSA-N 275.308 2.387 10 20 CECD Cc1cc(Br)cc(CN2CCN(C)CC2)c1O 124494042 OOYMMQWFSYMLND-UHFFFAOYSA-N 299.212 2.211 10 20 CECD CCOCc1cc(CNC[C@H]2CC[C@H](O)C2)ccc1OC 188798060 BQZRTTGQBJWDOH-HOCLYGCPSA-N 293.407 2.482 10 20 CECD CNC(=O)CCN(C)Cc1ccc(N2CCCCC2)cc1 138294384 NMYVHIYBZRQAIO-UHFFFAOYSA-N 289.423 2.245 10 20 CECD Cc1cc(C(=O)N[C@H]2CCC[C@@H]2O)c(C)n1-c1ccccn1 132635929 QLKGQFHLVRNWEP-GJZGRUSLSA-N 299.374 2.132 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H]2CCCS(=O)(=O)C2)c(O)c1 287128166 RNOVYVBSQJIANP-OLZOCXBDSA-N 297.420 2.176 10 20 CECD C[C@H](NCCn1ccnc1)c1ccc(F)c(F)c1O 191184748 GIAYEDMPVXBXQW-VIFPVBQESA-N 267.279 2.218 10 20 CECD CCN(CCCN(C)C)Cc1cc(C)ccc1O 230744837 SDPRDIOWWSPLOH-UHFFFAOYSA-N 250.386 2.474 10 20 CECD CN(C)c1ccc(CNC(C)(C)CCO)cc1F 266172393 RQNNILGWZQDUIE-UHFFFAOYSA-N 254.349 2.142 10 20 CECD CN(C(=O)Cc1ccc(N)cc1)C1Cc2ccccc2C1 262624328 RNRBEMIIABUCRX-UHFFFAOYSA-N 280.371 2.437 10 20 CECD Nc1ccc(CC(=O)NC[C@H]2OCCc3ccccc32)cc1 366344143 DDKPZKGCGFOUBV-QGZVFWFLSA-N 296.370 2.242 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](C)c2cnn(C)c2)c1O 273251610 CIBXNAAGQXLZBU-VIFPVBQESA-N 291.326 2.318 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@@H]1C[C@]12CCNC2 372493050 UFTSUVWYZNMDJU-YOEHRIQHSA-N 288.391 2.130 10 20 CECD CC[C@H](NCCCC(=O)NC)c1ccc(C)cc1O 280113180 NSTPNIWRPUTGRG-ZDUSSCGKSA-N 264.369 2.268 10 20 CECD CCC[C@@H](OC)C(=O)NCc1ccc(N(C)C)c(F)c1 294688957 KJVUDLDDYJLPSB-CQSZACIVSA-N 282.359 2.323 10 20 CECD CCNC(=O)[C@@H](NCc1ccc(OC)c(C)c1)C(C)C 293083403 WIBQWXKSIRAOLG-HNNXBMFYSA-N 278.396 2.254 10 20 CECD CN(C)c1ccc(CN2CCC[C@H](O)CC2)cc1F 294120096 TVWNJBHMGALKHQ-ZDUSSCGKSA-N 266.360 2.239 10 20 CECD O[C@@H](CNc1ccccc1OCC1CC1)Cn1cccn1 819450921 JASOUJVAOAUPSY-AWEZNQCLSA-N 287.363 2.145 10 20 CECD COc1ccc(N(C)C(=O)/C=C/c2cncc(F)c2)nc1 492957108 SRTNMKYGLIFECT-ZZXKWVIFSA-N 287.294 2.301 10 20 CECD CCn1cc(CNCc2cc(Cl)c(F)cc2O)nn1 827087674 RLOFRXPHEZAUHQ-UHFFFAOYSA-N 284.722 2.086 10 20 CECD O=C(Nc1cnn(C2CCC2)c1)c1c(F)ccc(O)c1O 900777324 UIYAHIJBVLGVGD-UHFFFAOYSA-N 291.282 2.411 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCOC1CCCC1 588405736 QWNSHHGZYSWGKF-VURMDHGXSA-N 291.347 2.186 10 20 CECD COc1cccc(CCNC(=O)c2cc(O)cs2)c1 732272113 HYSHIKUKGXIMGY-UHFFFAOYSA-N 277.345 2.435 10 20 CECD COc1cccc([C@H](C)NC[C@@H](O)C(C)C)c1O 846145198 NFAHWWSKNLDSKA-CMPLNLGQSA-N 253.342 2.068 10 20 CECD CC1=CCCN(C(=O)NCCc2ccc(N)cc2)C1 841960002 SWDDWBTYAFFKNR-UHFFFAOYSA-N 259.353 2.173 10 20 CECD CCOc1ccc(CN2CCC[C@@H]([C@@H](C)N)C2)c(O)c1 843051491 JKEOGGIBAKQEGZ-CHWSQXEVSA-N 278.396 2.350 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCN[C@H](C)[C@H]2C)c1O 843376857 FGAJQTWYHRFXRO-NXEZZACHSA-N 296.798 2.430 10 20 CECD CC1(C)CN(C(=O)Cc2ccc(N)cc2)[C@H]1[C@@H]1CCCO1 852873509 XCEZCMIMFOAGNY-HOCLYGCPSA-N 288.391 2.227 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2CCOC[C@@H]2C)c1 756537350 YHTPVYXYTBCWBV-UONOGXRCSA-N 278.396 2.072 10 20 CECD CNC(=O)[C@H]1CCC[C@@H]1NCc1ccc2c(c1)CCCO2 921951041 HKNAGFIZBNXAQJ-GJZGRUSLSA-N 288.391 2.016 10 20 CECD C[C@H](Sc1ncc(Cl)s1)c1nnnn1C 850000124 JWSROTZXRXRCSU-BYPYZUCNSA-N 261.763 2.173 10 20 CECD C[C@H](NCC1CCN(C)CC1)c1cc([N+](=O)[O-])ccc1O 756546575 SEWJPITZBZOSII-NSHDSACASA-N 293.367 2.293 10 20 CECD CN(CCC1CC1)Cc1cc2c(cc1O)OC[C@H]2O 768462157 KFPMGVCROBLNJH-CQSZACIVSA-N 263.337 2.050 10 20 CECD COCCC1(C(=O)N(C)c2ccc(N)cc2)CCC1 877077429 HUHDMEZYFNSPOZ-UHFFFAOYSA-N 262.353 2.438 10 20 CECD CCCOc1ccc(CN[C@@H]2C(=O)NCC[C@H]2C)cc1C 873122548 SUCMNDSHNREMCT-WBMJQRKESA-N 290.407 2.398 10 20 CECD Cc1ccc(CN2CCC[C@@H](n3ccnn3)C2)c(O)c1 877597395 KALZMGTUVYNSOF-CQSZACIVSA-N 272.352 2.129 10 20 CECD Cc1ccc(CNC[C@H]2CN(CC(C)C)CCO2)c(O)c1 876880613 LGFVORBXXUBMNZ-INIZCTEOSA-N 292.423 2.147 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCCc2ccco2)c1O 774941575 AZRLOGGGEJGNME-UHFFFAOYSA-N 292.291 2.234 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1CCO[C@@H](C)C1 776326155 YZAXVVNTVAHNIN-KBPBESRZSA-N 290.407 2.492 10 20 CECD C[C@@]1(CCCO)CCCN1C(=O)NCc1ccc(N)cc1 1120676753 BLZFCSZDDMBPIH-INIZCTEOSA-N 291.395 2.105 10 20 CECD Cc1cnc([C@H](C)n2cc(COc3ccc(N)cc3)nn2)o1 881354152 VGVRZPITXZVJKU-NSHDSACASA-N 299.334 2.345 10 20 CECD NC(=O)CC[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 893980463 MCBZCPSJEQCMMB-JTQLQIEISA-N 298.333 2.148 10 20 CECD C[C@H](Cc1cccc(O)c1)NC(=O)c1cccc(O)c1O 790893277 FZAGSVJMONFGNK-SNVBAGLBSA-N 287.315 2.164 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)c1ccoc1 795352752 JRHINKCSAXJXSV-UHFFFAOYSA-N 267.306 2.348 10 20 CECD Cc1ccc([C@H](C)NCC2(CO)CCOCC2)c(O)c1 186149850 BJOZEORGNYGURP-ZDUSSCGKSA-N 279.380 2.140 10 20 CECD COc1cc(O)c(CNC/C=C/C2CC2)cc1OC 1326341984 FLMWYOBKSMXNTJ-ONEGZZNKSA-N 263.337 2.465 10 20 CECD CCc1cccc(CNCC(C)(C)N(C)C)c1O 691481259 GLRPTOYQBQURRX-UHFFFAOYSA-N 250.386 2.384 10 20 CECD CCO[C@H](C(=O)NCc1ccc(N(C)C)cc1)C1CC1 1331866072 MHWYCWVYSJCGMI-HNNXBMFYSA-N 276.380 2.184 10 20 CECD CC1=NO[C@@](C)(C(=O)N[C@H](C)c2ccccc2O)C1 1262637230 NHFSYRDDUUJRBI-QMTHXVAHSA-N 262.309 2.124 10 20 CECD COc1cccc(O)c1CN[C@@H]1CCO[C@H]1C1CC1 922516674 VIYUSLJWPLSTLT-DOMZBBRYSA-N 263.337 2.058 10 20 CECD Nc1ccc(NC(=O)NC2(CC(=O)O)CCCC2)cc1 1601216565 HHQKGFLOFDZFIG-UHFFFAOYSA-N 277.324 2.178 10 20 CECD O=C(O)c1ccnc(NCc2ccc(N3CCCC3)cc2)n1 1602483380 MFGSQYURPZOGDI-UHFFFAOYSA-N 298.346 2.387 10 20 CECD Cc1cnc(C2(NC(=O)Cc3ccc(N)cc3)CCC2)[nH]1 1579544050 PQNDEPSLOLUEAG-UHFFFAOYSA-N 284.363 2.038 10 20 CECD CCN(C)c1ccc(CN[C@H](CSC)C(=O)O)c(C)c1 1776856220 VWAPZFUOJQMRRD-CQSZACIVSA-N 296.436 2.357 10 20 CECD COc1cc(CN2CCOC3(CCC3)C2)c(O)cc1C 160525011 GGORRGQLFOVRSB-UHFFFAOYSA-N 277.364 2.464 10 20 CECD Oc1cccc(Cl)c1CNCCCO[C@H]1CCOC1 153031614 CUGOIKUPLQOODL-NSHDSACASA-N 285.771 2.331 10 20 CECD CC[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)N(C)C 156319386 NBKRAXSNDQMRMY-OAHLLOKOSA-N 290.407 2.227 10 20 CECD Nc1ccc(CCNC(=O)c2cc(C3CC3)on2)cc1 262574351 HOJUXODHGGYTSB-UHFFFAOYSA-N 271.320 2.107 10 20 CECD COc1cccc(CN2CCCC[C@H]2[C@H](C)N)c1O 63191262 XHYLCCOROGYTHP-AAEUAGOBSA-N 264.369 2.103 10 20 CECD COC[C@]1(C(=O)O)CCCN1Cc1cc(Cl)ccc1O 692407111 FHYOKKRZHWWTAM-AWEZNQCLSA-N 299.754 2.111 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccc(O)c2O)cc1 186792067 ZSEWGABZIYBDIR-UHFFFAOYSA-N 286.331 2.094 10 20 CECD C[C@H](NCCCN1CCOCC1)c1ccc(N(C)C)cc1 37232285 SJXVGDAXGOSESG-HNNXBMFYSA-N 291.439 2.126 10 20 CECD Cc1nccn1CCCNCc1ccc2c(c1)CCO2 77329764 QGTHQDAIALNBQV-UHFFFAOYSA-N 271.364 2.306 10 20 CECD CCC(=O)N1CC[C@@H](N[C@H](C)c2ccc(N(C)C)cc2)C1 126447969 ZJTGLHMHZCSTSR-UKRRQHHQSA-N 289.423 2.414 10 20 CECD Cc1ccc(C(=O)N(C)C2CCC(CO)CC2)c(O)c1O 182604057 CPXUOIZOUFJBRY-UHFFFAOYSA-N 293.363 2.029 10 20 CECD C[S@](=O)CCNCc1cc(Cl)cc(Cl)c1O 124193296 GYEPZNJCZAGPHE-MRXNPFEDSA-N 282.192 2.167 10 20 CECD C[C@@H](NCC1(C(N)=O)CCCC1)c1cc(F)ccc1O 273553337 GJCUMRVQNLDEJK-SNVBAGLBSA-N 280.343 2.228 10 20 CECD COC(=O)[C@@H]1CCCCCN1Cc1cccc(OC)c1O 360021465 WDYJCINZOBKMJU-ZDUSSCGKSA-N 293.363 2.318 10 20 CECD CC1(C2CCN(Cc3ccccc3O)CC2)OCCO1 272282843 MYHYYTQAIYHXPL-UHFFFAOYSA-N 277.364 2.367 10 20 CECD Cc1cccc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)n1 273208781 SRWDQBNULYJWLJ-LLVKDONJSA-N 286.331 2.162 10 20 CECD COCCC(C)(C)CNC(=O)NCc1ccccc1O 273593157 SQIOKAKIBBPLDP-UHFFFAOYSA-N 280.368 2.254 10 20 CECD COc1cccc(CN2C[C@H](C)O[C@H](C3CC3)C2)c1O 280671166 UFRRUVLAUYDFAW-NHYWBVRUSA-N 277.364 2.400 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@@](O)(C2CC2)C1 373270482 KZAWGORHWCGYJJ-AWEZNQCLSA-N 267.756 2.392 10 20 CECD C[C@H]1COCC[C@H]1CNCc1cc(F)ccc1O 289577773 JUQFGTWXFJHZKC-QWRGUYRKSA-N 253.317 2.294 10 20 CECD CCN(CC)CCCOC(=O)c1cc(O)cs1 800165212 HLWUONLMIVUTST-UHFFFAOYSA-N 257.355 2.342 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1CCC1 808095975 ZCGKXVYOAPJEBZ-UHFFFAOYSA-N 254.326 2.294 10 20 CECD Cc1cc(CN(C)C2(CO)CCOCC2)ccc1N(C)C 294601422 NQHHCNXFECJEEY-UHFFFAOYSA-N 292.423 2.034 10 20 CECD C[C@@H](N[C@@H]1CCCNC1)c1cc(Cl)ccc1O 817941441 QHJACSDRZYVOLU-MWLCHTKSSA-N 254.761 2.448 10 20 CECD COC[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)C(C)C 817939518 CAGXBVGVFQIDDP-HOTGVXAUSA-N 279.428 2.013 10 20 CECD CO[C@@H](CNC(=O)c1cc(O)cs1)C(C)(C)C 829415537 QDAAIKPTRURRAR-JTQLQIEISA-N 257.355 2.245 10 20 CECD CCN(CC)c1ccc(CNC(=O)C[C@@H](C)N)cc1F 829038798 PCFJLKZXWSDEDZ-LLVKDONJSA-N 281.375 2.025 10 20 CECD Cc1cc(O)c(CNCCn2cccn2)cc1Cl 825132261 ZIEGWWXSZJNAPR-UHFFFAOYSA-N 265.744 2.340 10 20 CECD CC[C@](C)(CC(=O)O)NCc1ccc(N(C)C)cc1 828664981 MXQDMBDCVZPQAD-OAHLLOKOSA-N 264.369 2.486 10 20 CECD Cc1ncc2n1C[C@H](C(=O)N[C@H](C)c1ccccc1O)CC2 827946223 AUXFTZUGNQXXFG-DGCLKSJQSA-N 299.374 2.337 10 20 CECD Cc1cc(O)c(CN[C@H](C)c2ncnn2C)cc1Cl 825671761 OMQCBMLPWNOUHI-SECBINFHSA-N 280.759 2.333 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)cc1C 824839189 WBORPRPCVKZHBJ-XJNFMUPTSA-N 271.360 2.394 10 20 CECD COc1ccc(N(CCn2cncn2)CC2CC2)cc1 831587548 DWABKNWVOZTQFV-UHFFFAOYSA-N 272.352 2.203 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1ccnnc1 839918624 BRYKZVRHUDITKP-ZDUSSCGKSA-N 298.390 2.212 10 20 CECD C[C@@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)CCN1 841062129 GIHQKSQVCCJPBI-RKDXNWHRSA-N 272.751 2.415 10 20 CECD Nc1ccc(NC(=O)N[C@H](C2CC2)[C@@H](CO)C2CC2)cc1 841299694 MOVSSNJLBIWCMU-LSDHHAIUSA-N 289.379 2.187 10 20 CECD CC1(C)CNCC[C@H]1NCc1cccc(F)c1O 841073426 TXFMYUQBZYBTEG-GFCCVEGCSA-N 252.333 2.009 10 20 CECD C[C@H](O)CN(Cc1ccc(N(C)C)c(F)c1)C1CC1 848928457 DUQJCIBEVUSGHG-NSHDSACASA-N 266.360 2.237 10 20 CECD COC[C@H](O)CCN[C@H](C)c1ccc(Cl)cc1O 841748152 HQHOYUNUGQBVMP-MWLCHTKSSA-N 273.760 2.094 10 20 CECD Cc1nnc2ccc(C(=O)N(C)Cc3ccccc3O)cn12 749732731 KIRLOSNRUXSVRR-UHFFFAOYSA-N 296.330 2.016 10 20 CECD CCN(C)c1ccc(CN2CCCN(C(C)=O)CC2)cc1 741752952 KIUCWOLTHOLOAR-UHFFFAOYSA-N 289.423 2.197 10 20 CECD CCN(CC)C[C@H]1CCN(C(=O)c2cc(O)cs2)C1 743758413 DHHDURDLUHPSIA-LLVKDONJSA-N 282.409 2.258 10 20 CECD CCOc1ccc(CN[C@H](CCN)C(F)(F)F)c(O)c1 841091307 XYPGTROEDSLWBF-GFCCVEGCSA-N 292.301 2.160 10 20 CECD CNC[C@H](C)NCc1cc(C)cc(Br)c1O 853248637 HZGAVYPUPKEPBF-VIFPVBQESA-N 287.201 2.161 10 20 CECD COc1ccc(N(C)C[C@@H]2COC(C)(C)O2)c(OC)c1 851865336 ULSKCMATKHOHOG-GFCCVEGCSA-N 281.352 2.292 10 20 CECD NC(=O)[C@H](Cc1ccccc1)Sc1nccs1 758392088 NINSDQQCTCSNRR-JTQLQIEISA-N 264.375 2.332 10 20 CECD CN(C(=O)/C=C/c1cnn(C)c1)c1cc(F)ccc1F 750554409 ZJWYBCGHEUXMMT-ZZXKWVIFSA-N 277.274 2.375 10 20 CECD Cc1cc(CN2CCSC[C@@H]2C(=O)O)ccc1N(C)C 851705915 YSCPADSXLYKCND-CQSZACIVSA-N 294.420 2.063 10 20 CECD COC[C@H]1CCN(Cc2cc(OC)c(C)cc2O)C1 768444801 CUPWDHUKEUNGAJ-LBPRGKRZSA-N 265.353 2.178 10 20 CECD COCc1cc(N[C@H](C)Cc2ccc(O)c(O)c2)ncn1 762799777 AFRNXZHZJHDPMI-SNVBAGLBSA-N 289.335 2.077 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@@H]2COC[C@H]2C)c1O 932495592 DEZPXGNVJCWWKD-AMIZOPFISA-N 283.755 2.373 10 20 CECD COc1ccc(CNC(=O)[C@@H]2[C@H]3[C@@H]4CC[C@@H](C4)[C@H]32)c(O)c1 935771470 UKEIXIMTZLNLRF-KURSZUGOSA-N 287.359 2.309 10 20 CECD CC[C@H](N[C@@H](C)CC(N)=O)c1ccc(N(C)C)cc1 763396982 GQYVNCFJGOHHBO-FZMZJTMJSA-N 263.385 2.057 10 20 CECD C[C@@H](NC(=O)NCCCOC(F)F)c1ccccc1O 868587521 ZXVNAFOGSLBUCT-SECBINFHSA-N 288.294 2.382 10 20 CECD C[C@H]1CCCN(Cc2cc3c(cc2O)OC[C@H]3O)CC1 768444589 MNJANGOANKXSCW-XHDPSFHLSA-N 277.364 2.440 10 20 CECD CO[C@H]1CCC[C@@H]1CNCc1cc2c(cc1O)OCO2 774830419 CNUWGFNUZHOHKH-MFKMUULPSA-N 279.336 2.026 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)C1(F)CCCC1 773763372 UTAOWPLEACDMTE-JTQLQIEISA-N 281.327 2.427 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCOC1)c1ccc(N(C)C)cc1 773015437 OGTMHTMCVBUOIE-TZMCWYRMSA-N 276.380 2.356 10 20 CECD CC[C@@H](NCC1(CO)COC1)c1cc(Cl)ccc1O 775522528 SLYXKEHSNGCBRL-GFCCVEGCSA-N 285.771 2.095 10 20 CECD Cc1c(NCc2cc(F)c(N(C)C)cc2F)nnn1C 883229842 RZHXQSISZYOQNJ-UHFFFAOYSA-N 281.310 2.080 10 20 CECD Oc1cc2c(cc1CN1CC(C(F)(F)F)C1)OCO2 894892505 YFNKRUJSMALIRN-UHFFFAOYSA-N 275.226 2.115 10 20 CECD O=C(NCc1ccccc1O)c1[nH]nc2ccccc12 133765789 ZXNAKILQDUVWIK-UHFFFAOYSA-N 267.288 2.199 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCOC[C@H]2C)c1O 37323449 NDJVUPUHLWPHPR-SECBINFHSA-N 283.755 2.469 10 20 CECD CC(C)CNC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 135812057 VFFHRZPPWAWOHM-ZDUSSCGKSA-N 277.412 2.175 10 20 CECD C[C@@]1(CNC(=O)c2cccc(O)c2O)CC1(Cl)Cl 1324573904 DKHJYNQQENLXKY-NSHDSACASA-N 290.146 2.412 10 20 CECD CCOC(=O)CN(C)Cc1ccc(N(C)CC)cc1 1324741410 CPTAAEBILHSFSF-UHFFFAOYSA-N 264.369 2.138 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@]2(C)CC(C)=NO2)c1 1338905075 OLDVTRXLLKTVKJ-MEBBXXQBSA-N 292.335 2.133 10 20 CECD CCO[C@@H]1CCCN(Cc2c(O)cccc2OC)C1 771935085 KTWSIRJLSPGUBZ-GFCCVEGCSA-N 265.353 2.402 10 20 CECD Cc1cnc(-c2nnc(N(C)Cc3ccccc3O)n2C)o1 1350963136 YUPOZYALLSKWOJ-UHFFFAOYSA-N 299.334 2.121 10 20 CECD Cc1cnc(OCc2cc(C(=O)O)oc2C)c([N+](=O)[O-])c1 1600625648 KEZMDKWHIURJAO-UHFFFAOYSA-N 292.247 2.477 10 20 CECD Cc1ccc(CN2CCC[C@@H](C)[C@H]2C(=O)O)c(O)c1 1605273098 GPDJDVLXUOGEOC-RISCZKNCSA-N 263.337 2.386 10 20 CECD C[C@@H](Sc1ncc(C(=O)O)s1)c1cnccn1 1604456019 ABOCSUCEUJSIBQ-ZCFIWIBFSA-N 267.335 2.485 10 20 CECD Cc1cc(C(=O)O)nc(N[C@@H](C)c2ccccc2O)n1 1607599939 APFPLTYMFHVAMY-VIFPVBQESA-N 273.292 2.362 10 20 CECD Cc1noc2ncc(CNCCc3ccc(N)cc3)cc12 1579923790 LZGCBHMBFWERAT-UHFFFAOYSA-N 282.347 2.446 10 20 CECD CC1(C)[C@@H](NCc2ccc3c(c2)CCO3)[C@H]2CCCN[C@H]21 1576388740 AVPKSBIEBUKEEZ-UAGQMJEPSA-N 286.419 2.488 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](C)C(=O)O)c(O)c1C 1594349511 JYGWLVVMQGCYNS-GXSJLCMTSA-N 251.326 2.380 10 20 CECD OC1(CNCc2ccc3c(c2)CCCO3)CCCC1 921722551 PWJYFHGMQJUIFY-UHFFFAOYSA-N 261.365 2.406 10 20 CECD CCOCCOCCNCc1ccc2c(c1)CCCO2 922945528 SIHRCVQDVBNADI-UHFFFAOYSA-N 279.380 2.154 10 20 CECD CC[C@@H](NCCc1ccn(C)n1)c1ccccc1O 229578678 DDKCLFLKVUVEJH-CQSZACIVSA-N 259.353 2.409 10 20 CECD Cc1cccc(CN[C@@H]2CCN3CCCC[C@H]23)c1O 124709126 IYDYLPIRXCNAFK-HUUCEWRRSA-N 260.381 2.417 10 20 CECD COc1ccc(O)c([C@@H](C)NCCc2cnn(C)c2)c1 148785425 SPGYYTCWGBRCGG-LLVKDONJSA-N 275.352 2.028 10 20 CECD CC(=O)c1cc(F)cc(CN(C)[C@H]2CCCOC2)c1O 401648554 FAAIPNDFCFODRW-ZDUSSCGKSA-N 281.327 2.345 10 20 CECD COc1ccc(CN[C@@H]2CS[C@H](C)C2)c(O)c1 397975955 OSLICDPMZHBWNY-KOLCDFICSA-N 253.367 2.384 10 20 CECD CCS(=O)(=O)N(C)Cc1ccc(N2CCCCC2)cc1 64943091 KYOFDWVEHDQINZ-UHFFFAOYSA-N 296.436 2.458 10 20 CECD CCN(CC)c1ccc(CNCCN(C)CCOC)cc1 61376056 YFSNELVKDNDQSD-UHFFFAOYSA-N 293.455 2.201 10 20 CECD Cc1cc(NCc2ccccc2O)ccc1-n1cnnn1 37104030 UAOAKIIDVNLGIL-UHFFFAOYSA-N 281.319 2.288 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1noc(C)n1 136749641 VPXKYOXRQAYLFA-UHFFFAOYSA-N 275.308 2.136 10 20 CECD CCC(CC)C(=O)NCc1cccc(OC)c1O 81777931 KMRCRBJTCHEBRV-UHFFFAOYSA-N 251.326 2.453 10 20 CECD CN(C)c1ccc(CNC[C@@](C)(O)C(F)(F)F)cc1F 270452013 CMURTLLMWWUWRH-GFCCVEGCSA-N 294.292 2.295 10 20 CECD CCN(CCN[C@H](C)c1cc([N+](=O)[O-])ccc1O)C1CC1 273579552 MHZYXSLGHSFRKE-LLVKDONJSA-N 293.367 2.435 10 20 CECD CC[C@H](N[C@@H](CO)c1cnn(C)c1)c1ccc(F)cc1O 285957138 FIZMGABQIJXNLV-KBPBESRZSA-N 293.342 2.039 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CCc3c[nH]nc3C2)c1 370395857 JOERGYOFTLGWFX-CMPLNLGQSA-N 287.363 2.332 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H]1CCC[C@H](C(=O)O)C1 386498826 PUKSGFDTCIFEJK-RYUDHWBXSA-N 291.347 2.242 10 20 CECD CCCNC(=O)CN(CC)c1ccc(OC)cc1 299340086 DUMGXVOVBBIOAB-UHFFFAOYSA-N 250.342 2.048 10 20 CECD CC[C@@H](N)CN[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 817980720 WQAGZPJWMHTIJS-GXTWGEPZSA-N 295.402 2.050 10 20 CECD CCn1cnc(C(=O)NCc2ccc(N(C)C)cc2C)c1 827958186 ZVDAQGGUOPPBPW-UHFFFAOYSA-N 286.379 2.207 10 20 CECD CCn1ncnc1CNCc1cc(Cl)c(C)cc1O 825748982 LJSTZORQWXKWRU-UHFFFAOYSA-N 280.759 2.255 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@@H](C)c1cc(C)ccc1O 834880808 ROJLTCSPXNBOSX-WOSRLPQWSA-N 279.380 2.403 10 20 CECD O=C(NCc1ccc2c(c1)OCO2)c1cc(O)cs1 731862073 YXDQXQBRQQPMIV-UHFFFAOYSA-N 277.301 2.112 10 20 CECD Cc1noc(C)c1C[C@H](C)NC(=O)c1cc(O)cs1 738545809 QGXJTPHCGZAWIC-ZETCQYMHSA-N 280.349 2.420 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCCC2(C1)OCCO2 840937590 SDRISGGUCZJGJH-UHFFFAOYSA-N 290.407 2.400 10 20 CECD CCN(CC)c1ccc(CN=c2nc(C)[nH]n2CC)cc1 840887506 KMQRKZAIFBJPSC-UHFFFAOYSA-N 287.411 2.487 10 20 CECD c1cc(N2CCCCC2)ccc1CN[C@H]1CCNC1 841044378 DOMGWXCOIGNUQW-HNNXBMFYSA-N 259.397 2.128 10 20 CECD Nc1ccc(CCNC(=O)NCC2CCSCC2)cc1 841814942 AOOHJZVYTPGKNR-UHFFFAOYSA-N 293.436 2.254 10 20 CECD O=C(NCc1ccc(O)c(O)c1)[C@@H]1C[C@@H]2C=C[C@H]1CC2 845832919 ARKKYDAACSYCBO-KGYLQXTDSA-N 273.332 2.316 10 20 CECD CCCn1cc(NC(=O)NCc2ccccc2O)cn1 743218377 CLGIMFPEQNOGIM-UHFFFAOYSA-N 274.324 2.320 10 20 CECD CCOc1ccc(CN2CC[C@@H]3OCC[C@@H]3C2)c(O)c1 843420804 IAJOIRQVBQNOET-CJNGLKHVSA-N 277.364 2.402 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCCNC2)cc1 841043658 UUKMHSCAZSIUPE-HNNXBMFYSA-N 261.413 2.374 10 20 CECD CCc1cccc(CN(CC(=O)OC)C(C)C)c1O 848882652 WYDIESTUWODGGD-UHFFFAOYSA-N 265.353 2.338 10 20 CECD NC(=O)[C@H](NCc1ccc2c(c1)CCCO2)c1ccccc1 921522105 XVFREEGALFSPLH-QGZVFWFLSA-N 296.370 2.328 10 20 CECD Cc1ccc([C@@H](C)NCC[C@]2(O)CCCOC2)c(O)c1 846212878 NIASVGDXEBVLKQ-CZUORRHYSA-N 279.380 2.283 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NCC1=CCCC1 856096684 MLBKMAVKEZKDIZ-SOFGYWHQSA-N 259.305 2.338 10 20 CECD CON(C)C(=O)[C@H](C)N[C@H]1C[C@H](C)c2c(F)ccc(O)c21 858580193 XNBBJGTUWVJCSB-QXEWZRGKSA-N 296.342 2.078 10 20 CECD Cc1nc(CCN[C@@H]2C[C@@H](C)c3c(F)ccc(O)c32)n[nH]1 757636467 HIKCFSCLVKVPCH-LDYMZIIASA-N 290.342 2.338 10 20 CECD Cc1nccnc1NCc1ccc(N2CCC(O)CC2)cc1 853955819 XRRDJZKURHPZGA-UHFFFAOYSA-N 298.390 2.358 10 20 CECD COc1ccc(N2CCC(NCc3ncccn3)CC2)cc1 850393722 FWVCUJJGFHSHEZ-UHFFFAOYSA-N 298.390 2.244 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)OCc1cscn1 759593967 KPWKSQDEMLHFHU-DUXPYHPUSA-N 277.301 2.311 10 20 CECD O=C(NC[C@H](CCO)c1ccccc1)c1cc(O)cs1 755853666 GYOOPVZUJOBSJY-LBPRGKRZSA-N 291.372 2.350 10 20 CECD CCCc1cc(C(=O)NCc2cc(C)ccc2O)n[nH]1 862759772 LEGHTHBPQASYNK-UHFFFAOYSA-N 273.336 2.306 10 20 CECD COC(=O)CN(Cc1cc(F)c(N(C)C)cc1F)C1CC1 862252170 RYINDNXFFXOZEB-UHFFFAOYSA-N 298.333 2.168 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)[C@@]12CCC[C@@H]1C2 935309898 HHYJVZHSSKZHMW-NSODJVPESA-N 275.348 2.335 10 20 CECD CC[C@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@@H]1O 1116448815 GEHKPYBZOSLKRP-RDJZCZTQSA-N 274.408 2.490 10 20 CECD CC[C@H](NCC(=O)NCC(C)C)c1ccc(F)cc1O 1117139251 JEYDXSKOSUMQLR-ZDUSSCGKSA-N 282.359 2.344 10 20 CECD Cc1cccc(O)c1CN1CCCc2c(cnn2C)C1 877587890 SJKPKHCLWDHICW-UHFFFAOYSA-N 271.364 2.383 10 20 CECD CN[C@@H](CC(C)(C)C)C(=O)N(C)c1ccc(N)cc1 877077662 QOEQHNCJNWSEIG-ZDUSSCGKSA-N 263.385 2.256 10 20 CECD CCc1cccc(CN2CCCC[C@H]2CNC(C)=O)c1O 877676282 ZULVUCSZAYHGML-INIZCTEOSA-N 290.407 2.445 10 20 CECD O=C(NCc1ccccc1O)c1cnc(C2CC2)o1 878560068 YCROZBGRQXKRAH-UHFFFAOYSA-N 258.277 2.188 10 20 CECD CC[C@H](NCC(=O)NC1CCCC1)c1ccccc1O 775416811 YANGBNQLNXDGOW-AWEZNQCLSA-N 276.380 2.492 10 20 CECD C[C@H]1C[C@H](NCCOCCN(C)C)c2c(O)ccc(F)c21 774375628 DETWSCQTBCWJOE-AAEUAGOBSA-N 296.386 2.247 10 20 CECD OC[C@@H](Cc1ccccc1)NCc1cc(F)cc(F)c1O 883003632 YGQZFPSNCRINRD-CQSZACIVSA-N 293.313 2.364 10 20 CECD CCCN1C[C@@H](CNCc2cc(F)cc(F)c2O)CC1=O 883147159 MKZRWHGWUPRILG-SNVBAGLBSA-N 298.333 2.019 10 20 CECD Cc1cc(N(C)C)ccc1CNCc1ccnc(N(C)C)n1 782959739 MMAWZIBOFHVQCZ-UHFFFAOYSA-N 299.422 2.207 10 20 CECD OCC[C@@H]1CCC[C@H]1NCc1cc(F)cc(F)c1O 883093624 ASKCYXDRWSJOSD-TVQRCGJNSA-N 271.307 2.311 10 20 CECD Cc1cc(O)c(CN2C[C@H]3[C@@H](O)CC[C@H]3C2)cc1C 895784832 ODNKYBPIDMPYER-CFVMTHIKSA-N 261.365 2.212 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 896961855 GBGJRJNGMOWBBU-SNVBAGLBSA-N 283.755 2.431 10 20 CECD CN(C)c1cc(F)c(CNCc2cn(C)cn2)cc1F 898042389 OVJWNCBEELGAQD-UHFFFAOYSA-N 280.322 2.054 10 20 CECD Cc1nnc([C@@H](C)NCc2ccc(N(C)C)cc2)o1 785807106 YRGAKDYOXVJEIQ-SNVBAGLBSA-N 260.341 2.295 10 20 CECD COc1ccc(O)c(CNC(=O)C[C@@H]2CCC(=O)[C@@H]2C)c1 793688153 CWFRAQNNDNGWDK-MNOVXSKESA-N 291.347 2.022 10 20 CECD COc1ccc(C(=O)NCc2ccccc2O)c(O)c1 133797483 QDZLCWSZVRTOCE-UHFFFAOYSA-N 273.288 2.036 10 20 CECD CO[C@H](C)CNCc1ccc(Br)cc1O 691398919 CAGUYPGAFGLNDE-MRVPVSSYSA-N 274.158 2.279 10 20 CECD OC[C@H](Cc1ccccc1)NCc1ccccc1O 63218153 IQSMBJVFCKJXSZ-HNNXBMFYSA-N 257.333 2.085 10 20 CECD C[C@H]1CCCN(C(=O)NCCc2ccc(N)cc2)C1 91972364 QBGKWEQICNEAIZ-LBPRGKRZSA-N 261.369 2.253 10 20 CECD Cc1cc(C(=O)OCC(C)(C)O)c(C)n1-c1ccccn1 1345863481 ZHPUYYBYELVNGY-UHFFFAOYSA-N 288.347 2.417 10 20 CECD Nc1ccc(CNC(=O)NCC2CCSCC2)cc1 1357128320 YWOYZEQSFDGJTG-UHFFFAOYSA-N 279.409 2.211 10 20 CECD Cc1cc(O)c(CN[C@@H]2CC=C(C(=O)O)C2)cc1C 1600285962 JLFYBUQRQCZOSO-CYBMUJFWSA-N 261.321 2.272 10 20 CECD C[C@H](NCCc1ccccn1)c1cc(C(=O)O)ccc1O 1609781013 UBYQOTAILVRKGJ-NSHDSACASA-N 286.331 2.379 10 20 CECD C[C@@H](N[C@H](CO)C1CCCC1)c1cc(C(=O)O)ccc1O 1593207134 BARSPEJBTVBLIG-QMTHXVAHSA-N 293.363 2.292 10 20 CECD CC[C@H]1COCCN1Cc1cc(OC)c(C)cc1O 160233300 BFBLMAPIYXPJFX-ZDUSSCGKSA-N 265.353 2.320 10 20 CECD COc1ccc(N2CCC(N[C@@H](C)CCCO)CC2)cc1 168271967 YWIDMQKSZCQAMB-AWEZNQCLSA-N 292.423 2.415 10 20 CECD CN(C)c1ccc(CN[C@H]2CCN(C3CC3)C2)cc1 44683825 PDZQDSAWODTZPU-AWEZNQCLSA-N 259.397 2.079 10 20 CECD CO[C@H](CNCc1cc(F)cc(F)c1O)C1CC1 708496509 LRKFLNLCBMJQDY-GFCCVEGCSA-N 257.280 2.185 10 20 CECD COCC(C)(C)CNCc1cc(F)cc(F)c1O 708441635 JWTASSCCHDXVIV-UHFFFAOYSA-N 259.296 2.433 10 20 CECD CCc1cccc(CNC[C@@H]2CCN(CC)C2)c1O 691522264 KQIINOPJPQNQIO-ZDUSSCGKSA-N 262.397 2.386 10 20 CECD OC[C@@H](CC(F)F)NCc1cccc(Cl)c1O 717714414 YWSXIJQPMOSTBA-MRVPVSSYSA-N 265.687 2.151 10 20 CECD CCOC(=O)C(C)(C)C(=O)N[C@H](C)c1ccccc1O 827940872 JQDPBIWWFPVLJB-SNVBAGLBSA-N 279.336 2.159 10 20 CECD COC[C@H](C)CNC(=O)N[C@@H](C)c1cc(OC)ccc1O 170888417 YBNQPZZWSYORTR-MNOVXSKESA-N 296.367 2.044 10 20 CECD CC(C)N(CC(N)=O)Cc1ccc(N2CCCCC2)cc1 179656981 CRLUKLLLNOJPCJ-UHFFFAOYSA-N 289.423 2.373 10 20 CECD CCCCCN(CC(N)=O)Cc1cccc(OCC)c1O 180802790 CUKRKOSTUOTXDB-UHFFFAOYSA-N 294.395 2.268 10 20 CECD Cc1ccnc(N[C@H](C)Cc2ccc(O)c(O)c2)n1 184146585 WSKRVGCUFQYEEF-SNVBAGLBSA-N 259.309 2.239 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)CCc1ccoc1 186388280 KTLOTDVTLYIVRG-LLVKDONJSA-N 289.331 2.371 10 20 CECD COc1ccc(O)c(CN[C@]2(C)CCO[C@@H]2C)c1 230392179 RNMATMBKPUEZEK-QMTHXVAHSA-N 251.326 2.058 10 20 CECD COC(=O)CC(C)(C)NCc1cccc(C)c1O 181330205 IAOWAMDPJSRHBV-UHFFFAOYSA-N 251.326 2.132 10 20 CECD COc1cccc(CN2CCC[C@@H](OC)C2)c1O 91772676 UBEHEUCQDALLHD-GFCCVEGCSA-N 251.326 2.012 10 20 CECD CC(C)(C)S(=O)(=O)CCN[C@@H]1CCc2cccc(O)c21 296833111 MPFMPRSRYPGWAX-GFCCVEGCSA-N 297.420 2.182 10 20 CECD CO[C@H](C)CCNCc1cc(Cl)cc([N+](=O)[O-])c1O 263765617 BMZOWNGKBDQQAF-MRVPVSSYSA-N 288.731 2.468 10 20 CECD CO[C@H]1CCCC[C@@H]1NC(=O)NCc1ccccc1O 266566199 NNGIFAOBPCWOAR-JSGCOSHPSA-N 278.352 2.149 10 20 CECD CCOc1ccc(N(CC)CCN2C(=O)CCC2=O)cc1 269582422 FZVNTUPMHMGJFP-UHFFFAOYSA-N 290.363 2.061 10 20 CECD CN(C)c1ccc(CNC(=O)[C@]2(C)CCCOC2)cc1F 272601524 FEQDLZWUQKSGPK-MRXNPFEDSA-N 294.370 2.325 10 20 CECD Cc1cc(C)nc(N2CCN(Cc3ccccc3O)CC2)n1 272949592 NWORXNYJZZLILZ-UHFFFAOYSA-N 298.390 2.121 10 20 CECD C[C@H](CO)N(C)Cc1ccc(N2CCCCC2)cc1 289573139 ZVTHAXDZGSBRNM-CQSZACIVSA-N 262.397 2.490 10 20 CECD COC[C@@H](CN[C@H](C)c1c(C)cc(C)cc1O)OC 285115155 KVYFNQKFLXAZEB-CHWSQXEVSA-N 267.369 2.321 10 20 CECD COC(=O)c1cnc(SCCC(C)(C)O)s1 295385642 ULECSVSCOSELOF-UHFFFAOYSA-N 261.368 2.183 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2coc(C)n2)c1 801616755 WOVYNQDXPIWXIV-MRVPVSSYSA-N 276.292 2.188 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@H](C)CCCCO)c1 296337247 HQMVZVWORSXQMH-VXGBXAGGSA-N 295.379 2.381 10 20 CECD CSc1ccc(Cl)c(C(=O)OCC(=O)C(C)=O)c1 808487489 AVPJKEMEUQVYLS-UHFFFAOYSA-N 286.736 2.377 10 20 CECD C[C@@H]1C[C@H](O)CN1Cc1cc(Cl)c(F)cc1O 816589426 XZTQOGJHLMCUMH-APPZFPTMSA-N 259.708 2.140 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@H]2CNCCCO2)c(O)c1 817981906 OIUGOSWZPSSULL-KGLIPLIRSA-N 278.396 2.038 10 20 CECD CCOCC[C@@H](O)CNCc1ccc(N2CCCC2)cc1 818953776 MXEKSMQAGKNWBY-QGZVFWFLSA-N 292.423 2.164 10 20 CECD Oc1c(CN2CCn3cnnc3C2)ccc2ccccc12 816506315 YAWNHHSGPOTCQA-UHFFFAOYSA-N 280.331 2.153 10 20 CECD C[C@H](N[C@H](C)CN)c1ccc(Br)cc1O 817966423 NLPVHLNKXCOHLC-SFYZADRCSA-N 273.174 2.153 10 20 CECD CCn1ccnc1C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 813525471 SZKZCJBAPKEPEZ-LBPRGKRZSA-N 286.379 2.460 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CN(C)C[C@@H]3C2)cc1Cl 825720746 KEPASKMWKQWNRX-BETUJISGSA-N 280.799 2.347 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](N)C2CCC2)cc1 827340952 MWUCZEDBKJHHJV-INIZCTEOSA-N 289.423 2.276 10 20 CECD C[C@H](Oc1cccnc1)C(=O)N[C@H](C)c1ccccc1O 827937122 LNLDDAHSTHQIHD-NEPJUHHUSA-N 286.331 2.432 10 20 CECD Nc1ccc(NC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc1 832244396 PCIYZUGSXHIBCE-UHFFFAOYSA-N 298.346 2.085 10 20 CECD C[C@H](NCCCSc1nccs1)c1cn(C)nn1 902808922 OAMDWHZNSOYTHW-VIFPVBQESA-N 283.426 2.105 10 20 CECD O=C(c1cc(O)cs1)N1CC2(CCOCC2)[C@H]1C1CC1 832899298 SNNSZMPERHKGOL-CYBMUJFWSA-N 293.388 2.485 10 20 CECD COc1cccc([C@H](C)N[C@@H](C)CCN(C)C)c1O 846142349 RROJXYKURJRRJR-RYUDHWBXSA-N 266.385 2.392 10 20 CECD CS[C@H](CO)[C@@H](C)NCc1ccc(N(C)C)cc1C 840933935 KYYZRAHCGQJVCC-IUODEOHRSA-N 282.453 2.263 10 20 CECD CCN1CC[C@H](N(C)C(=O)Cc2ccc(N)cc2)C[C@H]1C 844184971 BAFKKNMDHLRLBX-CJNGLKHVSA-N 289.423 2.143 10 20 CECD Oc1ccc(Cl)cc1CNCC[C@@H]1CCNC1 841036378 MEEIKCKDJGPKEU-JTQLQIEISA-N 254.761 2.135 10 20 CECD Cc1cc(N(C)C)ccc1CNCCC(=O)NC(C)(C)C 840933685 HNKJQVQVQAFUOQ-UHFFFAOYSA-N 291.439 2.455 10 20 CECD NC1(CNCc2cccc(F)c2O)CCCCC1 841039140 CABNKVFRIMICEA-UHFFFAOYSA-N 252.333 2.283 10 20 CECD NCCCCCCNCc1ccc(N2CCOCC2)cc1 843127772 IEPCDHDKVJBNGI-UHFFFAOYSA-N 291.439 2.132 10 20 CECD C[C@@H]1C[C@H](NCCO[C@@H]2CCOC2)c2c(O)ccc(F)c21 927079044 CLGZFMREFYUABA-WZRBSPASSA-N 295.354 2.475 10 20 CECD C[C@H]1CN(Cc2c(O)ccc(Cl)c2F)CC[C@@H]1N 843050949 CGDRAHUVLRCKGR-KWQFWETISA-N 272.751 2.354 10 20 CECD COC1(CNCc2ccc3c(c2)CCCO3)CCOCC1 921920001 YYJCQXJDAOGHIU-UHFFFAOYSA-N 291.391 2.297 10 20 CECD CC[C@@H](NCCN(C)OC)c1ccc(F)cc1O 850477976 MEGCBNSYQRJTSQ-GFCCVEGCSA-N 256.321 2.065 10 20 CECD COc1cccc(O)c1CN1CC(C)(C)[C@@H]2COC[C@@H]21 825331304 CPBFUDTVCDDDSR-OLZOCXBDSA-N 277.364 2.258 10 20 CECD C[C@@H](CCO)CN[C@H](C)c1cc(F)cc(F)c1O 756617648 JRUHXBIIIRDWKG-DTWKUNHWSA-N 259.296 2.340 10 20 CECD C[C@@H](O)[C@H]1CCN(Cc2cc(F)c(N(C)C)cc2F)C1 862308449 ARXJEYNXINPZKO-MNOVXSKESA-N 284.350 2.234 10 20 CECD O=[N+]([O-])c1ccc(O)c(CN[C@@H]2C[C@H]2C(F)(F)F)c1 865753172 KVZNTCUADXCGOA-RKDXNWHRSA-N 276.214 2.341 10 20 CECD CC[C@](C)(O)C(=O)NCc1c(O)ccc2c1CCCC2 934944495 QIDNQWFBDAWFBG-INIZCTEOSA-N 277.364 2.048 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccn(C(C)C)n2)c1 862761005 ZRCVPPQMPWWMHV-UHFFFAOYSA-N 273.336 2.408 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@@H](S(C)(=O)=O)C2)c(O)c1 877049538 GRFFXTQBOZMGMA-ZIAGYGMSSA-N 297.420 2.146 10 20 CECD Cc1ccc(CN2CCOC[C@H]2[C@H]2CCCC2=O)c(O)c1 877465844 YXJQBXWBQUOSMN-CABCVRRESA-N 289.375 2.271 10 20 CECD CC(C)N1CCC(C(=O)N(C)c2ccc(N)cc2)CC1 877077643 PUEWDLHQLBLNEB-UHFFFAOYSA-N 275.396 2.352 10 20 CECD COc1ccc(CNCC2CC2)cc1Cn1cccn1 873011451 YJMLIAXTIVENEO-UHFFFAOYSA-N 271.364 2.440 10 20 CECD C=C/C=C\CCNC(=O)NCc1cccc(OC)c1O 883914565 VNGHJFGFVCCQOV-PLNGDYQASA-N 276.336 2.332 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C)[C@H]2CO)cc1 773887135 BJBAGRDBZWTGLL-XJKSGUPXSA-N 262.397 2.345 10 20 CECD CCOc1cccc(CN2CCN(C)[C@@H](C)[C@@H]2C)c1O 775986465 QUNIRCOOQNRXNB-STQMWFEESA-N 278.396 2.315 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(OC)c(C)cc2O)[C@@H]1C 787246492 QEEMHISXVLZIRA-YPMHNXCESA-N 293.363 2.093 10 20 CECD Cc1c(NC(=O)c2cccc(O)c2O)n[nH]c1C1CC1 790598897 QYSLXVUKJWYGHA-UHFFFAOYSA-N 273.292 2.259 10 20 CECD COc1ccc(CNC(=O)C(C)(Cl)Cl)c(O)c1 794381347 OULHEWRRDQTPEO-UHFFFAOYSA-N 278.135 2.211 10 20 CECD C[C@H]1CN(C(=O)c2ccc(CN=[N+]=[N-])o2)C[C@@H](C)O1 1537963002 OBKRJWPLGHLLLZ-DTORHVGOSA-N 264.285 2.339 10 20 CECD CC[C@@H](N[C@@H](C)c1ncnn1C)c1ccccc1O 276696453 VHQVQCAZWHKUFU-CMPLNLGQSA-N 260.341 2.323 10 20 CECD COC(=O)c1ccc(CN(C)Cc2ccccc2O)o1 111235934 QUXXJMDCLFAPHM-UHFFFAOYSA-N 275.304 2.404 10 20 CECD C[C@H](O)CCCNCc1c(O)cccc1Br 706883720 XHPXAUVHHLQZRK-VIFPVBQESA-N 288.185 2.405 10 20 CECD CN(C)c1cc(F)c(CNC2(CO)CCCC2)cc1F 1334890521 LBQIJRDKDKOGBU-UHFFFAOYSA-N 284.350 2.426 10 20 CECD CC[C@@H](F)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1336440279 YULKZOVQHQDXQO-IUODEOHRSA-N 294.370 2.449 10 20 CECD Nc1ccc(CNC(=O)N2CCC(c3ncc[nH]3)CC2)cc1 1338792791 JDDKOOZLSHIALL-UHFFFAOYSA-N 299.378 2.081 10 20 CECD CCCCN(C)c1nnc(-c2sccc2O)n1C 1262854786 WNMVBWQSBOVALF-UHFFFAOYSA-N 266.370 2.486 10 20 CECD CN(Cc1ccccc1O)C(=O)NC[C@H]1CCCCN1C 1263768592 ZTWYZOLQMQOMKN-CQSZACIVSA-N 291.395 2.018 10 20 CECD C[C@H](NC(=O)c1ccc2n1CCN[C@@H]2C)c1ccccc1O 1354535107 BVIDKKBTMYEQDH-NWDGAFQWSA-N 299.374 2.349 10 20 CECD Cc1cc(C(=O)O)nc(N[C@H](C)c2ccccc2O)n1 1600129053 APFPLTYMFHVAMY-SECBINFHSA-N 273.292 2.362 10 20 CECD CS[C@H](CO)[C@@H](C)NCc1ccc2c(c1)CCCO2 921764161 GNBZQMWWSUCUDL-IAQYHMDHSA-N 281.421 2.214 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccc(F)n2)cc1 127465270 WQHHBSSKBFFUIA-UHFFFAOYSA-N 273.311 2.217 10 20 CECD C[C@H](CCCCO)NCc1ccc(N(C)C)cc1 272211243 AHKRPNYHTLUJMN-CYBMUJFWSA-N 250.386 2.393 10 20 CECD C[C@H](N[C@@H](C)c1cc(F)ccc1O)C(=O)NC(C)(C)C 181234757 RATOBHMDTIGVPI-UWVGGRQHSA-N 282.359 2.485 10 20 CECD CC(C)(CO)CCNCc1cc(F)cc(F)c1O 708505673 ZGJPISUTRBKKRR-UHFFFAOYSA-N 259.296 2.169 10 20 CECD C[C@H](CC(=O)N(C)C)NCc1ccc(N2CCCC2)cc1 177975023 LTASMXYYHVYKBV-CQSZACIVSA-N 289.423 2.243 10 20 CECD COc1ccc(O)c(CNC(=O)OCC(F)(F)F)c1 172019526 HVGFBTCIIMZICI-UHFFFAOYSA-N 279.214 2.189 10 20 CECD CCO[C@H](CC)C(=O)NCc1ccc(N(C)C)cc1C 115280820 QKSNVQDVPBZPLJ-OAHLLOKOSA-N 278.396 2.492 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cccc2[nH]c(=O)oc12 124585216 NORIZPVHBXUKIV-UHFFFAOYSA-N 298.298 2.099 10 20 CECD COC(=O)N1CCC([C@H](C)NCc2ccccc2O)CC1 186354740 RHXWIZRSYHBEQV-LBPRGKRZSA-N 292.379 2.349 10 20 CECD CC1(C)C[C@@H](NC(=O)c2cccc(O)c2O)C(C)(C)O1 189560454 UFZCKWUBVIUIFO-LLVKDONJSA-N 279.336 2.174 10 20 CECD Cc1cc(NS(=O)(=O)C[C@H]2CCCO2)c(C)c(C)c1O 187061138 NMGZYOWCKDQSBV-GFCCVEGCSA-N 299.392 2.238 10 20 CECD CC(C)NC(=O)[C@H](C)NCc1ccc(N2CCCC2)cc1 228934429 QGENQBASUXHPQJ-AWEZNQCLSA-N 289.423 2.290 10 20 CECD CCN(CC)c1ccc(CNC(=O)C[C@@H]2CCNC2)cc1 190116836 NHDGRZPRURWWBG-HNNXBMFYSA-N 289.423 2.149 10 20 CECD C[C@@H]1[C@H](C(=O)NCCc2ccc(O)c(O)c2)[C@@H]1C1CC1 528856506 AXSFQUUGGHQLLD-LNHVQRHZSA-N 275.348 2.049 10 20 CECD Cc1cccc(CN[C@@]2(CO)COc3ccccc3C2)c1O 529643061 IELASHPAZPAFAU-SFHVURJKSA-N 299.370 2.156 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1ccc(CO)o1 269330545 BPHVYNSUOWRXGI-UHFFFAOYSA-N 274.364 2.470 10 20 CECD CC[C@H](NCCN(C)CCOC)c1ccc(C)cc1O 280251822 WREKQGVUEOOAST-HNNXBMFYSA-N 280.412 2.320 10 20 CECD CC(=O)C(=O)CSc1nnc(C)n1-c1ccccc1C 288978404 VBYOXTGRJIDZLA-UHFFFAOYSA-N 289.360 2.134 10 20 CECD COCCO[C@H]1CCCN(Cc2cccc(OC)c2O)C1 802653217 PSEQTCQDCBKSIC-AWEZNQCLSA-N 295.379 2.028 10 20 CECD CSC1(CNCc2cc(F)ccc2O)CCN(C)CC1 811513890 UXWUHHBQUMFBDK-UHFFFAOYSA-N 298.427 2.448 10 20 CECD C[C@@H](NC[C@@H]1CCCNC1)c1cc(F)ccc1O 817946001 PNWUHPNYMLVSKK-GHMZBOCLSA-N 252.333 2.182 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCN2C2CCCC2)c1 824904624 UBRJLDVDTNLGHY-OAHLLOKOSA-N 288.391 2.334 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCN(C(C)C)C2=O)cc1Cl 825291066 DCPGBHXIJPMWJL-CYBMUJFWSA-N 296.798 2.453 10 20 CECD COc1nccc(CN(C)c2ccc(OC)c(OC)c2)n1 824161238 LNQXVDQWMXTFKJ-UHFFFAOYSA-N 289.335 2.139 10 20 CECD CC[C@@H](C(=O)O)C(=O)N(CC)Cc1ccc(N(C)C)cc1 911118409 MMADODCZCPNWNA-CQSZACIVSA-N 292.379 2.212 10 20 CECD COc1cccc(O)c1CN1CCC([C@@H]2CCCN2)CC1 843046427 VRGIRGNYAQRHOZ-HNNXBMFYSA-N 290.407 2.365 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@H](c2ccncc2)C1 848101103 KRMPWNSBFLSDHH-LBPRGKRZSA-N 284.315 2.123 10 20 CECD CCN1C[C@@H](CNCc2ccc(N(C)C)cc2C)CC1=O 846096285 GANIVPAWKSHRTH-CQSZACIVSA-N 289.423 2.019 10 20 CECD CC[C@H](N[C@@H](CO)CCF)c1ccc(C)cc1O 846209382 QSKNJFYUWJSZHP-YPMHNXCESA-N 255.333 2.462 10 20 CECD CC(C)NC(=O)[C@@H](C)N[C@H](C)c1cc(F)cc(F)c1O 840892047 XKRAPBNOOYUUOR-RKDXNWHRSA-N 286.322 2.234 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1cc(C)c(C)cc1O 840959114 UEPMPWLJHPZCGU-AWEZNQCLSA-N 277.364 2.440 10 20 CECD N[C@@H]1CCC[C@@H](NCc2cccc(Cl)c2O)C1 841058059 OTOMSOCHUOZMON-GHMZBOCLSA-N 254.761 2.405 10 20 CECD COc1cccc([C@@H](C)N[C@H](CO)CC(C)C)c1O 846144679 MYEKIHWVRUWVQJ-NEPJUHHUSA-N 267.369 2.458 10 20 CECD Cc1cc(N(C)C)ccc1CNc1nc2ncccn2n1 840882112 MHAIITOWGZLUJQ-UHFFFAOYSA-N 282.351 2.111 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H]2CCCNC2=O)c(O)c1 840824925 AWJXHLAPYPEYKF-QWHCGFSZSA-N 276.380 2.186 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@@H](C)[C@@H](C)NC[C@H]2C)c1O 923446330 YGUGNBAIYUNQHQ-MXWKQRLJSA-N 294.370 2.305 10 20 CECD CN1C(=O)N(CCCSc2nccs2)C(=O)C1(C)C 761296758 HHRWLNPQZSJRPT-UHFFFAOYSA-N 299.421 2.298 10 20 CECD Cn1cnc2cc(/C=C3/SC(=S)NC3=O)ccc21 761199533 FZEHSNSMJAMJHP-BJMVGYQFSA-N 275.358 2.062 10 20 CECD CCOCc1cc(CN[C@@H](C)C(=O)OCC)ccc1OC 763285706 RGQVTYJKTDYDNT-LBPRGKRZSA-N 295.379 2.273 10 20 CECD Cc1ccc(CN2CCO[C@@H](C(F)(F)F)C2)c(O)c1 876756221 RANSMCSIDHOAMJ-GFCCVEGCSA-N 275.270 2.464 10 20 CECD CCO[C@@H]1CCCN(C(=O)/C=C\c2ccc(O)c(O)c2)C1 779481780 OJXKWWJWLFWLFW-FWPCIQOSSA-N 291.347 2.139 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@](O)(CC)C2)c1 779219365 OLLLJIFVHSSGGL-HNNXBMFYSA-N 265.353 2.138 10 20 CECD CCOC(=O)C1(CNCc2ccc(OCC)cc2O)CC1 770665317 IUWVWWBTHQYJTE-UHFFFAOYSA-N 293.363 2.224 10 20 CECD Cc1cc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)n(C)n1 773023462 YINFFRLAZSFBGS-GFCCVEGCSA-N 286.379 2.286 10 20 CECD C[C@H](O)C[C@@H](C)NCc1cc(Cl)cc(F)c1O 783603310 YEQAVMHVYKIVMC-SFYZADRCSA-N 261.724 2.434 10 20 CECD CN(C)c1ccc(CNC(=S)NC2(C)CC2)cc1F 789211698 FLQKTDNXOKZLKF-UHFFFAOYSA-N 281.400 2.408 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)COC(C)=O)c1 894502808 UJLPJWJAZIJHLN-VHSXEESVSA-N 267.325 2.003 10 20 CECD Cc1ccc(CN(C)C(=O)/C=C\c2ccc(O)c(O)c2)nc1 789865541 PXFQUJJKERBWFU-YVMONPNESA-N 298.342 2.473 10 20 CECD COc1ccc(CNC[C@@H]2CCOC[C@@H]2C)c(O)c1OC 894419502 GIIFFYMBTLCSCB-RYUDHWBXSA-N 295.379 2.172 10 20 CECD CCC1(O)CCN(Cc2cc(F)cc(F)c2O)CC1 894049268 DOZFVEJDNHLRLK-UHFFFAOYSA-N 271.307 2.407 10 20 CECD CCc1cc(NCc2ccc(OC)cc2O)ncn1 795284817 KTGXJMVKZXCYEL-UHFFFAOYSA-N 259.309 2.365 10 20 CECD CCC[C@](C)(CO)NCc1ccc(N(C)C)cc1 83469687 OGODVALZINWCGI-OAHLLOKOSA-N 250.386 2.393 10 20 CECD Nc1ccc(CCNC(=O)[C@H]2C[C@H]3CC[C@H]2C3)cc1 250246827 KZTYXCCNVWSDIQ-YDHLFZDLSA-N 258.365 2.364 10 20 CECD C[C@H]1C[C@H](C)N(c2nnc(-c3sccc3O)n2C)C1 1338086843 JHAKSDGIBPFCPY-IUCAKERBSA-N 278.381 2.484 10 20 CECD NC[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1261482649 UOZAPQMUZPBWTP-OAHLLOKOSA-N 259.397 2.067 10 20 CECD CC(C)(C)[C@@H](NCc1cc(F)cc(F)c1O)C(=O)O 1339241192 PPXICNRUGDXEAA-NSHDSACASA-N 273.279 2.259 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@@H](N)C(C)(C)C)c1 1340967220 MFBPWKYBARVZRK-IINYFYTJSA-N 294.395 2.342 10 20 CECD CC(C)[C@@H](C(=O)O)[C@@H](C)NCc1cc([N+](=O)[O-])ccc1O 1348958253 QXIKTRORMYAHHE-NOZJJQNGSA-N 296.323 2.135 10 20 CECD O=C(O)c1cnc(NCc2ccc3cccnc3c2O)nc1 1608978020 RORDVCLHGDUEEG-UHFFFAOYSA-N 296.286 2.041 10 20 CECD CCC[C@H](C(=O)O)N(C)Cc1cc(F)cc(C(C)=O)c1O 1776747908 JIXAZACLTLQAKK-CYBMUJFWSA-N 297.326 2.419 10 20 CECD CCC[C@@H](CCO)CNC(=O)Nc1ccc(N)cc1 841300890 VTYOBAMPIFSJQF-NSHDSACASA-N 265.357 2.189 10 20 CECD COc1ccc(CNC[C@@H]2CCCN(C)C2)cc1C 44532841 AXUOEEIGMCPPKP-HNNXBMFYSA-N 262.397 2.435 10 20 CECD COC[C@H](O)CCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 300419466 XBRIDKZAXZKGGY-YNEHKIRRSA-N 279.380 2.236 10 20 CECD COc1ccc(CNC[C@@](C)(OC)C2CC2)c(O)c1 311629229 YTJMXMSBZYBEJT-OAHLLOKOSA-N 265.353 2.306 10 20 CECD CCc1cccc(CN[C@@H](C)CN2CCCC2=O)c1O 691446975 OLCBIUHYUUZEGJ-LBPRGKRZSA-N 276.380 2.055 10 20 CECD Cc1nc([C@@H](C)NCc2cc(Cl)ccc2O)n[nH]1 392476192 SNECNECVGWHZMR-SSDOTTSWSA-N 266.732 2.323 10 20 CECD CCCN(CC)CCNC(=O)N(C)Cc1ccccc1O 175777800 LVNKKIFBGFKLLI-UHFFFAOYSA-N 293.411 2.266 10 20 CECD Cc1ccc(C(=O)Nc2cnc(C3CC3)nc2)c(O)c1O 179479515 WKIHCQIGHBYQMY-UHFFFAOYSA-N 285.303 2.326 10 20 CECD CC(=O)N(C)CCc1nc(-c2ccc(O)c(O)c2)cs1 124685972 LNNIRLIVVASRLV-UHFFFAOYSA-N 292.360 2.242 10 20 CECD CC(C)OCCNC(=O)N(C)Cc1ccc(N(C)C)cc1 184156025 FAHQUHIRQVRXDO-UHFFFAOYSA-N 293.411 2.319 10 20 CECD CCCn1cc(NC(=O)Cc2ccc(N)cc2)cn1 237040219 GVKLOBKVCGVATG-UHFFFAOYSA-N 258.325 2.057 10 20 CECD CCOC(=O)c1csc(Cc2ccc(N)cc2)n1 41581527 NVCKYZVPHJBRJD-UHFFFAOYSA-N 262.334 2.493 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1cc(Br)ccc1O 228562064 TYRGURJMKIJYCI-RKDXNWHRSA-N 288.185 2.404 10 20 CECD CC[C@@H]1COCCN1Cc1cccc(OC)c1O 132342741 SJRLKXPZAMBADJ-GFCCVEGCSA-N 251.326 2.012 10 20 CECD CCOCc1cc(CNC[C@H](O)C2CC2)ccc1OC 265220016 GNNATAUNOOKDDJ-HNNXBMFYSA-N 279.380 2.092 10 20 CECD CC[C@@H]1CN(Cc2cccc(Cl)c2O)C[C@@H]1O 271993501 SEWYZFPIQKAXKG-SKDRFNHKSA-N 255.745 2.248 10 20 CECD CN(C)c1ccc(CNCC2([S@](C)=O)CCC2)cc1F 280521590 BBKWCVUCOXBBHC-FQEVSTJZSA-N 298.427 2.283 10 20 CECD CCN(CC(=O)Nc1cc(C)no1)c1ccc(OC)cc1 299406765 XVTOXIRRHOIWFD-UHFFFAOYSA-N 289.335 2.457 10 20 CECD CC(C)[C@H](CO)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 806169248 JPVRVGNYWHNNRB-QWRGUYRKSA-N 282.340 2.216 10 20 CECD C[C@@H]1C[C@@H](NCCN(C)C)c2c(O)ccc(F)c21 806171462 JMXXIMDYWSHNHI-MWLCHTKSSA-N 252.333 2.231 10 20 CECD CO[C@@H]1CCN(C(=O)c2ccc(C)c(O)c2O)CC1(C)C 296956017 JUUGAKFMHSVRJZ-GFCCVEGCSA-N 293.363 2.293 10 20 CECD COc1ccc(N2CC[C@H](CNC(=O)[C@H]3C[C@H]3C)C2)cc1 819578442 LRJUYDBYUZNHOX-IOASZLSFSA-N 288.391 2.294 10 20 CECD Cc1ccc2c(c1)/C(=C/c1cnn(C)c1)C(=O)N2C 811701544 ZKFNTEBARSXTPL-QPEQYQDCSA-N 253.305 2.246 10 20 CECD CNCCCN[C@H](C)c1cc(Br)ccc1O 817942237 ZNIKTJJQLMUKNZ-SECBINFHSA-N 287.201 2.415 10 20 CECD Cc1cc(CNC2(CO)CCCC2)ccc1N(C)C 815075107 OFHLDXCSJPLQON-UHFFFAOYSA-N 262.397 2.456 10 20 CECD C[C@@H](NCC1=CCNCC1)c1ccc(F)cc1O 817968117 PFGMEUWOGOBKFQ-SNVBAGLBSA-N 250.317 2.102 10 20 CECD CO[C@]1(CNCc2cc(Cl)c(C)cc2O)CCOC1 825519911 PMZVIAAXCYPVLN-AWEZNQCLSA-N 285.771 2.249 10 20 CECD Cc1cc(C)n(CC(=O)N[C@H](C)c2ccccc2O)n1 827923514 STXQUCSCBQKCQZ-GFCCVEGCSA-N 273.336 2.083 10 20 CECD C[C@H](Oc1ccccn1)C(=O)N(C)Cc1ccccc1O 825481700 RGWWJVJYDMVRBP-LBPRGKRZSA-N 286.331 2.213 10 20 CECD CN(C)c1ccc(CNC[C@@H](O)C2CCC2)cc1F 825241218 XNCTVGRTCXIBJO-OAHLLOKOSA-N 266.360 2.142 10 20 CECD C[C@@H](Nc1ccc2nncn2n1)c1ccc(N(C)C)cc1 827938807 SYNKMPRHGGQGCY-LLVKDONJSA-N 282.351 2.363 10 20 CECD C[C@H]1CCC[C@@H](OCC(=O)NCc2ccc(N)cc2)C1 837303370 JSWZRAWFIWJNEY-SWLSCSKDSA-N 276.380 2.480 10 20 CECD COc1cccc(CN(CC(=O)O)CC(C)(C)C)c1O 692070188 HETWWRNQIGYAAJ-UHFFFAOYSA-N 281.352 2.334 10 20 CECD CN(C)c1ccc([C@@H]2NC3(CCCC3)C(=O)N2C)cc1F 742439840 OLVQFCRAROWXKW-CQSZACIVSA-N 291.370 2.265 10 20 CECD COc1cccc([C@@H](C)NCCN2CCCC2)c1O 846138987 ZHBOEHZPRZZZEG-GFCCVEGCSA-N 264.369 2.147 10 20 CECD O=C(NCc1ccc(N2CCCCC2)cc1)[C@@H]1CCOC1 742830085 DZVOCUQNUBCTMD-OAHLLOKOSA-N 288.391 2.330 10 20 CECD CSCCCNC(=S)NCc1ccccc1O 748158351 QGBSFLCDYGFXSC-UHFFFAOYSA-N 270.423 2.109 10 20 CECD CC(C)[C@@]1(C)C[C@@H]1C(=O)NCc1ccc(O)cc1O 910948294 XGNSVPWNEBARTQ-IUODEOHRSA-N 263.337 2.396 10 20 CECD Cc1cc(N(C)C)ccc1CN(C[C@H](C)O)C1CC1 848929081 SKSSLNKIMRTJEZ-ZDUSSCGKSA-N 262.397 2.406 10 20 CECD CCOCCNC(=S)NCc1cc(Cl)ccc1O 844583866 IGKKNUFNHQOYIQ-UHFFFAOYSA-N 288.800 2.046 10 20 CECD CCOc1ccc(CNCc2cccnc2O)c(O)c1 858304415 RKAVLAOFHRFNCU-UHFFFAOYSA-N 274.320 2.181 10 20 CECD Cc1ccc([C@H](C)N[C@H](C)CCS(C)(=O)=O)c(O)c1C 756658532 KSZOVJYQDYQOSJ-YPMHNXCESA-N 299.436 2.483 10 20 CECD Cc1cccc([C@H](O)CNC(=O)c2cc(O)cs2)c1 768310670 LPCUKHAEYLZFQZ-GFCCVEGCSA-N 277.345 2.226 10 20 CECD CCCOc1ccc(CNC[C@](C)(O)CN(C)C)cc1C 873094418 IFORINOWPCEWQK-KRWDZBQOSA-N 294.439 2.186 10 20 CECD C[C@@H](Cc1cnccn1)NCc1cc(F)ccc1O 779059401 FIBAABUUQZFHSA-JTQLQIEISA-N 261.300 2.042 10 20 CECD CCC(CC)(C(=O)O)C(=O)N[C@H](C)c1ccccc1O 871596542 OUGSIJRDSKOLSA-SNVBAGLBSA-N 279.336 2.460 10 20 CECD CN(C(=O)CC1C[C@@H]2CC[C@H](C1)N2)c1ccc(N)cc1 877079111 QWCZLGBESGHRQW-QXMXGUDHSA-N 273.380 2.152 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H]3C=C[C@H]2C3)c1O 880449732 KCJHYYNKDLOEQF-GWCFXTLKSA-N 261.296 2.494 10 20 CECD CCOc1ccc(CN2C[C@H](C)S(=O)[C@@H](C)C2)c(O)c1 792193554 XZPGBHIKDGFCLQ-RYUDHWBXSA-N 297.420 2.132 10 20 CECD COc1ccc(CNC[C@@H]2C[C@@H](C)O[C@H]2C)c(O)c1OC 894909441 COLFSYFEVYAPOW-MDZLAQPJSA-N 295.379 2.313 10 20 CECD CCC[C@@H](NCc1ccc(N(C)C)cc1C)C(=O)OC 897833891 CBHNKMQCXZVJPL-OAHLLOKOSA-N 278.396 2.492 10 20 CECD COc1ccc(CNC(=O)/C=C\c2cccnc2)c(O)c1 794369205 FFPWEZTVMSYXNS-DAXSKMNVSA-N 284.315 2.125 10 20 CECD COC(=O)C(C)(C)NCc1c(O)ccc(Cl)c1F 792174088 IOWJYWBMBDNVLY-UHFFFAOYSA-N 275.707 2.226 10 20 CECD COC(=O)N1CCC(CNCc2cc(C)ccc2O)CC1 796499951 IZOLMIYTNRFKIN-UHFFFAOYSA-N 292.379 2.269 10 20 CECD CC[C@H](F)C(=O)NCCCNCc1ccc(OC)c(C)c1 1164026306 BXKYBZIRNJSQGC-AWEZNQCLSA-N 296.386 2.348 10 20 CECD CCc1noc(C)c1C(=O)NCc1ccc(N)cc1 701417695 WCQUNKIILMNCSV-UHFFFAOYSA-N 259.309 2.058 10 20 CECD COCCO[C@H]1CCN(Cc2c(O)cccc2Cl)C1 276085363 XJZVMUMVPOMCMQ-NSHDSACASA-N 285.771 2.283 10 20 CECD Cc1ccc([C@H](C)NCC2CCS(=O)(=O)CC2)c(O)c1 186185455 JCJYWDJYYXNYGW-LBPRGKRZSA-N 297.420 2.176 10 20 CECD OC[C@H](CCF)NCc1ccc(N2CCCC2)cc1 1327310849 JTUGHYKQBDOQSC-AWEZNQCLSA-N 266.360 2.097 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@H](C(=O)O)CC2)cc1 710012138 XJBUXRPZSFBYLH-HDJSIYSDSA-N 276.380 2.486 10 20 CECD CCOc1cccc(CN[C@@H](C)c2noc(C)n2)c1O 1323766681 CSHONMVYSQBDFS-VIFPVBQESA-N 277.324 2.333 10 20 CECD COc1cc(O)c(CN2CC[C@@H](CF)C2)cc1OC 1331047041 RJLFXVNLRBQHFZ-JTQLQIEISA-N 269.316 2.201 10 20 CECD COc1cccc(O)c1CNCc1ccc(F)cn1 763518299 JEMJSDZXXQIKCZ-UHFFFAOYSA-N 262.284 2.225 10 20 CECD C[C@H](CN[C@H](C)c1cccc(-c2nn[nH]n2)c1O)C1CC1 1589958807 LSTUQJAUMCBHEC-NXEZZACHSA-N 287.367 2.269 10 20 CECD COc1cc(O)c(CN(C)CC(F)F)cc1OC 160134992 IOZDPPKHLYOVFY-UHFFFAOYSA-N 261.268 2.106 10 20 CECD O=C(Cc1cccc(F)c1)NCc1ccc(O)c(O)c1 159039724 ISVZYXUGTUSROK-UHFFFAOYSA-N 275.279 2.096 10 20 CECD COc1ccc(CNCCCCC(=O)O)cc1C 258961303 VXOQVLYLJFMEBW-UHFFFAOYSA-N 251.326 2.348 10 20 CECD COc1ccc(O)c([C@H](C)NCc2nncs2)c1 930215343 SVSPBYDETGBHPG-QMMMGPOBSA-N 265.338 2.103 10 20 CECD CCCCOC(=O)CN1CCCc2cc(CN)ccc21 700969976 RRPRXHLQHJJXIK-UHFFFAOYSA-N 276.380 2.241 10 20 CECD CC1CCN(CCNCc2cc(F)cc(F)c2O)CC1 708559311 PBUQTJWPZNCDAD-UHFFFAOYSA-N 284.350 2.492 10 20 CECD Oc1ccc(Cl)cc1CN1CC[C@@H]2NCC[C@@H]2C1 381332409 BTZNKBSPVGNBTI-MFKMUULPSA-N 266.772 2.229 10 20 CECD C[C@@H]1CC[C@@H](C(=O)O)CN1Cc1cc(F)ccc1O 397483159 GSRHOCGIEZKQPM-NXEZZACHSA-N 267.300 2.216 10 20 CECD CC(C)(C)[C@H](NCc1ccc2c(c1)CCO2)C(=O)O 756340615 UIGLSSWVOQQIBC-CYBMUJFWSA-N 263.337 2.210 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H](C)C[C@H](C)O)c1 252748320 DJMQMGAHQSUZJY-DCAQKATOSA-N 253.342 2.211 10 20 CECD COc1ccc(N2CCN(CC[C@@H]3CCCO3)CC2)cc1 188601225 TZDKLRMNVCKYBQ-KRWDZBQOSA-N 290.407 2.386 10 20 CECD CCCN(CCO)Cc1cc(Br)ccc1O 128025828 MVYJSEZYWGCOMZ-UHFFFAOYSA-N 288.185 2.359 10 20 CECD CCCC[C@H](COC)NC(=O)/C=C/c1ccc(O)c(O)c1 181102074 HCZQZVULTFINTF-BUUCAEBMSA-N 293.363 2.432 10 20 CECD COc1ccc(O)c(CN(C)[C@@H]2CCN(C)C[C@H]2C)c1 290626964 XOWGWACDBOMLPG-IUODEOHRSA-N 278.396 2.173 10 20 CECD Cc1ccc(O)c(CNc2nc3ccccn3n2)c1 195013176 PCLNRFLHAFKBKO-UHFFFAOYSA-N 254.293 2.355 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(F)ccc2O)CCN1C 226612769 WRGSLHMGTXPBLZ-MFKMUULPSA-N 252.333 2.104 10 20 CECD CN(Cc1ccccc1O)C(=O)C1CCN(C2CC2)CC1 194749231 YEVCBDVHJULYAI-UHFFFAOYSA-N 288.391 2.225 10 20 CECD Cc1ccc(O)c(CN2CCS[C@@H]3COCC[C@@H]32)c1 91856602 OSMDVLATOFAECT-DZGCQCFKSA-N 279.405 2.407 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccccc2O)[C@]12CCCO2 272650470 FKXSDGITPSEBCV-BZUAXINKSA-N 277.364 2.208 10 20 CECD C[C@H](N[C@H](CO)c1cnn(C)c1)c1cc(Cl)ccc1O 273536957 XOEKHWIGISUDCH-TVQRCGJNSA-N 295.770 2.163 10 20 CECD CCc1nc(CN(CC)c2ccc(OC)c(OC)c2)n[nH]1 274587107 IYXQZJFCFPPSGW-UHFFFAOYSA-N 290.367 2.411 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCc3c[nH]nc3C2)c1 376200508 XFGMDTSOQWXVAO-ZDUSSCGKSA-N 287.363 2.161 10 20 CECD COc1cccc(CNC[C@@H]2CCOC[C@@H]2C)c1O 285655832 YRKHMGYFWPYWDV-RYUDHWBXSA-N 265.353 2.163 10 20 CECD Cc1cnn(C)c1CNCc1ccc(N(C)C)c(F)c1 285447230 LWTFBHJROGFQFU-UHFFFAOYSA-N 276.359 2.223 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H](C)SC 808094289 IYINOMTZJKTQHO-SECBINFHSA-N 274.382 2.246 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)CC(=O)NCC 801548482 HRPZVNODGSUHNJ-UHFFFAOYSA-N 292.379 2.047 10 20 CECD C[C@@H](CCCO)CNCc1ccc(N(C)C)c(F)c1 294738088 GXGMVTSSLMUCDW-LBPRGKRZSA-N 268.376 2.390 10 20 CECD C[C@H](CN)N[C@H](C)c1cc(Br)ccc1O 817966232 JJEIALHNBHFEFZ-HTQZYQBOSA-N 273.174 2.153 10 20 CECD CCNCCN[C@@H](C)c1ccc(Br)cc1O 817951976 MBZVARDEHAAEEN-VIFPVBQESA-N 287.201 2.415 10 20 CECD CCOc1ccc(O)c(CNCc2nn(CC)nc2C)c1 818221605 QLRPHDIMUWDREU-UHFFFAOYSA-N 290.367 2.001 10 20 CECD COC[C@@H](NC[C@@H](N)c1ccc(N(C)C)cc1)C(C)C 817939519 CAGXBVGVFQIDDP-HZPDHXFCSA-N 279.428 2.013 10 20 CECD C[C@@H](NC(=O)CCCn1cccn1)c1ccccc1O 827930754 PWTNTOLPHZLNHH-GFCCVEGCSA-N 273.336 2.246 10 20 CECD CCOCCO[C@H](C)C(=O)N[C@H](C)c1ccccc1O 827931077 XOAQVRBQLDZOFQ-VXGBXAGGSA-N 281.352 2.011 10 20 CECD Cc1cc(O)c(CNC[C@@H](C)CCO)cc1Cl 825320349 JDZAXYUUVQIMBX-VIFPVBQESA-N 257.761 2.462 10 20 CECD NC1(CC(=O)NCc2ccc(N3CCCC3)cc2)CCC1 827004431 HYCAIPXVDKXSEU-UHFFFAOYSA-N 287.407 2.175 10 20 CECD CN(C)c1ccc(CNC(=O)C2(C(=O)C3CC3)CC2)cc1 822227037 RVVZWCWAOBZFLI-UHFFFAOYSA-N 286.375 2.128 10 20 CECD CCN(CC)c1ccc(CNC(=O)CCCCN)cc1F 829039251 XBKGSKCRCDHBFD-UHFFFAOYSA-N 295.402 2.417 10 20 CECD C[C@@H]1C[C@H](NCC2(N)CC2)c2c(O)ccc(F)c21 902406121 LTSKDBWQBAQYGC-SCZZXKLOSA-N 250.317 2.161 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@@H](OCC3CC3)C2)cc1 831966156 NRZDMTWFIDCEMR-MRXNPFEDSA-N 288.391 2.229 10 20 CECD O=C(NCc1ccccc1[N+](=O)[O-])c1cc(O)cs1 732273068 UXMOWRMTLPFYST-UHFFFAOYSA-N 278.289 2.292 10 20 CECD COC1CCC(NC(=O)NCCc2ccc(N)cc2)CC1 841916296 SXWKWDSKWLSTCO-UHFFFAOYSA-N 291.395 2.068 10 20 CECD C[C@@H](N[C@H](CO)CCF)c1cc(Cl)ccc1O 846209841 VUJDFTVEQAMKDZ-SCZZXKLOSA-N 261.724 2.417 10 20 CECD CNC(=O)[C@]1(C)CCN(Cc2ccc(N(C)C)cc2C)C1 840942022 ZVLBPFOGALIIDS-QGZVFWFLSA-N 289.423 2.019 10 20 CECD COc1cccc([C@H](C)N[C@@H]2CO[C@H](C)C2)c1O 846170714 CKWOSEPATFWGNJ-VWYCJHECSA-N 251.326 2.229 10 20 CECD COc1cccc([C@@H](C)NCCC(C)(C)O)c1O 846162221 CBLVULGHJFWIFB-SNVBAGLBSA-N 253.342 2.212 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccnc(F)c2)cc1F 748728883 UZOVUTIQULGPJZ-UHFFFAOYSA-N 291.301 2.356 10 20 CECD CC(C)O[C@H]1CCCN(C(=O)c2cc(O)cs2)C1 846661018 ZYEULCKMQBPWNC-NSHDSACASA-N 269.366 2.483 10 20 CECD CCN1C[C@@H](CN[C@H](C)c2cc(C)ccc2O)CC1=O 846210271 WVSPHYLSLOHCCI-CHWSQXEVSA-N 276.380 2.220 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2ncc(C)s2)c1 858252601 MCXNDZBRQMAMBE-UHFFFAOYSA-N 291.376 2.465 10 20 CECD CN(C(=O)c1cc(O)cs1)[C@@H](CO)Cc1ccccc1 855136854 VCJPWEDYLOVYSP-GFCCVEGCSA-N 291.372 2.129 10 20 CECD Cc1ccncc1CC(=O)NCc1ccc(N(C)C)cc1 854271906 UWXBKUZGBBJBRS-UHFFFAOYSA-N 283.375 2.315 10 20 CECD CN(C)c1cc(F)c(CNCC2(O)CCCC2)cc1F 858133266 MONDLNXRZIAQSR-UHFFFAOYSA-N 284.350 2.426 10 20 CECD CCOc1ccc(O)c(CN2CCc3n[nH]cc3C2)c1 857877814 PHXWNUQVMRZONY-UHFFFAOYSA-N 273.336 2.072 10 20 CECD C[C@@H](NCCOC[C@@H]1CCOC1)c1ccc(F)cc1O 756563008 KXAGTDVJUXSZQR-VXGBXAGGSA-N 283.343 2.235 10 20 CECD COc1cccc([C@H](C)NC[C@@H](CO)CC2CC2)c1O 850546408 LRXZEBHZRGDWHP-AAEUAGOBSA-N 279.380 2.460 10 20 CECD C/C=C/C[C@@H](CO)NCc1ccc2c(c1)CCCO2 922007748 FYDLFPZBLBDROL-FAAWYNLUSA-N 261.365 2.428 10 20 CECD CON(C)CCN[C@H](C)c1ccc(Cl)cc1O 850478730 XAXUBIWWQOWOLO-SECBINFHSA-N 258.749 2.189 10 20 CECD COC[C@H](O)CCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756780237 XSJQCOYRFFDSGM-UMNHJUIQSA-N 283.343 2.067 10 20 CECD Oc1cc2c(cc1CN1CCC(C(F)F)CC1)[C@H](O)CO2 768463368 SCRAZICBDFAELP-CYBMUJFWSA-N 299.317 2.295 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1C[C@H](O)C1(C)C 779347195 LENVIYYQQCXAHY-GJZGRUSLSA-N 262.397 2.310 10 20 CECD Cc1cccc(O)c1CN1CCC(OCCN(C)C)CC1 876722156 XHJSNMHRUUUGOR-UHFFFAOYSA-N 292.423 2.243 10 20 CECD Cc1ccc(CN2CCN(Cc3ccncc3)CC2)c(O)c1 877169110 GYYPGYSXCBBNDA-UHFFFAOYSA-N 297.402 2.413 10 20 CECD Oc1cc2c(nn1)CCN(Cc1cc(Cl)ccc1O)C2 775997687 XSJIWLRVXZZMTR-UHFFFAOYSA-N 291.738 2.100 10 20 CECD CN(Cc1cc(Cl)cc(F)c1O)CC(C)(C)O 775699455 DGWISOWNRPTIIT-UHFFFAOYSA-N 261.724 2.387 10 20 CECD Cc1coc(C(=O)NC[C@@H](N)c2ccc(N(C)C)cc2)c1 884011168 VQPUCIVEDQUYAY-CQSZACIVSA-N 287.363 2.084 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2cc(F)cc(F)c2O)C1 895013500 BDMBRNDVSRVYTO-HNNXBMFYSA-N 299.317 2.446 10 20 CECD C[C@H](O)[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 780891919 CNROCUNZDTVTPT-ZFWWWQNUSA-N 262.397 2.345 10 20 CECD COC(=O)C[C@@H]1CCCN1Cc1cc(F)cc(F)c1O 894050395 ONHAPHIALZTXSH-NSHDSACASA-N 285.290 2.198 10 20 CECD COc1ccc(CN2CC[C@@H](OC)[C@@H](C)C2)c(O)c1OC 894716739 BDUWRMMCUWBIIL-WCQYABFASA-N 295.379 2.266 10 20 CECD COCc1nccc(Sc2ncc(C(=O)OC)s2)n1 894022320 PVAQXAFPGOJNOA-UHFFFAOYSA-N 297.361 2.017 10 20 CECD CCCN(Cc1ccccc1O)[C@@H](C)C(=O)OC 76074132 VWOTUGMBMLPKQS-NSHDSACASA-N 251.326 2.166 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@H](F)C(F)(F)F 278377456 MVMAIJUWSSKTSC-VIFPVBQESA-N 265.206 2.251 10 20 CECD C[C@@H]1O[C@H](C)[C@H](C(=O)NCc2ccc(N(C)C)cc2)[C@H]1C 1334909493 UISAHHWIORBBTO-BCUIYNNISA-N 290.407 2.428 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)c1cnccn1 70477685 SCVIYRPDSLBOIZ-LBPRGKRZSA-N 256.353 2.393 10 20 CECD C[C@@H]1CCN(C(=O)NCc2ccc(N)cc2)CCS1 1338793676 RLLLFGALAUPQEQ-LLVKDONJSA-N 279.409 2.306 10 20 CECD Cc1nnc(O)c(CN[C@@H](C)c2ccccc2O)c1C 1254493207 SSUUIDAYRDINQN-NSHDSACASA-N 273.336 2.355 10 20 CECD COc1cccc(O)c1CN1CCC[C@H](OC)C1 768755170 VXQBCIQCPUVDPV-NSHDSACASA-N 251.326 2.012 10 20 CECD C[C@@H]1CC[C@H](C(=O)NCCc2ccc(O)c(O)c2)C1 776491804 ZJYPKPACWFZKSH-PWSUYJOCSA-N 263.337 2.193 10 20 CECD CC1(C)CCC[C@](O)(C(=O)NCc2cccc(O)c2O)C1 1347542111 ITNJPRYPEVKLJT-MRXNPFEDSA-N 293.363 2.045 10 20 CECD CCCCCOC1CN(C(=O)NCc2ccc(N)cc2)C1 1353539525 LZWPUIUSMXXSNM-UHFFFAOYSA-N 291.395 2.369 10 20 CECD C[C@H]1CCCN(Cc2ccc(F)c(F)c2O)[C@@H]1C(=O)O 1589333888 FBYMVLWUQUCQTH-UFBFGSQYSA-N 285.290 2.356 10 20 CECD CNCCNC(=O)c1cc(C)n(-c2cccc(C)c2)c1C 151277563 VAQMSEFPDOPCLO-UHFFFAOYSA-N 285.391 2.352 10 20 CECD CC(C)C(=O)NC1CCN(Cc2ccc(N)cc2)CC1 586044797 MRTMRSSZDGEJSF-UHFFFAOYSA-N 275.396 2.005 10 20 CECD CN(CC1=CCSC1)C(=O)Nc1ccc(N)cc1 850750705 NLRVJSBABLWLJG-UHFFFAOYSA-N 263.366 2.406 10 20 CECD CCCn1nccc1CNCc1ccc(OC)cc1O 825753670 TYUUCDKDJQCJJA-UHFFFAOYSA-N 275.352 2.297 10 20 CECD NCCCOC1CCN(Cc2c(O)cccc2Cl)CC1 128350283 BKNZVCHTYLOEAQ-UHFFFAOYSA-N 298.814 2.375 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)Cn2cccn2)c1 37155343 PYSBDYJKCMVGAY-NWDGAFQWSA-N 275.352 2.337 10 20 CECD Cc1ccc([C@H](C)NCC2([S@](C)=O)CC2)c(O)c1 282187416 GAUHKKWQJCDNPA-VOJFVSQTSA-N 267.394 2.262 10 20 CECD COc1cccc(CNC[C@]2(O)CCC[C@H]2C)c1O 293051289 ROFZXTVBLPTHPK-IAQYHMDHSA-N 265.353 2.042 10 20 CECD CCn1cc(CN[C@H](C)c2cc(C)ccc2O)nn1 404462384 SBSWXSKXXNDEDF-LLVKDONJSA-N 260.341 2.163 10 20 CECD CN1[C@H]2CC[C@H]1CC(NCc1cc(F)cc(F)c1O)C2 708387156 AGVFSCNKONTDMH-STQMWFEESA-N 282.334 2.385 10 20 CECD C[C@H](CCO)CCNCc1ccc(N(C)C)cc1 397612624 CVYFQOSXTIBIPJ-ZDUSSCGKSA-N 250.386 2.251 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC[C@@H]2CCOC2)c1 176138197 VAVBKRFMFGTWCP-VXGBXAGGSA-N 293.363 2.395 10 20 CECD CCOCCCCNC(=O)NCc1cc(OC)ccc1O 114589806 LVQNCCJCEVZXQV-UHFFFAOYSA-N 296.367 2.017 10 20 CECD C[C@H](NC[C@@](C)(O)C1CC1)c1cc(F)ccc1O 310981736 RDOYJVOZTCVHEH-LKFCYVNXSA-N 253.317 2.343 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N1CC[C@H](O)C1 304897969 SSHFXWGJBWCVPJ-LBPRGKRZSA-N 290.388 2.362 10 20 CECD COc1cccc(CNC(=O)Nc2ncccc2C)c1O 170791884 GKQMBRFAZMDQCG-UHFFFAOYSA-N 287.319 2.426 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)C1=CCCCC1 188544580 RKOJWFZZCQBQLI-UHFFFAOYSA-N 261.321 2.257 10 20 CECD CC(C)N1CC[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1=O 89729015 ROMNGQXXKAVRHQ-BBRMVZONSA-N 289.423 2.413 10 20 CECD C[C@H]1CO[C@H](C)CN1C(=O)NCc1ccc(N(C)C)cc1 193104424 AMWKXVAJTABMIR-QWHCGFSZSA-N 291.395 2.071 10 20 CECD CCN(Cc1ccc([N+](=O)[O-])c(OC)c1O)CC(F)F 278475889 ILQLHSMZGMXPCJ-UHFFFAOYSA-N 290.266 2.396 10 20 CECD CCOc1ccc(O)c(CNCCC[C@@H](C)O)c1 278626072 KDQJFSPXLZBXCP-LLVKDONJSA-N 253.342 2.042 10 20 CECD Cc1cc(O)c(CN2CCOC[C@H]2[C@@H]2CCCO2)cc1C 377702059 UAMHVTWTYRPWEO-RDJZCZTQSA-N 291.391 2.389 10 20 CECD Cc1cc(C(=O)N2CCCOCC2)c(C)n1-c1ccccn1 374026762 JGMMHLAKXOIFPY-UHFFFAOYSA-N 299.374 2.352 10 20 CECD C[C@H]1COCCN(Cc2ccc(N(C)C)c(F)c2)C1 370188056 ZXVBPRURZFFRKF-GFCCVEGCSA-N 266.360 2.360 10 20 CECD CO[C@@H](C(=O)NCc1c(O)ccc2c1CCCC2)C1CC1 281606951 OWOKQPBHDFGRPY-MRXNPFEDSA-N 289.375 2.312 10 20 CECD COC(=O)[C@@H](CC(C)(C)C)OC(=O)c1cccc(O)c1O 801858992 RFULOXVINVFJFZ-LLVKDONJSA-N 296.319 2.232 10 20 CECD COc1ccc(O)c(CN[C@@H](C)c2ccnc(O)c2)c1 816639076 HDSZODYFDSIFDW-JTQLQIEISA-N 274.320 2.352 10 20 CECD CSC[C@@H](O)CNCc1ccc(N2CCCC2)cc1 818954536 UUEDVUUPMJMOAK-HNNXBMFYSA-N 280.437 2.100 10 20 CECD CCOc1ccc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(O)c1 824836851 CMAFQRZZHNVPPQ-XJNFMUPTSA-N 287.359 2.176 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCN2C)c1cn(C)nn1 902779236 PCKSRHORZOQXBU-GFCCVEGCSA-N 285.395 2.048 10 20 CECD Cc1cc(O)c(CNC[C@]2(O)CCSC2)cc1Cl 825331132 IWNZIJKBVQNVPZ-CYBMUJFWSA-N 287.812 2.312 10 20 CECD CC[C@@H](NC(COC)COC)c1ccc(N(C)C)cc1 834893808 XTVQVMKYBSTOCA-MRXNPFEDSA-N 280.412 2.455 10 20 CECD CCO/C=C/C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 841187036 PLHJYQFCWGUCTA-IIANPFDCSA-N 262.353 2.480 10 20 CECD C[C@]1(c2nc(Cc3ccc(N)cc3)no2)CCCOC1 843158675 GLEVWZPHDVDKSX-HNNXBMFYSA-N 273.336 2.311 10 20 CECD CN(C)C(=N)NCc1cc(Cl)cc(Cl)c1O 849028253 FUOUCSCEYCTGSW-UHFFFAOYSA-N 262.140 2.285 10 20 CECD COC(=O)C[C@@H](C)CC(=O)NCc1cc(Cl)ccc1O 846660540 HCZCIUIIODEHAP-VIFPVBQESA-N 299.754 2.251 10 20 CECD CC[C@@H](N[C@@H](CO)CCF)c1ccc(F)cc1O 846207531 CRSKRGHODKRBLJ-ZYHUDNBSSA-N 259.296 2.293 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CCOC2)c1O 846146482 RVIHCZFACBZNIP-WDEREUQCSA-N 251.326 2.088 10 20 CECD CN(C)c1ccc(CN[C@H]2CC[C@@H](CN)C2)cc1F 841083265 ADYBKTAOQAIBAD-YPMHNXCESA-N 265.376 2.109 10 20 CECD Cc1cc(CN(C)c2ccc3c(c2)OCO3)n(C)n1 841867827 PLMSRCPCTUEWMZ-UHFFFAOYSA-N 259.309 2.094 10 20 CECD C[C@H]1C[C@H](N)CCN1Cc1cc(Cl)cc(F)c1O 846705368 ZEUXJMNSINYTDW-GZMMTYOYSA-N 272.751 2.496 10 20 CECD CCCN1CCC[C@@H]1C(=O)NCc1ccc(N(C)C)cc1 749564410 VHDVGCOAUUOYTQ-MRXNPFEDSA-N 289.423 2.243 10 20 CECD CCCCN1CC(=O)N[C@@H]1c1ccc(N(C)C)cc1C 840806354 XZFLMUKXDLWICD-INIZCTEOSA-N 275.396 2.292 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1c(O)cccc1Cl 841066225 YLTCVRGSBYSKDF-CABZTGNLSA-N 254.761 2.276 10 20 CECD CN(C)c1cc(F)c(CNC[C@@](C)(O)C2CC2)cc1F 858134288 NWNAPIAYOJYPPL-OAHLLOKOSA-N 284.350 2.281 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(C)c(C)c1O 858587928 SIOSNKRTAGTQDF-VXGBXAGGSA-N 280.368 2.068 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](CN(C)C)C2)c1O 754742255 UVMNKSSOFXGHNK-ZDUSSCGKSA-N 278.396 2.093 10 20 CECD COc1ccc(O)c(CNC(=O)NCCc2ccoc2)c1 853736490 CWXNGFVYKOSZHS-UHFFFAOYSA-N 290.319 2.036 10 20 CECD Cc1cc(NCc2ccc(N3CCC(O)CC3)cc2)ncn1 853955376 DCCKHOZRNGPRCQ-UHFFFAOYSA-N 298.390 2.358 10 20 CECD CCC[C@@H](O)CC(=O)NCc1ccc(N2CCCC2)cc1 750204964 ZQUQBTUVIJXWCX-MRXNPFEDSA-N 290.407 2.454 10 20 CECD CCC[C@@H](CNC(=O)NCCc1ccc(N)cc1)OCC 861641476 SSSVYDRVBRXWQZ-HNNXBMFYSA-N 293.411 2.316 10 20 CECD CCOc1ccc(N(C)CC[C@@H]2CCS(=O)(=O)C2)cc1 760845896 WVOSMIRBLFNXEY-CYBMUJFWSA-N 297.420 2.346 10 20 CECD CC[C@@H](C)N(CCO)Cc1ccc(N(C)C)c(F)c1 862387151 HTDBINNHWCKLLL-GFCCVEGCSA-N 268.376 2.485 10 20 CECD CCCOc1ccc(CN[C@@H](COC)C(=O)OC)cc1C 877469860 UXLLZFXPJIMZGW-AWEZNQCLSA-N 295.379 2.061 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1C[C@H](N)C1(C)C 876767147 CFQCTILSIRQLNS-GJZGRUSLSA-N 289.423 2.051 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@]3(CCCOC3)C2)c(O)c1 877495551 YLSTWCCXUIPOEA-WMLDXEAASA-N 291.391 2.471 10 20 CECD Oc1cc(F)c(Cl)cc1CN1C[C@H]2COC[C@H]2C1 872266630 ZPTJZGLAGWNQCC-AOOOYVTPSA-N 271.719 2.263 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1C2CCC1CC2 779493230 KZVNHPICNVZVBU-KRXBUXKQSA-N 259.305 2.264 10 20 CECD CO[C@]1(C)C[C@@H](NC(=O)NCc2ccc(N)cc2)C1(C)C 1120611341 QVCBSMQPPCCOHT-CZUORRHYSA-N 291.395 2.272 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H](O)C[C@H]2C)c1O 788268589 GKOWXGAKLVDDLX-KCJUWKMLSA-N 271.744 2.009 10 20 CECD CCOc1ccc(O)c(CN[C@@]2(C)CCO[C@H]2C)c1 784641358 XQAWSJTWWIVMJA-NHYWBVRUSA-N 265.353 2.448 10 20 CECD COc1cc(C)cc(CN[C@H]2CCSC2)c1O 894315914 NUWHGNXJXADIQF-NSHDSACASA-N 253.367 2.304 10 20 CECD Oc1ccc(Cl)cc1CN1C[C@H]2CC[C@@H](O)[C@H]2C1 895783797 AQZVUNNQNUZUSH-LJWDBELGSA-N 267.756 2.248 10 20 CECD c1cc(N2CCCCC2)ccc1CNC[C@H]1COCO1 894868888 MYYJVUUFVQHGNJ-INIZCTEOSA-N 276.380 2.139 10 20 CECD CS[C@H](C)CCC(=O)OCC(=O)c1ccc(O)c(O)c1 784530136 JIVWBQOHQGHSOJ-SECBINFHSA-N 298.360 2.355 10 20 CECD COc1cc(C)cc(CN[C@@H](C)Cn2cccn2)c1O 894173815 REXUJGKSTDLRPQ-LBPRGKRZSA-N 275.352 2.084 10 20 CECD COC1(CNCc2cc([N+](=O)[O-])ccc2O)CCCC1 790955524 RZLWNIKFGSRHDG-UHFFFAOYSA-N 280.324 2.349 10 20 CECD C[C@H](O)CN[C@@H](C)c1cccc(C(F)(F)F)c1O 798179744 LXWQBQVEYSHASD-YUMQZZPRSA-N 263.259 2.442 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@@H]1CO[C@H](C)C1 1326784048 PYGDCPFLRSJVNF-OCCSQVGLSA-N 291.395 2.038 10 20 CECD CO[C@H]1C[C@H](NCc2cc(Br)ccc2O)C1 706512657 RRJRISPTJRNGBO-XYPYZODXSA-N 286.169 2.422 10 20 CECD CC[C@@H](NCc1ncnn1CC)c1ccccc1O 785789924 WHTXPWIOOJAIRW-GFCCVEGCSA-N 260.341 2.245 10 20 CECD CC[C@H](C)C[C@@H](N)C(=O)N[C@H](C)c1cc(OC)ccc1O 1340340613 NPSZLXPDCXHDGL-MISXGVKJSA-N 294.395 2.342 10 20 CECD C[C@@H](N[C@H]1CCOC1(C)C)c1cc(C(=O)O)ccc1O 1604330647 YHDRDSSLLLUQHI-RNCFNFMXSA-N 279.336 2.309 10 20 CECD CC/C=C/CN[C@@H](C)c1cccc(-c2nn[nH]n2)c1O 1604120396 RBDRMVFUIIMLSE-YEZKRMTDSA-N 273.340 2.189 10 20 CECD O=C(O)[C@]12CCC[C@H]1CN(Cc1ccc(F)c(F)c1O)C2 1602222322 WUDZBDPOFYZHJU-BONVTDFDSA-N 297.301 2.357 10 20 CECD C[C@@](O)(CC(=O)NCc1ccc(N)cc1)c1ccccc1 1576261132 XZGAEFQTNXXWII-QGZVFWFLSA-N 284.359 2.183 10 20 CECD Oc1c(F)cc(F)cc1CN[C@]12CCC[C@H]1NCC2 1580888203 HYWALYSJMTYXOF-OCCSQVGLSA-N 268.307 2.045 10 20 CECD C[C@@H](CN[C@H](C)c1cc(Cl)ccc1O)C(=O)O 1589067864 QSJCCZQPRSECRG-JGVFFNPUSA-N 257.717 2.417 10 20 CECD COc1ncccc1CNCc1ccc(N(C)C)cc1 37408050 DXSGPPWDDFGFDZ-UHFFFAOYSA-N 271.364 2.446 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@@H](C)c1cc(C)ccc1O 188484064 GGOYIHRRKPOPEL-NWDGAFQWSA-N 264.369 2.218 10 20 CECD COCC[C@H](CO)N[C@H]1C[C@@H](C)c2c(C)ccc(O)c21 312155065 BSKMMVDEKBDZSC-UPJWGTAASA-N 279.380 2.236 10 20 CECD COCCOCCCCN[C@@H]1CCc2cccc(O)c21 312845243 PPPQSWQLZGOCHS-CQSZACIVSA-N 279.380 2.412 10 20 CECD CCCOC(=O)[C@@H](C)N1CCOc2cc(N(C)C)ccc21 175023937 XUCLJZJVCOPMIJ-GFCCVEGCSA-N 292.379 2.293 10 20 CECD CCOC(=O)CN(Cc1ccccc1O)C(C)C 179949620 CBMKGNKTYRTIEM-UHFFFAOYSA-N 251.326 2.166 10 20 CECD O=C(NCc1ccccc1O)c1ccc(F)cc1[N+](=O)[O-] 124613083 QTLNCKNYINCMHA-UHFFFAOYSA-N 290.250 2.370 10 20 CECD COc1ccc(O)c(CN2C[C@H](C)OC[C@@H]2C)c1 217779306 FASLEKXTSXJBQP-QWRGUYRKSA-N 251.326 2.010 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CC[C@@H](C)OC)c1 184026311 FNZLPBXHUMKRCI-MNOVXSKESA-N 281.352 2.393 10 20 CECD COc1ccc(O)c(CN2CCS[C@H]3COCC[C@@H]32)c1 180683418 TVSVXVLZPJXEDT-ZFWWWQNUSA-N 295.404 2.107 10 20 CECD CCC[C@H](CCO)CNC(=O)/C=C/c1ccc(O)c(O)c1 181207715 CUBXJPRZAUTNEQ-VUDGCMKMSA-N 293.363 2.026 10 20 CECD COc1cccc(CN2CCC(NCC3CC3)CC2)c1O 133623046 BNCNLXWZKBGQBF-UHFFFAOYSA-N 290.407 2.365 10 20 CECD CCN(CCN[C@H]1CCc2cccc(O)c21)C1CC1 297877846 UWWXWLYGHKJGBE-AWEZNQCLSA-N 260.381 2.453 10 20 CECD COc1ccc(O)c(CN2CCC(CCCO)CC2)c1 272988297 WKBGRGZQZVHZNL-UHFFFAOYSA-N 279.380 2.385 10 20 CECD CCCc1cc(NC(=O)NCc2ccccc2O)n(C)n1 271360859 HENWMQPSALNHKR-UHFFFAOYSA-N 288.351 2.400 10 20 CECD OCCCN(Cc1ccccn1)Cc1ccccc1O 289382678 CTVKGFJATNKLKA-UHFFFAOYSA-N 272.348 2.172 10 20 CECD C[C@@H](CCCCO)NC(=O)NCc1ccc(N(C)C)cc1 296129984 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917593263 LWFWXHFPCVTRBE-UHFFFAOYSA-N 265.426 2.467 10 20 CECD C[C@@H]1O[C@H](C)C[C@@H]1CNC(=O)NCc1ccccc1O 840278113 YSNMGRMSLQWXEJ-NTZNESFSSA-N 278.352 2.005 10 20 CECD COc1cccc([C@H](C)N[C@@H]2CCN(C(C)C)C2=O)c1O 846152881 VGNNQNRUNDFKQD-WCQYABFASA-N 292.379 2.061 10 20 CECD Cc1ccc(C(=O)N2C[C@@H](C)OC3(CCC3)C2)c(O)c1O 844099714 AYBDZONNFPMWLU-LLVKDONJSA-N 291.347 2.190 10 20 CECD CCO/C=C\C(=O)N[C@@H](C)c1cc(OC)ccc1O 847590997 MKBICMHQRYCNEY-DMEOUFDRSA-N 265.309 2.128 10 20 CECD COCC1CCC(NC(=O)c2ccc(C)c(O)c2O)CC1 840522068 NKFOJKGWCCQSNI-UHFFFAOYSA-N 293.363 2.341 10 20 CECD C[C@H](NC(=O)C(=O)Nc1ccc(N)cc1)C1CCCCC1 841048036 KFIQPZQYLUSIAK-NSHDSACASA-N 289.379 2.292 10 20 CECD Cc1cc(Br)cc(CN2CCC(N)CC2)c1O 843047751 ZQYHXYACBYVCIN-UHFFFAOYSA-N 299.212 2.386 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@@H](N)C1 843486097 PQOTYEBRPPXECJ-GASCZTMLSA-N 289.423 2.227 10 20 CECD C[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)CC(C)(C)O1 841957049 MIRGYGKMLNARJJ-GFCCVEGCSA-N 291.395 2.020 10 20 CECD 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153141536 PNWFCWFPXVTYBI-AWEZNQCLSA-N 262.397 2.393 10 20 CECD C[C@@H]1SCCN(C(=O)Cc2ccc(N)cc2)[C@@H]1C 157076390 OWGHZLDLSDXSLB-MNOVXSKESA-N 264.394 2.164 10 20 CECD COc1cc(O)c(CN2CCC[C@@H]2C(C)(C)O)cc1OC 154419686 IUDRXFYHFCUNIM-OAHLLOKOSA-N 295.379 2.145 10 20 CECD CCc1nnc(CNCc2c(O)cccc2OC)s1 810176212 KKUOFQFEJZAEMB-UHFFFAOYSA-N 279.365 2.105 10 20 CECD Cn1ncc(CNCc2ccc3c(c2)CCO3)c1Cl 815122406 LERNBTGAELMMBA-UHFFFAOYSA-N 277.755 2.298 10 20 CECD COc1cccc(O)c1CN[C@@H](C)CCCCO 824655683 YTUXBNXDVGDEPH-NSHDSACASA-N 253.342 2.042 10 20 CECD COc1ccc(O)c([C@H](C)NCc2c[nH]nc2C)c1 38011146 KOWAWBLDQHRUTP-JTQLQIEISA-N 261.325 2.283 10 20 CECD Cc1nnsc1CN[C@H]1CCc2cccc(O)c21 297424936 UXJTVGGXRBGMJP-JTQLQIEISA-N 261.350 2.329 10 20 CECD COc1cc(Cl)cc(CNC[C@@H]2CC[C@@H](O)C2)c1O 187985403 KNGNNEMKBUALRY-BXKDBHETSA-N 285.771 2.305 10 20 CECD COCCC(C)(C)NC(=O)Nc1ccc(N)cc1 398290544 GFLATKALNWFUDF-UHFFFAOYSA-N 251.330 2.205 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H]2CCCOC2)c1 109543446 SHKJFJVIAQSZNN-MNOVXSKESA-N 251.326 2.230 10 20 CECD C[C@H](CC(=O)O)CC(=O)N(C)Cc1ccc(N(C)C)cc1 61836192 WEYYQMFSRCWNQX-LBPRGKRZSA-N 292.379 2.212 10 20 CECD COc1cccc(CNC(=O)/C=C(\C)C2CC2)c1O 171486963 NFFCLYRXFMGBFP-CSKARUKUSA-N 261.321 2.373 10 20 CECD CN(C)c1ccc(CNC(=O)CC(C)(C)CC(=O)O)cc1 61826536 QSKSCOGXJUDABJ-UHFFFAOYSA-N 292.379 2.260 10 20 CECD CS[C@@H](CO)[C@H](C)NCc1c(O)cccc1Cl 152451216 CIAMCBCNGCWLQU-UFBFGSQYSA-N 275.801 2.248 10 20 CECD Cc1ccnc(NC(=O)NCCc2ccc(O)c(O)c2)c1 184194910 AZRXQFRFKILRGI-UHFFFAOYSA-N 287.319 2.165 10 20 CECD C[C@H](NCc1ccc(C(N)=O)cc1)c1ccc(F)cc1O 184861974 OQXUBQHZKFVIHA-JTQLQIEISA-N 288.322 2.481 10 20 CECD C/C=C(\C)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 84815055 VNOKLHMIBBOZQY-UUILKARUSA-N 292.354 2.449 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H](C)CNC)cc1F 236906923 WUTODLZUGPAECM-GFCCVEGCSA-N 295.402 2.144 10 20 CECD C[C@@H](Cn1ccnc1)N[C@H]1CCc2cccc(O)c21 296066663 RYLJQQRKLNVUEM-AAEUAGOBSA-N 257.337 2.254 10 20 CECD Cc1ccc([C@@H](O)CNCc2ccc(N(C)C)cc2)o1 266028334 RWLIRDVJEJGMRR-HNNXBMFYSA-N 274.364 2.477 10 20 CECD CCC(=O)CNC(=O)c1cc(C)n(-c2ccccn2)c1C 270764232 NQOACFBOSQQLEZ-UHFFFAOYSA-N 285.347 2.198 10 20 CECD C[C@H](N[C@@H]1CCCC[C@H]1O)c1cc([N+](=O)[O-])ccc1O 273562924 IPKNBTBSRWOXOZ-MRCXROJRSA-N 280.324 2.255 10 20 CECD CC(C)C[C@@H](CO)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273300366 BFMPBNBTIPLCHI-QWRGUYRKSA-N 282.340 2.358 10 20 CECD CC(=O)N1CCC[C@@H](CNCc2cc(C)ccc2O)C1 279640612 CWNNZDHJACXLCH-AWEZNQCLSA-N 276.380 2.049 10 20 CECD Cc1ccc(C(=O)NCC2CCSCC2)c(O)c1O 272735086 KSXHKGXOGCQQAB-UHFFFAOYSA-N 281.377 2.279 10 20 CECD Cc1cc(C)c([C@H](C)N[C@H](C)C(=O)NCCF)c(O)c1 285366493 VUMKVGLTAOAZOP-NWDGAFQWSA-N 282.359 2.134 10 20 CECD CC(=O)C(=O)CSc1ncc(-c2ccccc2)[nH]1 808020255 SINDGNOUBPZCRG-UHFFFAOYSA-N 260.318 2.327 10 20 CECD C[C@H](NCCCc1cnn(C)n1)c1cc(Cl)ccc1O 293593573 CWGPAYFELUQSLE-JTQLQIEISA-N 294.786 2.458 10 20 CECD Cc1cc(O)c(CN2C[C@H](C)S(=O)(=O)[C@@H](C)C2)cc1C 290388849 BMZGMDCUXVUCDM-STQMWFEESA-N 297.420 2.016 10 20 CECD Cc1cc(CC(=O)NCc2ccc(N3CCCC3)cc2)on1 816867173 ICOKXRXCLKHEAB-UHFFFAOYSA-N 299.374 2.442 10 20 CECD CNc1c(Cl)ncnc1NCCc1ccc(O)c(O)c1 811811141 NBMUMZGKHQAQQV-UHFFFAOYSA-N 294.742 2.238 10 20 CECD C[C@@H](NC[C@H]1CNCCO1)c1ccc2ccccc2c1O 817983949 SFDIYOHILYMPNX-TZMCWYRMSA-N 286.375 2.184 10 20 CECD OC[C@H](CNCc1cc(F)ccc1O)CC1CC1 827358900 GCLDOINCTVWXOO-NSHDSACASA-N 253.317 2.030 10 20 CECD CCc1nnc([C@@H](C)OC(=O)c2cc(O)cs2)o1 732354577 WEPMWROIWCODID-ZCFIWIBFSA-N 268.294 2.317 10 20 CECD COC1(C)CN(Cc2cc(Br)ccc2O)C1 839102386 NDRYQHYGMDMWCA-UHFFFAOYSA-N 286.169 2.375 10 20 CECD COC[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)C(C)C 743635882 XPEOOIYVSSPLEL-OAHLLOKOSA-N 293.411 2.223 10 20 CECD COc1cccc([C@H](C)NC[C@H]2CC[C@H](O)C2)c1O 846165010 KDYDLIHQGJXIOL-SRVKXCTJSA-N 265.353 2.212 10 20 CECD C[C@@H]1C[C@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)CCN1 841060719 BLOIJMGDTSCYFY-LDYMZIIASA-N 299.758 2.184 10 20 CECD C[C@H](CO)C1CCN(Cc2cc(F)ccc2O)CC1 846057209 DWGZDBZQNBKOMY-LLVKDONJSA-N 267.344 2.372 10 20 CECD CN[C@@H]1CCN(Cc2cc(Cl)cc(C(C)=O)c2O)C1 843344611 NQMQWXHPXANEMQ-GFCCVEGCSA-N 282.771 2.042 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)N[C@@H](C)CN)cc1 841983122 ZYRKJFKFUSHRIE-ZDUSSCGKSA-N 292.427 2.021 10 20 CECD O=C(NCc1cc(Cl)ccc1O)N1CCCC1 844777237 LSEIOGCTQDEFLY-UHFFFAOYSA-N 254.717 2.351 10 20 CECD Oc1c(Cl)cc(Cl)cc1CNC[C@@H]1C[C@H](F)CN1 841079724 QSBLYUJIQLCGKZ-UWVGGRQHSA-N 293.169 2.489 10 20 CECD CC[C@@H](NC(=O)c1cc(O)cs1)C1CCOCC1 746409850 PGRAXECRVYRFCS-LLVKDONJSA-N 269.366 2.389 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)OCCC(N)=O 759543180 NVFSDQGILOQIKJ-UHFFFAOYSA-N 292.360 2.188 10 20 CECD C[C@H]1CN(C2CC2)C[C@H]1NCc1ccc(N(C)C)cc1 757708301 XIFJWPXWXXECMG-SUMWQHHRSA-N 273.424 2.325 10 20 CECD COC(=O)N1CC(N[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)C1 756757804 DPYHNOBYUDUHCY-KCJUWKMLSA-N 294.326 2.120 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCCCCCCO 759595336 QHIJNTSLVBETPY-VURMDHGXSA-N 280.320 2.207 10 20 CECD C[C@H](N[C@H](C)c1cc(F)cc(F)c1O)c1nncn1C 756531718 BKZSRBIOODAJTN-SFYZADRCSA-N 282.294 2.211 10 20 CECD CCOc1ccc(CNC[C@@H](CO)CC2CC2)c(O)c1 850388334 LGNQAVFCSBTWDA-ZDUSSCGKSA-N 279.380 2.289 10 20 CECD COC[C@@H](C)CC(=O)NCc1ccc2c(c1)CCCN2C 755251741 ZXYKILBLOUOOGA-ZDUSSCGKSA-N 290.407 2.358 10 20 CECD COc1cc(CNCc2c(C)cccc2O)ccn1 877014796 QWDYWMAWQMSXQG-UHFFFAOYSA-N 258.321 2.394 10 20 CECD C[C@@H](c1ccc(N(C)C)cc1)N1C(=O)NC(C)(C)C1=O 761577326 GOZGMGPPRPFNNH-JTQLQIEISA-N 275.352 2.144 10 20 CECD CN1CCC2(CCCN2C(=O)c2cc(O)cs2)CC1 768840070 IAODFRHJURKYOF-UHFFFAOYSA-N 280.393 2.154 10 20 CECD COCC1(NCc2ccc(N(C)C)c(F)c2)CC1 765271872 PXBDCPMKZUJBBR-UHFFFAOYSA-N 252.333 2.160 10 20 CECD COc1ccc(O)c(CNCCNc2cccc(C)n2)c1 777483167 HNVQDRGZCCQKRP-UHFFFAOYSA-N 287.363 2.306 10 20 CECD Cc1ncc2c(n1)CC[C@@H](NCc1c(C)cccc1O)C2 876926479 WOZMHYODYNSRRS-CQSZACIVSA-N 283.375 2.446 10 20 CECD COc1ccc(N(C)Cc2ccc(O)nc2)cc1OC 877342741 RKFCSRNCTUMPEY-UHFFFAOYSA-N 274.320 2.441 10 20 CECD COc1ccnc(NC(=O)/C=C\c2ccc(O)c(O)c2)c1 779540565 RXMDGPWDKRTBSH-HYXAFXHYSA-N 286.287 2.153 10 20 CECD CCOC(=O)C1(CNCc2ccc(N(C)C)c(F)c2)CC1 770665306 IBMOSQACISJMLA-UHFFFAOYSA-N 294.370 2.325 10 20 CECD COC[C@@H](NCc1cc(C)c(C)cc1O)[C@H]1CCCO1 788534683 IEMHULIANNNXDB-GDBMZVCRSA-N 279.380 2.293 10 20 CECD COC1(C(=O)NCc2ccc(N(C)C)cc2C)CCC1 781641974 NKUCEWYQDALAFP-UHFFFAOYSA-N 276.380 2.246 10 20 CECD CCCCCN(CC(N)=O)Cc1cc(F)cc(F)c1O 894430986 IHVPTGYWFPOGJD-UHFFFAOYSA-N 286.322 2.148 10 20 CECD C[C@H](N[C@H](C)c1cc(F)cc(F)c1O)c1ncnn1C 788983940 PDIGLSXGYMHENW-SFYZADRCSA-N 282.294 2.211 10 20 CECD C[C@H](Cc1cccnc1)NCc1cc2c(cc1O)OCO2 897969424 JFAVGJBXDOEPFF-LLVKDONJSA-N 286.331 2.237 10 20 CECD NC(=O)CCC1CCN(Cc2cc(F)cc(F)c2O)CC1 894044123 TTZIULKMZAGXET-UHFFFAOYSA-N 298.333 2.148 10 20 CECD COc1cc(C)cc(CN2CCN(C)CC2(C)C)c1O 894030451 HQAKFIXCXPFABY-UHFFFAOYSA-N 278.396 2.235 10 20 CECD O=C1NC(=S)S/C1=C\c1cnn(CC2CCC2)c1 899335567 DWYTYFBMVDUBNE-WMZJFQQLSA-N 279.390 2.172 10 20 CECD COc1ccc(CNC(=O)c2ccccc2O)c(O)c1 794379809 WSKWXHPKGYWKPH-UHFFFAOYSA-N 273.288 2.036 10 20 CECD Cc1ccc([C@@H](C)NCCC2(O)CCOCC2)c(O)c1 797031874 LBVDMVZJBDLASS-CYBMUJFWSA-N 279.380 2.283 10 20 CECD CC[C@H](C)NC(=O)CCNCc1ccc(N(C)C)cc1 37997052 PHWWZUNIASMDIN-ZDUSSCGKSA-N 277.412 2.147 10 20 CECD Nc1ccc(CCNC(=O)NC/C=C\C2CC2)cc1 1328725714 QORUJHYGFLJYOX-UPHRSURJSA-N 259.353 2.077 10 20 CECD Nc1ccc(CN2CCC([C@@H]3CCCN3)CC2)cc1 1345160616 WJGIKYJRUVBCHH-INIZCTEOSA-N 259.397 2.233 10 20 CECD Cc1cccnc1[C@@H](C)NC(=O)Cc1ccc(N)cc1 1341680633 UGDAONCFKGRVRR-GFCCVEGCSA-N 269.348 2.392 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC[C@@H](C(=O)O)C1 1600236309 RWZNYGPJLSVTPV-TZMCWYRMSA-N 276.380 2.404 10 20 CECD O=C(O)[C@H]1CCCCN1Cc1ccc(F)c(F)c1O 1608819722 QOTGMMIYEXJACW-SNVBAGLBSA-N 271.263 2.110 10 20 CECD CC[C@H](N[C@@H]1CCc2nc(C)nn2C1)c1ccccc1O 155587052 VHMMPXHOLIFALG-OCCSQVGLSA-N 286.379 2.348 10 20 CECD O=C(Nc1nc2ccccc2[nH]1)c1cccc(O)c1O 126411412 RXHXGIBSPXOQSB-UHFFFAOYSA-N 269.260 2.226 10 20 CECD CC[C@@H]1CN(Cc2cc3c(cc2O)OCO3)CCCO1 281113785 BNDDLWOFBFTNRH-GFCCVEGCSA-N 279.336 2.122 10 20 CECD CN(C)c1ccc(CNC(=O)NCc2ccoc2)cc1F 58573124 LXEFDDLCALBIOQ-UHFFFAOYSA-N 291.326 2.484 10 20 CECD CCc1cc(C(=O)NCCCSc2nccs2)[nH]n1 114376171 OXFWXFKQADIMOO-UHFFFAOYSA-N 296.421 2.341 10 20 CECD CC1=C(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CCCO1 186398297 JPRZABVMYYJJTI-SNVBAGLBSA-N 291.347 2.229 10 20 CECD C[C@@H](CCN(C)C)NCc1cccc(Cl)c1O 124755742 SYLXHFHRYHNUMS-JTQLQIEISA-N 256.777 2.475 10 20 CECD CCOC(=O)CN(Cc1ccc(N)cc1)C(C)C 35064783 LPVFHOAGZFMWAQ-UHFFFAOYSA-N 250.342 2.042 10 20 CECD CCOc1cc(N[C@H](C)Cc2ccc(O)c(O)c2)ncn1 185696301 OGVKARIVBJOGOB-SNVBAGLBSA-N 289.335 2.330 10 20 CECD CCCCCN1CC(=O)N[C@H]1c1cc(OC)ccc1O 182325232 MXZPXFHJESYTHI-OAHLLOKOSA-N 278.352 2.021 10 20 CECD CC(C)COC(=O)CN1CCOc2cc(N(C)C)ccc21 181497531 CFBNNHZHXVSKTL-UHFFFAOYSA-N 292.379 2.151 10 20 CECD CCCNC(=O)CCNCc1cc(Cl)ccc1O 45072161 CUBKXOJQVUJWJX-UHFFFAOYSA-N 270.760 2.052 10 20 CECD CC(C)CNC(=O)NC(=O)[C@@H](C)Sc1nccs1 48875592 WMTDJJYIBLSCFQ-MRVPVSSYSA-N 287.410 2.106 10 20 CECD CN(C)c1ccc(OCCC2OCCCO2)cc1 289436525 SRHDVBXIMBUDOR-UHFFFAOYSA-N 251.326 2.285 10 20 CECD Cc1cccc(CN(C)[C@@H]2CCN(C)C[C@@H]2C)c1O 290414343 KFYQRUKATXVDGR-DZGCQCFKSA-N 262.397 2.473 10 20 CECD CCNC(=O)COc1ccc2c(c1)c(C)c(C)n2C 421204275 SIRIXGWUESVFOL-UHFFFAOYSA-N 260.337 2.310 10 20 CECD Cc1ccnc(N(C)Cc2ccc(N3CCOCC3)cc2)n1 265480795 CWIQZQIGHNOKSH-UHFFFAOYSA-N 298.390 2.258 10 20 CECD COC[C@@H](CN[C@H](C)c1cc(Cl)ccc1O)OC 273478234 TXKLIWMSBLXKRB-MWLCHTKSSA-N 273.760 2.358 10 20 CECD COC(=O)[C@H](C)N(C)Cc1cc(Cl)cc(C(C)=O)c1O 280662155 FFXJYJPXJIYDKX-QMMMGPOBSA-N 299.754 2.242 10 20 CECD COCC1(CCNC(=O)c2ccc(C)c(O)c2O)CCC1 293881752 LBVDFGKUDAUDRP-UHFFFAOYSA-N 293.363 2.343 10 20 CECD CC(=O)C(=O)COc1ccc([N+](=O)[O-])c2ccccc12 808025018 ZIJYQRHPAKPAKX-UHFFFAOYSA-N 273.244 2.285 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2ccc(F)cc2)o1 808009620 NZUVRQAPCIMPSP-UHFFFAOYSA-N 280.280 2.126 10 20 CECD CO[C@@H](C)CN(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 805310504 YIOMVUROCMQSCL-QWHCGFSZSA-N 293.411 2.490 10 20 CECD COc1cc(O)c(CN2CC[C@H](CO)C[C@@H]2C)cc1OC 290259539 WPACNBZYIDMYNS-RYUDHWBXSA-N 295.379 2.002 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NCCOCCO)c1O 808672130 DNXNADWOGXKZTK-SNVBAGLBSA-N 273.760 2.014 10 20 CECD CC(=O)C(=O)CSc1nncn1-c1cccc(Cl)c1 808015627 UNTNDPIQMDRMPP-UHFFFAOYSA-N 295.751 2.171 10 20 CECD CC[C@H](CNC(=O)NCc1ccc(N(C)C)c(F)c1)OC 290826982 BCPYKXJHPWRIDT-GFCCVEGCSA-N 297.374 2.116 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)[C@@H]1CCO[C@@H](C)C1 819761686 ZIEAGLHXBIDFEL-NWDGAFQWSA-N 298.379 2.309 10 20 CECD CNCCN[C@@H](C)c1cc(Br)c(F)cc1O 817952756 MBOOJIPGOZLFPO-ZETCQYMHSA-N 291.164 2.164 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)CCCN)c1 817978159 XQNRFJPOLPAGBR-GHMZBOCLSA-N 252.358 2.179 10 20 CECD Cc1ccc(O)c(CN2CC[C@@H](C(=O)O)[C@H](C)C2)c1 388663111 OQGALDINENZMJD-DGCLKSJQSA-N 263.337 2.243 10 20 CECD CCCN(CC(=O)O)Cc1ccc(N(C)C)c(F)c1 829475933 ZHNOIASLWGWOAB-UHFFFAOYSA-N 268.332 2.188 10 20 CECD CC[C@@H](NCc1cc(Cl)cc(F)c1O)[C@@H](C)O 824920867 ADRZYUWHBNIKJF-RDDDGLTNSA-N 261.724 2.434 10 20 CECD CC[C@@H](OC)C(=O)N[C@H](C)c1cc(OC)ccc1O 728983058 SWRIVRQDROBIEU-NOZJJQNGSA-N 267.325 2.003 10 20 CECD CCN(Cc1ccc(Br)cc1O)[C@@H](C)CO 826015760 BIMNULNPYLBUOQ-VIFPVBQESA-N 288.185 2.357 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@@H](C)c1ccc(F)cc1O 903343190 NJWUUJFMYNFWLJ-JSGCOSHPSA-N 296.386 2.293 10 20 CECD COc1cc(O)c(CNC[C@H]2CC[C@@H](C)O2)cc1OC 835086757 JGRBVBMHUACGNX-ZYHUDNBSSA-N 281.352 2.067 10 20 CECD COc1cccc([C@H](C)NCC2(O)CCCC2)c1O 846148145 XGDUQXABWMHXOD-NSHDSACASA-N 265.353 2.357 10 20 CECD CCc1cccc(CNCC(C)(C)N2CCOCC2)c1O 848890315 GUFITOHLPLQFSO-UHFFFAOYSA-N 292.423 2.155 10 20 CECD CN(C)c1ccc(CN2C[C@@H](C(=O)O)[C@H](C3CC3)C2)cc1 846290097 DWLHQOQSCKIFNA-JKSUJKDBSA-N 288.391 2.295 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCN[C@H](C)C1 841062529 MQVXTKATEMGYLI-HIFRSBDPSA-N 261.413 2.291 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cc(F)cc(C(C)=O)c1O 844838851 IBIGYQDPBGCIIJ-GFCCVEGCSA-N 283.299 2.029 10 20 CECD CCc1cccc(CN2CC(c3nc(C)no3)C2)c1O 848914088 DFOOTEUTDYJYLG-UHFFFAOYSA-N 273.336 2.245 10 20 CECD C[C@@H](C[C@H]1CCOC1)NC(=O)Nc1ccc(N)cc1 841299742 JHTAAPHFTLVWDS-WDEREUQCSA-N 263.341 2.205 10 20 CECD Cc1cccc2c1N[C@@H](c1cccc(O)c1O)NC2=O 914579559 GNYGOIMOIVXNOI-CQSZACIVSA-N 270.288 2.260 10 20 CECD C[C@H]1CN(CCN[C@H](C)c2ccc(Cl)cc2O)CCO1 841748367 XBISIOMNDISBJQ-NWDGAFQWSA-N 298.814 2.417 10 20 CECD Cc1cccc(CN(C)c2ccc(OCC(=O)O)cc2)n1 846279406 CJQMERHJPKBPJW-UHFFFAOYSA-N 286.331 2.490 10 20 CECD COc1ccc(N(C)CCN(C)C(=O)[C@H]2C[C@@H]2C)cc1 844851610 BXVUYWPYQKSEPU-WFASDCNBSA-N 276.380 2.246 10 20 CECD C[C@@H](NCC(=O)NC1CCCC1)c1cc(F)cc(F)c1O 756705568 LFOQMRXRGAXYFR-SECBINFHSA-N 298.333 2.380 10 20 CECD CSC(C)(C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 852792255 UBHIEZZKOUMWRG-CYBMUJFWSA-N 295.452 2.010 10 20 CECD CCc1nncn1CCN[C@@H](C)c1ccc(C)cc1O 756618893 CSJXFFYSZZWBCQ-LBPRGKRZSA-N 274.368 2.205 10 20 CECD Cc1conc1C(=O)NCc1ccc2c(c1)CCCN2C 865053600 JRQMBHQBNBBTCU-UHFFFAOYSA-N 285.347 2.295 10 20 CECD Cc1ccc(O)c(CNC(=O)/C=C/C2CCOCC2)c1 862759632 HMWFCIDWVQFRCC-HWKANZROSA-N 275.348 2.300 10 20 CECD Cc1nc(C)c(C(=O)COC(=O)c2cc(O)cs2)o1 767345461 JPSLJAFTLDNSFN-UHFFFAOYSA-N 281.289 2.098 10 20 CECD COC(=O)[C@H](COC(C)C)N(C)Cc1ccc(C)cc1O 876812816 YZGNNPOBKWKJQS-AWEZNQCLSA-N 295.379 2.099 10 20 CECD COc1ccc(CNc2ncccc2OC)c(O)c1 776253745 QESKIVQTXVSOHW-UHFFFAOYSA-N 260.293 2.417 10 20 CECD CC[C@@H]1C[C@H]1CNC(=O)c1c(F)ccc(O)c1O 1117776042 BHMUFUNHDZVFRR-SFYZADRCSA-N 253.273 2.013 10 20 CECD C[C@H]1C[C@@H]1C(=O)Nc1c(Cl)ccc2nonc12 1117547930 NVEPNVUTPVMKMX-WDSKDSINSA-N 251.673 2.471 10 20 CECD Cc1cccc(O)c1CN(C)[C@@H](C)C(=O)OC(C)C 876779400 DASYHXOWYFKWEY-LBPRGKRZSA-N 265.353 2.473 10 20 CECD CN(C)c1ccc(CN(C(=O)[C@H]2C[C@@H](O)C2)C2CC2)cc1 873967776 VRJVOUPBEZRUNG-AKAXFMLLSA-N 288.391 2.015 10 20 CECD CC[C@@H]1COCCN1CCNCc1c(O)cccc1Cl 873187849 BGPZUSJOWZQMBC-GFCCVEGCSA-N 298.814 2.246 10 20 CECD Cc1cc(C(=O)N[C@H](C)c2ccc(N(C)C)cc2)nn1C 773020101 NRTKGTATBDLQHK-GFCCVEGCSA-N 286.379 2.286 10 20 CECD CC(C)CN1CCC[C@@H]1C(=O)N(C)Cc1ccccc1O 1120706834 DAEPNORDBNFPLH-OAHLLOKOSA-N 290.407 2.471 10 20 CECD Cn1c(-c2sccc2O)nnc1N1CC[C@H]2C[C@H]2C1 1121366945 VPMPNEYOTVPACE-IUCAKERBSA-N 276.365 2.095 10 20 CECD C[C@H](NCCOC(F)(F)F)c1cc([N+](=O)[O-])ccc1O 788982725 YUMFYGPCLZSIPW-ZETCQYMHSA-N 294.229 2.487 10 20 CECD C[C@@H]1C[C@H](C(=O)NCc2ccc3c(c2)CCCN3C)CO1 784075888 GZHCDSJOWSMMKN-DOMZBBRYSA-N 288.391 2.110 10 20 CECD COc1cccc(O)c1CNCCO[C@@H]1CCCCO1 894798525 FENKRFDBADRKGY-OAHLLOKOSA-N 281.352 2.034 10 20 CECD CC[C@@H](N[C@H]1CC(=O)N(C2CC2)C1)c1ccc(F)cc1O 796829169 ZRDYUZLZQISILC-SMDDNHRTSA-N 292.354 2.335 10 20 CECD Nc1ccc(CC(=O)N[C@@H]2CCC[C@H](F)C2)cc1 1327122453 ZYGAPDDEIPASHU-WCQYABFASA-N 250.317 2.208 10 20 CECD COc1cccc(O)c1CNCCOC1CCC1 742387008 OCPIBGQSPVBDDO-UHFFFAOYSA-N 251.326 2.060 10 20 CECD O=C(O)CN(Cc1cc(F)cc(F)c1O)C1CCCC1 708214581 CRVSGMZQQCMYNX-UHFFFAOYSA-N 285.290 2.500 10 20 CECD c1cc(N2CCCC2)ccc1CN1C[C@@H]2CC[C@H](C1)N2 1329801790 XAUBLLKHYZLISM-IYBDPMFKSA-N 271.408 2.223 10 20 CECD CC(C)[C@@H](O)CNCc1ccc(Br)cc1O 691452066 CAQWVVBXIFRHGS-LBPRGKRZSA-N 288.185 2.261 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)C12CCC(CC1)C2 752597028 SEVAYWLXFQINND-UHFFFAOYSA-N 275.348 2.337 10 20 CECD COc1cccc(O)c1CN[C@H]1CCN2CCC[C@H]2C1 725845541 CRPLCPVOTZMWTN-STQMWFEESA-N 276.380 2.117 10 20 CECD C[C@@H](NC[C@](C)(O)C(F)F)c1ccc(N(C)C)cc1 698562049 DNFLIUYRVCZUCC-YGRLFVJLSA-N 272.339 2.419 10 20 CECD O=C(O)c1cnc(Sc2ncnc3[nH]ccc23)s1 1602535176 VCNBHPAPRDJXFP-UHFFFAOYSA-N 278.318 2.264 10 20 CECD CN(Cc1ccc(N)cc1)[C@H](CO)CC(C)(C)C 1578489933 WZAFYBJNYPKDAZ-AWEZNQCLSA-N 250.386 2.498 10 20 CECD CC1(C)[C@@H]2NCCC[C@H]2[C@H]1NCc1ccc2c(c1)CCO2 1576388738 AVPKSBIEBUKEEZ-DJIMGWMZSA-N 286.419 2.488 10 20 CECD COc1cc(CN2CCC[C@@](C)(C(=O)O)C2)c(O)cc1C 1599407859 RZYSHGBCQFDYER-MRXNPFEDSA-N 293.363 2.396 10 20 CECD Cn1ccc(N2CCC[C@@H](Sc3nccs3)C2=O)n1 150919225 JUJNLLLZWGHYEN-SECBINFHSA-N 294.405 2.164 10 20 CECD CCCN(Cc1ccccc1O)[C@H]1CCN(CC)C1=O 851792411 OGEPNHIDFLPZJM-AWEZNQCLSA-N 276.380 2.225 10 20 CECD Cn1ncc2c1CCC[C@@H]2NCc1cc(F)ccc1O 226584565 WBXJWQVMYOROTK-ZDUSSCGKSA-N 275.327 2.432 10 20 CECD Cc1ccc([C@@H](C)NCCc2cnn(C)c2)c(O)c1 128122752 LUUCRDLUJQAZLF-GFCCVEGCSA-N 259.353 2.327 10 20 CECD CNC(=O)Cc1ccccc1NCc1ccccc1O 36991409 GVEMCNDVGHISNA-UHFFFAOYSA-N 270.332 2.293 10 20 CECD O=C(NCCOCC1CCCC1)c1cccc(O)c1O 313482462 JKMXZPOIGPGODL-UHFFFAOYSA-N 279.336 2.034 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H](F)C1)OCO2 689902331 DFEULUUJJQIZTO-JTQLQIEISA-N 253.273 2.055 10 20 CECD CCO[C@@H]1C[C@@H]1C(=O)NCc1ccc2c(c1)CCCN2C 69960513 PMNJABYWCLDQKD-GOEBONIOSA-N 288.391 2.110 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1ccc(F)c(F)c1F 182523178 ZAADOCOCBZGQRD-UHFFFAOYSA-N 297.232 2.445 10 20 CECD CN(CC(F)F)C(=O)NCc1ccc(N2CC=CC2)cc1 127983865 ANYZMOGRBQKZEX-UHFFFAOYSA-N 295.333 2.469 10 20 CECD Cc1noc(NC(=O)c2cc(C)n(-c3ccccn3)c2C)n1 127015925 RRFKPQMLAVZDQH-UHFFFAOYSA-N 297.318 2.433 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)c1cnns1 47832391 ZDGZELHEGAHHIX-UHFFFAOYSA-N 288.376 2.068 10 20 CECD O[C@@H](CNCc1ccc2c(c1)CCO2)Cc1ccccc1 238068323 ANRPYWIHTDKVRW-QGZVFWFLSA-N 283.371 2.315 10 20 CECD COc1ccc(N2CCCN(CCC(C)(C)O)CC2)cc1 363956980 BYDBIQBKETVNJQ-UHFFFAOYSA-N 292.423 2.368 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@H]2C)c1O 278281688 TURMDSGFULAOSI-SECBINFHSA-N 266.297 2.293 10 20 CECD Cc1ccc(O)c(CN[C@@H](c2nncn2C)C(C)C)c1 285580076 TXVKFWDFRXGXEE-CQSZACIVSA-N 274.368 2.316 10 20 CECD COC[C@H](O)CCN[C@H](C)c1cc(Cl)cc(C)c1O 808709941 JIMLKGZUGNTZQW-ZYHUDNBSSA-N 287.787 2.402 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)CCCN)c1 817978162 XQNRFJPOLPAGBR-WDEREUQCSA-N 252.358 2.179 10 20 CECD Cc1cc(O)c(CNC[C@@H](CO)[C@@H]2CCOC2)cc1Cl 825752399 ACFBIEJEBMZSRV-YPMHNXCESA-N 299.798 2.089 10 20 CECD Cc1cc(O)c(CNC[C@H](CO)[C@H]2CCOC2)cc1Cl 825752397 ACFBIEJEBMZSRV-WCQYABFASA-N 299.798 2.089 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)[C@](C)(CO)C2)c1 827699838 MTPGZEOVMKMTFV-LRDDRELGSA-N 279.380 2.241 10 20 CECD Cc1cc(O)c(CN(C)CC(=O)NC2CC2)cc1Cl 824534520 FSPDPILCXHQCMO-UHFFFAOYSA-N 282.771 2.064 10 20 CECD C[C@H](NC(=O)[C@@]1(C(=O)O)CC1(C)C)c1ccccc1O 902516196 BZZFDPYLIWYBBQ-BJOHPYRUSA-N 277.320 2.070 10 20 CECD C[C@H](CC(=O)O)NCc1ccc(N2CCCC2)cc1 738890653 JEEFIXUSCFXKAC-GFCCVEGCSA-N 262.353 2.240 10 20 CECD CC(C)(CNC(=O)c1cccc(O)c1O)OCC1CC1 839846393 UMKQXGRKKXYPKA-UHFFFAOYSA-N 279.336 2.033 10 20 CECD CNC(=O)C[C@H](C)N[C@H](C)c1cc2c(cc1O)CCCC2 834898691 BLSXIJLGJQVTKA-NWDGAFQWSA-N 290.407 2.446 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@H]1CCCNC1 841032354 BMMJMXDAOYUVEZ-JSGCOSHPSA-N 279.403 2.369 10 20 CECD CCCCCC(=O)N(CC(=O)O)Cc1ccccc1O 911483496 BHPOJOWHPRLVET-UHFFFAOYSA-N 279.336 2.386 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@H]2CCCNC2=O)c(O)c1 840824923 AWJXHLAPYPEYKF-CHWSQXEVSA-N 276.380 2.186 10 20 CECD COC[C@@H](CCO)N[C@@H](C)c1ccc(Cl)cc1O 841756233 WGLNTGOCVXSTQT-GXSJLCMTSA-N 273.760 2.094 10 20 CECD CN(C)c1ccc(CN2C[C@H]3[C@H](C2)C3(F)F)cc1 844461158 ITDWAWRZQMJVKV-STQMWFEESA-N 252.308 2.450 10 20 CECD CCCOC(=O)[C@H](C)N1CCCc2cc(CN)ccc21 843350093 IVNFRUVQCVGISM-LBPRGKRZSA-N 276.380 2.240 10 20 CECD COc1cccc([C@@H](C)NCCCCCO)c1O 846166606 AWZZSDPYGYPTBW-LLVKDONJSA-N 253.342 2.214 10 20 CECD O=C(COCC(F)(F)F)NCc1cc(Cl)ccc1O 846473093 OQWOSICJJNCPCP-UHFFFAOYSA-N 297.660 2.241 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](CO)CC(F)F 840941618 DSLCXLKYQHUYLZ-GFCCVEGCSA-N 272.339 2.167 10 20 CECD CCc1cccc(CN2CC[C@@H](C(=O)OC)[C@H]2C)c1O 848905009 FPZSMFCSBDODSS-BXUZGUMPSA-N 277.364 2.338 10 20 CECD CC1(C)C[C@@]1(C)NC(=O)/C=C/c1ccc(O)c(O)c1 856138436 YNXZATBZECJFFF-KEDPEKRHSA-N 261.321 2.416 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)NCc1ccc2c(c1)CCCO2 921618573 JHLPKBXBAWOVQL-OLZOCXBDSA-N 290.407 2.404 10 20 CECD Cc1cc(C(=O)NCc2cc(Cl)ccc2O)n[nH]1 857547624 MUQFIMICDMUSGH-UHFFFAOYSA-N 265.700 2.007 10 20 CECD Cc1ccc(NC(=O)/C=C/c2ccc(O)c(O)c2)c(O)n1 756242490 NCTKXQMHLJVEQD-QPJJXVBHSA-N 286.287 2.159 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCC1=CCCC1 856096685 MLBKMAVKEZKDIZ-VURMDHGXSA-N 259.305 2.338 10 20 CECD C[S@](=O)c1ccc(CNCc2ccccc2O)cc1 754333398 CZICCVXCCVEYSP-IBGZPJMESA-N 275.373 2.419 10 20 CECD C[C@@H](NC(=O)Nc1cnns1)c1ccc(N(C)C)cc1 755342147 BJJWEEKHFDUQJT-SECBINFHSA-N 291.380 2.487 10 20 CECD C/C=C/C[C@@H](CO)NCc1ccc(OCC)cc1O 769937165 NJBJYWJGKHXANV-LQPUYASZSA-N 265.353 2.208 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc2nonc2c1 1117727380 QSQPQBZGODVTLJ-UHFFFAOYSA-N 283.287 2.201 10 20 CECD Cc1ccc(CN[C@H]2COc3ccccc3[C@H]2O)c(O)c1 877537306 KPTHPTKAZLGSIJ-WMLDXEAASA-N 285.343 2.285 10 20 CECD COc1ccc(CNCCNC(=O)[C@H]2CC2(C)C)cc1C 1125807957 TYZLUODSNHHTGK-CQSZACIVSA-N 290.407 2.256 10 20 CECD COc1ccc(O)c(CN(CCO)CC(C)(C)C)c1 775680926 LGDHBUSJGYSACF-UHFFFAOYSA-N 267.369 2.241 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1c(O)cccc1F 886548130 XVHMSGQDKVDZJN-ZJUUUORDSA-N 289.372 2.005 10 20 CECD CN[C@@H](CC(C)C)C(=O)NCc1ccc(N(C)C)cc1C 884223011 HAJNHLIUKYXQLR-INIZCTEOSA-N 291.439 2.311 10 20 CECD C[C@@H]1CC[C@@H](Cn2cc(COc3ccc(N)cc3)nn2)O1 881393068 HJCJWOPAWAOUML-ABAIWWIYSA-N 288.351 2.007 10 20 CECD CC(C)=C(C)C(=O)OCC(=O)c1ccc(O)c(O)c1 784037810 ICVDWJZPXXOFIQ-UHFFFAOYSA-N 264.277 2.180 10 20 CECD CCN(C)C[C@@H]1CCN(Cc2cc(F)cc(F)c2O)C1 894086803 NEDSZQPFUDINPZ-NSHDSACASA-N 284.350 2.444 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CCC(F)(F)CC1 794292783 BZGKKDSXFVMQTF-DUXPYHPUSA-N 283.274 2.369 10 20 CECD COc1ccc(CNC(=O)N[C@@H]2CC[C@H](C)C2)c(O)c1 793066085 KNIMNXRUEYWWTO-CMPLNLGQSA-N 278.352 2.389 10 20 CECD C[C@@H](CCCO)NCc1c(O)cccc1Br 706872048 WYSRFVNDDDQRJD-VIFPVBQESA-N 288.185 2.405 10 20 CECD CN[C@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1326200016 LYHPACWNCXPZRU-INIZCTEOSA-N 273.424 2.471 10 20 CECD CC[C@H](N[C@H]1CCCN(CC)C1=O)c1ccccc1O 722362083 XCWNRRRNTFHBIH-KBPBESRZSA-N 276.380 2.444 10 20 CECD Nc1ccc(CN2CCSC3(CCOCC3)C2)cc1 1334774043 CVLFGEYBNNWXAE-UHFFFAOYSA-N 278.421 2.367 10 20 CECD CC[C@@H](CO)NCc1ccc(Br)cc1O 691400948 HXSWIQRZBCPENM-JTQLQIEISA-N 274.158 2.015 10 20 CECD Cc1ccc(CN[C@H]2C[C@@H]3C[C@]3(C(=O)O)C2)c(O)c1 1607783698 AFKRNNPFBTZLCJ-XUJVJEKNSA-N 261.321 2.044 10 20 CECD 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SMKPUFBSTTZFTJ-PHIMTYICSA-N 298.180 2.233 10 20 CECD CC[C@@H](C)N(CC(=O)OC)Cc1cc(F)cc(F)c1O 1332005149 RQSBGDCRDRRPNJ-SECBINFHSA-N 287.306 2.444 10 20 CECD c1nc(=NCc2ccc(N3CCCC3)cc2)n(CC2CC2)[nH]1 1337726487 ILDUYELQYWJKGV-UHFFFAOYSA-N 297.406 2.322 10 20 CECD CC(C)Cn1ccc(C(=O)NCc2ccc(N)cc2)n1 1263304018 PPXNUUNNLSJJLO-UHFFFAOYSA-N 272.352 2.051 10 20 CECD O=C(O)c1cnc(SCCc2cnoc2)s1 1608979094 JMNXJOZMWDCHCS-UHFFFAOYSA-N 256.308 2.164 10 20 CECD Cc1cccc(O)c1CN1C[C@H]2CC[C@H]1[C@H](C(=O)O)C2 1600543348 SHRRUIFAAPYMJI-SCRDCRAPSA-N 275.348 2.386 10 20 CECD Nc1ccc(CN[C@H]2Cc3cccc(O)c3C2)cc1 1580445720 RNQXQVPLFJWIAT-AWEZNQCLSA-N 254.333 2.231 10 20 CECD O=C(O)C1(C(=O)NCc2c(O)ccc3ccccc23)CCC1 1594863303 ZTHSKPRALWDWCR-UHFFFAOYSA-N 299.326 2.417 10 20 CECD O=C1NC(=S)S/C1=C\c1ccc(C(=O)O)c(F)c1 1777698943 PKQFBUWYIISCHN-YWEYNIOJSA-N 283.305 2.013 10 20 CECD COc1ccc(O)c(CNCC[C@H]2C[C@H]3CC[C@H]2O3)c1 839162863 DGGHSTIATGULQB-SGIREYDYSA-N 277.364 2.448 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@H]2CCOC2)c1 252806387 HBFOFZVAXVUPNA-WOPDTQHZSA-N 265.353 2.476 10 20 CECD C[C@H](N[C@H](C)c1ccc(F)cc1O)C(=O)NC(C)(C)C 181235090 MJBNQZWGYJUUEX-ZJUUUORDSA-N 282.359 2.485 10 20 CECD Oc1cccc2c1[C@@H](NCCN1CCSCC1)CC2 297493335 BNGLPMAYJMJVOM-ZDUSSCGKSA-N 278.421 2.018 10 20 CECD CCNC(=O)C(C)(C)NCc1cc(Cl)ccc1O 312883498 YUCGJFXECJRVAE-UHFFFAOYSA-N 270.760 2.050 10 20 CECD O=C(O)C1CCC(NCc2ccc3c(c2)CCO3)CC1 86735530 ZJLCBVALHMTSGH-UHFFFAOYSA-N 275.348 2.355 10 20 CECD CC(C)OCC(C)(C)NC(=O)c1cccc(O)c1O 396394962 VGPUKEFBKWGTLX-UHFFFAOYSA-N 267.325 2.031 10 20 CECD Cc1cc(C(=O)N(C)Cc2ccc(N(C)C)cc2)no1 60678763 QIPZWHDGLXTCAJ-UHFFFAOYSA-N 273.336 2.321 10 20 CECD CC[C@H](NCCO)c1cc(Br)ccc1O 20597023 NMEMWGIOECCRQW-JTQLQIEISA-N 274.158 2.188 10 20 CECD COc1cccc(CNC(=O)C[C@H]2C=CCC2)c1O 68488496 KYPDUOVIFZHSOR-NSHDSACASA-N 261.321 2.373 10 20 CECD c1c[nH]c(CNCc2ccc(N3CCSCC3)cc2)n1 67693632 YOIKBBZAADLTLV-UHFFFAOYSA-N 288.420 2.253 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)cn1 183484557 KRLULWNIJWDDMZ-NSHDSACASA-N 286.331 2.162 10 20 CECD CCCC[C@@H](COC)NC(=O)NCc1ccccc1O 76978757 BGHQCBOXZGRNMX-ZDUSSCGKSA-N 280.368 2.397 10 20 CECD CN(C)C(=O)CC1CCN(Cc2cc(F)ccc2O)CC1 180328307 HBSPGTRYVKRTSA-UHFFFAOYSA-N 294.370 2.222 10 20 CECD COc1ccc(O)c(CNCCC(=O)OC(C)(C)C)c1 182445127 CRGWDLPNORBIIV-UHFFFAOYSA-N 281.352 2.222 10 20 CECD CC(C)[C@@H](N)CCN(C)Cc1cc(F)ccc1O 220327167 DUQLOBMURDJFMV-ZDUSSCGKSA-N 254.349 2.337 10 20 CECD CCN(Cc1cnn(C)c1)Cc1cc(C)ccc1O 92438108 HUPDAMQASBFUPV-UHFFFAOYSA-N 259.353 2.456 10 20 CECD CN(C)c1ccc(CN2CCOC3(CCOCC3)C2)cc1 91894513 ZQULGSWXYJBBOE-UHFFFAOYSA-N 290.407 2.134 10 20 CECD CCC1(O)CCN(Cc2cccc(OC)c2O)CC1 271187884 KFZSWBDZNVWMEZ-UHFFFAOYSA-N 265.353 2.138 10 20 CECD Cc1cccc(CN2CCOC[C@@H]2[C@@H]2CCCC2=O)c1O 375472599 WZIBSEGEINBOLY-LSDHHAIUSA-N 289.375 2.271 10 20 CECD COC(=O)C(C)(C)CCNCc1ccc2c(c1)CCO2 281008370 WODFLIGKHIKYOP-UHFFFAOYSA-N 277.364 2.300 10 20 CECD CCOc1ccc(O)c(CN2CCN(CC)C[C@H]2C)c1 289577968 JVQBDGBTSMGZLS-CYBMUJFWSA-N 278.396 2.317 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CCC[C@@H]2C[C@@H]21 804294471 LXBSSLIGQXWPGS-GJJFQZOLSA-N 259.305 2.122 10 20 CECD CCN(CC)c1ccc(CNc2ncn(C)n2)cc1F 292483270 QZGGDTUTXUZKSZ-UHFFFAOYSA-N 277.347 2.413 10 20 CECD CCOCc1cc(CNC[C@@H](O)CC)ccc1OC 291733754 NZKAPWQYTJIISD-AWEZNQCLSA-N 267.369 2.092 10 20 CECD COc1cccc(O)c1CN1CCC[C@@H]1c1nc(C)no1 809720897 JDPVXXVVGYOKPD-GFCCVEGCSA-N 289.335 2.429 10 20 CECD CC[C@@H](NC[C@@H](N)C1CC1)c1ccc(F)cc1O 817964547 CHXNDYQYBPDYRH-CHWSQXEVSA-N 252.333 2.309 10 20 CECD CC[C@@H](NC[C@]1(COC)CCCN1)c1ccc(F)cc1O 817973988 HXUAYHGURKGTMC-ZBFHGGJFSA-N 296.386 2.341 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@](C)(O)C1CCC1 813455063 HYFNFWUAUGTRDD-KRWDZBQOSA-N 290.407 2.228 10 20 CECD Oc1c(F)cc(Cl)cc1CNCCOCCF 827949926 PTUKTSMMAULXSM-UHFFFAOYSA-N 265.687 2.260 10 20 CECD CN(C)c1ccc(CN2CCC(C(=O)O)CC2)cc1F 820548113 YWYPRTZKNLNDFN-UHFFFAOYSA-N 280.343 2.188 10 20 CECD CN(C)c1ccc(CN2CCN3CC(F)(F)C[C@H]3C2)cc1 828763072 PPPLCXAROXJPPW-HNNXBMFYSA-N 295.377 2.278 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCc3n[nH]cc32)c1O 821269669 GBKTZXBMGLWQFF-UHFFFAOYSA-N 289.310 2.410 10 20 CECD C[C@@H](NC(=O)Cc1n[nH]c2c1CCCC2)c1ccccc1O 827941668 VHRPFNOGBRMXTA-LLVKDONJSA-N 299.374 2.414 10 20 CECD CCCONC(=O)N(C)Cc1ccc(N(C)C)cc1 828232558 PQMWSRQCEKUDES-UHFFFAOYSA-N 265.357 2.236 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)[C@@H](C)C(=O)O 901448805 NBVGDNVAKGIYTB-NEPJUHHUSA-N 264.369 2.260 10 20 CECD Cc1cc(C)c([C@@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c(O)c1 834906844 HUBFCSXDGVRVTF-FRRDWIJNSA-N 276.380 2.314 10 20 CECD CO[C@@H]1C[C@H](NC(=O)c2ccc(C)c(O)c2O)C12CCC2 838118392 UUFDITMBOCTKAE-NWDGAFQWSA-N 291.347 2.094 10 20 CECD CCCC(=O)N(C)CCN(C)c1ccc(OC)cc1 844852591 RRLUNJANTWZWRU-UHFFFAOYSA-N 264.369 2.390 10 20 CECD COCCCCN(C)Cc1cc(OC)c(OC)cc1O 841692399 PWTLOKQPOHVHIE-UHFFFAOYSA-N 283.368 2.268 10 20 CECD CCC[C@H]1CNCCN1Cc1ccc(OCC)cc1O 843057664 GUPKGBXSEQNXEZ-AWEZNQCLSA-N 278.396 2.365 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1(O)CCCC1 840933980 LBEAMNGXNQDKMN-UHFFFAOYSA-N 262.397 2.456 10 20 CECD CCOc1cccc([C@@H]2NC(C)(C)C(=O)N2CC)c1O 840832951 OIUGFMYMSRBXMF-CYBMUJFWSA-N 278.352 2.020 10 20 CECD CC[C@H](C)[C@@H](OC(=O)c1cc(O)cs1)C(=O)OC 922437620 JVROYQJTOOZPMZ-OIBJUYFYSA-N 272.322 2.198 10 20 CECD O=C(NCc1ccccc1O)c1cccc2c1OCO2 748345973 TULWWFVZWYVZOU-UHFFFAOYSA-N 271.272 2.051 10 20 CECD Cc1ccc(CN(C)c2ccc(OCC(=O)O)cc2)cn1 848711421 ODEXPKYXXKQENZ-UHFFFAOYSA-N 286.331 2.490 10 20 CECD CCOc1cccc(CN[C@H](C)CCCN)c1O 841080012 MTUUUEUTULQEJO-LLVKDONJSA-N 252.358 2.008 10 20 CECD CCc1cccc(CN2CCCN(CC)C(=O)C2)c1O 848904887 CJWYHPVZZUWSKZ-UHFFFAOYSA-N 276.380 2.009 10 20 CECD CC[C@H](C)C[C@H](CO)NCc1cc([N+](=O)[O-])ccc1O 842755003 VLUSKMZQXZXQMB-CMPLNLGQSA-N 282.340 2.187 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C3OCCO3)C2)cc1 932002288 VZPAWVDYISVHBD-HNNXBMFYSA-N 290.407 2.338 10 20 CECD CC[C@]1(C)CCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 768464175 OARHNSSODOJADR-GDBMZVCRSA-N 277.364 2.440 10 20 CECD CCCCN1CC(=O)N[C@H]1c1cc(F)c(N(C)C)cc1F 864379731 QKLBTPIPHWWPHR-OAHLLOKOSA-N 297.349 2.261 10 20 CECD CC(C)CN1CC(=O)N[C@@H]1c1cc(Cl)cc(F)c1O 768273545 KGCNOPVLWJANKV-ZDUSSCGKSA-N 286.734 2.271 10 20 CECD C[C@H]1C[C@@H](NC[C@H]2C[C@H](N)C2)c2c(O)ccc(F)c21 873255741 HRGDXMLYXKFHRT-QFOLPQNPSA-N 264.344 2.407 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCC[C@@H](F)C2)c(O)c1O 1118279726 LKSSASATVRIBCG-NXEZZACHSA-N 267.300 2.417 10 20 CECD CC[C@H](NCCCn1cncn1)c1ccc(N(C)C)cc1 776975375 PYCUWVCCOPYMKX-INIZCTEOSA-N 287.411 2.475 10 20 CECD CC(=O)c1ccc(C(=O)NCc2ccc(O)c(O)c2)s1 778914374 IXWURGCDQMUPSY-UHFFFAOYSA-N 291.328 2.292 10 20 CECD COc1cc(O)c(CN2CCC[C@@H](CCO)C2)cc1OC 775682495 ZCBIJVTVYQZZFV-LBPRGKRZSA-N 295.379 2.004 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2nccs2)c1 770424789 YKJSVCKWNKCJBV-QMMMGPOBSA-N 278.333 2.348 10 20 CECD C[C@@H](NCCCO)c1cccc(C(F)(F)F)c1O 798179937 ULHZPKNDOGNVKE-MRVPVSSYSA-N 263.259 2.444 10 20 CECD O=C(O)[C@H]1CC[C@@H](NCc2cc(F)cc(F)c2O)CC1 1339267235 IFELXDVVBWPIPH-DKTWLAJQSA-N 285.290 2.403 10 20 CECD Cc1cc(Br)cc([C@H](C)N[C@H](C)CO)c1O 187049378 WSIIXGHUUHXWOV-BDAKNGLRSA-N 288.185 2.495 10 20 CECD COCCOCCCN[C@@H](C)c1ccc(F)cc1O 62745340 SKOJMCZNDVZAQD-NSHDSACASA-N 271.332 2.235 10 20 CECD COC[C@H](C)NCc1cc(Br)cc(F)c1O 715743472 BVXTUQUKZJYMEE-ZETCQYMHSA-N 292.148 2.418 10 20 CECD OC[C@@H](CC(F)(F)F)NCc1c(O)cccc1Cl 717714259 XJDVPMPXONFFST-SSDOTTSWSA-N 283.677 2.449 10 20 CECD C=C=CCNC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 1346389660 IRZHOMFTBDIETR-LBPRGKRZSA-N 259.353 2.454 10 20 CECD C[C@H](O)C[C@H](C)CN[C@H](C)c1cc(C(=O)O)ccc1O 1609789240 YWJUGLOUWGSERD-GARJFASQSA-N 281.352 2.148 10 20 CECD CCC[C@@](C)(NCc1cc(C)cc(OC)c1O)C(=O)O 1605198632 DRVHWZHSCPECIN-OAHLLOKOSA-N 281.352 2.442 10 20 CECD CCOc1ccc(CN2CC[C@@H](C)C[C@@H]2C(=O)O)c(O)c1 1605690669 MZMVZILMRCFVOS-BXUZGUMPSA-N 293.363 2.476 10 20 CECD CCN(CC)C(=O)CNCc1cc(Cl)ccc1O 134492709 VEFZWDWGLPTYBE-UHFFFAOYSA-N 270.760 2.004 10 20 CECD C[C@H](CNCc1ccc2c(c1)CCO2)N(C)C1CC1 105487959 OTBOHINJSBLWEF-GFCCVEGCSA-N 260.381 2.194 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)NC[C@H](C)N)c1 1579656570 ZKTIQPPNAHZVRA-LBPRGKRZSA-N 285.391 2.480 10 20 CECD C[C@H](NCC1(C)CC1)c1cccc(-c2nn[nH]n2)c1O 1589979586 WUAIQIKRSWIEEC-VIFPVBQESA-N 273.340 2.023 10 20 CECD C[C@H](N[C@@H]1CC[C@H]2C[C@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589953724 FQQMVPBFOZYIEW-FIQHERPVSA-N 299.378 2.412 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](CCO)C(C)C)c1O 162252819 GJEFMARVPLQSBM-CQSZACIVSA-N 283.343 2.231 10 20 CECD CCc1cccc(CN[C@H]2CCn3ccnc3C2)c1O 848903883 GGBXLCTXBHVSQW-AWEZNQCLSA-N 271.364 2.256 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@H]1CN 253202410 YVVYBSYCBBGLND-DZGCQCFKSA-N 261.413 2.169 10 20 CECD CCOC(C)(C)CNCc1cc2c(cc1O)OCO2 159179961 UZCJSISJKOODFE-UHFFFAOYSA-N 267.325 2.026 10 20 CECD C[C@@H]1C[C@H](N[C@H]2CCc3cccc(O)c32)CCN1C 312064491 DXMDSHBESRGEOI-BNOWGMLFSA-N 260.381 2.452 10 20 CECD Oc1cccc(Cl)c1CNCCOC[C@H]1CCCO1 115624998 JCQVURFQQMKGRW-LLVKDONJSA-N 285.771 2.331 10 20 CECD C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCCO1 171143978 YHHFWLGUEKAEAL-CYBMUJFWSA-N 291.395 2.073 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(Cl)cn2C)c1 114542755 AXQGLEXSCZEAQD-UHFFFAOYSA-N 294.738 2.323 10 20 CECD CC1(C)[C@@H](O)C[C@@H]1NCc1cc(Cl)ccc1O 128187893 GTVBHBAFISVKRL-RYUDHWBXSA-N 255.745 2.295 10 20 CECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)[C@H]1CCOC1 135201746 RUEGBRCWRXPLAD-ZBFHGGJFSA-N 290.407 2.038 10 20 CECD COc1cc(Cl)cc(CNC[C@H]2CCOC2)c1O 228671160 YMQJTOCHLFPKII-SECBINFHSA-N 271.744 2.180 10 20 CECD Oc1c(Cl)cc(Cl)cc1CNCCc1ncn[nH]1 80573538 CTDKNQKFRAZDGX-UHFFFAOYSA-N 287.150 2.149 10 20 CECD C[C@H](O)C[C@H]1CCCN1Cc1ccc(N(C)C)cc1 93481987 GBKHNOHONYHFIY-XJKSGUPXSA-N 262.397 2.488 10 20 CECD CCCOc1ncc[nH]c1=NCc1cccc(OC)c1O 527880591 MFRVUEASJREQRX-UHFFFAOYSA-N 289.335 2.014 10 20 CECD CCOc1ccc(N(CC)CC2OCCO2)cc1 272125689 TYTFNJHADXVLMY-UHFFFAOYSA-N 251.326 2.285 10 20 CECD CCC[C@@](C)(N)C(=O)NCc1c(O)ccc2c1CCCC2 272463746 OXHJJRUFILMHRH-QGZVFWFLSA-N 290.407 2.405 10 20 CECD CCOc1cc(Sc2ncc(C(=O)OC)s2)ncn1 294940290 LCCNEGODSOTHKG-UHFFFAOYSA-N 297.361 2.270 10 20 CECD C[C@@H](N[C@@H]1CCCNCC1)c1cc([N+](=O)[O-])ccc1O 817967860 CVWAEUYSXKSFPB-GHMZBOCLSA-N 279.340 2.093 10 20 CECD CCCCN(C)C[C@@H](C)NC(=O)c1cc(O)cs1 811600677 LBAARMLLGVZNHO-SNVBAGLBSA-N 270.398 2.304 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@@H](C)S(C)(=O)=O)c(O)c1 815598245 QBYIXZWRXWRWLV-NEPJUHHUSA-N 285.409 2.093 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@H](N)C(C)C)c1 817959725 URKCHXMUPHBMEH-ZWNOBZJWSA-N 252.358 2.035 10 20 CECD Cc1cc(N(C)C(=O)/C=C/c2cccnc2)ccn1 492566637 OFJXGNUKOWAMSH-AATRIKPKSA-N 253.305 2.461 10 20 CECD O=C(CCc1ccon1)NCCCSc1nccs1 827475346 YJQQMERDAQVLJO-UHFFFAOYSA-N 297.405 2.362 10 20 CECD C[C@H](NCCCON)c1cc(Br)ccc1O 902426157 RNUXVTMILKKHEF-QMMMGPOBSA-N 289.173 2.086 10 20 CECD CC(C)[C@@H](OC(=O)c1cc(O)cs1)C(=O)N1CCCC1 732355957 WMNLOPGZPTUGGU-GFCCVEGCSA-N 297.376 2.258 10 20 CECD CN(C)c1ccc(CN[C@@H]2Cc3ccccc3[C@H]2N)cc1 904462587 WXIJCMLUMWHSMI-QZTJIDSGSA-N 281.403 2.467 10 20 CECD CC[C@H](NC[C@]1(C)CCC(=O)N1)c1ccc(F)cc1O 834910779 ZISBENQQKWHHET-WFASDCNBSA-N 280.343 2.241 10 20 CECD CCC1CN(Cc2cc(OC)c(OC)cc2O)C1 835073409 AIUGTMOLDCUNLO-UHFFFAOYSA-N 251.326 2.251 10 20 CECD Cc1nc([C@H]2CCN(Cc3ccc(N(C)C)cc3)C2)n[nH]1 839658195 DKRIFVBMIMALRA-AWEZNQCLSA-N 285.395 2.169 10 20 CECD Oc1cccc(Cl)c1CNC[C@@H](O)c1ccco1 747098895 DVZDBEDWQOPNJQ-GFCCVEGCSA-N 267.712 2.462 10 20 CECD O=C(O[C@H](C(=O)O)c1ccccc1)c1cc(O)cs1 740297474 HVYDECUJHBBMRE-NSHDSACASA-N 278.285 2.436 10 20 CECD CCOC(=O)CCCCOC(=O)c1cc(O)cs1 740959746 KDCAYFWCQGIJNS-UHFFFAOYSA-N 272.322 2.344 10 20 CECD CCOc1ccc(CNC2CCC(N)CC2)c(O)c1 843107503 QOJSWCDOBFGTSK-UHFFFAOYSA-N 264.369 2.150 10 20 CECD Cc1cc(O)c(CN[C@@H](CCN)C(F)F)cc1C 841073695 KCBRNCFENFYESC-NSHDSACASA-N 258.312 2.081 10 20 CECD COc1ccc(CNC[C@@]2(C)CCCNC2)cc1C 841058374 WPQPSOHBUKJJHP-INIZCTEOSA-N 262.397 2.483 10 20 CECD C[C@@H](NCc1cccc(F)c1O)[C@@H]1CCCNC1 841032706 FNZLQYLFLNTKFS-GHMZBOCLSA-N 252.333 2.009 10 20 CECD C[C@@H]1C[C@H](N[C@H](C)c2cc(F)cc(F)c2O)CO1 842928897 KSXGPGLWFDXTHH-MRTMQBJTSA-N 257.280 2.498 10 20 CECD CC[C@H](C(=O)NCc1ccc(N(C)C)cc1C)[C@H](C)O 842231601 MIIFBJFMWKYEQA-WFASDCNBSA-N 278.396 2.084 10 20 CECD CN(C)c1ccc([C@H](N)CNCc2cccc(O)c2)cc1 841044628 XBDIDGMPJYJQPD-QGZVFWFLSA-N 285.391 2.248 10 20 CECD COC(=O)N1CC(N[C@@H](C)c2ccc(Cl)cc2O)C1 841751705 OJAPTMLKWPCYHD-QMMMGPOBSA-N 284.743 2.147 10 20 CECD C[C@H]1CCCN(Cc2cccc(F)c2O)[C@H]1CN 843052573 VUTXLBFIHWQBMC-GWCFXTLKSA-N 252.333 2.091 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNCCOCCF)c1O 853091859 WQBZSASDLGXJNK-UHFFFAOYSA-N 292.694 2.030 10 20 CECD COCC1(NCc2cc(Cl)cc(OC)c2O)CC1 697542268 GROQCMAZYUUVQN-UHFFFAOYSA-N 271.744 2.323 10 20 CECD COc1ccc(N(C)CCC2OCCCO2)cc1OC 754642143 YDLKSIQLOGHGGU-UHFFFAOYSA-N 281.352 2.293 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CCc2c[nH]nc2C1 758503277 FFHHJUJTNHRTOU-JTQLQIEISA-N 277.755 2.416 10 20 CECD CC[C@H](C)CS(=O)(=O)N[C@H](C)c1ccccc1O 867834918 UXGQQOAHEBWULU-WDEREUQCSA-N 271.382 2.419 10 20 CECD CCc1ocnc1C(=O)NCc1cc(C)ccc1O 862760072 KXQBYZODQHEREW-UHFFFAOYSA-N 260.293 2.181 10 20 CECD C[C@H](NCCC1(C)OCCO1)c1cc([N+](=O)[O-])ccc1O 760883338 JXMNJJOQPJQJIX-JTQLQIEISA-N 296.323 2.104 10 20 CECD CN1CCN(c2ccc(CNCC3(C)CC3)cc2F)CC1 1116488070 LIDKMYHFLDAIGY-UHFFFAOYSA-N 291.414 2.467 10 20 CECD CCN1CCN(Cc2cc(Cl)ccc2O)C(C)(C)C1=O 779198285 CJNGIYOLZSDISZ-UHFFFAOYSA-N 296.798 2.488 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CC[C@H](n2cncn2)C1 777219165 CXHUEAZMHUOKTD-NSHDSACASA-N 296.733 2.223 10 20 CECD CCn1nccc1NC(=O)NCc1ccc(N(C)C)cc1 776024116 WJEUKWYTUVFHDY-UHFFFAOYSA-N 287.367 2.291 10 20 CECD CSC[C@@](C)(O)CNCc1cc(Cl)cc(F)c1O 776208942 FDDXGTTYQDBSHA-LBPRGKRZSA-N 293.791 2.388 10 20 CECD C[C@H](CC(=O)NCc1ccc(O)c(O)c1)c1ccncc1 778915247 SLDJHEPRETZRGU-LLVKDONJSA-N 286.331 2.303 10 20 CECD CCN(C)c1ccc(Cn2cc([C@@](C)(N)CC)nn2)cc1 881313148 BCISJGPGHQMKDZ-INIZCTEOSA-N 287.411 2.366 10 20 CECD COC(=O)[C@@H]1CCN(Cc2c(O)cccc2Cl)[C@@H]1C 787420628 JRIPXIHIUUBXCV-NXEZZACHSA-N 283.755 2.429 10 20 CECD CN(C)c1ccc(CN2CCC[C@@]2(C)CO)cc1F 789557540 KCBAPFIPRUPXSH-HNNXBMFYSA-N 266.360 2.239 10 20 CECD COC(=O)[C@H]1CCN(Cc2cc(Cl)ccc2O)[C@@H]1C 787420674 KIVASMJBJVRQBP-SKDRFNHKSA-N 283.755 2.429 10 20 CECD COc1cc(C)cc(CNCCC(=O)NC(C)(C)C)c1O 894248906 LLTOUJCPTVUSOS-UHFFFAOYSA-N 294.395 2.104 10 20 CECD COc1ccc2c(c1)CCCN2Cc1nnc(C)o1 797720393 YBHJBBFANPDZSM-UHFFFAOYSA-N 259.309 2.339 10 20 CECD CCn1cnc2c(NCc3ccc(OC)cc3O)ncnc21 795284033 GRDXSPCBQBXBOK-UHFFFAOYSA-N 299.334 2.173 10 20 CECD Cc1cc(C)c(O)c(CN2C[C@@H](C)O[C@@]3(CCOC3)C2)c1 794705800 QYLYMBVQLPHUQJ-PBHICJAKSA-N 291.391 2.389 10 20 CECD COc1cc(Cl)cc(CNCC2(N(C)C)CC2)c1O 397797215 GMZSJPAYNAODER-UHFFFAOYSA-N 284.787 2.238 10 20 CECD CCOc1cccc(CNCc2cc(C)ncn2)c1O 756991553 VKIFMHDXVJSHAS-UHFFFAOYSA-N 273.336 2.179 10 20 CECD CC[C@@H](NC[C@@H](C)CN1CCOCC1)c1ccccc1O 155936752 PKOXZESLHKKWAD-GDBMZVCRSA-N 292.423 2.401 10 20 CECD COc1ccc(N(C)CCCC(=O)O)cc1OC 258877940 LQZJGFAQSXBXFN-UHFFFAOYSA-N 253.298 2.005 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCC[C@@]1(C)N 827205402 MINDJSGTBYRCKT-XJKSGUPXSA-N 276.380 2.258 10 20 CECD Nc1ccc(NC(=O)NCC[C@H]2C[C@H]3CC[C@H]2O3)cc1 841299178 VUKRZCRMFORJIS-ZLKJLUDKSA-N 275.352 2.348 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCc2cncn2C)c1 401718731 IGJGFEGUYWJWRY-GFCCVEGCSA-N 259.353 2.327 10 20 CECD CN(C)CC1CCN(Cc2cc(F)cc(F)c2O)CC1 708433161 IFXCBRZRPPBGIM-UHFFFAOYSA-N 284.350 2.444 10 20 CECD C[C@@H]1C[C@H](NCc2cc(F)cc(F)c2O)CCN1C 708505691 ZQGWNDQLLDRVFR-BXKDBHETSA-N 270.323 2.243 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2c(C)cnn2C)c1 394076536 BUOMVHDCSOQMDD-LLVKDONJSA-N 275.352 2.294 10 20 CECD C[C@H](O)CN[C@H](C)c1cc(Br)ccc1O 134835036 NWZHVBGMCUEXMR-JGVFFNPUSA-N 274.158 2.186 10 20 CECD Cc1ccc(C(=O)N2CCSC(C)(C)C2)c(O)c1O 182576872 URIAIIYLJMHVMB-UHFFFAOYSA-N 281.377 2.374 10 20 CECD C[C@@H](O)CN(C)Cc1ccc(N2CCCCC2)cc1 130819146 KFZILNXWWFVKPH-CQSZACIVSA-N 262.397 2.490 10 20 CECD O=C(CCc1c[nH]cn1)NCCCSc1nccs1 193247977 QJTZSAIYUBEACX-UHFFFAOYSA-N 296.421 2.097 10 20 CECD CN(C)c1ccc(CN(CCC(=O)O)C2CC2)cc1 83662632 YONMLHKNFRZANQ-UHFFFAOYSA-N 262.353 2.192 10 20 CECD COCC[C@@](C)(O)CNCc1ccc(N2CCCC2)cc1 227215756 QXGBXXJRHISVLR-QGZVFWFLSA-N 292.423 2.164 10 20 CECD Cc1cc(C(=O)N(C)CC(=O)O)c(C)n1-c1ccccc1 237167430 DLUZVTWFJXTKPQ-UHFFFAOYSA-N 286.331 2.251 10 20 CECD CC(=O)N1CCC[C@@H](CNCc2cc(C)c(C)cc2O)C1 279934292 YJDANEUXBLSQDM-HNNXBMFYSA-N 290.407 2.357 10 20 CECD C[C@H]1C[C@@H](N2CCCC2)CN1Cc1ccccc1O 289740634 QCYHBWOHOAYDMP-DZGCQCFKSA-N 260.381 2.451 10 20 CECD Cc1cccc(CN[C@H](c2nncn2C)C(C)C)c1O 289621555 WKKQPMCEWWRKEU-ZDUSSCGKSA-N 274.368 2.316 10 20 CECD CC[C@@H](C)NC(=O)CN(CC)c1ccc(OC)c(OC)c1 299273163 KPVVASKWYBAVMP-GFCCVEGCSA-N 294.395 2.445 10 20 CECD COCC(C)(C)N(C)Cc1ccc([N+](=O)[O-])c(OC)c1O 292730254 GDUKCKSXYGTRJE-UHFFFAOYSA-N 298.339 2.166 10 20 CECD CN(Cc1c(O)cccc1Cl)C[C@@H](O)C1CC1 809751577 IWYNYNCIWMEFPN-CYBMUJFWSA-N 255.745 2.248 10 20 CECD Cc1ccc(C(=O)OCCCN2CCCC2)c(O)c1O 800156810 AMHBTDHIYHMNDM-UHFFFAOYSA-N 279.336 2.049 10 20 CECD Cc1ccc(O)c([C@@H](C)NC[C@@H]2C[C@H](F)CN2)c1 817976272 JHTMFHPUOUJOAG-WOPDTQHZSA-N 252.333 2.051 10 20 CECD OCc1ccc(NCc2ccc(N3CCOCC3)cc2)nc1 811501685 SLENILFKQGRKOE-UHFFFAOYSA-N 299.374 2.023 10 20 CECD CNCCN[C@H](C)c1cccc(C(F)(F)F)c1O 817952543 RPXAAVHWOBEGBG-MRVPVSSYSA-N 262.275 2.281 10 20 CECD CCC[C@@H]1C[C@H]1C(=O)NCc1cccc(OC)c1O 812495263 GGBMXEUYAPQQIF-ZYHUDNBSSA-N 263.337 2.453 10 20 CECD c1cc(N2CCOCC2)ccc1CN1CC[C@H]2C[C@H]2C1 827506684 KDNAQSVXBNHSJJ-HOTGVXAUSA-N 272.392 2.365 10 20 CECD O=C(O)[C@H]1CCCCN1Cc1cccc(Cl)c1O 821510193 CNXHGEWGIFDZML-LLVKDONJSA-N 269.728 2.485 10 20 CECD O=C(O)c1ccnc(NCc2ccccc2O)c1[N+](=O)[O-] 738694187 VSTZYGHKZWNZCG-UHFFFAOYSA-N 289.247 2.006 10 20 CECD CCC/C=C/[C@@H](O)C(=O)N(C)Cc1ccccc1O 901055008 KCNPDBPOXQNKNI-AZWQULSGSA-N 263.337 2.068 10 20 CECD O=C(C[C@@H]1CCCN1)NCc1c(O)ccc2c1CCCC2 830597562 ONNMHYGJAIMLOW-ZDUSSCGKSA-N 288.391 2.029 10 20 CECD CCC1(CN[C@H](C)c2cc([N+](=O)[O-])ccc2O)COC1 834900908 TVEFPFQPJDCKAD-SNVBAGLBSA-N 280.324 2.378 10 20 CECD Cc1cc(C)c2c(N)c(C(=O)O[C@@H]3CCOC3)sc2n1 837383598 DKFSRWRPSNZKEA-SECBINFHSA-N 292.360 2.441 10 20 CECD CO[C@H]1CCCN(C(=O)NCCc2ccc(N)cc2)CC1 841956417 BAHQBWDZUGLXAD-HNNXBMFYSA-N 291.395 2.022 10 20 CECD C[C@H]1C[C@H](NCc2c(O)cccc2Cl)CCN1 841061607 LNLHBYBOGBKJGO-VHSXEESVSA-N 254.761 2.276 10 20 CECD C[C@H]1CCC[C@@H](CNC(=O)C(=O)Nc2ccc(N)cc2)C1 841022409 SVWQRZIRICGOJV-NWDGAFQWSA-N 289.379 2.150 10 20 CECD COCC[C@H](CO)N[C@@H](C)c1ccc(Cl)cc1O 841751631 IIZZJGHCFJJQLO-GXSJLCMTSA-N 273.760 2.094 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[S@@](=O)C[C@H](C)C1 840942155 UHXDWIIHMMMAFR-ZUOKHONESA-N 294.464 2.261 10 20 CECD CC(=O)c1cc(F)cc(CN(C2CC2)[C@H](C)C(=O)O)c1O 842471170 LZZTXKPIWNERIY-MRVPVSSYSA-N 295.310 2.171 10 20 CECD O=C(CCOCC(F)F)NCc1cc(Cl)ccc1O 846473607 NKYUPWXLBXFUJF-UHFFFAOYSA-N 293.697 2.334 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCCC[C@H]2CN)c1 841031473 SITIYDIIPDASJD-WFASDCNBSA-N 278.396 2.398 10 20 CECD CN(C)c1ccc(CNC(=N)NC2CCC2)cc1F 848998925 HIRSUBNVSCDHKJ-UHFFFAOYSA-N 264.348 2.058 10 20 CECD C[C@@H]1CCC[C@@H](C)N(C(=O)C(=O)Nc2ccc(N)cc2)C1 841049490 SJUCQLAVXSQSBB-VXGBXAGGSA-N 289.379 2.244 10 20 CECD C[C@H]1CN(C(=O)CSc2ncc(Cl)s2)CCO1 849998419 FTIWPZOINSMXET-ZETCQYMHSA-N 292.813 2.136 10 20 CECD C[C@H]1COC[C@@H]1NCc1c(O)ccc(Cl)c1F 922641314 GQYLIWIJKHUJRH-XVKPBYJWSA-N 259.708 2.309 10 20 CECD COCCOC[C@@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 756732037 GATRKNBTKQTKMJ-GHMZBOCLSA-N 298.339 2.003 10 20 CECD CC(C)[C@](C)(O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756576307 MEPXOEBBVHGYKD-IINYFYTJSA-N 282.340 2.358 10 20 CECD CC(C)OCCOC(=O)/C=C/c1ccc(O)c(O)c1 759598769 YGPFUWRFBCKSAS-GQCTYLIASA-N 266.293 2.079 10 20 CECD OC[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)C1 923004440 SYOHVWHXUJOCSY-ZKCHVHJHSA-N 259.708 2.045 10 20 CECD C[C@@H](NC[C@@H]1COCCO1)c1cc2c(cc1O)CCCC2 756435105 VSOAQGGOEPPZDT-IUODEOHRSA-N 291.391 2.337 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ncoc2C2CC2)c1 862754965 MLNLWCDTDQBNBB-UHFFFAOYSA-N 272.304 2.496 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)[C@@H]1CCC(=O)N(C)C1 862428189 NBFCIHODEVYIQP-MRXNPFEDSA-N 289.423 2.114 10 20 CECD CC[C@@H]1CN(Cc2ccc(N3CCCC3)cc2)C[C@@H]1O 1116448816 GEHKPYBZOSLKRP-WBVHZDCISA-N 274.408 2.490 10 20 CECD Cc1cccc(O)c1CN1CCNC(=O)[C@H]1CC(C)C 877461252 CHKCVNACVTTWDF-CQSZACIVSA-N 276.380 2.047 10 20 CECD O=C(CCc1cccc2c1OCO2)NCc1ccccc1O 771418080 QDQDQAHOQDHFCY-UHFFFAOYSA-N 299.326 2.370 10 20 CECD CSCC[C@H](NCc1ccc2c(c1)CCCO2)C(=O)O 1120087743 RWGIJUFZNDGVGX-ZDUSSCGKSA-N 295.404 2.308 10 20 CECD CN(Cc1ccccc1O)C(=S)NC1(C)CC1 789195624 WZFXBOGAPRVNDK-UHFFFAOYSA-N 250.367 2.251 10 20 CECD CCN(CC)c1ccc(CN2C[C@@H](O)[C@H](C)C2)cc1 897685758 RRHCHOLFIWZQKA-CZUORRHYSA-N 262.397 2.345 10 20 CECD COc1ccc(CNCc2ccccc2O)c(O)c1OC 892793112 WKRDUPACGBUBCR-UHFFFAOYSA-N 289.331 2.405 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H](CF)C2)c(O)c1O 1332751093 FMYZGDIHCRYJTK-JTQLQIEISA-N 267.300 2.228 10 20 CECD CC(C)OC(=O)[C@H](C)N(C)Cc1ccc(N)cc1 1262487828 HLOFEHNYLGUBPM-NSHDSACASA-N 250.342 2.041 10 20 CECD CC(C)OC(=O)[C@@H](C)N(C)Cc1ccc(N)cc1 1262487827 HLOFEHNYLGUBPM-LLVKDONJSA-N 250.342 2.041 10 20 CECD CC[C@H](C)[C@H](CNC(=O)c1cc(O)cs1)OC 1351011648 AQNDANFWWHBAEL-WPRPVWTQSA-N 257.355 2.245 10 20 CECD CCn1cc(CCSc2ncc(C(=O)O)s2)cn1 1605920968 QJAODGQWHHIPEE-UHFFFAOYSA-N 283.378 2.393 10 20 CECD CC(C)NCC(=O)NCc1cc(Cl)cc(Cl)c1O 1575727412 CHHYDZFSPOMSNI-UHFFFAOYSA-N 291.178 2.313 10 20 CECD COC(=O)c1coc(/C=C/C(=O)Nc2ccc(N)cc2)c1 1578885283 HVPVGZSJWIZNIS-VOTSOKGWSA-N 286.287 2.300 10 20 CECD CCC[C@](C)(NCc1cc(OC)c(OC)cc1O)C(=O)O 1595560071 RQZUXSHPGCDQGB-HNNXBMFYSA-N 297.351 2.142 10 20 CECD Cc1ccc(CN2CC[C@@H](C)[C@H](C(=O)O)C2)c(O)c1 1594360370 WXEOCMFMHZYRRR-DGCLKSJQSA-N 263.337 2.243 10 20 CECD O=C(NCc1ccc(O)c(O)c1)C1(c2ccccc2)CC1 158969094 SAXKWBDXUFMGBZ-UHFFFAOYSA-N 283.327 2.446 10 20 CECD O=C(NCc1ccc(N2CC=CC2)cc1)Nc1cccnn1 152106175 ZGAPHLRUEZDBNW-UHFFFAOYSA-N 295.346 2.175 10 20 CECD CN(Cc1ccccc1O)C(=O)c1snnc1C1CC1 810156870 XJOAXBNMVBKMTG-UHFFFAOYSA-N 289.360 2.393 10 20 CECD COc1ccc(O)c(CN(C)C[C@@H]2CCCN(C)C2)c1 179734037 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264.369 2.129 10 20 CECD O=C(CSC[C@@H]1CCCCO1)NCc1ccccc1O 263872189 NIBTUNNNBBIJIA-ZDUSSCGKSA-N 295.404 2.311 10 20 CECD C[C@@H]1C(=O)N(Cc2ccc(N3CCCC3)cc2)C(=O)N1C 277219895 FXBVJNMLOUOEGR-GFCCVEGCSA-N 287.363 2.069 10 20 CECD CCN(C)C(=O)CN[C@H](C)c1ccc(C)c(C)c1O 274748899 AENPNYDHHVXFAH-GFCCVEGCSA-N 264.369 2.138 10 20 CECD Cc1ccc([C@@H](C)NC[C@@H](O)C2CCOCC2)c(O)c1C 273530778 WEKUWDGFIOACTD-CZUORRHYSA-N 293.407 2.447 10 20 CECD CC[C@@H](N[C@@H]1CC(=O)N(C(C)C)C1)c1ccccc1O 274896962 KKEIOEODQYCGTR-TZMCWYRMSA-N 276.380 2.442 10 20 CECD CCNc1nc(SCC(=O)C(C)=O)nc2ccccc12 289749727 UQTZGSZBTOMLHY-UHFFFAOYSA-N 289.360 2.312 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@H](C)C(=O)NCCF)cc1 282650419 HZUGZOCBGPNEHY-QWHCGFSZSA-N 295.402 2.268 10 20 CECD C[C@H](CNCc1ccc(N(C)C)c(F)c1)CN(C)C 291815674 YOWOFVMLUNBZGY-GFCCVEGCSA-N 267.392 2.179 10 20 CECD O=C(CSC(F)(F)F)NCc1ccccc1O 299456208 ARNHIVIPNOJKID-UHFFFAOYSA-N 265.256 2.261 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccccn1 808095246 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256.305 2.392 10 20 CECD C[C@@H](CCCCO)NCc1ccc(N(C)C)cc1 272211244 AHKRPNYHTLUJMN-ZDUSSCGKSA-N 250.386 2.393 10 20 CECD Oc1cccc2c1[C@H](NCCCn1cccn1)CC2 296064216 RVFVPYASRHQQBC-CYBMUJFWSA-N 257.337 2.256 10 20 CECD CCN(C)C(=O)[C@H](C)N[C@H](C)c1ccc(N(C)C)cc1 188502453 BRYGQEDPEXJTRT-OLZOCXBDSA-N 277.412 2.270 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCCOC2)c1 109543445 SHKJFJVIAQSZNN-QWRGUYRKSA-N 251.326 2.230 10 20 CECD CCOCCCNC(=O)NCc1ccc(N(C)C)c(F)c1 58556651 VKQFBGZSWPOHNJ-UHFFFAOYSA-N 297.374 2.118 10 20 CECD COc1cccc(CNCc2cscn2)c1O 111607924 NTDAJSILJNXXEG-UHFFFAOYSA-N 250.323 2.147 10 20 CECD CN(Cc1cc(F)ccc1O)C[C@@H]1CCC[C@@H]1O 180260066 JTLZNDHFFLZZJL-GWCFXTLKSA-N 253.317 2.124 10 20 CECD CN(Cc1cc(Cl)ccc1O)Cc1nccn1C 134103429 LBXGEDDUWZTOSH-UHFFFAOYSA-N 265.744 2.411 10 20 CECD CC(C)N(C)c1ccc(/C=C2/SC(=S)NC2=O)cn1 190220452 VIRJIANXYADJQQ-UXBLZVDNSA-N 293.417 2.415 10 20 CECD CC(C)c1nnsc1C(=O)NCc1ccc(N)cc1 87441420 JGZTYBXFGZZKBK-UHFFFAOYSA-N 276.365 2.174 10 20 CECD COc1ccc(CCNCc2cccc(C)c2O)cn1 529662586 SGXZMKBBUHTTHQ-UHFFFAOYSA-N 272.348 2.437 10 20 CECD C[C@H]1CN(C(=O)/C=C\c2cccnc2)c2cccnc2O1 255071164 JOZOLBSALHMOGZ-DGMVEKRQSA-N 281.315 2.304 10 20 CECD O=C1[C@H]2CCCN2C(=O)N1Cc1ccc(N2CCCC2)cc1 272341856 WMMYYRNVEVMUBA-OAHLLOKOSA-N 299.374 2.213 10 20 CECD C[C@H](N[C@@H]1CCO[C@@H]1C)c1ccc(F)c(F)c1O 276894761 IGBWSPNDGRUOPH-VAOFZXAKSA-N 257.280 2.498 10 20 CECD COc1cccc(CN(C)C[C@@H]2CCCC[C@@H]2O)c1O 272632785 NILHDQHRPQYXIJ-JSGCOSHPSA-N 279.380 2.384 10 20 CECD CO[C@@H]1CCN(C(=O)c2ccc(C)c(O)c2O)[C@H](C)C1 281842517 SYRPJWNFRKFOSR-GHMZBOCLSA-N 279.336 2.046 10 20 CECD CC(=O)C(=O)CSc1nccn1-c1cccc(C)c1 808016529 OXRRJWZVNNNHHQ-UHFFFAOYSA-N 274.345 2.431 10 20 CECD CC(C)SCCNC(=O)c1c(F)ccc(O)c1O 295771032 PVAHEVOCBOSXKP-UHFFFAOYSA-N 273.329 2.108 10 20 CECD C[C@@H](NC1CCNCC1)c1cc(F)cc(F)c1O 817937570 XUVORNXIDFCMJQ-MRVPVSSYSA-N 256.296 2.073 10 20 CECD C[C@@H]1CCC[C@@H]1N1C(=O)CN(Cc2ccccc2O)C1=O 819167733 HPBIINHCHVUGPH-YPMHNXCESA-N 288.347 2.345 10 20 CECD CCOc1ccc(CNCC[C@@H](C)CCO)c(O)c1 824517427 UVGVFRYJGJAJOP-GFCCVEGCSA-N 267.369 2.289 10 20 CECD CC[C@@H]1OCC[C@H]1NCc1cc(OC)ccc1O 839191911 MDCRMPAJYCUDPK-OCCSQVGLSA-N 251.326 2.058 10 20 CECD COc1ccc(N(C)C/C=C(\C)C(=O)O)cc1F 832378956 YEMCHJQLDMOFOG-RMKNXTFCSA-N 253.273 2.301 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)N[C@@H](C)C(=O)O 738265399 PZZFHBRJRKQTME-JTQLQIEISA-N 292.360 2.359 10 20 CECD C[C@@H](Cc1cnccn1)N[C@H]1CCc2cccc(O)c21 834544577 NWKGLKLCVFEBCF-FZMZJTMJSA-N 269.348 2.390 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC[C@H](F)C2)cc1 844782530 BJHLLGHFJYSPRT-ZDUSSCGKSA-N 279.359 2.396 10 20 CECD CC(C)[C@@H]1C[C@H](C(=O)NCCc2ccc(N)cc2)CCO1 911783033 OQXVKJHMGUUCLW-ZBFHGGJFSA-N 290.407 2.379 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C)C[C@H]1C(N)=O 840939064 KFBUKRQVGVKLLK-LRDDRELGSA-N 289.423 2.147 10 20 CECD CCOc1cccc(CNCC(N)(CC)CC)c1O 841031417 SYHLEGZMWCADPI-UHFFFAOYSA-N 266.385 2.398 10 20 CECD COc1ccc(N2CCC(NC3CCNCC3)CC2)cc1 841026527 GVJBYEDOOTYYEC-UHFFFAOYSA-N 289.423 2.006 10 20 CECD O=C(O)CCCC(=O)NCc1ccc(N2CCCC2)cc1 844252420 QPTYDKVPMKSWNG-UHFFFAOYSA-N 290.363 2.158 10 20 CECD C/C=C/C[C@H](CO)N[C@H](C)c1cccc(OC)c1O 846165840 ZQWJIEMVDVGCEG-GKUNOOHESA-N 265.353 2.379 10 20 CECD C[C@H]1C[C@H](N)CCN1Cc1ccc(N(C)C)c(F)c1 846698208 CHBNLGIMFDWPGY-WCQYABFASA-N 265.376 2.203 10 20 CECD CCN(Cc1ccncc1)C(=O)NCCc1ccc(N)cc1 841961194 BFVWJDCYUGPVFF-UHFFFAOYSA-N 298.390 2.438 10 20 CECD C[C@H](COCC1CC1)NC(=O)NCc1ccccc1O 844940789 ZQWQAQGQBKXXHV-LLVKDONJSA-N 278.352 2.007 10 20 CECD C[C@@H]1COC[C@H]1NCc1ccc(N(C)C)c(F)c1 922641315 KIFDXQZPJYHHBO-ZWNOBZJWSA-N 252.333 2.016 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](CCN)C(F)F 841072830 AJYJHXSQTSSOPI-ZDUSSCGKSA-N 271.355 2.133 10 20 CECD COc1cccc(O)c1CNC[C@](C)(O)c1ccsc1 740899576 JGYCJEMBXMOBIG-HNNXBMFYSA-N 293.388 2.460 10 20 CECD CC(C)(CNC(=O)NCc1ccccc1O)OCC1CC1 840278065 YKEOATNKEANXOJ-UHFFFAOYSA-N 292.379 2.397 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C[C@@H]1CCC(=O)N1 925082541 XOOOKLJZPGPQGC-ZFWWWQNUSA-N 289.423 2.208 10 20 CECD COc1cc(Cl)cc(CN2C[C@@H]3CCC[C@]3(N)C2)c1O 857226737 YGXJSOSILQBGOV-NHYWBVRUSA-N 296.798 2.367 10 20 CECD CC1CCC(O)(CNCc2cc([N+](=O)[O-])ccc2O)CC1 853092526 XVVMIZJYSHVGFI-UHFFFAOYSA-N 294.351 2.331 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCc2cc(C)[nH]n2)c1 756586688 VRFZFXAGIRLSCG-JTQLQIEISA-N 289.335 2.061 10 20 CECD C[C@H](O)CCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756572655 NHYWLOHTPRVLCN-WCABBAIRSA-N 253.317 2.440 10 20 CECD CO[C@@H](CNC(=O)c1cccc(O)c1O)C1CCCCC1 856224634 HPHJZVVPSLAVNY-AWEZNQCLSA-N 293.363 2.423 10 20 CECD Cc1cccc(-n2c(C)cc(CNC(=O)CO)c2C)c1 863161976 ODUVYNLURORCHN-UHFFFAOYSA-N 272.348 2.011 10 20 CECD COC1(C(=O)NCc2ccc(O)c(O)c2)CCCCCC1 934944516 RDBXARFQSFEJOP-UHFFFAOYSA-N 293.363 2.453 10 20 CECD COC1(CC(=O)NCc2cc(C)ccc2O)CCC1 862757092 HHINFKJZMOGHPD-UHFFFAOYSA-N 263.337 2.276 10 20 CECD CCC[C@@H](O)CC(=O)N[C@@H](C)c1cc(OC)ccc1O 761968214 TUOLSKUSYIYWRB-WDEREUQCSA-N 281.352 2.129 10 20 CECD COC(=O)[C@H](CC(F)(F)F)NCc1ccc(C)cc1O 877470024 XDLGSAYGAMVZAE-JTQLQIEISA-N 291.269 2.284 10 20 CECD CC(C)[C@](C)(O)C(=O)N(C)Cc1ccc(N(C)C)cc1 771103669 LRRMEENZAINFAA-INIZCTEOSA-N 278.396 2.118 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2nccs2)c1 770424788 YKJSVCKWNKCJBV-MRVPVSSYSA-N 278.333 2.348 10 20 CECD Cc1cc(Cn2cc(CC[C@@H](C)O)nn2)ccc1N(C)C 881377646 RWVMBNQHYHWOGY-CYBMUJFWSA-N 288.395 2.014 10 20 CECD CCn1nccc1CNCc1cc(F)cc(F)c1O 883182490 CYWZNINYNMJYKR-UHFFFAOYSA-N 267.279 2.177 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1CCOC2(CCC2)C1 896015779 SXNGNDZYMCSXOI-GFCCVEGCSA-N 275.348 2.358 10 20 CECD C[C@H](NC(=O)[C@H](C)n1ccnc1)c1ccc(N(C)C)cc1 1324138660 IZVNQTPYFVOMFA-STQMWFEESA-N 286.379 2.388 10 20 CECD CCN1C(=O)/C(=C/c2nn(C)cc2Cl)SC1=S 1337682739 XDZRBKCOCQKEFJ-YWEYNIOJSA-N 287.797 2.295 10 20 CECD CSC[C@H](CCO)N[C@H](C)c1c(O)cccc1F 1333464923 CTMLTSMEZMNNSN-ZJUUUORDSA-N 273.373 2.296 10 20 CECD O=C(NCc1cccc(O)c1O)c1occ2c1CCC2 1349079521 NRAMMQFUWLCQFH-UHFFFAOYSA-N 273.288 2.110 10 20 CECD C[C@H](NCCOC(F)(F)F)c1cc(C(=O)O)ccc1O 1604341017 FIRMKKBFUTXZOG-ZETCQYMHSA-N 293.241 2.277 10 20 CECD CC[C@H](C)N(C)CCNCc1cccc(OC)c1O 217386583 QDQFNYZMZVYPBM-LBPRGKRZSA-N 266.385 2.221 10 20 CECD Nc1ccc(NC(=O)c2cccc(Cn3ccnn3)c2)cc1 1580449739 UOVBLXRAFCSKNQ-UHFFFAOYSA-N 293.330 2.161 10 20 CECD CN(Cc1ccoc1C(=O)O)c1ccc2c(c1)OCO2 1598532538 YRVVXLGQOUKLOZ-UHFFFAOYSA-N 275.260 2.343 10 20 CECD COc1cccc(OC)c1/C=C1/SC(=S)NC1=O 206403720 RNOUONDABARLQH-UXBLZVDNSA-N 281.358 2.193 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2c(O)cccc2Cl)C1 155585837 SIMBVBVFXSYUHD-GFCCVEGCSA-N 296.798 2.394 10 20 CECD C[C@H](NCc1cc(F)ccc1O)C1CCOCC1 226615600 FXXINJUKUCDPCL-JTQLQIEISA-N 253.317 2.436 10 20 CECD CC[C@H](NC[C@@]1(OC)CCOC1)c1ccccc1O 160141125 GFXSMNUTQTYWTF-ZFWWWQNUSA-N 265.353 2.238 10 20 CECD CCc1cccc(CNC[C@H](CC)CCO)c1O 691485097 YLNYMHCTBQBPMP-GFCCVEGCSA-N 251.370 2.453 10 20 CECD CCCCS(=O)(=O)N1CCOc2cc(N(C)C)ccc21 174062236 JMJZBRGPCDCCEF-UHFFFAOYSA-N 298.408 2.081 10 20 CECD CN1CCCc2cc(CNC(=O)c3cccn3C)ccc21 69950484 GTDNVRBBAHOASW-UHFFFAOYSA-N 283.375 2.338 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)C[C@H](C)O)c1 252748321 DJMQMGAHQSUZJY-VWYCJHECSA-N 253.342 2.211 10 20 CECD CCCNC(=O)CNCc1ccc(N2CCCCC2)cc1 35134163 HNEQUGQUOSULPI-UHFFFAOYSA-N 289.423 2.293 10 20 CECD CCOc1ccc(O)c(CN2CC[C@H](OCCOC)C2)c1 188814517 XDCXFGWPJWZYRH-HNNXBMFYSA-N 295.379 2.028 10 20 CECD CC(C)CC(=O)NCc1ccc(N2CCOCC2)cc1 48944303 XKHWVEDXPBYJKO-UHFFFAOYSA-N 276.380 2.186 10 20 CECD C[C@H](NCc1ccc(N2CCOCC2)cc1)[C@@H]1CCOC1 135201684 RUEGBRCWRXPLAD-GOEBONIOSA-N 290.407 2.038 10 20 CECD CSC1(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 190591341 YOZOSHNQLWZMHS-UHFFFAOYSA-N 282.384 2.404 10 20 CECD Fc1cnc(NCc2ccc(N3CCOCC3)cc2)nc1 269474933 KBDMTRBSAJVUHG-UHFFFAOYSA-N 288.326 2.064 10 20 CECD CO[C@@H](C(=O)NCc1ccc(N2CCCC2)cc1)C1CC1 280604089 GFQMYLJVHVSAHB-MRXNPFEDSA-N 288.391 2.328 10 20 CECD CC1=C(C(=O)NCc2ccccc2O)SCCO1 283621046 ZQTYEPMKUCTSJU-UHFFFAOYSA-N 265.334 2.003 10 20 CECD CC1(C)CC[C@@H]1NC(=O)/C=C/c1ccc(O)c(O)c1 287247782 RIBZHSXOVNQPQH-BPJJOFIESA-N 261.321 2.416 10 20 CECD CC[C@H](NC[C@]1(O)CCO[C@H]1C)c1ccc(F)cc1O 287713654 XTSRNIGMXUCITI-VZJVUDMVSA-N 283.343 2.112 10 20 CECD CC(=O)N1CCCN(Cc2ccc(N(C)C)c(C)c2)CC1 293597901 UXPMBXOXQPKAEU-UHFFFAOYSA-N 289.423 2.115 10 20 CECD C[C@@H](NC(=O)c1cnc(S)[nH]1)c1ccc(N(C)C)cc1 800694278 GJJZIRUZBHRJPH-SECBINFHSA-N 290.392 2.255 10 20 CECD CCOc1ccc(CN2C[C@@H](C)C[C@@H](CO)C2)c(O)c1 817412579 MVWFCQXTLISADQ-QWHCGFSZSA-N 279.380 2.241 10 20 CECD CN(C)c1ccc(CN2CC[C@H](CCCO)C2)cc1F 825339071 ZRCSZUHBVQCVCZ-ZDUSSCGKSA-N 280.387 2.486 10 20 CECD CNC(=O)CCCN(C)Cc1cc(Cl)c(C)cc1O 824883164 GYBAWFSPYRBOBK-UHFFFAOYSA-N 284.787 2.312 10 20 CECD CCOc1cccc(CN2CC[C@@H](CCCO)C2)c1O 825338885 WXLZVKJKIHBDKY-CYBMUJFWSA-N 279.380 2.385 10 20 CECD Oc1ccccc1CN(CCn1cncn1)Cc1ccco1 732202628 ZLNVMHWFGLEPPL-UHFFFAOYSA-N 298.346 2.279 10 20 CECD Cc1cc(N(C)C)ccc1CN(C)C[C@@H](C)C(=O)O 901596574 HSIQLNNZPGTCHB-GFCCVEGCSA-N 264.369 2.214 10 20 CECD C[C@H](N[C@@H](C)[C@@H](O)C(F)(F)F)c1ccc(F)cc1O 866463183 KQJQQKOABFKFSC-OKTBNZSVSA-N 281.249 2.494 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](CCN)C2)c1O 843377580 DIMUPFDRAYDSKN-GFCCVEGCSA-N 294.370 2.295 10 20 CECD Cc1n[nH]cc1CN1CCCc2cc(CN)ccc21 843057406 KORPAPQMXUOMOP-UHFFFAOYSA-N 256.353 2.130 10 20 CECD C[C@H](N)[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 843052445 UEPDNEDXDGHJQW-GXTWGEPZSA-N 279.403 2.451 10 20 CECD CC[C@@H](NCc1cc(F)ccc1O)[C@@H](O)C(C)C 840967051 CSMABXLGPBWROL-OCCSQVGLSA-N 255.333 2.416 10 20 CECD CCC[C@@H]1CNCCN1Cc1cc(F)ccc1O 843057325 CDKOYKRAQFIVOM-CYBMUJFWSA-N 252.333 2.105 10 20 CECD C[C@@H]1NCCC[C@@H]1NCc1c(O)ccc(Cl)c1F 841064572 YTMKFNHHYSBEFR-KWQFWETISA-N 272.751 2.415 10 20 CECD C[C@@H]1COC[C@@H]1NCc1c(O)ccc(Cl)c1F 922641129 GQYLIWIJKHUJRH-XCBNKYQSSA-N 259.708 2.309 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCOCC2CCC2)c1 858363072 NYXPKYBHOWGOMI-UHFFFAOYSA-N 292.379 2.317 10 20 CECD Cc1cc(O)c(CN2C[C@@H]3CCC[C@]3(N)C2)cc1C 857226759 YWDFBBPBNKHWFB-HOCLYGCPSA-N 260.381 2.322 10 20 CECD CCOCCOCCN[C@H](C)c1cccc(OC)c1O 927085459 IJECCWPULNZUET-GFCCVEGCSA-N 283.368 2.105 10 20 CECD Cc1cc(O)c(CNCCCNc2ncccn2)cc1C 751505482 GMHREEBUQXQYMH-UHFFFAOYSA-N 286.379 2.391 10 20 CECD C/C=C\C[C@@H](CO)NCc1ccc2c(c1)CCCO2 922007767 FYDLFPZBLBDROL-GWQWAINWSA-N 261.365 2.428 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2CCO[C@H](C)C2)c1 756782079 MJRNASVXYGUXLV-NTZNESFSSA-N 293.363 2.397 10 20 CECD Oc1ccc(CNc2ncnc3ccncc23)cc1O 752638524 NGWPLGUYOJFEOW-UHFFFAOYSA-N 268.276 2.048 10 20 CECD CN(C)c1ccc(OCC(=O)NCC(C)(C)C)cc1 863470326 ZOZUYDSNNZOWLW-UHFFFAOYSA-N 264.369 2.294 10 20 CECD CC[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@H]1O 862253783 SNIDHYFQROJIMU-MEBBXXQBSA-N 284.350 2.234 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCn3ccnc32)c1O 931526321 NXPQPCDXSKSOGW-UHFFFAOYSA-N 291.738 2.465 10 20 CECD COC(=O)CCN(Cc1c(O)cccc1OC)CC(C)C 768849569 ICPHQONKCLITCX-UHFFFAOYSA-N 295.379 2.422 10 20 CECD CC(C)(C)CNC(=O)CN1CCCc2cc(CN)ccc21 863541183 XZHUYXJGXNOAKA-UHFFFAOYSA-N 289.423 2.060 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](CC)NC(C)=O 866598535 HKQQLHOADRLBPY-AWEZNQCLSA-N 292.379 2.046 10 20 CECD CCN1CCC[C@H]1CNC(=O)N[C@H](C)c1ccccc1O 868013450 HMCNXQDQEZZNQF-OLZOCXBDSA-N 291.395 2.237 10 20 CECD Cc1ccc(O)c(CNC(=O)c2c(C)noc2C)c1 862759961 ODQWMSMRUGPGON-UHFFFAOYSA-N 260.293 2.235 10 20 CECD C[C@@H](NC(=O)NCCCCC(=O)O)c1ccccc1O 874405215 SDOMBSORNNHCIU-SNVBAGLBSA-N 280.324 2.007 10 20 CECD CC(=O)C1=NN(c2ccc(C)c(Cl)c2)C(=O)C1 1119002121 FKSJPFBIUSHJEQ-UHFFFAOYSA-N 250.685 2.330 10 20 CECD Cc1csc(N2CCN(Cc3ccc(N)cc3)CC2)n1 1120370894 IXLGGCGKRKMQGC-UHFFFAOYSA-N 288.420 2.356 10 20 CECD C[C@@H](NC(=O)COc1cccnc1)c1ccc(N(C)C)cc1 773014989 MHERHYPQLBIHGX-CYBMUJFWSA-N 299.374 2.404 10 20 CECD Cc1cc(C)c([C@@H](C)NCCN2CCOC[C@@H]2C)c(O)c1 788586607 DQHDVJVOQPFDCE-LSDHHAIUSA-N 292.423 2.380 10 20 CECD CN(CCCn1ccnc1)Cc1cc(F)cc(F)c1O 894776541 HIDYBSGTEKJTLQ-UHFFFAOYSA-N 281.306 2.389 10 20 CECD CC[C@H](O)CCCNCc1cc(C)cc(OC)c1O 894288366 STYNDANSSIPAPC-ZDUSSCGKSA-N 267.369 2.350 10 20 CECD CC(C)n1cc([C@@H](C)NC(=O)c2cccc(O)c2O)cn1 790707401 OCBHEJFIBFDVGS-SNVBAGLBSA-N 289.335 2.366 10 20 CECD Cc1ccc(N(C)C(=O)c2ccoc2CC(N)=O)cc1C 795387960 HBUVDUQYNSDRLF-UHFFFAOYSA-N 286.331 2.201 10 20 CECD COc1ccc(CNC(=O)c2ccnn2C(C)C)c(O)c1 794377483 JARMGTGKDIISAF-UHFFFAOYSA-N 289.335 2.108 10 20 CECD Oc1ccc([C@H]2CCNc3c2ccc(O)c3O)cc1O 97758776 SJLVXVFXUUXDJP-SECBINFHSA-N 273.288 2.457 10 20 CECD COc1cc(C)cc(CN[C@@H]2CC[C@H](OC)C2)c1O 1332708730 VIBOWLWYONBDFS-OLZOCXBDSA-N 265.353 2.366 10 20 CECD Cc1nc(CNC(=O)NCc2ccc(N)cc2)sc1C 1335518573 LFMLMFUDAXQBFV-UHFFFAOYSA-N 290.392 2.342 10 20 CECD Cc1ccc(O)c(CN(C)C[C@@H]2CCCN(C)C2)c1 92253843 ZNENIVZODXOCIT-CQSZACIVSA-N 262.397 2.474 10 20 CECD COc1ccc(N2CCC(NC(=O)[C@H]3C[C@H]3F)CC2)cc1 1337092688 NUWRNYUIHDZKKX-LSDHHAIUSA-N 292.354 2.138 10 20 CECD CC[C@@H](C)[C@H](CNC(=O)NCc1ccc(N)cc1)OC 1336974642 CABXBJXJAWQAIX-RISCZKNCSA-N 279.384 2.129 10 20 CECD COc1ccc(N(C)C(=O)c2cccc3c2CCN3)cn1 1263158794 KUMYMGAXJYAAIC-UHFFFAOYSA-N 283.331 2.335 10 20 CECD Cc1cc(C)c(O)c(CN2CCC[C@H]2CC(=O)O)c1 1610455015 DACNGUYWVSFYPQ-ZDUSSCGKSA-N 263.337 2.448 10 20 CECD Oc1c(Cl)cccc1CNCC1CCNCC1 1574439661 FIAUTGUELLHDEZ-UHFFFAOYSA-N 254.761 2.135 10 20 CECD CC(C)[C@@H](NCc1cc(Cl)c(F)cc1O)C(=O)O 1588950691 UFFRPOIZLDLBSL-LLVKDONJSA-N 275.707 2.384 10 20 CECD Nc1ccc(CCN[C@@H]2CC[C@@H]3[C@H]4OCC[C@H]4[C@@H]32)cc1 1580443606 SNOOJOYKRRRHBH-FIDHJVLJSA-N 272.392 2.214 10 20 CECD CCN1CCC[C@@H]1CN[C@H](C)c1cc(C(=O)O)ccc1O 1596421401 JVAJWMJZMLFFSJ-DGCLKSJQSA-N 292.379 2.225 10 20 CECD COCCO[C@@H]1CCCN(Cc2cc(F)ccc2O)C1 802653365 SYAWQAJNSKEEIN-CQSZACIVSA-N 283.343 2.159 10 20 CECD C[C@H]1CCN(Cc2ccc(N(C)C)cc2)[C@H](C(=O)O)C1 846279449 AFEAYCMOYVVALN-WFASDCNBSA-N 276.380 2.438 10 20 CECD Cn1cncc1CCNCc1ccc2c(c1)CCCO2 922273324 FDSTWZRPJADDAH-UHFFFAOYSA-N 271.364 2.077 10 20 CECD COc1ccc(O)c([C@@H](C)NCCC[C@H](C)CO)c1 230669730 FCCDDBYQABVROY-NWDGAFQWSA-N 267.369 2.460 10 20 CECD OC[C@@H](C[C@H]1CCCO1)NCc1c(O)cccc1Cl 886226832 SCLWMXXUDORGGU-GHMZBOCLSA-N 285.771 2.065 10 20 CECD CN(C)c1ccc(CNc2nc(C(=O)O)co2)cc1 1777040369 YFPGGDOXMMDZGW-UHFFFAOYSA-N 261.281 2.051 10 20 CECD O=C1CN(Cc2cccc(Cl)c2O)[C@H]2CCCC[C@@H]2N1 179921978 KRHPVMARWYUDDK-STQMWFEESA-N 294.782 2.289 10 20 CECD OCCN(Cc1cc(Br)ccc1O)C1CC1 128114449 DSTZQAIVHRKAEG-UHFFFAOYSA-N 286.169 2.111 10 20 CECD CCN(C)CCN[C@H](C)c1ccc(F)c(F)c1O 187669155 STVVGTOPTMKIJK-SECBINFHSA-N 258.312 2.273 10 20 CECD Cc1nccn1C[C@@H](C)CNCc1cc(F)ccc1O 180427892 MYAHBZVLZZHNHI-NSHDSACASA-N 277.343 2.462 10 20 CECD CN1c2ccccc2C(=O)N[C@H]1c1cc([N+](=O)[O-])ccc1O 41864163 QBPADGNMPBDNMD-CQSZACIVSA-N 299.286 2.179 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H]2CCOC2)cc1F 264500400 LZYLTSJNIACVDK-CYBMUJFWSA-N 294.370 2.325 10 20 CECD C[C@H](CF)NC(=O)NCc1ccc(N2CCCC2)cc1 287495303 IYWDLFMVSLXDKC-GFCCVEGCSA-N 279.359 2.444 10 20 CECD CCCCN(Cc1ccccc1O)Cc1cnnn1C 282830150 BPXCFHKREPZPLU-UHFFFAOYSA-N 274.368 2.323 10 20 CECD CC(=O)C(=O)CSc1nc(-c2ccc(Cl)cc2)n[nH]1 808015182 FSZPHEGWMDNYHK-UHFFFAOYSA-N 295.751 2.375 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2cccnc2F)c1 806791707 HJQKNGQLPNXSBB-VIFPVBQESA-N 290.294 2.426 10 20 CECD OCCOCCCNCc1ccc2ccccc2c1O 816565962 HPKXBQWCBLQMDD-UHFFFAOYSA-N 275.348 2.034 10 20 CECD COc1cc(CN(C)C[C@@H]2CCCN2C)c(O)cc1C 817371647 BAPCYLUJJWRQHS-AWEZNQCLSA-N 278.396 2.235 10 20 CECD CCOc1cccc(CN2C[C@@H](C)[C@](C)(CO)C2)c1O 827699257 FUMZEXZIAVVANV-WBMJQRKESA-N 279.380 2.241 10 20 CECD Cc1cc(O)c(CNCCN2CCO[C@H](C)C2)cc1Cl 825246459 ATWRBNDXZLEMQV-GFCCVEGCSA-N 298.814 2.164 10 20 CECD Cc1cc(O)c(CN2C[C@@H](O)C[C@@H]2C)cc1Cl 825666088 GWCKXIWNWMVLBU-ONGXEEELSA-N 255.745 2.309 10 20 CECD C[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@H](C(F)(F)F)O1 829414991 IKPQUSPAVVSWCU-HZGVNTEJSA-N 295.282 2.246 10 20 CECD COc1cccc(CNC(=O)c2cc(O)cs2)c1O 732284117 IRYXZTUNNXGQAY-UHFFFAOYSA-N 279.317 2.098 10 20 CECD C[C@H](C(=O)N1CCCCC1)N(C)Cc1ccccc1O 269673307 XZUQICANMDLDJA-CYBMUJFWSA-N 276.380 2.225 10 20 CECD COc1ccc(N(C)C[C@H]2CC3(CCNCC3)CO2)cc1 903763431 JTQQMJZEGHZJQO-MRXNPFEDSA-N 290.407 2.290 10 20 CECD COC1CCN(C(C)(C)CNCc2ccccc2O)CC1 730817698 RWGPXOSUGWFXRW-UHFFFAOYSA-N 292.423 2.371 10 20 CECD Cn1nc(C2CC2)cc1C(=O)Nc1ccc(N)cc1 911660198 HZFFFUZWOAWWIJ-UHFFFAOYSA-N 256.309 2.132 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 843056810 AICTXFDFMZVADI-RKDXNWHRSA-N 272.751 2.354 10 20 CECD CCN1C(=O)C(C)(C)N[C@@H]1c1cc(C)c(C)cc1O 840834061 SOSBRPVGOWPEQL-ZDUSSCGKSA-N 262.353 2.238 10 20 CECD CO[C@H](C(=O)NCc1cc(Cl)ccc1O)C(C)C 846474698 ZTVGDHJPVCRCRN-LBPRGKRZSA-N 271.744 2.333 10 20 CECD CS[C@@H](C)CC(=O)NCCc1ccc(N)cc1 844164703 OJGMETWAJDQSIK-JTQLQIEISA-N 252.383 2.069 10 20 CECD CCOCc1cc(CN[C@@H](C)C[C@H](C)N)ccc1OC 843129884 SRPOCXLNAKUPHH-STQMWFEESA-N 280.412 2.447 10 20 CECD COc1cccc([C@H](C)N[C@H]2CCCC[C@@H]2O)c1O 846145793 PGZMMEUHSNGPTL-DRZSPHRISA-N 265.353 2.355 10 20 CECD COc1cccc([C@@H](C)NC[C@@H]2CCCN(C)C2)c1O 846147746 VIPDQCYIWSDLIL-OLZOCXBDSA-N 278.396 2.393 10 20 CECD Cc1ccc(O)c(CNC(=O)NC[C@@H]2C[C@@H](C)O[C@@H]2C)c1 858540591 JGDAUNLBTWPZBX-UPJWGTAASA-N 292.379 2.313 10 20 CECD C[C@@H](c1ccccc1)[C@H](O)CNC(=O)c1cc(O)cs1 856291871 GGPNRFJQWFNZJP-GXFFZTMASA-N 291.372 2.348 10 20 CECD Cc1ccc(C(=O)OCCc2c(C)noc2C)c(O)c1O 756179438 VGLSFRWTNITWHA-UHFFFAOYSA-N 291.303 2.411 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CCC(=O)[C@@H](C)C2)c1O 764103519 YRLTXAXRGKWYOF-WDEREUQCSA-N 291.347 2.022 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccnn2CC(F)F)c1 862755967 OCVCDIYIQRCVLA-UHFFFAOYSA-N 295.289 2.092 10 20 CECD CC[C@@H](COC)NC(=O)N[C@H](C)c1ccccc1O 868292969 OVJNUUXWJXYDNH-MNOVXSKESA-N 266.341 2.177 10 20 CECD CCCN(Cc1c(C)cccc1O)[C@@H]1CCS(=O)(=O)C1 876538853 XUPZXSZPYOLWAC-CYBMUJFWSA-N 297.420 2.100 10 20 CECD CCCC(=O)N1CCC[C@@H]1C(=O)N(C)c1ccc(N)cc1 877078365 NRDLENIEEWHRFC-CQSZACIVSA-N 289.379 2.023 10 20 CECD CC(C)Cc1noc(COC(=O)c2cccc(O)c2O)n1 776281275 AOKAFSPQZBUFBA-UHFFFAOYSA-N 292.291 2.036 10 20 CECD Cc1ccc(C(=O)Nc2ccn(CC(F)F)n2)c(O)c1O 770505052 WUFUGCLMHAVNGA-UHFFFAOYSA-N 297.261 2.120 10 20 CECD C[C@H](N[C@@H](C)[C@H](C)N1CCOCC1)c1c(O)cccc1F 886524041 BMDXNBJHICEKST-AVGNSLFASA-N 296.386 2.291 10 20 CECD CN(Cc1cc(F)cc(F)c1O)C[C@H]1CCC[C@H]1O 894089997 YUWOIXQRYGQAGZ-NOZJJQNGSA-N 271.307 2.263 10 20 CECD CC[C@@H](C[C@H](C)CO)NCc1ccc(OC)c(OC)c1O 893074140 KXWPMOAMNMHWBO-AAEUAGOBSA-N 297.395 2.296 10 20 CECD C[C@@H](NC(=O)NC[C@]1(C)CCCNC1)c1ccccc1O 892057743 QLIMMQYFKVQPMD-MLGOLLRUSA-N 291.395 2.142 10 20 CECD Cc1cc(C)c(O)c(CN2CCO[C@]3(CCO[C@@H]3C)C2)c1 794657565 BGXPSEDQKSTCAO-RHSMWYFYSA-N 291.391 2.389 10 20 CECD COc1ccc(CNC(=O)Cc2ccsc2)c(O)c1 794387163 FYNWUVFDCXZHLJ-UHFFFAOYSA-N 277.345 2.321 10 20 CECD C[C@H](O)CCN(C)Cc1ccc(N2CCCC2)cc1 1319706802 DPQUQEBWKOPEOO-AWEZNQCLSA-N 262.397 2.490 10 20 CECD CC(C)[C@@H](CO)NCc1c(O)cccc1Br 706804750 PMDWZBRCHHNPPP-LLVKDONJSA-N 288.185 2.261 10 20 CECD C1=C[C@H](NCc2ccc(N3CCOCC3)cc2)CC1 698193757 BYUKCQXCHZAKSP-HNNXBMFYSA-N 258.365 2.331 10 20 CECD OCCCCNCc1cccc(Br)c1O 193281064 NTUASIXJTQXRRW-UHFFFAOYSA-N 274.158 2.017 10 20 CECD CCc1cccc(CNC[C@@](C)(O)C(F)(F)F)c1O 698600448 MLJZZZKPYOPJII-GFCCVEGCSA-N 277.286 2.358 10 20 CECD CCN1CCC[C@@H](N[C@H](C)c2ccccc2O)C1=O 722344737 CXZBUSSCMZOZGW-DGCLKSJQSA-N 262.353 2.054 10 20 CECD COc1cc(C)cc(CNC[C@@H]2CCC[C@@H](O)C2)c1O 1331992902 FXQPYQAPNQIJNQ-TZMCWYRMSA-N 279.380 2.350 10 20 CECD C[C@@H](NC[C@@H](CO)CC1CCOCC1)c1ccccc1O 1256035330 MHVBRBPHUNTOQQ-HIFRSBDPSA-N 293.407 2.468 10 20 CECD COc1cccc(O)c1CNCc1cccc(F)n1 1341815921 OYOJPBZJBBGNQW-UHFFFAOYSA-N 262.284 2.225 10 20 CECD CC(C)[C@H]1CN(C(=O)NCc2ccc(N)cc2)CCCO1 1262603749 UFDWQCZIJXIWNF-OAHLLOKOSA-N 291.395 2.225 10 20 CECD Cc1ccc(-n2c(C)ccc2C)c(C(=O)NCCN)c1 1579655678 ILUURVSLRBJWOQ-UHFFFAOYSA-N 271.364 2.091 10 20 CECD O=C(O)CCC(=O)NCc1cc(Cl)cc(Cl)c1O 1594995604 RNLLJMOTVJAJJY-UHFFFAOYSA-N 292.118 2.180 10 20 CECD CCOCc1cc(CN[C@@H](CC)C(=O)O)ccc1OC 1776907130 PHHKKWKQNKBSTP-ZDUSSCGKSA-N 281.352 2.185 10 20 CECD CCC(=O)N1CC[C@H](N[C@@H](CC)c2ccccc2O)C1 156377008 NQZLHCSBDXBHEU-JSGCOSHPSA-N 276.380 2.444 10 20 CECD CCN(Cc1cc(OC)c(OC)cc1O)C1CC1 159717954 WVMIICVKRMDAJS-UHFFFAOYSA-N 251.326 2.394 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@H](C)CC(N)=O 228614706 UMKMMOYKLBGMAC-GMTAPVOTSA-N 262.353 2.102 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1ccc2c(c1)CCO2 38014257 ZAKCBQDWCCDLGR-GFCCVEGCSA-N 276.380 2.016 10 20 CECD COc1ccc(O)c([C@H](C)NCC2([S@](C)=O)CCC2)c1 281071303 OGOCLBCPEJUQGK-YBTHPKLGSA-N 297.420 2.353 10 20 CECD CCN1CCN(Cc2cc(F)cc(F)c2O)C[C@H]1C 708397969 DQPHJUPGPOCJOB-SNVBAGLBSA-N 270.323 2.196 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@@H]2CC(=O)OC)c1 179895467 LOLMQXYCROKZRG-CYBMUJFWSA-N 293.363 2.318 10 20 CECD COCCN(C)CCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 61375632 UGLTUSDSRGZVNA-UONOGXRCSA-N 292.423 2.417 10 20 CECD NC(=O)c1cnc(Sc2nccs2)c(Cl)c1 68669904 XVJNRCYSSJAFMR-UHFFFAOYSA-N 271.754 2.442 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CC[C@H](O)CC2)c1 252811657 OTCLOTOGXUKXHS-SRVKXCTJSA-N 265.353 2.355 10 20 CECD C[C@H](N[C@H](C)CO)c1ccc(N2CCOCC2)cc1Cl 129318243 LOSSNBHOFXNTEN-NEPJUHHUSA-N 298.814 2.208 10 20 CECD CNc1c(Cl)ncnc1NCc1cccc(OC)c1O 124905169 MCECADAVIQIEAT-UHFFFAOYSA-N 294.742 2.498 10 20 CECD CC1(C)[C@@H](O)C[C@H]1NCc1cc(Cl)ccc1O 128187618 GTVBHBAFISVKRL-NEPJUHHUSA-N 255.745 2.295 10 20 CECD CC[C@@H](C)[C@@H](O)CN[C@@H](C)c1cc(OC)ccc1O 185438710 ZKOGZCWKLILRRZ-ZETOZRRWSA-N 267.369 2.458 10 20 CECD C[C@@H](NCCC(=O)N1CCCC1)c1ccc(N(C)C)cc1 37228780 MEWVJXURVNLGTO-CQSZACIVSA-N 289.423 2.416 10 20 CECD CS[C@H](CO)[C@H](C)N[C@H](C)c1ccc(F)c(F)c1O 187729662 ZMQKZBJDJIYUDF-VHSKPIJISA-N 291.363 2.433 10 20 CECD Cc1ccc([C@H](C)NC[C@@H](O)C(F)(F)F)c(O)c1 230659279 WCEKCVVKFCVIPT-GZMMTYOYSA-N 263.259 2.274 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)[C@H](C)CS(C)(=O)=O 93389920 XSLJTGPIHMMXAU-CYBMUJFWSA-N 298.452 2.008 10 20 CECD COC(CN(Cc1ccc(N(C)C)cc1)C1CC1)OC 275626458 OKDJZEKGOOQNGC-UHFFFAOYSA-N 278.396 2.336 10 20 CECD C[C@H]1CN(Cc2cc(Cl)c(F)cc2O)CCO1 294878611 KSGUFZNZCCTTTM-QMMMGPOBSA-N 259.708 2.405 10 20 CECD CCCCN(CCCO)Cc1c(O)cccc1OC 809751724 JEUSDUBTYMMDLY-UHFFFAOYSA-N 267.369 2.385 10 20 CECD CC(=O)C(=O)COC(=O)c1cc(C)n(C(C)C)c1C 808486412 BAGIBKINJMQZPB-UHFFFAOYSA-N 265.309 2.001 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@H](C)c1c(C)cc(C)cc1O 294657403 HDTMNAWOOVPSDG-QWHCGFSZSA-N 299.436 2.483 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CC13CCNCC3)CC2 817977003 YXYNFEIIYAKSID-TZMCWYRMSA-N 258.365 2.111 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@H]2CCCCN2)c1 817949871 OMHAWZBAXBPGHZ-VXGBXAGGSA-N 264.369 2.194 10 20 CECD COc1cc(O)c(CNC[C@@](C)(OC)C2CC2)cc1OC 812772242 BTMVNSVLUZDLKY-MRXNPFEDSA-N 295.379 2.314 10 20 CECD Cc1cc(C(=O)NCCc2ccc(N)cc2)c(C)[nH]1 818544732 JOILLEHYQRGCKI-UHFFFAOYSA-N 257.337 2.186 10 20 CECD CC1(C)CN(C(=O)c2cc(O)cs2)[C@H]1[C@H]1CCCO1 811595523 PSYCVWHSWYGNSG-PWSUYJOCSA-N 281.377 2.483 10 20 CECD Cc1c(CNC(=O)[C@H]2CN(C)C[C@@H]2C)n(C)c2ccccc12 487554681 RULYFMSEMDHBPI-WFASDCNBSA-N 299.418 2.301 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@H]2CCC[C@H](N)C2)c1 817970444 VQKVHVNDHREJHG-DRZSPHRISA-N 292.379 2.099 10 20 CECD CCCN1CCC[C@H](C(=O)NCc2ccccc2O)C1 822921521 UTLYHVNZGSGUKR-AWEZNQCLSA-N 276.380 2.130 10 20 CECD CCO[C@@H]1COC[C@H]1N[C@H](CC)c1ccccc1O 825196680 LZFDPVONVZEYGE-UMVBOHGHSA-N 265.353 2.237 10 20 CECD CN(C)c1ccc(/C=C\CN2CC[C@@](F)(C(=O)O)C2)cc1 901513758 CVCIMGFNRPRNFE-QGZUEGPWSA-N 292.354 2.264 10 20 CECD C[C@@H](NCCN1CCCOCC1)c1ccc(Cl)cc1O 903228991 UYLMADGKYKRFIN-GFCCVEGCSA-N 298.814 2.419 10 20 CECD CCOc1ccc(CN(C)C2CCN(OC)CC2)c(O)c1 835075796 BPFMAVCTBYPNNY-UHFFFAOYSA-N 294.395 2.249 10 20 CECD CC[C@@H](NC(=O)NCc1ccccc1O)C(F)F 836511248 HOGSHFNSXYURKH-SECBINFHSA-N 258.268 2.235 10 20 CECD C[C@H]1CCCN([C@H](C)CNC(=O)c2cc(O)cs2)C1 731869559 LMTLJUPCRFSHMZ-WDEREUQCSA-N 282.409 2.304 10 20 CECD CC1(C)C[C@H](O)CCN(C(=O)c2cc(O)cs2)C1 839786867 HDZMSHBDIPHLIM-SECBINFHSA-N 269.366 2.077 10 20 CECD CC[C@@H](OC)C(=O)N(C)CCN(C)c1ccc(OC)cc1 844852984 BVPOMDGEJAUHLW-OAHLLOKOSA-N 294.395 2.015 10 20 CECD COc1c(N)ncnc1NCc1ccc(N2CCCC2)cc1 848645221 CYCPAOQVZRQECW-UHFFFAOYSA-N 299.378 2.280 10 20 CECD CC(C)CCC(=O)N(CC(=O)O)Cc1ccccc1O 911484531 OTZAYCXCQPUEKL-UHFFFAOYSA-N 279.336 2.242 10 20 CECD CCN(C)c1ccc(CNCCc2ccc(N)cc2)cn1 841038199 HAZNWWCNKLLKHB-UHFFFAOYSA-N 284.407 2.452 10 20 CECD CC(C)CN1CC[C@H](CNC(=O)Nc2ccc(N)cc2)C1 841299746 JLMLYKZHBBTUQL-CYBMUJFWSA-N 290.411 2.368 10 20 CECD COc1cccc(O)c1CN1C[C@H]2[C@H](C1)C2(F)F 846113494 YEQDXMQTWHDHSR-UWVGGRQHSA-N 255.264 2.098 10 20 CECD Cc1csc([C@H](C)C(=O)NCc2ccc(O)cc2O)n1 910946923 VVLOAWMBXMFZRJ-SECBINFHSA-N 292.360 2.283 10 20 CECD C[C@@H]1CSCCN(C(=O)NCCc2ccc(N)cc2)C1 841960167 WRAXEWAXVHCCDY-LBPRGKRZSA-N 293.436 2.206 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CC[C@H]2NCC[C@H]2C1 843127094 OKBQKYXXIDNHAB-TVQRCGJNSA-N 284.762 2.369 10 20 CECD CCOc1ccc(CN2CCCC[C@@H]2[C@@H](C)N)c(O)c1 843045864 LHTNHQJKIBBPQM-IUODEOHRSA-N 278.396 2.493 10 20 CECD COc1cccc([C@@H](C)N[C@@H]2CCn3ccnc3C2)c1O 846162249 CGFOPBWEZALINY-VXGBXAGGSA-N 287.363 2.263 10 20 CECD CC[C@H](C)NC(=O)CCNCc1ccc2c(c1)CCCO2 921555526 DJBRWEMYYPJGBM-ZDUSSCGKSA-N 290.407 2.406 10 20 CECD CC[C@H](C(=O)NCc1c(O)ccc2c1CCCC2)[C@@H](C)O 842234013 MXCGYBNUWHVFQA-YPMHNXCESA-N 291.391 2.294 10 20 CECD Cc1ccnc(COC(=O)c2cccc(O)c2O)c1 758563174 UPXAPSONOOUAKS-UHFFFAOYSA-N 259.261 2.158 10 20 CECD COC1CCN(CCN[C@H](C)c2ccc(C)cc2O)CC1 756641115 GHASVLXQUOCYAY-CQSZACIVSA-N 292.423 2.462 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccnnc1C 753093297 BSTCLQMBHQLECK-UHFFFAOYSA-N 284.363 2.089 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1[C@H]2[C@@H]3CC[C@@H](C3)[C@H]21 934936353 SWOZWMWFSYEUHV-RJTWHSRJSA-N 257.333 2.301 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)COC1CCCC1 935946873 PGRHXZGHKRXBSG-UHFFFAOYSA-N 298.379 2.453 10 20 CECD CCOC(=O)[C@H](NCc1cc(C)ccc1O)C1CC1 1116755756 TYUSSSWQGDALKB-CQSZACIVSA-N 263.337 2.132 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCC1CCC1 779530748 ZJEXXHJQBBRHCI-ALCCZGGFSA-N 261.321 2.417 10 20 CECD Cc1cccc(O)c1CN(C)CCCNC(=O)C1CCC1 877478677 PNPIHKCWDWCECB-UHFFFAOYSA-N 290.407 2.439 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@H]2CCCS2)c1O 775031373 ARSIYEKOOFOAPA-SNVBAGLBSA-N 298.364 2.294 10 20 CECD CS[C@@H]1CC[C@@H](NC(=O)c2ccc(C)c(O)c2O)C1 780955023 PZOLSOIYEHOQKF-NXEZZACHSA-N 281.377 2.420 10 20 CECD CC(C)OC(=O)C1CCN(C(=O)c2cc(O)cs2)CC1 899574636 OUGVOUJUUQHVBB-UHFFFAOYSA-N 297.376 2.258 10 20 CECD Cc1cnc(CNCc2ccc(N(C)C)c(F)c2)o1 789559698 WLAWESJLXDSZJP-UHFFFAOYSA-N 263.316 2.478 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1cncnc1 794335158 DUCREPYISQDMGI-UHFFFAOYSA-N 298.390 2.100 10 20 CECD C[C@@H](NCCC1(O)CCOCC1)c1ccc(N(C)C)cc1 797032011 MNAPXJALMTZMNM-CQSZACIVSA-N 292.423 2.335 10 20 CECD CC[C@@H](N[C@@H]1CCN(C)C1)c1ccc(F)cc1O 796748352 UNGJBFKNONQWKG-DGCLKSJQSA-N 252.333 2.276 10 20 CECD Cc1cc(CNCCCSc2nccs2)n[nH]1 1318988622 NJQGIZVKUJBUDJ-UHFFFAOYSA-N 268.411 2.447 10 20 CECD Cc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2N(C)C)c(O)c1O 1323605727 PMCQOKNPSRDJAJ-OLZOCXBDSA-N 292.379 2.009 10 20 CECD CC[C@@](C)(O)CNCc1c(O)cccc1Br 706883697 VXDNCTPCRCFPGE-GFCCVEGCSA-N 288.185 2.405 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@@H]1CCC[C@H](O)C1 708517047 NOIRTWLDRGIDNR-SKDRFNHKSA-N 271.307 2.311 10 20 CECD Cc1cc(N(C)C)ccc1CNc1ncc(O)cn1 1339577225 ANYWXMGMSMFJGN-UHFFFAOYSA-N 258.325 2.169 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC1(CC(N)=O)CC1 1331556584 JFBLQRPLLMIQSV-VXGBXAGGSA-N 288.391 2.494 10 20 CECD Nc1ccc(CC(=O)Nc2cnn(C3CCC3)c2)cc1 1342155971 MFBJPAAJTJEJLU-UHFFFAOYSA-N 270.336 2.372 10 20 CECD C[C@H]1CCN(c2nnc(-c3sccc3O)n2C)C1 1341281648 VMFGJPDWAISJIR-QMMMGPOBSA-N 264.354 2.095 10 20 CECD Cc1ccccc1C(=O)NCc1ccc(O)c(O)c1 159111171 RHSSLXRMLFYMFO-UHFFFAOYSA-N 257.289 2.336 10 20 CECD Cc1ccc(O)c(CN[C@@](C)(CC(=O)O)C2CC2)c1 1600465233 UGHSZORFXMSRHK-HNNXBMFYSA-N 263.337 2.434 10 20 CECD C[C@@H](NC[C@H]1CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589978769 PVDNPNMSYNJELE-NXEZZACHSA-N 287.367 2.269 10 20 CECD CCN(C)c1ccc([C@@H](C)NCc2nncn2C)cc1 152299075 HSBJNLMUFMAHNO-GFCCVEGCSA-N 273.384 2.122 10 20 CECD CCc1cccc(CNCCOC[C@@H]2CCCO2)c1O 848896747 ILHAXPPQQHUEQC-HNNXBMFYSA-N 279.380 2.240 10 20 CECD NC[C@@H]1CCCC[C@@H]1NCc1ccc2c(c1)CCO2 841029056 FCLNWCCFORSUBK-GJZGRUSLSA-N 260.381 2.229 10 20 CECD COc1ccc(O)c([C@H](C)NC2CCC(N)CC2)c1 51693668 HAVGGDGJWVJCDZ-UNXYVOJBSA-N 264.369 2.321 10 20 CECD COC[C@H](CCO)N[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 300419138 PTGGMHIRDFUQMJ-RWMBFGLXSA-N 279.380 2.236 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2[C@H]3[C@H]4CC[C@@H](C4)[C@H]32)cc1 300649286 ZUNFVSMVQWCRBK-XXINRUCKSA-N 257.337 2.435 10 20 CECD Oc1cccc(Cl)c1CN1CC[C@@]2(CCNC2)C1 310955067 CDUMKFPTZWIQRN-CQSZACIVSA-N 266.772 2.231 10 20 CECD Oc1ccc(Cl)cc1CNCCc1cn[nH]c1 379586648 KCIPIBFZPVWLBD-UHFFFAOYSA-N 251.717 2.101 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](C)[C@@H](O)C2)c1O 388201525 SETBJLIDWUZGBW-OQPBUACISA-N 283.755 2.061 10 20 CECD CCN(CC)c1ccc(CN(C)CC(=O)OC)cc1F 179394391 VNPPWOZORJGPEG-UHFFFAOYSA-N 282.359 2.277 10 20 CECD C[C@H](NCCNC(=O)c1ccco1)c1ccccc1O 183395445 VLMRWURCWWWPOM-NSHDSACASA-N 274.320 2.066 10 20 CECD CC1(C)CN(Cc2cc3c(cc2O)OCO3)CCS1 83630842 NTTCWFMDQQIXAG-UHFFFAOYSA-N 281.377 2.448 10 20 CECD Oc1cccc(Cl)c1CNCCN1CCSCC1 226648512 NAZKCGIYONDDCE-UHFFFAOYSA-N 286.828 2.184 10 20 CECD C[C@H](CC(F)(F)F)NC(=O)c1cccc(O)c1O 229418048 HOVHMQDJWIMTAF-ZCFIWIBFSA-N 263.215 2.169 10 20 CECD COc1ccc(O)c(CN2CC[C@@]3(CCOC3)C2)c1 180615946 WUGRSGDGWMQKCO-OAHLLOKOSA-N 263.337 2.013 10 20 CECD CC(=O)NCc1ccc(C(=O)Nc2ccc(N)cc2)cc1 236669856 DGKWJHCZGLQAQZ-UHFFFAOYSA-N 283.331 2.157 10 20 CECD CCc1nc(CC(=O)NCCc2ccc(N)cc2)cs1 237035434 CLUDPFHSHGPXFX-UHFFFAOYSA-N 289.404 2.189 10 20 CECD C[C@@H](O)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1 276183711 YHYRPPHCXAVYLV-CYBMUJFWSA-N 276.380 2.016 10 20 CECD O=C(NC1CCCCC1)c1c(F)ccc(O)c1O 276761701 XEKIKIFQMLRDGG-UHFFFAOYSA-N 253.273 2.299 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)c1cccc(O)n1 282446293 IVSVFTOOZACXIE-UHFFFAOYSA-N 298.342 2.302 10 20 CECD COC[C@@H](CO)N[C@H](C)c1ccc(N2CCCCC2)cc1 280983271 MFIWOEIPVSJMJC-GDBMZVCRSA-N 292.423 2.335 10 20 CECD C[C@@H](CN(C)C)N[C@@H](C)c1cc(F)cc(F)c1O 806170278 PPCGYARHWYMXEG-IUCAKERBSA-N 258.312 2.271 10 20 CECD Cn1c(-c2ccccc2)cnc1SC[C@@H]1CNC(=O)O1 298853580 BUOCZJLWIJKNHO-NSHDSACASA-N 289.360 2.288 10 20 CECD CC[C@@H](C)[C@H](CNC(=O)c1c(F)ccc(O)c1O)OC 295844367 VVVSLEIDLUQMFD-KCJUWKMLSA-N 285.315 2.028 10 20 CECD CC(=O)C(=O)COC(=O)COc1cc(C)ccc1C(C)C 808486384 AMYXLMNQWKHLKE-UHFFFAOYSA-N 292.331 2.199 10 20 CECD C[C@@H](NCc1cnc2n1CCC2)c1ccccc1O 719940793 RAPOLMXIFQQIEK-LLVKDONJSA-N 257.337 2.386 10 20 CECD CN(C)c1ccc([C@H](N)CN[C@@H]2CCCCC[C@@H]2N)cc1 817942123 MLTFTXUKFXQRFW-GVDBMIGSSA-N 290.455 2.002 10 20 CECD C[C@H](N)CN[C@H](C)c1cc(Br)c(F)cc1O 817973454 UCMPBEUIHOOPHI-NKWVEPMBSA-N 291.164 2.292 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H]2CCNC2)cc1 826019426 FERHCLLBDAGMIM-HNNXBMFYSA-N 289.423 2.101 10 20 CECD CCC(=O)[C@@H]1CCCN1C(=O)/C=C/c1ccc(O)c(O)c1 909354623 YBGWKUTXZTYSFB-WMADIVHISA-N 289.331 2.081 10 20 CECD CN(C)c1ccc(CNCCC(C)(C)N)cc1F 903939145 RNPNSUWQCIXIGY-UHFFFAOYSA-N 253.365 2.109 10 20 CECD CC(C)(N)CC(=O)NCc1c(O)ccc2c1CCCC2 830597264 CTCFGOGIXNGYMP-UHFFFAOYSA-N 276.380 2.015 10 20 CECD CCCCCC(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832293151 QIKILDVQYYGKIP-OAHLLOKOSA-N 277.412 2.449 10 20 CECD COCCOCCN1CCCc2cc(OC)cc(OC)c21 839654936 CLCWDBBQKSAUSY-UHFFFAOYSA-N 295.379 2.119 10 20 CECD CCO[C@@H](C)c1noc(COC(=O)c2cc(O)cs2)n1 736825727 PHWAOBDQCVQYRY-ZETCQYMHSA-N 298.320 2.291 10 20 CECD CC1(C)CC[C@@H](OC(=O)c2cc(O)cs2)C1=O 840228834 UCCIQBWRHGLSPT-MRVPVSSYSA-N 254.307 2.368 10 20 CECD C[C@@H]1C[C@H](CN)CN1Cc1ccc(N(C)C)c(F)c1 843058497 URQCBZFGUSWZJZ-DGCLKSJQSA-N 265.376 2.061 10 20 CECD Cc1cccc(CN(C)C(=O)NCCc2ccc(N)cc2)n1 841956252 ZVENFMRHHSGZRU-UHFFFAOYSA-N 298.390 2.356 10 20 CECD COc1ccc(CNC(=O)C2SCCCS2)c(O)c1 841433134 QDGJNTOEUCKUTO-UHFFFAOYSA-N 299.417 2.213 10 20 CECD CCC[C@H](C)C(=O)N(CC(=O)O)Cc1ccccc1O 911485353 YRAQQIHGPWUONP-NSHDSACASA-N 279.336 2.242 10 20 CECD CCOc1cccc(CNCC2(N)CCCC2)c1O 849349773 IQUQNKQFCZZYFU-UHFFFAOYSA-N 264.369 2.152 10 20 CECD C[C@@H](CNC(=O)NCCc1ccc(N)cc1)C1CC1 841737257 RTHATWMXDXSRLZ-NSHDSACASA-N 261.369 2.157 10 20 CECD CN(C)c1ccc(/C=C\CN2CCC[C@H]2C(=O)O)cc1 840995596 XTFHROFFGGBTIW-QTLSWZBMSA-N 274.364 2.315 10 20 CECD C[C@@H](CCCCN)NC(=O)N(C)Cc1ccccc1O 841993560 FUZXGAJOYAGAOQ-LBPRGKRZSA-N 279.384 2.051 10 20 CECD Cc1ccc([C@@H](C)N[C@@H]2CCc3c(nnn3C)C2)c(O)c1 848564422 NDFNKNCBLHAHFJ-VXGBXAGGSA-N 286.379 2.037 10 20 CECD COc1cccc(CN2C[C@@H]3[C@H](C2)C3(F)F)c1O 846111296 LEIYLQMNHAAACJ-AOOOYVTPSA-N 255.264 2.098 10 20 CECD CC(C)OCc1noc(CN(C)Cc2ccccc2O)n1 929978210 ZHNFEGFMVUNBHH-UHFFFAOYSA-N 291.351 2.332 10 20 CECD CN(C)c1ccc(CN[C@@H]2[C@H]3OC[C@H]4C[C@@H]2C[C@@H]43)cc1 924573250 GTUUCVRXJZYIOC-WLGNDBIMSA-N 272.392 2.266 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@H]([S@@](C)=O)C2)c1O 850356636 QUZYUIWBZBYZDK-MTJIALIYSA-N 297.420 2.180 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@@H](C2CC2)N(C)C)c1 756433542 PWWHHUMLOBZVFJ-NHYWBVRUSA-N 278.396 2.392 10 20 CECD CN(Cc1ccccc1O)[C@@H]1C[C@H]2CCCC[C@H]2NC1=O 851841452 SHOPSRWBEUNGJU-BPLDGKMQSA-N 288.391 2.271 10 20 CECD COc1cccc(O)c1CNCc1c(C2CC2)cnn1C 850380041 NROANWORYMEYLM-UHFFFAOYSA-N 287.363 2.302 10 20 CECD CN(C)c1ccc(CNc2ncnc3c2ncn3C)cc1 750531019 YJTOZECVWXTWIY-UHFFFAOYSA-N 282.351 2.041 10 20 CECD CC[C@H](CO)N[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 756344282 SXLLIYFCAQYRFV-FXPVBKGRSA-N 253.317 2.440 10 20 CECD CC(=O)N1CC[C@@H](N[C@@H]2C[C@H](C)c3c(F)ccc(O)c32)C1 857084287 LNHZRPQLJXKUBG-UFGOTCBOSA-N 292.354 2.290 10 20 CECD CCN(CCC(=O)NC)Cc1ccc(N(C)C)c(C)c1 933862521 IYFKERIALINXFZ-UHFFFAOYSA-N 277.412 2.019 10 20 CECD Nc1ccc(CNC(=O)c2ccnn2CC2CCC2)cc1 868062771 VPNJZLVZKHEFRL-UHFFFAOYSA-N 284.363 2.195 10 20 CECD O=C(/C=C/c1ccsc1)NCc1ccc(O)c(O)c1 768914695 FIZAFNLSUDMZBW-DUXPYHPUSA-N 275.329 2.489 10 20 CECD O=C(N[C@@H]1CCOC2(CCC2)C1)c1cc(O)cs1 768396307 GSMJCZCWQRZRSZ-SECBINFHSA-N 267.350 2.285 10 20 CECD CCOC(=O)[C@@H](C)NCc1cc(Cl)cc(F)c1O 763276884 IBUJIACHBIFFQR-SSDOTTSWSA-N 275.707 2.226 10 20 CECD CC[C@@H]1CN(Cc2ccc(C)cc2O)C[C@H](C)S1(=O)=O 877521650 GFUDVHXVJNGHAM-GXTWGEPZSA-N 297.420 2.098 10 20 CECD CC(C)[C@@H]1C[C@@H](NC(=O)c2cc(O)cs2)CCO1 772932663 JPBJPZCMOVORBP-ONGXEEELSA-N 269.366 2.387 10 20 CECD C[C@H](NC(=O)[C@@]1(C)CCOC1)c1ccc(N(C)C)cc1 773011254 DYAKRFVYRZMPQU-LRDDRELGSA-N 276.380 2.356 10 20 CECD CC[C@@H](NCC(=O)NCC(C)C)c1ccc(F)cc1O 1117139250 JEYDXSKOSUMQLR-CYBMUJFWSA-N 282.359 2.344 10 20 CECD CCN(C)c1ccc([C@@H](C)NCCN2CCC2)cc1 773091852 KTINIVXVKNYGCK-CQSZACIVSA-N 261.413 2.499 10 20 CECD C[C@@H]1COCC[C@@H]1CNCc1cc(F)cc(F)c1O 883118581 ZUHNRHADHIXMHI-NXEZZACHSA-N 271.307 2.433 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)[C@H]1CCCS1 773743803 LHZGOXHMCDRZGW-TVQRCGJNSA-N 281.377 2.041 10 20 CECD C[C@H](NCc1cnc[nH]1)c1ccc(N2CCOCC2)cc1 796451235 UPQSJCPOEAZJML-ZDUSSCGKSA-N 286.379 2.097 10 20 CECD CCc1nncn1CCN[C@H](CC)c1ccc(F)cc1O 796779502 DMZHHXZNERREGM-CYBMUJFWSA-N 292.358 2.426 10 20 CECD CC[C@H](NCCCn1cncn1)c1ccc(C)cc1O 794816147 XCBKVYYPQKKCLE-AWEZNQCLSA-N 274.368 2.423 10 20 CECD COc1ccc(CNC(=O)/C=C/c2cnccc2C)c(O)c1 794381234 NFZHOBHSMBETKA-GQCTYLIASA-N 298.342 2.434 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCc1cnccn1 793516382 SPKWFUDUOUACPT-UHFFFAOYSA-N 298.390 2.100 10 20 CECD COc1ccc(CN[C@@H](C)C(=O)N2CCCC2)cc1C 134490712 UMFKFBDTHQMCSN-ZDUSSCGKSA-N 276.380 2.104 10 20 CECD O=C(O)C1(CNCc2ccc3c(c2)CCCO3)CCC1 900041316 KJQBONGPINJQSU-UHFFFAOYSA-N 275.348 2.356 10 20 CECD CC[C@H](CCO)NCc1cc(Cl)cc(OC)c1O 169089369 NISMZYSQBSQPFL-LLVKDONJSA-N 273.760 2.305 10 20 CECD COCCO[C@H]1CCN(Cc2cccc(Cl)c2O)C1 188822507 BDFFASQGVBDFCF-LBPRGKRZSA-N 285.771 2.283 10 20 CECD CCOc1cccc(CNC[C@@H]2CC[C@H](O)C2)c1O 188839357 GPRKPBYVFVULEV-YPMHNXCESA-N 265.353 2.042 10 20 CECD COc1ccc(O)c(CN2CCCCC[C@@H]2C(=O)O)c1 86814948 YPSFIYUUVFWTOL-CYBMUJFWSA-N 279.336 2.230 10 20 CECD CSC[C@@H](CCO)N[C@@H](C)c1c(O)cccc1F 1333464921 CTMLTSMEZMNNSN-VHSXEESVSA-N 273.373 2.296 10 20 CECD COc1ccc2c(c1)OC[C@@H](NCc1ccc(N)cc1)C2 1334754850 TVIOTABJYVOJEZ-HNNXBMFYSA-N 284.359 2.371 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCCNC2)cc1Cl 1579638337 XGGUERJBVRCMBC-LLVKDONJSA-N 254.761 2.196 10 20 CECD CO[C@H]1C[C@@H](COc2ccc(N(C)C)c(C(=O)O)c2)C1 1599326628 NDPDVEQTIYVAIU-KLPPZKSPSA-N 279.336 2.255 10 20 CECD CCN1CCCc2cc(CN[C@H](C)CC(=O)O)ccc21 1776875191 OCMVRFFHKULGDY-GFCCVEGCSA-N 276.380 2.412 10 20 CECD CN(Cc1ccc(N2CCOCC2)cc1)C[C@H]1CCCO1 161794722 JKVJEIUXEGUAFE-QGZVFWFLSA-N 290.407 2.134 10 20 CECD CCCCS(=O)(=O)N[C@H](C)c1cc(OC)ccc1O 151307080 OHNDGPLGWCSVSE-SNVBAGLBSA-N 287.381 2.181 10 20 CECD COc1cccc(CN(C)[C@H]2CCN(C(C)C)C2)c1O 825332169 SMVRNRMVPRXRLG-AWEZNQCLSA-N 278.396 2.315 10 20 CECD CC(C)[C@H]1C[C@H](NC(=O)Cc2ccc(N)cc2)CCO1 831505993 NGVMAMUMTNGBKJ-HUUCEWRRSA-N 276.380 2.131 10 20 CECD CO[C@@H](CNC(=O)Cc1ccc(N)cc1)C1CCCC1 703036805 JQVPOGQKOADARN-HNNXBMFYSA-N 276.380 2.133 10 20 CECD COCCC(C)(C)NCc1cccc(OC)c1O 397926087 RKMVUDLWLYNCJU-UHFFFAOYSA-N 253.342 2.306 10 20 CECD CCCN(C)C(=O)NCc1ccc(N(C)C)c(F)c1 57648031 ADSSXMRZQOOFEU-UHFFFAOYSA-N 267.348 2.443 10 20 CECD CN(CC(F)F)C(=O)NCc1ccc(N(C)C)c(F)c1 103612576 ALXDCIBVSCTUSK-UHFFFAOYSA-N 289.301 2.298 10 20 CECD C[C@@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)CCS1 171721815 YEGWOYOMRKXNFV-GFCCVEGCSA-N 293.436 2.400 10 20 CECD C[C@@H](NCC1(C)OCCO1)c1ccc(F)c(F)c1O 187813401 VCQYJYAMSXUKQT-MRVPVSSYSA-N 273.279 2.084 10 20 CECD CN(Cc1cn2cccnc2n1)c1ccc2c(c1)OCO2 121249414 CVLNIJYBHWAODI-UHFFFAOYSA-N 282.303 2.094 10 20 CECD CCN(C)c1ccc([C@H](C)NCC(=O)NCC2CC2)cc1 181295249 LMXUTQGQUPFFDK-ZDUSSCGKSA-N 289.423 2.320 10 20 CECD CN1C(=O)/C(=C\c2cccc3c2OCO3)SC1=S 48642715 RLOCSTHXXJSDSI-WEVVVXLNSA-N 279.342 2.246 10 20 CECD CCO[C@H]1C[C@@](CO)(NCc2ccccc2O)C1(C)C 186597698 JFUAXCZFDKHORA-HOCLYGCPSA-N 279.380 2.048 10 20 CECD C[C@@H](NCc1ccc(N2CCOCC2)cc1)c1ncc[nH]1 138902306 IKSZCRSNYKDXJG-CYBMUJFWSA-N 286.379 2.097 10 20 CECD CCCCC(=O)NCc1ccc(N2CCN(C)CC2)cc1 49740610 JBPBFYLRFUDBLD-UHFFFAOYSA-N 289.423 2.245 10 20 CECD COc1cccc(CN(CCO)c2ccccc2)c1O 191971491 NJTLFSXDXPQEPK-UHFFFAOYSA-N 273.332 2.400 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)N[C@@H](C)CN)c2C)c1 262544255 UIFWWEKEQLYHMA-LBPRGKRZSA-N 285.391 2.480 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@H](OCC2CC2)C1 366152615 RQWCYCMGUAUACP-LBPRGKRZSA-N 291.347 2.129 10 20 CECD CCOc1ccc(O)c(CN2CC[S@](=O)[C@H](C)[C@H]2C)c1 271192904 MLPKOTCCMZCGIQ-HTGLOVNISA-N 297.420 2.132 10 20 CECD CCn1cc(CN[C@@H](C)c2cc([N+](=O)[O-])ccc2O)cn1 273470909 JUHWEJGCJHOFCT-JTQLQIEISA-N 290.323 2.368 10 20 CECD CC(=O)N1CCC[C@H](CNCc2cc(C)c(C)cc2O)C1 279934298 YJDANEUXBLSQDM-OAHLLOKOSA-N 290.407 2.357 10 20 CECD CN(C)c1ccc(CN[C@H]2C[C@H](O)C2(C)C)cc1F 272322534 IRCLUYIBASXTLJ-KBPBESRZSA-N 266.360 2.141 10 20 CECD CN(CCc1cnccn1)Cc1ccc(N(C)C)c(F)c1 272719879 FBJZTZSAAPVSDI-UHFFFAOYSA-N 288.370 2.356 10 20 CECD CN(C)[C@@H]1CC[C@H]2[C@H](C1)OCCN2Cc1ccccc1O 374890904 FEXGDYVJEXMTIW-VYDXJSESSA-N 290.407 2.076 10 20 CECD CN(C)c1ccc(CN2C[C@@H](O)C(C)(C)C2)cc1F 280464117 MQENVMSYYOVHOJ-CQSZACIVSA-N 266.360 2.094 10 20 CECD CCN(Cc1nnc(C)n1C)c1ccc(OC)c(OC)c1 299278982 NEJBDYFUGAXNOZ-UHFFFAOYSA-N 290.367 2.167 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@](C)(OC)C2CC2)c1 812497674 ANRHCCHUPLKBEW-QFYYESIMSA-N 293.363 2.393 10 20 CECD Cc1cc(CN2C[C@H](CO)OC(C)(C)C2)ccc1N(C)C 817278430 AYTHWEQBOKSCIN-OAHLLOKOSA-N 292.423 2.033 10 20 CECD CCOCC[C@H](O)CNCc1c(C)c2ccccc2n1C 571396320 AISSZJBWQVEQRW-AWEZNQCLSA-N 290.407 2.364 10 20 CECD CC[C@@H](NC[C@@H]1CCCN1)c1ccc(F)cc1O 817954594 ZMDVMWFKTLKAMD-WCQYABFASA-N 252.333 2.324 10 20 CECD CCCN(CCn1ccccc1=O)Cc1ccccc1O 727831087 HKEFFSIFTVSEPZ-UHFFFAOYSA-N 286.375 2.466 10 20 CECD CCOc1ccc(O)c(CN2C[C@@H](C)C[C@H](C(=O)O)C2)c1 817881987 SXBWLSFAVAUUHI-AAEUAGOBSA-N 293.363 2.334 10 20 CECD CSCC[C@H](C)NC(=O)c1c(F)ccc(O)c1O 825944625 BVPDBKBBHFSDIJ-ZETCQYMHSA-N 273.329 2.108 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1coc(CN)c1 829763871 BPNNRBBJAKMXMW-UHFFFAOYSA-N 287.363 2.043 10 20 CECD O=C1OCCN1[C@@H]1CCN(Cc2cccc(Cl)c2O)C1 827001039 RONFDGVBVZTHRF-LLVKDONJSA-N 296.754 2.072 10 20 CECD COc1ccc(NC(=O)c2cc(O)cs2)cn1 731861502 DKRYCAAZMCSYCA-UHFFFAOYSA-N 250.279 2.110 10 20 CECD CCOC(=O)C1(C(=O)N[C@H](C)c2ccccc2O)CCC1 827941112 MJMPQNYVANOOJC-LLVKDONJSA-N 291.347 2.303 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1C[C@H]2CC[C@H]1O2 733972189 NEPRISVUIJROKU-OUAUKWLOSA-N 298.433 2.309 10 20 CECD O=C(NC[C@H]1CC1(Cl)Cl)c1cc(O)cs1 732267005 AWSXZJOPJUBUFQ-RXMQYKEDSA-N 266.149 2.377 10 20 CECD C[C@@H](CN1CCCCC1)NC(=O)c1cc(O)cs1 732271615 LSSCMWGEUCSZLI-JTQLQIEISA-N 268.382 2.058 10 20 CECD CN(CCN)Cc1ccc(N(C)C)cc1C(F)(F)F 841100489 IZWFEWCJKUFMMR-UHFFFAOYSA-N 275.318 2.162 10 20 CECD CC[C@H](O)CCNCc1ccc(N(C)C)cc1C 840937433 SWDXJGXYCPTKKF-HNNXBMFYSA-N 250.386 2.312 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](C(=O)O)[C@H]2C)c1O 846283354 DQOBBXRMGJFGSQ-PELKAZGASA-N 295.310 2.029 10 20 CECD COc1ccc(N(C)CCN(C)CC2(O)CCCC2)cc1 844402445 XNBHYQHCDOUERV-UHFFFAOYSA-N 292.423 2.368 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H](OC(C)C)C2)c(O)c1O 846367609 RRGGUQHEPKCVHN-GFCCVEGCSA-N 293.363 2.436 10 20 CECD CC(C)[C@@H](Sc1ncc(Cl)s1)C(=O)NC(N)=O 849997943 HVCFTGBYMKZEHK-ZCFIWIBFSA-N 293.801 2.108 10 20 CECD Oc1c(F)cccc1CN1CCC([C@@H]2CCNC2)CC1 843127438 RCWBYOBMVSFLIN-CYBMUJFWSA-N 278.371 2.353 10 20 CECD C[C@@H](CCCCN)NCc1ccc(N(C)C)c(F)c1 841081068 SORYXISMNLHZGA-LBPRGKRZSA-N 267.392 2.499 10 20 CECD C[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)[C@@H]1CCN 844902558 QPALCNXJJMNRJU-DGCLKSJQSA-N 292.379 2.070 10 20 CECD CCN(C)c1ccc(CN(CC(N)=O)CC(C)C)cc1 741753268 RAXJNJBZXSMJPY-UHFFFAOYSA-N 277.412 2.086 10 20 CECD CCOCc1cc(CNC[C@H](N)C(C)C)ccc1OC 841028821 ICYBSSVMDQSNFP-HNNXBMFYSA-N 280.412 2.305 10 20 CECD Cc1cccc(CN(C)C(C)(C)CN2CCOCC2)c1O 840976012 CLWYOJQQSSTDMG-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CC[C@H](C)C[C@H](CO)NCc1cc(OC)ccc1O 843427560 RCCUKZYSZLNDCG-WCQYABFASA-N 267.369 2.288 10 20 CECD C[C@H](NCc1ccc2c(c1)CCCN2C)c1cnnn1C 924871473 NKAKHWUWPQPZCJ-LBPRGKRZSA-N 285.395 2.048 10 20 CECD Cn1ncnc1CN(Cc1ccccc1O)C1CCCC1 750044048 AOWZPFLATBHVOP-UHFFFAOYSA-N 286.379 2.466 10 20 CECD CCC[C@@H](O)CCN[C@@H](C)c1cc(C(=O)OC)ccc1O 927015011 DRKGHTILNAXAGS-WCQYABFASA-N 295.379 2.381 10 20 CECD CC[C@](C)(O)CN[C@@H](C)c1cc(F)cc(F)c1O 756554961 QPNKKMQQHMAKLE-SDBXPKJASA-N 259.296 2.482 10 20 CECD COC(=O)[C@@H](NCc1cc(F)c(N(C)C)cc1F)C1CC1 862339189 KJPXZDBVYBIZES-AWEZNQCLSA-N 298.333 2.072 10 20 CECD COCc1cc(CNCc2cc(C)ccc2O)no1 862478177 DJAIWAAZPHQWOD-UHFFFAOYSA-N 262.309 2.125 10 20 CECD CCN(CCCO)Cc1cc(Cl)cc(F)c1O 775717070 QYYPWKRTQGQIKI-UHFFFAOYSA-N 261.724 2.389 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnc(Cl)n2C)cc1 873828983 JRUGKFCJAXMVTK-UHFFFAOYSA-N 292.770 2.070 10 20 CECD Cc1cccc(O)c1CN1CCC[C@H](Cn2ccnn2)C1 876814341 MEZCZVLFKBEHCU-AWEZNQCLSA-N 286.379 2.204 10 20 CECD OC[C@H]1CSCCN1Cc1cc(Cl)c(F)cc1O 877780391 OWZDNYCFRKLOIU-VIFPVBQESA-N 291.775 2.094 10 20 CECD COC(=O)[C@H]1CCCN(Cc2c(C)cccc2O)C1 876556630 VGQSCSISLFDTLS-LBPRGKRZSA-N 263.337 2.086 10 20 CECD CCOC(=O)[C@@H](C)[C@@H](C)NCc1cc(F)cc(F)c1O 894454711 VGLZTTZSXDSPRM-DTWKUNHWSA-N 287.306 2.348 10 20 CECD COc1cc(C)cc(CN2CCC[C@@H]2C(C)(C)O)c1O 894452950 ADYPZVPOHGMBGX-CQSZACIVSA-N 279.380 2.445 10 20 CECD C[C@@H](O)[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894423424 RUECWYGABOLLFU-NXEZZACHSA-N 271.307 2.263 10 20 CECD CCOC(=O)c1cncnc1CSc1nccs1 787489430 AMXWIUNNOUJSMN-UHFFFAOYSA-N 281.362 2.402 10 20 CECD COc1ccc(CNC(=O)Nc2ccccn2)c(O)c1 794762309 SLASKAUZMZIKCK-UHFFFAOYSA-N 273.292 2.118 10 20 CECD O=C(NC[C@H]1C[C@H]2C=C[C@H]1C2)c1c(F)ccc(O)c1O 1336968390 CSRYXKVXFYRZKU-LPEHRKFASA-N 277.295 2.179 10 20 CECD CCCc1nnc(N(C)Cc2ccccc2O)n1C 1339539335 MDUWSMONIXYTFE-UHFFFAOYSA-N 260.341 2.110 10 20 CECD CC[C@@H](CNCc1cc(C)cc(OC)c1O)OC 1262111871 SFJIDVQNCBNANK-LBPRGKRZSA-N 253.342 2.224 10 20 CECD Cc1ccc(CN2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)O)c(O)c1 1600413670 VTGFUSQWIFXYIW-WHOFXGATSA-N 275.348 2.386 10 20 CECD CCN(C)c1ccc(CN[C@H](C(=O)O)C(C)C)cc1 1603723631 DSYZGJMBDKWGHD-AWEZNQCLSA-N 264.369 2.342 10 20 CECD C[C@H](NC1CCCC1)c1cccc(-c2nn[nH]n2)c1O 1589953057 CBQKHSKMAXRFCQ-VIFPVBQESA-N 273.340 2.166 10 20 CECD C[C@@H](N[C@@]1(C)CC1(C)C)c1cccc(-c2nn[nH]n2)c1O 1589952858 YELCEUIZONCQEX-PSLIRLAXSA-N 287.367 2.412 10 20 CECD CCN1CCC[C@H]1CN[C@H](C)c1cc(C(=O)O)ccc1O 1596421403 JVAJWMJZMLFFSJ-YPMHNXCESA-N 292.379 2.225 10 20 CECD CCN1C(=O)/C(=C/c2ccc(C(=O)O)nc2)SC1=S 1776874041 JFUJLQCGPWRPON-UITAMQMPSA-N 294.357 2.001 10 20 CECD COc1cccc(C(=O)NCc2ccc(O)c(O)c2)c1 158914355 NYBPJFYUEUJWJP-UHFFFAOYSA-N 273.288 2.036 10 20 CECD CCc1cccc(CN2CCO[C@@H](CF)C2)c1O 848917534 ULSQLKCGPSDDSK-ZDUSSCGKSA-N 253.317 2.125 10 20 CECD C[C@@H](NC(=O)[C@@H]1C[C@H]2CC[C@H]1O2)c1ccccc1O 827937620 ZZGDCVFPWQVXEH-BGOOENEXSA-N 261.321 2.137 10 20 CECD CN1CCN(Cc2cc(F)ccc2O)CC1(C)C 234361408 GSXHUEGERZCCPW-UHFFFAOYSA-N 252.333 2.057 10 20 CECD CC(C)NCCC(=O)N(C)Cc1ccc(N(C)C)cc1 37801176 VRLIPIBZKNGNQI-UHFFFAOYSA-N 277.412 2.099 10 20 CECD CN(C)c1ccc(CNCC2([S@@](C)=O)CCC2)cc1 280647280 NWTTZJGVCHFNRF-LJQANCHMSA-N 280.437 2.143 10 20 CECD COc1ccc(O)c(CN2CCO[C@H](C(C)C)C2)c1 709028854 RFWHKJFJOPEEKS-HNNXBMFYSA-N 265.353 2.258 10 20 CECD FC(F)(F)OCCNCc1ccc2c(c1)CCO2 398164677 DPGXLAOGOGOINW-UHFFFAOYSA-N 261.243 2.248 10 20 CECD COc1cccc(CNC(=O)c2cccc(C)c2O)c1O 105652707 KGSROBGXGHUJME-UHFFFAOYSA-N 287.315 2.345 10 20 CECD C[C@H](NCC(C)(C)C(N)=O)c1cc(Cl)ccc1O 186220145 OAZPOXWLKGUMDC-QMMMGPOBSA-N 270.760 2.208 10 20 CECD CCOc1cccc(CN(C)CCCOC)c1O 134048685 TVDMGUNQNGRLNB-UHFFFAOYSA-N 253.342 2.259 10 20 CECD CCCOc1ccc(CN(CCO)CC(F)F)c(O)c1 193018493 HWQZFEZGATWGEG-UHFFFAOYSA-N 289.322 2.240 10 20 CECD CC(=O)N[C@@H]1CCCN(c2ccc(OC(F)F)cc2)C1 81203233 OJSPQDRNQDFZHT-LLVKDONJSA-N 284.306 2.393 10 20 CECD COc1ccc(O)c(CN[C@@]2(C)CCCOC2)c1 225932069 SPASNORFQYNTPH-AWEZNQCLSA-N 251.326 2.060 10 20 CECD CC[C@H]1CC[C@@H](C(=O)N(C)Cc2ccccc2O)O1 268201645 GFAZZQDPEHWNTQ-JSGCOSHPSA-N 263.337 2.308 10 20 CECD CC(=O)N1CCC[C@H](CNCc2cc(C)ccc2O)C1 279640615 CWNNZDHJACXLCH-CQSZACIVSA-N 276.380 2.049 10 20 CECD CN(C)C1(CN[C@@H]2CCc3cccc(O)c32)CCOCC1 297629089 JGVOVKYOLPYOHN-CQSZACIVSA-N 290.407 2.080 10 20 CECD CCN1CCN(Cc2cc(Cl)c(F)cc2O)CC1 816480343 KTNKCXJHGKTPDI-UHFFFAOYSA-N 272.751 2.322 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cc(C=O)c[nH]1 815630085 WONMRBPHWUPDOK-UHFFFAOYSA-N 285.347 2.132 10 20 CECD COC(=O)CC(C)(C)NCc1ccc(N(C)C)c(C)c1 815073946 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C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@H]2c1cc(Cl)c(F)cc1O 840820223 QVWHIRDCUAEXPM-BITCUVMXSA-N 298.745 2.414 10 20 CECD C[C@H](N[C@H](C)[C@H](O)C(F)(F)F)c1ccccc1O 866466076 YUYLSYJPFRCTQO-RNSXUZJQSA-N 263.259 2.355 10 20 CECD CCc1cnc(CN(C)c2ccc(OCC(=O)O)cc2)o1 846279652 JLNWMGBFMKJPRV-UHFFFAOYSA-N 290.319 2.337 10 20 CECD COc1ccc(N(C)CCN(C)C[C@H](C)OC)cc1 844402465 YJKHZBDXSQPKSR-ZDUSSCGKSA-N 266.385 2.098 10 20 CECD CC[C@H](C)C[C@H](CO)NCc1c(O)cccc1OC 842753372 FEYLCAFIFROCMR-NWDGAFQWSA-N 267.369 2.288 10 20 CECD Cc1cccc(CN[C@H](CCN)C(F)(F)F)c1O 841090006 CYISLDOSEIMGQF-SNVBAGLBSA-N 262.275 2.070 10 20 CECD COCC[C@@H]1COCCN1Cc1ccc(N(C)C)cc1C 840948522 UZFAGIZYWPKYPV-QGZVFWFLSA-N 292.423 2.298 10 20 CECD Nc1ccc(NC(=O)C(=O)N2CCCCCCCC2)cc1 841140711 GFRFYWRVKCKJIL-UHFFFAOYSA-N 289.379 2.390 10 20 CECD COc1cccc([C@@H](C)NCCOC[C@@H]2CCCO2)c1O 846142578 ATWPFCQRXLMCDI-OLZOCXBDSA-N 295.379 2.247 10 20 CECD C[C@@H](CN[C@H](C)c1cc(Cl)ccc1O)S(C)(=O)=O 756768944 BJWXMZDXRWTURX-DTWKUNHWSA-N 291.800 2.129 10 20 CECD C/C=C(\C)C(=O)NCc1ccc(N2CCC(O)CC2)cc1 856211087 DXERUKXVTJWHPT-QLKAYGNNSA-N 288.391 2.230 10 20 CECD CCOc1ccc(O)c(CN[C@H](CO)CC(F)(F)F)c1 756994628 UVSJPPWGNHPIEX-JTQLQIEISA-N 293.285 2.194 10 20 CECD OC1CCN(c2ccc(CNCc3cc[nH]c3)cc2)CC1 850406276 ZRRQMKRYDCFILR-UHFFFAOYSA-N 285.391 2.266 10 20 CECD Cc1cc(C(=O)NC2([C@@H](C)O)CC2)c(C)n1-c1ccccn1 856132170 WXOBHQZDSOVOAT-CYBMUJFWSA-N 299.374 2.132 10 20 CECD COC1CCN(Cc2ccc(N3CCOCC3)cc2)CC1 768215622 JDUIZVSDMAQUKD-UHFFFAOYSA-N 290.407 2.134 10 20 CECD COc1ccc(CNC(=O)c2cnc(C3CC3)o2)c(O)c1 879847454 ZQMRHDDFUPIEDL-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CCOc1ccc([C@@H]2NC(=O)[C@H]3C[C@H](C)CCN32)c(O)c1 777899209 KGNFTWNYQWFBIC-WDBKCZKBSA-N 290.363 2.020 10 20 CECD COCCN(Cc1ccc(C)cc1O)CC(F)F 876678217 IVAABODTGPCLEX-UHFFFAOYSA-N 259.296 2.414 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](C(C)(C)O)C2)c1 877797299 SSLMTWBBXRJRHH-CYBMUJFWSA-N 279.380 2.384 10 20 CECD C[C@H](N[C@@H](C)c1ccccc1O)C(=O)NCC(F)(F)F 879651922 PFPFIZLKWUJDDJ-IUCAKERBSA-N 290.285 2.110 10 20 CECD CCOc1ccc(CN2C[C@@H](C)N(C)C[C@@H]2C)c(O)c1 775981483 QXZNMJNIKLRUMQ-OLZOCXBDSA-N 278.396 2.315 10 20 CECD COc1cc(N2C[C@H]3C[C@H]3C2)c([N+](=O)[O-])cc1OC 884589526 CPIHHNBCWBSXQM-DTORHVGOSA-N 264.281 2.068 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2cc(F)cc(F)c2O)C1 894075593 GDMQPEJWORSCBO-CQSZACIVSA-N 285.290 2.055 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(F)cc(F)c2O)[C@@H]1C 894538050 NTZQDSPPHDKDTA-LDYMZIIASA-N 285.290 2.054 10 20 CECD CO[C@]1(C(=O)N[C@H](C)c2ccccc2O)CCSC1 899181643 IYNPHGDXIUVNIY-QMTHXVAHSA-N 281.377 2.092 10 20 CECD COc1ccc(CN[C@@H]2CCO[C@H](C)C2)c(O)c1OC 893219446 GYFPUSPFDZIJEW-ZYHUDNBSSA-N 281.352 2.067 10 20 CECD COc1ccc(CNc2cc(C)nc(OC)n2)c(O)c1 795283633 FKUBBEKBDHYLOL-UHFFFAOYSA-N 275.308 2.120 10 20 CECD COc1ccc(CNC(=O)C2(SC)CCC2)c(O)c1 794387242 HEXOTHLNWNFONO-UHFFFAOYSA-N 281.377 2.303 10 20 CECD CC[C@H](NC[C@@H]1COCCO1)c1ccc(C)cc1O 794798812 YTKPCXNXOGTBKN-OCCSQVGLSA-N 265.353 2.157 10 20 CECD O=C(N[C@@H]1CCC[C@@H](F)C1)c1cccc(O)c1O 1332485328 NHMLIMGPPPZBRA-RKDXNWHRSA-N 253.273 2.108 10 20 CECD OC[C@H](NCc1ccc(N2CCCC2)cc1)C1CC1 1318847913 QGRQGRLBAQUXAQ-INIZCTEOSA-N 260.381 2.147 10 20 CECD CCOC[C@@H]1CN(Cc2cccc(CC)c2O)CCO1 706615212 PACYIOFZSWYGGH-HNNXBMFYSA-N 279.380 2.192 10 20 CECD CCCn1cc(/C=C2/SC(=S)NC2=O)c(C)n1 1337621772 KOYRVIVBQMKKHT-WEVVVXLNSA-N 267.379 2.090 10 20 CECD CS[C@H]1CC[C@H](NC(=O)NCc2ccc(N)cc2)C1 1336841919 ZDYRQXDVOSWCOD-STQMWFEESA-N 279.409 2.352 10 20 CECD O=C(O)[C@@]1(F)CCN(Cc2ccc(Cl)cc2O)C1 1601716829 JEDNLZGDAKOVND-GFCCVEGCSA-N 273.691 2.044 10 20 CECD CC[C@@H](NCC1CCC1)c1cccc(-c2nn[nH]n2)c1O 1604056482 UCZXVKBDIVOPKQ-CYBMUJFWSA-N 287.367 2.413 10 20 CECD CCOC(=O)[C@@H](CC)Sc1ncc(C(=O)O)s1 1605510478 YHDDLIQGLRNQFW-ZCFIWIBFSA-N 275.351 2.275 10 20 CECD CO[C@H]1C[C@@H](CN[C@H](C)c2cc(C(=O)O)ccc2O)C1 1607006098 FAUMACMJWIKFIZ-FOGDFJRCSA-N 279.336 2.166 10 20 CECD O=C(O)[C@H](CNCc1cccc(F)c1O)c1ccccc1 1574817712 RUAAWVOTFGJCHE-CYBMUJFWSA-N 289.306 2.489 10 20 CECD CCCc1noc(CSc2ncc(C(=O)O)s2)n1 1596101657 UAANEXOGESYEGN-UHFFFAOYSA-N 285.350 2.469 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccc(F)n2)cc1F 162499340 BAOMAUHREDZEOJ-UHFFFAOYSA-N 291.301 2.356 10 20 CECD CC[C@@H]1COCCN1Cc1cc(OC)c(C)cc1O 160233185 BFBLMAPIYXPJFX-CYBMUJFWSA-N 265.353 2.320 10 20 CECD CC1CC(Cn2cc(COc3ccc(N)cc3)nn2)C1 900651336 YCQTVBQQJDZDLD-UHFFFAOYSA-N 272.352 2.485 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@H]2NCCCOCCO 230672068 KULKNFAKPAXBTP-QWHCGFSZSA-N 279.380 2.238 10 20 CECD O=S(=O)(NCc1ccccc1O)c1ccc(F)cc1F 158585804 NUVCNDAGJMZKEV-UHFFFAOYSA-N 299.298 2.149 10 20 CECD COc1ccc(CN[C@@H](C)[C@H]2CCCOC2)c(O)c1 389071617 MINGBMOHPYURNX-AAEUAGOBSA-N 265.353 2.306 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)N2CCN(C)CC2)cc1 69131543 WIHAGQRCDPXTDF-UHFFFAOYSA-N 297.402 2.482 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cscn1 115282039 USSHCXPRQGSISO-UHFFFAOYSA-N 275.377 2.448 10 20 CECD CN(Cc1ccccc1O)C[C@H](O)c1ccc(C#N)cc1 305084437 SMTMGZFLEWPOAT-KRWDZBQOSA-N 282.343 2.429 10 20 CECD CN(Cc1ccc(N(C)C)c(F)c1)CC(C)(C)O 126392270 HFWSVPTVOOSKRI-UHFFFAOYSA-N 254.349 2.094 10 20 CECD C[C@@H](NCCCO[C@H]1CCOC1)c1ccc(F)cc1O 185702357 RGVPBKHCZUROBU-YPMHNXCESA-N 283.343 2.378 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H](C)c1ccccc1O 183523627 UPOCURAGKFBPOV-OPQQBVKSSA-N 255.383 2.155 10 20 CECD C[C@@]1(CNC(=O)c2cccc(O)c2O)CCCS1 126492106 XGCHQXWFLQDZME-ZDUSSCGKSA-N 267.350 2.113 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1=CCCCO1 80987028 HWSMGGREGNPECH-UHFFFAOYSA-N 274.364 2.405 10 20 CECD C[C@H]1CN(C(=O)NCc2ccc(N(C)C)cc2)[C@@H](C)CO1 193104435 AMWKXVAJTABMIR-STQMWFEESA-N 291.395 2.071 10 20 CECD Cc1cc([N+](=O)[O-])cnc1NCCc1ccc(O)c(O)c1 92665990 HEDNQQJZEBKOJU-UHFFFAOYSA-N 289.291 2.364 10 20 CECD C[C@@H](Cn1cccn1)N[C@@H]1CCc2cccc(O)c21 296686123 GWVUHQMARXSWQO-WCQYABFASA-N 257.337 2.254 10 20 CECD CC(=O)c1cc(F)cc(CN2CCOC[C@H]2C2CC2)c1O 90007402 AXFVEDGZAXPIOJ-HNNXBMFYSA-N 293.338 2.345 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C[C@H]2CCC[C@H]2C1 276546027 GSZDOEZSVBLIBR-DTORHVGOSA-N 265.284 2.109 10 20 CECD Cc1cc(O)c(CNCC2([S@@](C)=O)CCC2)cc1C 280739178 WPTNBAFHEIGQFC-LJQANCHMSA-N 281.421 2.400 10 20 CECD CC(C)(C(=O)NCc1ccc(O)c(O)c1)C1CCOCC1 280881304 UJEBLKKMKDIAIF-UHFFFAOYSA-N 293.363 2.167 10 20 CECD Cc1cccc(CNc2ccc(CCO)nc2)c1O 809779884 CILGHNOUDUZQRH-UHFFFAOYSA-N 258.321 2.243 10 20 CECD CO[C@](C)(C(=O)N(C)Cc1ccccc1O)C1CC1 292498543 FNXGEOJHCPMQIY-HNNXBMFYSA-N 263.337 2.166 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC[C@@H]2CCCN2)c1 828666462 DMIQTMHJXRFSAC-NEPJUHHUSA-N 292.379 2.110 10 20 CECD C[C@@H](NC(=O)c1cnn(CCF)c1)c1ccccc1O 827946299 CVYAWYSOINSTCX-SNVBAGLBSA-N 277.299 2.049 10 20 CECD CN(C)c1ccc(CN[C@](C)(CCF)C(=O)O)cc1F 901915232 JWPHJZGGNKWQPA-CQSZACIVSA-N 286.322 2.184 10 20 CECD CC1=NO[C@](C)(C(=O)N[C@@H](C)c2ccc(N(C)C)cc2)C1 904684405 ZVOAXAOHGMJUSE-LRDDRELGSA-N 289.379 2.485 10 20 CECD COc1ccc(O)c(CNC(=O)NC[C@@H](C)C2CC2)c1 734067219 LCLWWDWFBZWVNB-SNVBAGLBSA-N 278.352 2.246 10 20 CECD NC(=O)Cc1ccc(CN[C@H]2CCc3cccc(O)c32)cc1 834803064 JKNNHKRELKSTIH-HNNXBMFYSA-N 296.370 2.197 10 20 CECD CCN1C[C@@H](N[C@@H](C)c2cc(Cl)ccc2O)CC1=O 834889847 KJARNAGQNIVOOI-ONGXEEELSA-N 282.771 2.317 10 20 CECD CCN(C)c1ccc(CN[C@H](C)[C@H](C)C(=O)O)cc1 846229386 TXLGZMUSFPDYMO-NWDGAFQWSA-N 264.369 2.342 10 20 CECD CC[C@@H](C)NC(=O)CCNCc1ccc(N(C)C)cc1C 840930143 JDZKOZPRVHOEPP-CQSZACIVSA-N 291.439 2.455 10 20 CECD CC[C@@H](C)NC(=N)NCc1cc(Cl)ccc1O 849048791 LMAUKUVYEUZMHN-MRVPVSSYSA-N 255.749 2.458 10 20 CECD C[C@@H](CC(=O)O)CC(=O)NCc1ccc(N(C)C)c(F)c1 911301192 YPGAVEMFOUDDPY-SNVBAGLBSA-N 296.342 2.009 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc([N+](=O)[O-])c2O)C[C@@H](C)N1 843048950 BMOWDVSKEBIFDJ-DTORHVGOSA-N 299.758 2.136 10 20 CECD CN(CCc1ccncc1)C(=O)NCCc1ccc(N)cc1 841956350 CUFCDTUMXRHRFA-UHFFFAOYSA-N 298.390 2.090 10 20 CECD CC(=O)CCC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840558127 XZCRMFPSYRBDHV-ZDUSSCGKSA-N 290.407 2.477 10 20 CECD C/C=C/C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 920879850 VTYUYHHIASUDEW-ITDFMYJTSA-N 274.364 2.277 10 20 CECD CC[C@@H](CN1CCCC1)NC(=O)c1cc(O)cs1 751392378 XFWWQVSRIWFFSF-JTQLQIEISA-N 268.382 2.058 10 20 CECD CC(=O)c1cc(F)cc(CN(C)Cc2nnc(C)o2)c1O 852471998 SCBYTCUZWGZHPW-UHFFFAOYSA-N 293.298 2.057 10 20 CECD C[C@H](NC[C@H]1COCCO1)c1cc2c(cc1O)CCCC2 756435107 VSOAQGGOEPPZDT-WFASDCNBSA-N 291.391 2.337 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1cc(F)ccc1O 756731402 ABWIPSRITWDOPL-QWRGUYRKSA-N 271.332 2.233 10 20 CECD Cc1cc(C)c(O)c(CN2CC[S@](=O)[C@@H](C)[C@@H]2C)c1 754732684 UTKHMXRPKJEKRT-JMERFSKESA-N 281.421 2.350 10 20 CECD Cc1cccc(O)c1CN1CC[S@](=O)C(C)(C)CC1 877570581 PSPGMTXOKLEQKF-IBGZPJMESA-N 281.421 2.434 10 20 CECD CN(Cc1ccccc1O)C(=O)CCC1(O)CCC1 866597715 YDBIKOFVODYXGD-UHFFFAOYSA-N 263.337 2.046 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)N[C@@H](C)[C@H](C)O 1118090651 NHPFTURLSGYTCR-IHRRRGAJSA-N 264.413 2.351 10 20 CECD C[C@H]1C[C@@H]1CNCc1ccc(N2CCN(C)CC2)cc1 775991132 KPYXNGZKLTVJSE-GOEBONIOSA-N 273.424 2.184 10 20 CECD Nc1ccc(CC(=O)N(CC(F)F)C2CCC2)cc1 1119388680 VPQIUMQTCSSKFG-UHFFFAOYSA-N 268.307 2.458 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccncn1 770763210 AIBKQNKKRJUJRS-UHFFFAOYSA-N 285.351 2.173 10 20 CECD C[C@H](N[C@@H]1CCCC[C@H]1O)c1c(O)cccc1F 886594773 UHMSQVZWKSZHBM-MVWJERBFSA-N 253.317 2.485 10 20 CECD COc1ccc(CNC2CCC(OC)CC2)c(O)c1OC 894859770 YDCJWEGOGNSLDX-UHFFFAOYSA-N 295.379 2.457 10 20 CECD COCC[C@H](C)NCc1cc(C)cc(OC)c1O 894212137 YSPDVHFQWDLJQY-NSHDSACASA-N 253.342 2.224 10 20 CECD Cc1ccc(C(=O)OCc2cnc(Cl)cn2)c(O)c1O 798608074 MNOMZJJMBGUXFR-UHFFFAOYSA-N 294.694 2.207 10 20 CECD CCN(CCC(=O)NC)Cc1c(O)ccc(Cl)c1F 897709601 GGNHPSCJJCEJJO-UHFFFAOYSA-N 288.750 2.143 10 20 CECD CC[C@@H](NCCCn1cncn1)c1ccc(C)cc1O 794816149 XCBKVYYPQKKCLE-CQSZACIVSA-N 274.368 2.423 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCO2)C1CCN(C)CC1 396448360 RNKBOYYRLKERFQ-CYBMUJFWSA-N 274.408 2.441 10 20 CECD Cc1ccc(O)c(CN2CCO[C@H]([C@@H]3CCCO3)C2)c1 91928186 DJLCDXSKEHYRHH-HOTGVXAUSA-N 277.364 2.080 10 20 CECD CC1=NO[C@](C)(C(=O)Nc2c(Cl)ccc3nonc23)C1 1336298136 BETGKEHZRLMCRA-LBPRGKRZSA-N 294.698 2.370 10 20 CECD C[C@H](CN1CCCC1=O)N[C@H](C)c1cc(F)ccc1O 94617708 JWQITPJMKIVZKH-GHMZBOCLSA-N 280.343 2.193 10 20 CECD C[C@@H](O)C[C@@H](C)NCc1cc(F)c(N(C)C)cc1F 1335157288 SMWMQCYANCOOCJ-NXEZZACHSA-N 272.339 2.280 10 20 CECD CN(C)C1(CNCc2ccc3c(c2)CCO3)CCC1 97928810 ODKCPIVCBXNPMR-UHFFFAOYSA-N 260.381 2.195 10 20 CECD Cc1ccc(CN[C@H](Cc2ccccc2)C(=O)O)c(O)c1 1594362662 YJZBCUZLBJWRHW-OAHLLOKOSA-N 285.343 2.486 10 20 CECD CN(C)c1ccc(OCC[C@H]2CCOC2)cc1C(=O)O 1598328714 ZDVKIXCZQRLJIL-LLVKDONJSA-N 279.336 2.256 10 20 CECD CN(Cc1ccccc1O)C(=O)COC(C)(C)C 158404603 AFMBHPABQZTUPK-UHFFFAOYSA-N 251.326 2.166 10 20 CECD CN(C)c1ccc(CNc2c([N+](=O)[O-])ncn2C)cc1 8374695 PTXYDBHXINQWHY-UHFFFAOYSA-N 275.312 2.006 10 20 CECD CCCNC(=O)CCN[C@@H](C)c1cc(C)ccc1O 45072555 JNNNAPIGQGPYTR-LBPRGKRZSA-N 264.369 2.268 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Br)ccc2O)CO1 402293435 NPXQYYQPOLRZJZ-LDYMZIIASA-N 286.169 2.422 10 20 CECD CC[C@@H](C)NC(=O)NCc1ccc(N2CCOCC2)cc1 54786332 ANQIVZZYGSTSKW-CYBMUJFWSA-N 291.395 2.121 10 20 CECD COCC[C@@H](C)NC(=O)NCc1ccc(N(C)C)cc1C 115672008 HCAAYHOAKJQKPL-CYBMUJFWSA-N 293.411 2.285 10 20 CECD Cc1nn(C)c(C)c1CN(C)c1ccc2c(c1)OCO2 121245479 DAWWEWHWKKSOIR-UHFFFAOYSA-N 273.336 2.402 10 20 CECD CCOc1ccc(O)c(CN2C[C@H](C)O[C@H](COC)C2)c1 188391413 TYBFXEYQZACIBL-WFASDCNBSA-N 295.379 2.027 10 20 CECD CCOc1cccc(CN2CCN(C(C)C)CC2)c1O 132268903 INEGPMPLXJSFNE-UHFFFAOYSA-N 278.396 2.317 10 20 CECD Cc1ccc([C@H](C)NCC2(CS(C)(=O)=O)CC2)c(O)c1 186090091 UNIGSVFHUOHLCT-LBPRGKRZSA-N 297.420 2.176 10 20 CECD CC(C)NC(=O)[C@@H](C)NCc1ccc(N2CCCC2)cc1 228934413 QGENQBASUXHPQJ-CQSZACIVSA-N 289.423 2.290 10 20 CECD CC1CCN(c2ccc(CNC(=O)C(C)(C)O)cc2)CC1 191808100 ONMMVLPCSNOSDX-UHFFFAOYSA-N 290.407 2.310 10 20 CECD COc1cccc(CNC[C@@]2(O)CCc3ccccc32)c1O 269798558 IUUMETBCWLIXNO-SFHVURJKSA-N 299.370 2.324 10 20 CECD COC(=O)[C@@]1(F)CCN(Cc2cccc(Cl)c2O)C1 271879116 UODSFTNXRYJYDO-CYBMUJFWSA-N 287.718 2.133 10 20 CECD CN(Cc1ccc(CO)o1)c1ccc2c(c1)OCO2 272534957 NWFFKILHNQOQSH-UHFFFAOYSA-N 261.277 2.137 10 20 CECD COc1cc(O)c(CNC2CC(F)(F)C2)cc1OC 277287089 AKCGPQONYPHDHD-UHFFFAOYSA-N 273.279 2.297 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2cccs2)o1 808013621 KHIYGHGREIVWCD-UHFFFAOYSA-N 268.319 2.048 10 20 CECD Cc1cc(C)c([C@@H](C)NCCOCCN(C)C)c(O)c1 815619712 WALKUCXZCWCQSX-CQSZACIVSA-N 280.412 2.238 10 20 CECD Cc1ccc(C(=O)OCc2nnc(C(C)C)o2)c(O)c1O 727004150 HHJRRIQIBJEZHR-UHFFFAOYSA-N 292.291 2.270 10 20 CECD C[C@@H](CC(=O)O)C(=O)NCc1ccc(N2CCCC2)cc1 827296887 WKMSZQSTDKYMBW-LBPRGKRZSA-N 290.363 2.014 10 20 CECD C[C@@H]1SCC[C@H]1NC(=O)N(C)Cc1ccccc1O 828532184 SKVUJJRKNAPDAA-CMPLNLGQSA-N 280.393 2.428 10 20 CECD O=C(COC(F)(F)F)NCc1cc(Cl)ccc1O 823986068 FTOQJNJLDMWFHR-UHFFFAOYSA-N 283.633 2.198 10 20 CECD Cc1cc(Br)c(O)c(CNCC2(N)CC2)c1 904449104 GQBJZFFDQOOBIP-UHFFFAOYSA-N 285.185 2.044 10 20 CECD CN(CCCCNCc1cc(F)ccc1O)C1CC1 835062351 BJPXPUXCCMGTQB-UHFFFAOYSA-N 266.360 2.495 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1CC[C@@H](C(=O)O)C1 911332573 YLAXLLCJLWEGKS-DTWKUNHWSA-N 297.738 2.163 10 20 CECD C/C(=C\C(=O)N(CC(=O)O)Cc1ccccc1O)C1CC1 911486086 MIOTZNFSEFZKOD-DHZHZOJOSA-N 289.331 2.162 10 20 CECD C[C@@H]1COCC[C@@H]1CNC(=O)Nc1ccc(N)cc1 841300646 YPJBWOKBOXEVML-GHMZBOCLSA-N 263.341 2.063 10 20 CECD C[C@H](N[C@@H](C)c1cc([N+](=O)[O-])ccc1O)c1ccn(C)n1 840816785 PXZCGLSNEVYDRZ-UWVGGRQHSA-N 290.323 2.446 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCCC[C@@H]2C(=O)O)cc1 843305700 GIPJKDDKFDIDHG-LSDHHAIUSA-N 276.380 2.486 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCNC2(C)C)c1O 841086464 OGZDGACGZYTTTE-GFCCVEGCSA-N 284.787 2.284 10 20 CECD CCc1cccc(CN[C@@H](C)C(=O)N[C@@H](C)CC)c1O 848899391 FOYSAOVVYVTXDT-RYUDHWBXSA-N 278.396 2.347 10 20 CECD COC1CCC(CC(=O)NCc2ccc(O)cc2O)CC1 910948824 AZQSBCCXNMAHGS-UHFFFAOYSA-N 293.363 2.309 10 20 CECD Oc1cccc(Cl)c1CNCC[C@@H]1CCNC1 841036338 LNTHPJQLUUZPAP-JTQLQIEISA-N 254.761 2.135 10 20 CECD COc1ccc(N2CCN(C(=O)OCCCF)CC2)cc1 841475517 RADFAFLBOLYHPA-UHFFFAOYSA-N 296.342 2.313 10 20 CECD COc1cccc([C@H](C)N[C@H](C)C[C@H](C)O)c1O 846163037 KGXWMBKHWIZUAI-VWYCJHECSA-N 253.342 2.211 10 20 CECD N[C@@H]1CCC[C@@H](NCc2cc(Cl)cc([N+](=O)[O-])c2O)C1 841055734 VJBOLBNDSODDHK-GHMZBOCLSA-N 299.758 2.313 10 20 CECD C[C@@H]1C[C@@H](CN)CN1Cc1cc(Cl)cc(F)c1O 843056878 BIJRZTCMVKMMQT-BDAKNGLRSA-N 272.751 2.354 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)N[C@@H](C)CNC 851680090 GBZNQSZODMWJMV-ZDUSSCGKSA-N 293.411 2.312 10 20 CECD C[C@H](O)C[C@@H](C)N[C@H](C)c1cc(F)cc(F)c1O 757655790 KZOSECAAQBWSSE-HRDYMLBCSA-N 259.296 2.480 10 20 CECD CCCOc1ccc(CN[C@@H](C)C(=O)OC)cc1C 877475009 BXOTUAUKUVTUEW-LBPRGKRZSA-N 265.353 2.435 10 20 CECD Cc1ccc(CNC[C@@H]2COC3(CCCC3)O2)c(O)c1 877133452 BIZLSRHBWVUQNP-CQSZACIVSA-N 277.364 2.476 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H](O)CSC 778061136 ARSYOQFNFNBQCS-GFCCVEGCSA-N 267.394 2.172 10 20 CECD Cc1ccc2c(c1)N[C@H](c1cc([N+](=O)[O-])ccc1O)NC2=O 877862881 CBDTZNYGGAOWPD-AWEZNQCLSA-N 299.286 2.463 10 20 CECD C[C@@](O)(CCNC(=O)c1cc(O)cs1)c1ccccc1 779506545 WHEHYZYPUADSDY-OAHLLOKOSA-N 291.372 2.481 10 20 CECD CCCOc1ccc(CN[C@@H](CCOC)C(=O)O)cc1C 871878709 SOYHWPHUBUZQRZ-AWEZNQCLSA-N 295.379 2.363 10 20 CECD O=C(/C=C\c1cccnc1)N1CCc2ncccc21 770672501 MLWVHHJSEVBKIL-WAYWQWQTSA-N 251.289 2.079 10 20 CECD CCN(CC)c1ccc(CNCCN(C)OC)cc1 883173343 IXLVCEWJPCGQBK-UHFFFAOYSA-N 265.401 2.116 10 20 CECD C[C@@H](Nc1cncc2ncnn12)c1ccc(N(C)C)cc1 772295536 HKDQMRNSNMJDAM-LLVKDONJSA-N 282.351 2.363 10 20 CECD CC[C@H](NC(=O)/C=C/c1ccc(O)c(O)c1)c1ncc[nH]1 785420988 JBHTVDRJHRKTPB-MALLOTDXSA-N 287.319 2.102 10 20 CECD COc1ccc(CNCCOCC2CCC2)c(O)c1OC 893616923 LWHYUCRPUUYSCC-UHFFFAOYSA-N 295.379 2.316 10 20 CECD COC(=O)[C@@H]1CCN(Cc2cc(F)cc(F)c2O)[C@H]1C 894538047 NTZQDSPPHDKDTA-GZMMTYOYSA-N 285.290 2.054 10 20 CECD COc1ccc(CNC(=O)c2cc(C)ccc2O)c(O)c1 794369059 ACEJWAHNKYXTMW-UHFFFAOYSA-N 287.315 2.345 10 20 CECD CCCNC(=O)CCN[C@@H](CC)c1ccc(F)cc1O 796703455 VJMSEPRIUMWTPZ-ZDUSSCGKSA-N 282.359 2.488 10 20 CECD COc1ccc(CNc2ncnc3[nH]ccc23)c(O)c1 795285559 RUSRZMCWQFVAOF-UHFFFAOYSA-N 270.292 2.284 10 20 CECD COc1ccc(O)c(CN2CCOC(C)(C)[C@@H]2C)c1 687952061 DBLPNXSYHWQZJI-NSHDSACASA-N 265.353 2.400 10 20 CECD CN(CC(=O)c1cccn1C)Cc1ccccc1O 109773549 BIFACAOODKMXGG-UHFFFAOYSA-N 258.321 2.045 10 20 CECD COc1cccc(CN[C@@H]2CCC[C@H](OC)C2)c1O 746755676 REMPLMHPTKGMGU-OLZOCXBDSA-N 265.353 2.448 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@H]2CCCCS2(=O)=O)c1 694591017 QLWZERXJCDYRFJ-QWHCGFSZSA-N 297.420 2.319 10 20 CECD COc1cc(C)cc(CNC2CCC(O)CC2)c1O 1331993421 JMXLNYYHDVMISG-UHFFFAOYSA-N 265.353 2.102 10 20 CECD CCN(C)C(=O)CN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 229588089 UAVYJSXNLYXWRT-RYUDHWBXSA-N 276.380 2.317 10 20 CECD Oc1cccc(Cl)c1CNCC1=CCCOC1 288529515 VMBDHMCGOUXVEA-UHFFFAOYSA-N 253.729 2.482 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(F)cn2)cc1 181644537 KEGHDCPWRFNYHF-UHFFFAOYSA-N 273.311 2.217 10 20 CECD CN(C)C1(CN[C@@H]2CCc3cccc(O)c32)CCC1 296533420 RVCKNGOIYDAQPP-CYBMUJFWSA-N 260.381 2.453 10 20 CECD CCC[C@@H]1CN(C(=O)Nc2ccc(N)cc2)CCO1 709029840 OSXOHWUDMPIMNQ-CYBMUJFWSA-N 263.341 2.302 10 20 CECD COc1ccc(CN[C@@H]2C[C@@H](C)O[C@H]2C)c(O)c1 384541761 FAFGOTCUDYTRMO-GBIKHYSHSA-N 251.326 2.056 10 20 CECD C[C@@H](N[C@H](CO)CC(F)(F)F)c1ccc(F)cc1O 717773065 GAQSLKIVNCPPCF-APPZFPTMSA-N 281.249 2.495 10 20 CECD CCOCCCCNC(=O)NCc1ccc(N(C)C)cc1 56332664 UFTCKJHVAATLNV-UHFFFAOYSA-N 293.411 2.369 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](C)OC)c1 170900523 GKLHAIYMHOEHEY-NXEZZACHSA-N 267.325 2.003 10 20 CECD CC[C@H](N[C@H]1CCCCNC1=O)c1ccc(N(C)C)cc1 177874428 XQXTVNCGSRXIQD-HOTGVXAUSA-N 289.423 2.462 10 20 CECD CC[C@H](C)NC(=O)CN(C)c1ccc(OC)c(F)c1 177068023 IRQARZAXLJWXPQ-JTQLQIEISA-N 268.332 2.185 10 20 CECD Cc1cc(C(=O)N[C@@H]2CCNC2)c(C)n1-c1ccccc1 125918166 LUNQQYWRCHGSCZ-CQSZACIVSA-N 283.375 2.186 10 20 CECD CCC[C@@](C)(NCc1cc(F)ccc1O)C(=O)OC 184046788 QHMDQSWYDRBDFY-CQSZACIVSA-N 269.316 2.353 10 20 CECD O=C(NCc1ccccc1O)c1ccncc1Cl 135451282 LMMNPBQBWNDJFW-UHFFFAOYSA-N 262.696 2.371 10 20 CECD COCCN(CCOC)Cc1cc(C)c(C)cc1O 83104523 UWUQPMWVGZAXNX-UHFFFAOYSA-N 267.369 2.104 10 20 CECD CCC[C@@](C)(O)CNCc1cc(OC)ccc1O 224810364 AJPVDMBHSMMLPQ-CQSZACIVSA-N 253.342 2.042 10 20 CECD O=S(=O)(NCc1ccccc1O)C1CCCCC1 135101655 FDOOGWYUYBDATI-UHFFFAOYSA-N 269.366 2.144 10 20 CECD Cc1ccc(O)c(CN2CCNC(=O)[C@@H]2c2ccccc2)c1 92675995 XQPZFCRITQUONV-KRWDZBQOSA-N 296.370 2.374 10 20 CECD Cc1noc(C)c1/C=C1/SC(=S)N(C)C1=O 255499291 BRRKVGWTHNCTCE-XBXARRHUSA-N 254.336 2.122 10 20 CECD COCCC1CCN(Cc2cc3c(cc2O)OCO3)CC1 529638716 WDNUGFNCECXHNZ-UHFFFAOYSA-N 293.363 2.369 10 20 CECD CC[C@H](NCC(=O)NC(C)C)c1ccc(C)cc1O 279976002 DIITUHXCTHOMNP-ZDUSSCGKSA-N 264.369 2.266 10 20 CECD CC[C@@H]1CO[C@@H](C)CN1C(=O)/C=C/c1ccc(O)c(O)c1 272685305 SSGOGYQMOFLNFV-VAFIWLDWSA-N 291.347 2.137 10 20 CECD COc1cccc(CN2C[C@H](N3CCCC3)C[C@@H]2C)c1O 289698702 OLWJJLGCBULLNZ-DZGCQCFKSA-N 290.407 2.459 10 20 CECD CCC[C@@](C)(NCc1cc([N+](=O)[O-])ccc1O)C(=O)O 284299290 RNCRZQSMZDBNFU-CYBMUJFWSA-N 282.296 2.033 10 20 CECD C[C@H]1C[C@@H]1CNC(=O)NCc1ccc(N(C)C)c(F)c1 299329032 OJTFUOVGLPPNJI-CMPLNLGQSA-N 279.359 2.347 10 20 CECD CCOCC(C)(C)NCc1ccc([N+](=O)[O-])c(OC)c1O 293755516 XFEPDMDEYIJMFB-UHFFFAOYSA-N 298.339 2.214 10 20 CECD CN(Cc1cccc(Cl)c1O)C1(CO)CCOCC1 827909894 YROVOSSFXLOFCI-UHFFFAOYSA-N 285.771 2.019 10 20 CECD Cc1nc(C(C)C)oc1C(=O)NCc1ccc(O)cc1O 828912094 XWAXORZXTMXEAW-UHFFFAOYSA-N 290.319 2.448 10 20 CECD Cc1noc(C)c1COC(=O)c1cc(O)cs1 731910246 QEFXNPVSHCWOSC-UHFFFAOYSA-N 253.279 2.416 10 20 CECD CO[C@@H](C1CC1)[C@@H](C)NC(=O)NCc1ccccc1O 836642884 WATMPYOMROLONS-QMTHXVAHSA-N 278.352 2.005 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)c1cn(C)nn1 902805535 AZLYVHYYFIHXNK-LBPRGKRZSA-N 273.384 2.040 10 20 CECD CC(C)(C)CNC(=O)C(C)(C)NC(=O)c1cc(O)cs1 830712205 KWVCIQDKEAWODT-UHFFFAOYSA-N 298.408 2.124 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H](C)[C@@H]2CN)c1O 843353399 HIPLHNNOIJZURT-BONVTDFDSA-N 294.370 2.293 10 20 CECD CC(C)[C@@H](O)C1(CNC(=O)Nc2ccc(N)cc2)CC1 841295714 DGRYXGNJNIEUMK-CYBMUJFWSA-N 277.368 2.187 10 20 CECD CCOc1cccc(CN[C@@H](C)C[C@@H](C)N)c1O 843129640 RBGYRMFNYGOBER-MNOVXSKESA-N 252.358 2.006 10 20 CECD Cc1cc(O)c(CN2CC(=O)N[C@@H](C)C2)cc1C(C)C 840134943 VWPDLKGXUSHQRX-LBPRGKRZSA-N 276.380 2.144 10 20 CECD Oc1ccc(Br)cc1CN[C@@H]1CCCNCC1 841057345 IZPXJSABJMYSBG-GFCCVEGCSA-N 299.212 2.386 10 20 CECD N[C@@H]1CN(Cc2ccccc2O)C[C@H]1c1cccc(F)c1 841104697 XPHRHHGVNBNAKO-JKSUJKDBSA-N 286.350 2.458 10 20 CECD O=C(NCc1nc2c(s1)CCC2)c1cc(O)cs1 927650159 NODGYFTVMSAUAH-UHFFFAOYSA-N 280.374 2.329 10 20 CECD C[C@@H](N[C@H]1CCCN(C)C1=O)c1cc(Cl)ccc1O 756638376 OSSZWAZKOSYZCJ-SKDRFNHKSA-N 282.771 2.317 10 20 CECD CCN(CC)c1ccc(CNCCO[C@@H]2CCOC2)cc1 922941119 HDBVHUIGLOQZPU-QGZVFWFLSA-N 292.423 2.428 10 20 CECD C[C@H](NCC(=O)NC1CCCC1)c1ccc(F)cc1O 756704016 DIDYINKZWVLOMF-JTQLQIEISA-N 280.343 2.241 10 20 CECD CO[C@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)C1(C)C 753375016 XQGBJGOTKXLTRZ-STQMWFEESA-N 280.324 2.204 10 20 CECD CCn1nncc1CNCc1ccc2ccccc2c1O 862434247 SQROFJMFNYVNBL-UHFFFAOYSA-N 282.347 2.447 10 20 CECD Cc1cccc(CC(=O)NCCc2ccc(O)c(O)c2)c1 768900588 JLJXTUOOWQFRDX-UHFFFAOYSA-N 285.343 2.308 10 20 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Cc1cc(Br)c(O)c(CNC/C=C/CO)c1 850357511 LZTROKYIKOVFQS-NSCUHMNNSA-N 286.169 2.101 10 20 CECD CC[C@H](N[C@H](C)CC(N)=O)c1ccc(N(C)C)cc1 763396985 GQYVNCFJGOHHBO-RISCZKNCSA-N 263.385 2.057 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)c2cc(C)oc2C)c1 1118877489 HBONEPSJHMHBHL-UHFFFAOYSA-N 295.360 2.389 10 20 CECD CCOCc1cc(CN[C@H](C)C(=O)OCC)ccc1OC 763285705 RGQVTYJKTDYDNT-GFCCVEGCSA-N 295.379 2.273 10 20 CECD COc1ccc(CN[C@H](C[C@@H]2CCCO2)C(=O)O)cc1C 1119611985 PNKGNSDUFCNFPB-UONOGXRCSA-N 293.363 2.116 10 20 CECD COC(=O)c1cnoc1CN[C@H](C)c1ccccc1O 879649338 NQZMCNWZXCVZCF-SECBINFHSA-N 276.292 2.018 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCO[C@@H](C)C2)c1 776473490 LDKOGUKSZCEWDH-SDDRHHMPSA-N 293.363 2.393 10 20 CECD COc1cccc(O)c1CN1CCc2ncsc2C1 783746022 UMYPAXVIUUBLBR-UHFFFAOYSA-N 276.361 2.416 10 20 CECD COc1ccc(CN[C@@]2(C)CCO[C@@H]2C)c(O)c1OC 893521416 NJTISQLLBCVIBI-BMIGLBTASA-N 281.352 2.067 10 20 CECD COc1ccc(O)c(CN2c3ccccc3C[C@H]2CO)c1 895241414 FUSIXQGNUGZWRL-AWEZNQCLSA-N 285.343 2.324 10 20 CECD CC[C@@H](NC[C@]1(OC)CCOC1)c1ccc(F)cc1O 796939474 CLOHVDJGKHUQDY-UKRRQHHQSA-N 283.343 2.378 10 20 CECD COc1ccc(CN=c2cc[nH]c3ccncc23)c(O)c1 795290114 QIIQMDCCARMJJQ-UHFFFAOYSA-N 281.315 2.378 10 20 CECD C[C@@H]1CN(C(=O)c2cc(O)cs2)C[C@H](C2CC2)O1 792670383 QSICSTFMQRHVTE-LDYMZIIASA-N 267.350 2.093 10 20 CECD C[C@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc(N)cc1 19397055 HXXJGIQENQZWID-SMDDNHRTSA-N 278.352 2.182 10 20 CECD COc1cc(Cl)cc(CN[C@H](CO)CC(F)F)c1O 717830159 MTQHXHJIRZMQCU-VIFPVBQESA-N 295.713 2.160 10 20 CECD CN(C)c1ccc(CNCc2ncc(Cl)n2C)cc1 71122537 VLWQGBVMZYPWAC-UHFFFAOYSA-N 278.787 2.429 10 20 CECD Cc1cnn(CC2CC2)c1NC(=O)Cc1ccc(N)cc1 1261494315 MVDHFSORCKJWSD-UHFFFAOYSA-N 284.363 2.365 10 20 CECD CCN(C)c1ccc(CN2CCN(c3ncc[nH]3)CC2)cc1 1261543931 AYYUADXRBAEHAF-UHFFFAOYSA-N 299.422 2.188 10 20 CECD Cc1cc(O)c(CN2CC[C@@H](C(=O)O)C2)c(Cl)c1 1600286087 KHUCGWBKBGFHKJ-SECBINFHSA-N 269.728 2.261 10 20 CECD CCn1ccc(CN[C@@H](C)c2cc(C(=O)O)ccc2O)n1 1597907423 PWVFAAOHNNTBFG-JTQLQIEISA-N 289.335 2.158 10 20 CECD Oc1cc2c(cc1CN1CCOC3(CCCC3)C1)OCO2 164480634 QTTAZABNXYDKKX-UHFFFAOYSA-N 291.347 2.266 10 20 CECD CCc1nc(CCNC(=O)Cc2ccc(N)cc2)cs1 166660206 UBOVKIXCIXZUKV-UHFFFAOYSA-N 289.404 2.189 10 20 CECD O=C(O)C1(NCc2ccc3c(c2)CCO3)CCSCC1 1777600239 ZJRNAHBAVPNHQU-UHFFFAOYSA-N 293.388 2.062 10 20 CECD CCCN(CC)CCNCc1ccc2c(c1)CCO2 223226242 PFPUTBHVNPMPAX-UHFFFAOYSA-N 262.397 2.443 10 20 CECD CCOC1CCN(C(=O)Nc2ccc(N)cc2)CC1 40690250 CXHHXGRETRYZKO-UHFFFAOYSA-N 263.341 2.302 10 20 CECD Oc1cc2c(cc1CNC[C@H]1CCCSC1)OCO2 288402378 IAKIAJITWRCUHH-SNVBAGLBSA-N 281.377 2.354 10 20 CECD CCc1cccc(CN[C@H](CCO)C(F)(F)F)c1O 894853227 YGGSHJDGGUGOMJ-LLVKDONJSA-N 277.286 2.358 10 20 CECD C[C@H](N[C@@H](CO)C[C@@H]1CCCO1)c1cc(F)ccc1O 886670143 JXYCBWNVPKLFNO-UHTWSYAYSA-N 283.343 2.112 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2COc3ccccc32)c1 173578934 QHGNRJRNQHVTIA-CQSZACIVSA-N 299.326 2.193 10 20 CECD CCOCCN1CCN(Cc2cccc(Cl)c2O)CC1 179669460 JMVCXXOUVCKLOO-UHFFFAOYSA-N 298.814 2.200 10 20 CECD CCCCCS(=O)(=O)NCc1cc(OC)ccc1O 184554952 REGNALYRCYDBRL-UHFFFAOYSA-N 287.381 2.010 10 20 CECD C[C@H](N)C1CCN(Cc2cc(F)ccc2O)CC1 219871543 ZHGMUDRJLHXCFZ-JTQLQIEISA-N 252.333 2.091 10 20 CECD COc1ccc(CNC[C@](C)(O)CSC)cc1C 217862038 WUHNSYBMVJEDRG-AWEZNQCLSA-N 269.410 2.207 10 20 CECD CC[C@](C)(CO)NCc1cc(Cl)cc(OC)c1O 228677165 XOWTYMKPWOQTJC-CYBMUJFWSA-N 273.760 2.305 10 20 CECD Oc1c(Br)cccc1CN[C@H]1CCOC1 87783489 YIESPUJMRBEYSB-VIFPVBQESA-N 272.142 2.033 10 20 CECD CC[C@H](NCCCC(=O)NC)c1ccc(N(C)C)cc1 268876157 YUHJGNISVXMMRS-HNNXBMFYSA-N 277.412 2.320 10 20 CECD CCC(=O)NCc1cccc(Br)c1O 277569502 QKUSDDAPKQBDJB-UHFFFAOYSA-N 258.115 2.181 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@@H](O)C2CCOCC2)c1 273484347 MXTAEFJRLUWPNH-BLLLJJGKSA-N 279.380 2.139 10 20 CECD C[C@H](NCCCn1ccnc1)c1cc([N+](=O)[O-])ccc1O 273298357 AQEKASMIVSVIOE-NSHDSACASA-N 290.323 2.238 10 20 CECD C[C@](O)(CCc1ccccc1)C(=O)NCc1ccccc1O 283064620 CPHZISDYOXUYQO-SFHVURJKSA-N 299.370 2.392 10 20 CECD CCCCN(C)C[C@H](C)NCc1cc2c(cc1O)OCO2 288708003 ZCAQLNPFXUZLJV-LBPRGKRZSA-N 294.395 2.331 10 20 CECD CO[C@@H](CNCc1ccc(N(C)C)c(F)c1)C1CC1 292901019 DRPYNHRSDVSKEC-HNNXBMFYSA-N 266.360 2.406 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)NC[C@@H]1CCCSC1 292268472 KWLCQCLFGQWVAH-FUEXJSSKSA-N 293.388 2.370 10 20 CECD CCC[C@@H](OC)C(=O)NCc1ccc(N(C)C)cc1 294483148 QWZANVZQMCWLAT-CQSZACIVSA-N 264.369 2.184 10 20 CECD CCc1nocc1CN(C)C(=O)c1ccc(C)c(O)c1O 293953998 HXNINPKFFFDMDR-UHFFFAOYSA-N 290.319 2.229 10 20 CECD COc1ccc(O)c(CN2CCC[C@H](CCO)CC2)c1 817419914 ZNANWCDAOBFLGB-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD C[C@@H](NCC1CCNCC1)c1cc(F)ccc1O 817941131 MSFXMFCROWYLGG-SNVBAGLBSA-N 252.333 2.182 10 20 CECD Cc1cc(C(=O)N2CCO[C@H]3C[C@H]32)c(C)n1-c1ccccn1 816899220 PBHKGINOGDADIX-CABCVRRESA-N 297.358 2.102 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCCC1CCOCC1 814460813 BTIGSAOFORWZAP-RQOWECAXSA-N 292.331 2.471 10 20 CECD COc1cccc(O)c1CN[C@@H](C1CC1)[C@H](CO)C1CC1 824846452 SHFFLVDDQXTLDH-PBHICJAKSA-N 291.391 2.288 10 20 CECD COc1ccc(N2CCN(C(=O)CCCF)CC2)cc1F 829869276 MMRRGMMDBLUGNQ-UHFFFAOYSA-N 298.333 2.233 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CC[C@@H]3C[C@H]3C2)c1O 827506218 FBZNURCJDIIOON-KOLCDFICSA-N 278.308 2.151 10 20 CECD Cc1noc([C@@H]2CCCN(C(=O)c3cc(O)cs3)C2)n1 731869727 DAGZTZMOMOTIBW-SECBINFHSA-N 293.348 2.165 10 20 CECD NC1(CC(=O)NCc2c(O)ccc3c2CCCC3)CCC1 830597590 PKKWIHXNNUIDAI-UHFFFAOYSA-N 288.391 2.159 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnn3ccccc23)cc1 731962911 DPSJRBOOWPKLME-UHFFFAOYSA-N 294.358 2.330 10 20 CECD COc1ccc(CNC2C[C@@H]3CC[C@H](C2)N3)cc1C 841030609 ORTPHOUEZOYSPL-YIONKMFJSA-N 260.381 2.376 10 20 CECD CCOCc1cc(CN[C@@H]2CC[C@@H](CN)C2)ccc1OC 841085186 WGHOAKCZUOCOKA-CZUORRHYSA-N 292.423 2.449 10 20 CECD CC[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)CCCO1 841958694 IJBNHBVCMFXKRA-OAHLLOKOSA-N 291.395 2.022 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@@H]([C@H](C)O)C1 840936155 FPXAOTRLTVIQAR-DZGCQCFKSA-N 262.397 2.264 10 20 CECD CC[C@@H](NC[C@@H]1CCCNC1=O)c1ccc(F)cc1O 840826130 QLSPIQXFCYHFOT-GXFFZTMASA-N 280.343 2.098 10 20 CECD C[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@H]1C 841958340 PIVRTAIQQGQXHG-VXGBXAGGSA-N 261.369 2.109 10 20 CECD CN(C)CCOc1ccc(N(C)CC2CCNCC2)cc1 843070599 VUAUWWHTAFABFV-UHFFFAOYSA-N 291.439 2.063 10 20 CECD CCc1cccc(CN2CC(OCC(F)F)C2)c1O 848916740 MAQWIXMSAKDETR-UHFFFAOYSA-N 271.307 2.421 10 20 CECD C[C@@H]1C[C@@H](NCC2(C)OCCO2)c2c(O)ccc(F)c21 756779900 NSDHUPOEWPAKGD-MWLCHTKSSA-N 281.327 2.432 10 20 CECD COc1cccc(CNC(=O)Cc2ccc(C)o2)c1O 754084788 BBGNPNFTUVJODH-UHFFFAOYSA-N 275.304 2.161 10 20 CECD C[C@@H](NC(=O)NCc1ccc(N(C)C)cc1)C1CC1 31729574 HDOQRIVMZYBXOD-LLVKDONJSA-N 261.369 2.350 10 20 CECD COc1ccc2c(c1)CCCN2CC[C@H]1CCOC1=O 753843386 SWGOSTXEAUUYFD-LBPRGKRZSA-N 275.348 2.401 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NCC[C@H](C)N 857114384 OBFTTWAJQVBTRO-ZDUSSCGKSA-N 292.427 2.021 10 20 CECD COC(=O)N1CC(N[C@@H]2C[C@H](C)c3c(F)ccc(O)c32)C1 756757802 DPYHNOBYUDUHCY-GZMMTYOYSA-N 294.326 2.120 10 20 CECD CC(C)CN(Cc1cc2c(cc1O)OC[C@@H]2O)C1CC1 768440045 CRSAUJDXDYEHGC-HNNXBMFYSA-N 277.364 2.438 10 20 CECD O=C1NC(=S)S/C1=C/c1cccc(-n2cccn2)c1 760211710 PHFZUBRZJLRVSC-DHZHZOJOSA-N 287.369 2.361 10 20 CECD OC[C@H](CNCc1ccc2c(c1)CCO2)Cc1ccco1 768840315 BQJMGLCLGIKEDB-AWEZNQCLSA-N 287.359 2.155 10 20 CECD Cc1cccc(O)c1CN(CC(F)F)C[C@@H](C)O 877572199 NMZHBMMQGNAJCP-SNVBAGLBSA-N 259.296 2.149 10 20 CECD CCC(C)(C)NC(=S)NCCc1ccc(O)c(O)c1 774139513 RQHCHHHYZOASSD-UHFFFAOYSA-N 282.409 2.293 10 20 CECD COc1c([N+](=O)[O-])ccc(CNCC=C(C)C)c1O 775113960 YGIXLVQJPSUEEX-UHFFFAOYSA-N 266.297 2.365 10 20 CECD CCC[C@@H]1NC(=O)N(Cc2ccc(N(C)C)cc2C)C1=O 777655232 HDZLZMAOXIPIAX-AWEZNQCLSA-N 289.379 2.282 10 20 CECD C[C@H](NCc1ccc(N2CCN(C)CC2)cc1)C1CC1 771823804 SSWKVGVFQNUSQO-AWEZNQCLSA-N 273.424 2.327 10 20 CECD CCOC(=O)CN(CC)Cc1cc(C)cc(OC)c1O 893969341 LPVVJDDMPDDTRC-UHFFFAOYSA-N 281.352 2.094 10 20 CECD COC[C@H](C)CNCc1ccc(N(C)C)cc1C 783626938 DCRRYFAUFOAWOD-GFCCVEGCSA-N 250.386 2.433 10 20 CECD CSC1(C(=O)NCc2ccccc2O)CCC1 787445160 KJCLYEOAIMFZLL-UHFFFAOYSA-N 251.351 2.294 10 20 CECD COc1ccc(CNCCc2ccco2)c(O)c1OC 892440507 CZEHCMSAEAUDDK-UHFFFAOYSA-N 277.320 2.335 10 20 CECD COc1ccc(CNC(=O)C2CC(F)(F)C2)c(O)c1 794376544 FTDYQTJGHUQVPF-UHFFFAOYSA-N 271.263 2.062 10 20 CECD C[C@@H](Nc1cc(O)ncn1)c1ccc(N(C)C)cc1 1333705289 FGQOILSHIVURLF-SNVBAGLBSA-N 258.325 2.421 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CCN(C(C)C)C1 725848914 CRPCXGMQHIOVBM-ZDUSSCGKSA-N 278.396 2.221 10 20 CECD COc1cccc(CNC[C@@H]2C[C@@H](C)O[C@H]2C)c1O 686510847 IESWMSOBPVMVEN-MDZLAQPJSA-N 265.353 2.304 10 20 CECD CC(C)OC1CCN(C(=O)NCc2ccc(N)cc2)CC1 1338794353 ZCMMPRCRFNKRBQ-UHFFFAOYSA-N 291.395 2.368 10 20 CECD Cc1cccc(CCNC(=O)NCc2ccc(N)cc2)n1 1335524096 ZJZRVFAUOGCDDO-UHFFFAOYSA-N 284.363 2.014 10 20 CECD CO[C@@H]1CC[C@@H](NC(=O)NCc2cc(C)ccc2O)C1 1332649062 ATQYWIGHLRGLDK-CHWSQXEVSA-N 278.352 2.067 10 20 CECD C[C@@H]1C[C@H](C(=O)NCCCSc2nccs2)CCN1 1341561091 KURBGMMWCOJQGU-GHMZBOCLSA-N 299.465 2.130 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)C[C@@H](C(=O)O)C2)c1O 1604695473 ZMSJBBPZWHOHDE-WCQYABFASA-N 293.363 2.252 10 20 CECD C[C@]1(C(=O)O)CCCN(Cc2ccc(F)c(F)c2O)C1 1593776795 SFBZMALVAAVSPB-AWEZNQCLSA-N 285.290 2.357 10 20 CECD COCCN(C)CCCN[C@H](C)c1ccc(N(C)C)cc1 153745618 BLVWCJJEVIJIKB-OAHLLOKOSA-N 293.455 2.372 10 20 CECD CCn1cncc1CN[C@@H](C)c1cc(OC)ccc1O 845971879 NMGHCGNNCJDKOS-NSHDSACASA-N 275.352 2.468 10 20 CECD O=C(NC1(C(F)F)CCCC1)c1cccc(O)c1O 813886464 FRLLWLCNXMQKMJ-UHFFFAOYSA-N 271.263 2.406 10 20 CECD CO[C@@H]1C[C@H](NC(=O)Nc2ccc(N)cc2)C1(C)C 234790487 SZOXRNGAMWTCJW-NWDGAFQWSA-N 263.341 2.204 10 20 CECD OC[C@H](CC(F)(F)F)N[C@@H]1CCc2cccc(O)c21 717745481 QOIFSXOMQAVMJY-VHSXEESVSA-N 275.270 2.282 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCOC[C@@H]2C)c1O 398896590 BVDCVYWSPIQYKN-JTQLQIEISA-N 281.327 2.345 10 20 CECD CCC[C@@H](C)C(=O)NCc1cccc(OC)c1O 113423298 AFCZRAHARLWDHB-SNVBAGLBSA-N 251.326 2.453 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccc(Cl)nn1 38106087 ATUYUAODNNJENK-UHFFFAOYSA-N 277.711 2.108 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCCOC(C)C)c1 184139945 XYECQBACITYQCD-NSHDSACASA-N 296.367 2.186 10 20 CECD OCCCCCNCc1cc(Br)ccc1O 76275399 DXVZYLIETNKYBQ-UHFFFAOYSA-N 288.185 2.407 10 20 CECD NC(=O)c1cccc(CNCc2ccc3c(c2)CCO3)c1 37363116 JKWBARJNUCSYCP-UHFFFAOYSA-N 282.343 2.010 10 20 CECD Cc1cc(C(=O)NCCN)c(C)n1-c1cccc(Cl)c1 237589904 TUKNMPRKHIEFQF-UHFFFAOYSA-N 291.782 2.436 10 20 CECD C[C@@H]1CC[C@H](CCC(=O)NCCc2ccc(N)cc2)O1 237386387 FALJBZHXVAGNLM-IUODEOHRSA-N 276.380 2.275 10 20 CECD CCc1ncc(NC(=O)NCc2ccc(N(C)C)cc2)cn1 269496885 BRXPWUHBROWCCX-UHFFFAOYSA-N 299.378 2.427 10 20 CECD Cc1ccc(O)c(CN2CCC(CCC(N)=O)CC2)c1 271207689 SNIUPGDTCDCGQV-UHFFFAOYSA-N 276.380 2.178 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)N[C@@H]2C[C@H]3CC[C@@H]2O3)c1 273368759 BYDTYOTYAKVUIA-XKFJNSEWSA-N 291.347 2.149 10 20 CECD CC(=O)Nc1ccc(CNCc2cccc(C)c2O)cn1 279482012 WUWMAUIRJKDEAG-UHFFFAOYSA-N 285.347 2.344 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)NCCF)c1ccc(N(C)C)cc1 282821478 RTXAMUAZWACFSH-SWLSCSKDSA-N 295.402 2.268 10 20 CECD 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295.433 2.344 10 20 CECD CC[C@H]1CO[C@H](C)CN1C(=O)c1cc(O)cs1 754906983 KLBQBMCWFOTLKB-BDAKNGLRSA-N 255.339 2.093 10 20 CECD C[C@H]1CCN(C(=O)c2cc(O)cs2)C[C@@H]1n1ccnc1 759469550 LQYUCGXBKDZYHD-JQWIXIFHSA-N 291.376 2.374 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CCn3c(cnc3C)C2)c1 862756138 QYWUUVOEWQCMAT-ZDUSSCGKSA-N 299.374 2.084 10 20 CECD C[C@@H](NC(=O)CN(C)C1CCC1)c1ccc(N(C)C)cc1 863906743 VUEFZFZLABAOCE-CYBMUJFWSA-N 289.423 2.414 10 20 CECD Cc1ccc(O)c(CNC(=O)CCn2cc(Cl)cn2)c1 862759131 WYEUWBJDZKEBRN-UHFFFAOYSA-N 293.754 2.257 10 20 CECD CCOc1ccc(O)c(CN2CCN(CC)[C@H](C)C2)c1 769381126 LIWVOUGWKGNEJI-CYBMUJFWSA-N 278.396 2.317 10 20 CECD O=C(O)[C@H]1CCCN(Cc2cccc(Cl)c2O)C1 874044324 ACYCUNYWZFDXGH-JTQLQIEISA-N 269.728 2.342 10 20 CECD COCC1(C(=O)NCCCSc2nccs2)CC1 778737191 AMCPBWJOHQZPBC-UHFFFAOYSA-N 286.422 2.168 10 20 CECD Cc1cncnc1N(C)Cc1ccc(N(C)C)cc1 881772386 VSFZFOMLRIUZLG-UHFFFAOYSA-N 256.353 2.487 10 20 CECD Oc1c(F)cc(Cl)cc1CNC[C@@]1(O)CCSC1 776232012 QJUKCCCLGMWRQW-LBPRGKRZSA-N 291.775 2.142 10 20 CECD COc1ccc(N(C)CCOCC(F)F)cc1OC 787187098 NKLJCFGOGFBDST-UHFFFAOYSA-N 275.295 2.422 10 20 CECD COc1ccc(CN(CC(C)(C)O)C2CC2)c(O)c1OC 893707288 RDXRYUFISBGMGL-UHFFFAOYSA-N 295.379 2.145 10 20 CECD COc1cc(C)cc(CN(C)Cc2cnccn2)c1O 893977708 LGHYYUUUDZHOPX-UHFFFAOYSA-N 273.336 2.131 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CCC(F)(F)C2)c1 795101281 PKHLTTZWUMPOKD-VIFPVBQESA-N 285.290 2.452 10 20 CECD CCC[C@@H](CNC(=O)c1cccc(O)c1O)OCC 705329046 VEYFHLXJENYXER-JTQLQIEISA-N 267.325 2.033 10 20 CECD C[C@H](CNCc1ccccc1O)NC(=O)OC(C)(C)C 192678455 YODWAMCLHQQDAO-LLVKDONJSA-N 280.368 2.395 10 20 CECD COc1ccc(CN[C@H](CO)CC(F)F)cc1C 717756311 UCBSZAQZADREBA-NSHDSACASA-N 259.296 2.109 10 20 CECD CC[C@@H](F)C(=O)NC[C@H]1CCN(c2ccc(OC)cc2)C1 1335961793 MYBIRGVCNGNLPE-IUODEOHRSA-N 294.370 2.386 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)NCc2ccc(N)cc2)C12CCC2 1353412889 CUTRPVAXBCVDDL-ZIAGYGMSSA-N 289.379 2.026 10 20 CECD COCCN(Cc1ccc(N)cc1)CC(F)(F)F 1352787980 LALPQTQGJJGQDP-UHFFFAOYSA-N 262.275 2.280 10 20 CECD Cc1ccc(CN2C[C@H](C(=O)O)CC[C@H]2C)c(O)c1 1605273132 JBRPNHLRZIBQOJ-DGCLKSJQSA-N 263.337 2.386 10 20 CECD C[C@H](N[C@H](C)CCO)c1ccc(N2CCOCC2)c(F)c1 151989774 ICOHEOSWTODZBO-OLZOCXBDSA-N 296.386 2.084 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)c1ccc2c(c1)CCO2 156653047 WPHMOQNDAYUVRJ-UHFFFAOYSA-N 299.326 2.005 10 20 CECD CCC(CC)[C@@H](O)CNCc1cccc(OC)c1O 225818827 RYYGXGNVFDYTBX-ZDUSSCGKSA-N 267.369 2.288 10 20 CECD COc1ccc(CNCCc2ccnn2C)cc1C 231032732 PGNXMQISXPUMLC-UHFFFAOYSA-N 259.353 2.069 10 20 CECD c1csc(CNCc2ccc(N3CCOCC3)cc2)n1 40443916 IUFWCSHSAFXHIK-UHFFFAOYSA-N 289.404 2.270 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](O)C[C@@H](C)C2)c1O 401599635 YRMRYOAMUJYDIT-RNCFNFMXSA-N 297.782 2.451 10 20 CECD Cc1cc(C)nc(C(=O)NCc2ccccc2O)c1 311369181 HVMGLBYWJQWBGI-UHFFFAOYSA-N 256.305 2.334 10 20 CECD COc1ccc(O)c([C@@H](C)NC[C@@](C)(O)C(F)F)c1 698571505 UQCFHWCHGJOEHP-AMIZOPFISA-N 275.295 2.068 10 20 CECD CCOC(=O)CN(Cc1cccc(C)c1O)C1CC1 179750525 GFNAFNPZUSEUAV-UHFFFAOYSA-N 263.337 2.228 10 20 CECD CN(C)c1ccc(CNC(=O)C2[C@H]3CCC[C@H]23)cc1 177611656 DKVXVYIGOQEFSI-KBPBESRZSA-N 258.365 2.415 10 20 CECD Oc1ccc(CNc2ncnc3ncccc23)cc1O 119648989 VOZGZRKQZRQSJY-UHFFFAOYSA-N 268.276 2.048 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@]1(C)CCOC1 124833862 KXRGNMABGJFQKY-MRXNPFEDSA-N 291.395 2.039 10 20 CECD COc1ccc(N(C)CC(=O)Nc2nccs2)cc1F 121823514 LGCGSEDGPGXKDO-UHFFFAOYSA-N 295.339 2.366 10 20 CECD COC(=O)c1ccc(CNCc2ccc(N(C)C)cc2)o1 35046381 JQRMJESQOLRYMU-UHFFFAOYSA-N 288.347 2.422 10 20 CECD C[C@H](NCC1(O)CCCC1)c1ccc(F)cc1O 87015752 GWTVDQPBLWWIHV-JTQLQIEISA-N 253.317 2.487 10 20 CECD C[C@H](NCc1cnn(C)c1)c1ccc(F)c(F)c1O 191215716 LGBCUAJWWZPKDL-QMMMGPOBSA-N 267.279 2.255 10 20 CECD CC(C)c1nnc(CCC(=O)NCc2ccccc2O)o1 80087186 FXBNPAYOWTWCOX-UHFFFAOYSA-N 289.335 2.148 10 20 CECD CCC(CC)(CCO)CNC(=O)Cc1ccc(N)cc1 236628881 SWONTNJTEKQDCN-UHFFFAOYSA-N 278.396 2.116 10 20 CECD CCn1nncc1CN[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 527918869 FJWAXRJOBBWWJW-JOYOIKCWSA-N 290.342 2.481 10 20 CECD CCOC(=O)N1CC[C@H](NCc2ccc(OC)c(C)c2)C1 274411854 DQSBODXHLROBIX-AWEZNQCLSA-N 292.379 2.324 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC[C@H]1CCCO1 274919696 KYYQKEQBXLWVSD-WCQYABFASA-N 293.363 2.104 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCO[C@H]2C2CC2)c1 373177300 ORKIJDKAKQBHAQ-ZBFHGGJFSA-N 277.364 2.448 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2CC[C@@H](CO)O2)c(O)c1C 293708280 MPGWQZJPEGYWMK-MJBXVCDLSA-N 279.380 2.200 10 20 CECD CC[C@@H](C)NC(=O)CN(CC)c1ccc(OC)cc1 299343469 FMWVQETUVHVELK-GFCCVEGCSA-N 264.369 2.436 10 20 CECD CC(C)[C@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@H](C)N 399783426 WILAMQREZCWWJJ-BBRMVZONSA-N 291.439 2.330 10 20 CECD CCCN(CC)C[C@@H](C)NC(=O)NCc1ccccc1O 291078488 XXAOARMUQVRWRC-CYBMUJFWSA-N 293.411 2.312 10 20 CECD CNCCN[C@@H](C)c1cc(Br)ccc1O 817951247 CHBVCLORBYZOOF-QMMMGPOBSA-N 273.174 2.025 10 20 CECD COc1cc(CCNC(=O)c2cc(O)cs2)ccc1O 734175173 QTQOMBVDHAMXMR-UHFFFAOYSA-N 293.344 2.140 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@H](C)CCCO)c1 834871330 NDNKHAWBJHLDMZ-NEPJUHHUSA-N 295.379 2.238 10 20 CECD C[C@@H]1CCCC[C@@H]1OCC(=O)NCc1ccc(N)cc1 837303340 IBENZGQMXSSKBA-DOMZBBRYSA-N 276.380 2.480 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC[C@]2(O)CCCOC2)c1 846212481 LRVXAEVZOJZKJJ-CZUORRHYSA-N 279.380 2.283 10 20 CECD CCC(CC)(CO)C(=O)N[C@@H](C)c1cc(OC)ccc1O 847588657 AKYCTLJZXKCEHM-NSHDSACASA-N 295.379 2.377 10 20 CECD CCO/C=C/C(=O)NCc1ccc(N(C)C)c(F)c1 841091262 WBSKWTFUIAIAGF-BQYQJAHWSA-N 266.316 2.058 10 20 CECD COc1cccc([C@@H](C)N[C@H]2CCc3n[nH]cc3C2)c1O 846153066 FDYOGDGXHXERPG-PWSUYJOCSA-N 287.363 2.332 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](CN)C[C@@H]2C)c1O 843362451 HJAPJFSFDMGZKO-GXSJLCMTSA-N 296.798 2.417 10 20 CECD CCc1cccc(CN[C@H]2C[C@H]3CCCCN3C2=O)c1O 848914351 IBEBOBUKRCEBOM-CABCVRRESA-N 288.391 2.198 10 20 CECD CC[C@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 841955440 CCSFFPLXKIAQGO-DOMZBBRYSA-N 291.395 2.020 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)[C@H](C)CN1 843119705 CSLOZJINESPPBT-RKDXNWHRSA-N 272.751 2.367 10 20 CECD CC[C@](C)(CC(=O)OC)NCc1ccc2c(c1)CCO2 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284.363 2.480 10 20 CECD CN(CC1CC1)C(=O)NCc1ccc(N(C)C)c(F)c1 57646902 JBSAXAMLDOTESO-UHFFFAOYSA-N 279.359 2.443 10 20 CECD CCn1nccc1/C=C/C(=O)NCc1ccc(N(C)C)cc1 119294272 BBYHURSUUDFBFK-MDZDMXLPSA-N 298.390 2.299 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2C[C@H]2C2CC2)c1 176146918 FATSVMMXPUVWSN-QWHCGFSZSA-N 261.321 2.063 10 20 CECD CCO[C@@H](CCN(C)C)CN[C@H](C)c1ccccc1O 183548607 PHUWVXPGMQQKDJ-KGLIPLIRSA-N 280.412 2.400 10 20 CECD Cc1ccc(C(=O)NCCc2ccc(O)c(O)c2)cc1O 193812262 FYJMPBWBNPZKRG-UHFFFAOYSA-N 287.315 2.084 10 20 CECD COC(=O)c1cc(CN(C)Cc2ccccc2O)c[nH]1 91974552 BPIYKRMSALWWKR-UHFFFAOYSA-N 274.320 2.139 10 20 CECD COc1ccc(O)c(CN2CCC[C@H]2c2ncon2)c1 362049180 ZOGVVEIRLXQTAN-LBPRGKRZSA-N 275.308 2.121 10 20 CECD CCN(CC)c1ccc(CN2CC[C@@H](CC(N)=O)C2)cc1 367707988 PWYOTBLLCGYBAK-HNNXBMFYSA-N 289.423 2.230 10 20 CECD CCCCN(CC)C(=O)c1c(F)ccc(O)c1O 276734838 UJLWCRRCUKIYJE-UHFFFAOYSA-N 255.289 2.499 10 20 CECD Cc1ccc(O)c(CN2CCOC[C@H]2[C@H]2CCCC2=O)c1 372756982 ICHRQMRYFAFHJI-CABCVRRESA-N 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284.381 2.124 10 20 CECD CSC1(C(=O)N[C@H](C)c2ccccc2O)CC1 827946549 LPXSHGZDBCYRCT-SECBINFHSA-N 251.351 2.465 10 20 CECD CCOc1ccc(CNCCC2(CO)CC2)c(O)c1 825040664 ROSOWMQZJNOECL-UHFFFAOYSA-N 265.353 2.043 10 20 CECD CC[C@H](CO)N(C)Cc1cc(Cl)cc(F)c1O 824533262 CJUHTTYBNWHVIU-SNVBAGLBSA-N 261.724 2.387 10 20 CECD COc1cc(O)c(CNC2CCC(OC)CC2)cc1OC 839171439 FTLVJPPFAAZAAH-UHFFFAOYSA-N 295.379 2.457 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)Cc1cnc[nH]1 900399211 BGPHNPUELHKSIV-UHFFFAOYSA-N 286.379 2.067 10 20 CECD C[C@@H]1C[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)c2nccn21 836956545 WKALVVMLWXCGRW-FTXDBJGXSA-N 299.330 2.130 10 20 CECD C[C@@H](C(=O)NCCc1ccc(O)c(O)c1)C(C)(C)C 270565145 WLAIBBDXYWIVSB-JTQLQIEISA-N 265.353 2.439 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@H]2C[C@@H](N)C2)cc1F 844183296 WGOVXGBALBTYHO-BETUJISGSA-N 293.386 2.025 10 20 CECD CCC1(CN[C@H](C)c2cccc(OC)c2O)COC1 846168832 MMWVEGDVXUJXPR-LLVKDONJSA-N 265.353 2.478 10 20 CECD FC(F)CN1CC[C@@H](NCc2ccc3c(c2)CCO3)C1 841894648 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CECD N[C@@H]1CCC[C@@H]2CN(Cc3cc(F)ccc3O)C[C@H]21 300417083 KHRRLUPFSIWSQB-LERXQTSPSA-N 264.344 2.091 10 20 CECD C[C@@H](NCCC1CC(O)C1)c1cc(F)ccc1O 702450876 MXEITNDFDSWTRP-GRZMOONWSA-N 253.317 2.343 10 20 CECD CO[C@@H]1C[C@@H](NC(=O)Nc2ccc(N)cc2)C12CCC2 713079528 RYBKIFPNGGCDPP-CHWSQXEVSA-N 275.352 2.348 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@H](C)[C@@H](O)C2)c1O 388201526 SETBJLIDWUZGBW-SDBXPKJASA-N 283.755 2.061 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](C)C(C)(C)O)c1 393959089 AINGPSBXXHWXSR-ZJUUUORDSA-N 253.342 2.211 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2cn[nH]c2)cc1F 108996856 CQUFFNBQHAZARN-UHFFFAOYSA-N 290.342 2.325 10 20 CECD Cc1ccc(O)c(CNCCOCC(F)(F)F)c1 66738262 ZNEDIRHECCPOQL-UHFFFAOYSA-N 263.259 2.369 10 20 CECD Cc1ccc(C(=O)NCC2(O)CCCCCC2)c(O)c1O 179506742 XMWSQDLMVJPNST-UHFFFAOYSA-N 293.363 2.221 10 20 CECD CCC1(CNCc2cc3c(cc2O)OCO3)CCOCC1 313893476 PTJSHXZZXOOMDT-UHFFFAOYSA-N 293.363 2.417 10 20 CECD CCC(=O)[C@H]1CCCCN1C(=O)c1ccc(C)c(O)c1O 185817259 YFHKYSYGRJLCIV-GFCCVEGCSA-N 291.347 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2.003 10 20 CECD CNC(=O)C[C@H](C)NCc1ccc2ccccc2c1O 825068553 SLDQLBNNZJLYRN-NSHDSACASA-N 272.348 2.160 10 20 CECD C[C@@]1(CNCc2ccc3c(c2)CCCO3)CCCNC1 904354998 JHGWOXUPZWHMGL-QGZVFWFLSA-N 274.408 2.491 10 20 CECD Cc1cc(O)c(CN(CC(N)=O)CC(C)C)cc1Cl 824575524 HKULXPXVOMHWQX-UHFFFAOYSA-N 284.787 2.297 10 20 CECD COc1ccc(O)c([C@H](C)NC/C=C(\C)C(=O)O)c1 833733171 AXPGVAXJJFCZMA-ZKXNXJMVSA-N 265.309 2.082 10 20 CECD C[C@H]1CC[C@H](CNC(=O)c2c(F)ccc(O)c2O)C1 831005844 QRKWDQYGCXLNRR-IUCAKERBSA-N 267.300 2.403 10 20 CECD C[C@H]1CC[C@H](CNC(=O)NCc2ccc(N(C)C)cc2)O1 836251925 RNUIOCDBGHBOIC-SWLSCSKDSA-N 291.395 2.119 10 20 CECD C[C@@H](NC(=O)[C@H](C)c1cnccn1)c1ccccc1O 913763521 JEUUMVPRJGILAK-GHMZBOCLSA-N 271.320 2.163 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@@H](O)COCC(C)C 840930725 OMCJAUNTQSCLAW-QGZVFWFLSA-N 294.439 2.184 10 20 CECD CCc1cccc(CN(C)Cc2nc(C)no2)c1O 848929058 SFTBRGGCGLLARM-UHFFFAOYSA-N 261.325 2.278 10 20 CECD CC(C)(C)N1CC[C@@H](NCc2cc(F)ccc2O)C1=O 843416858 YYGHBMASUHXQHZ-GFCCVEGCSA-N 280.343 2.020 10 20 CECD Cc1ccc([C@@H](C)NCc2ccc(C(N)=O)nc2)c(O)c1C 756641059 RUAHXZUHXFUNLS-GFCCVEGCSA-N 299.374 2.354 10 20 CECD COc1ccc(N2CCN(C(=O)CCCF)CC2)cc1 854198085 CMKKPAOZGYURNG-UHFFFAOYSA-N 280.343 2.094 10 20 CECD CC(C)(F)CCNC(=O)NCc1ccccc1O 852552248 OKUSKBROWTVQLV-UHFFFAOYSA-N 254.305 2.330 10 20 CECD CC(C)c1nc([C@@H](C)NC(=O)c2cc(O)cs2)n[nH]1 763224864 WMJIZKWYOQLPRH-SSDOTTSWSA-N 280.353 2.186 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(C)cc1O 877564074 XLGRHPSXBJMNIS-OLZOCXBDSA-N 263.337 2.132 10 20 CECD Cc1cccc(CN[C@@H](C)[C@H](O)C(F)(F)F)c1O 877693802 QYMQSPBZSJYRAO-KWQFWETISA-N 263.259 2.102 10 20 CECD CS[C@@H](C)CNCc1ccc(N2CCC(O)CC2)cc1 877112904 UWRRPPNONUFQNO-ZDUSSCGKSA-N 294.464 2.489 10 20 CECD CCN(C)c1ccc([C@H](C)NCCOCCN(C)C)cc1 774381354 MKILZDSQGOQATD-HNNXBMFYSA-N 293.455 2.372 10 20 CECD CCc1nn(C)cc1/C=C1/SC(=S)N(CC)C1=O 770568761 MTDXIBRZRDPUAT-UXBLZVDNSA-N 281.406 2.204 10 20 CECD CC(C)(CNC(=O)c1cccc(O)c1O)C1CCOCC1 887389986 SGWHUTJFFLEAJK-UHFFFAOYSA-N 293.363 2.280 10 20 CECD C[C@H](N[C@@H](CO)C[C@H]1CCCO1)c1c(O)cccc1F 886672931 XIEVMJPWMVLAND-QJPTWQEYSA-N 283.343 2.112 10 20 CECD CC[C@](C)(O)c1cn(Cc2ccc(N(C)C)cc2)nn1 881272322 SNYLYPZLUNZVHV-HNNXBMFYSA-N 274.368 2.010 10 20 CECD COc1ccc(CN(C)C[C@@H]2CCCCO2)c(O)c1OC 891787250 SGFYQQZUKZAHCI-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD Cc1cc(C)c([C@H](C)NCCN2CCOC[C@H]2C)c(O)c1 788586594 DQHDVJVOQPFDCE-CABCVRRESA-N 292.423 2.380 10 20 CECD COc1cc(CN2CC[C@@]3(CCN(C)C3)C2)c(O)cc1C 793763651 DYWDUURGCHGKEM-QGZVFWFLSA-N 290.407 2.237 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NCCC(C)(C)N 892857897 BHZXMVQRBLWRAL-UHFFFAOYSA-N 293.411 2.441 10 20 CECD Cc1cc(O)c(CN2CCn3cnnc3[C@@H]2C)cc1C 792189868 UUEDMIUWWMEIQD-LBPRGKRZSA-N 272.352 2.177 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CCOC[C@H]1C 796497693 ODAOFKPHYRACIQ-NEPJUHHUSA-N 265.353 2.163 10 20 CECD CC1(C)CO[C@@H](CNC(=O)Nc2ccc(N)cc2)C1 717565367 WSTOMKPDXFTYEF-GFCCVEGCSA-N 263.341 2.205 10 20 CECD CCN1CCC[C@H](NCc2cc(Cl)ccc2O)C1=O 722351313 AXKFSXVRVWJJQH-LBPRGKRZSA-N 282.771 2.146 10 20 CECD COc1ccc(O)c(CNC[C@H](OC)C(F)(F)F)c1 776175151 XBEUTTSMXVSWAF-NSHDSACASA-N 279.258 2.068 10 20 CECD Cc1cc(NS(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)ccc1O 776747652 IPPNPEKTVDMJBS-QWRGUYRKSA-N 298.408 2.335 10 20 CECD O=C(O)[C@H](CC(F)F)NCc1cc(Cl)cc(F)c1O 1601639436 ULOZZUPYQVCWNW-QMMMGPOBSA-N 297.660 2.383 10 20 CECD COCC[C@H](C)N[C@@H](C)c1cc(C(=O)O)ccc1O 1606852355 ITEPQQHMWBLBIH-UWVGGRQHSA-N 267.325 2.166 10 20 CECD CC(C)(C)CC[C@@H](CO)NC(=O)NCc1ccc(N)cc1 1575125958 QTAUXQYCNRTBRH-AWEZNQCLSA-N 293.411 2.255 10 20 CECD COc1ccc(CN[C@H]2[C@H](C)NCC[C@H]2C)cc1C 1579216536 ZBBYDNURADNJRI-PVXIVEMSSA-N 262.397 2.480 10 20 CECD CCCC[C@@H](NCc1ccc(OC)c(C)c1)[C@@H](O)C(=O)O 1776774484 CKDWPTBAJGLSGO-UKRRQHHQSA-N 295.379 2.098 10 20 CECD CN(C)c1ccc(CNC(=O)CCCCCCN)cc1F 166457141 HVYIRCWLPCYHMD-UHFFFAOYSA-N 295.402 2.417 10 20 CECD COc1ccc(N2CCC(NC[C@H]3CCOC3)CC2)cc1 157313689 OKRKQFGYAUIFQV-CQSZACIVSA-N 290.407 2.290 10 20 CECD C[C@H]1CCN(Cc2cc(F)ccc2O)[C@@H](C(=O)O)C1 1594424438 SPONXXLBSLFSBP-JOYOIKCWSA-N 267.300 2.216 10 20 CECD CC(C)CCOCCNCc1cc2c(cc1O)OCO2 45094384 SYCOUGKQRBDAHW-UHFFFAOYSA-N 281.352 2.273 10 20 CECD CCN(Cc1cccc(OC)c1O)C[C@H](C)OC 291059200 JRPJIHSHMVZYQQ-NSHDSACASA-N 253.342 2.258 10 20 CECD Nc1ccc(CNC(=O)CC[C@@H]2CCCCO2)cc1 69384346 HJTCUHFQBCVEAQ-AWEZNQCLSA-N 262.353 2.234 10 20 CECD O=C(O)C1CCC(NCc2cc(F)cc(F)c2O)CC1 708215151 IFELXDVVBWPIPH-UHFFFAOYSA-N 285.290 2.403 10 20 CECD Oc1cc2c(cc1CN[C@@H]1CCC[C@@H]3C[C@@H]31)OCO2 694319092 HPNHETPASCCCKH-ADEWGFFLSA-N 261.321 2.399 10 20 CECD C[C@@H](NC[C@H](O)CC(F)(F)F)c1ccccc1O 879649458 UHBPITKWCFLNLB-RKDXNWHRSA-N 263.259 2.356 10 20 CECD COC(=O)CCN(Cc1ccccc1O)CC(C)C 179560287 PKMBYEKESDALKO-UHFFFAOYSA-N 265.353 2.413 10 20 CECD C[C@H](N[C@H]1C[C@H](O)C1(C)C)c1cc(F)ccc1O 128324262 IXGFHPQNMLKXCR-HJIKLVIJSA-N 253.317 2.341 10 20 CECD Cc1c(/C=C/C(=O)N2CCN(C)c3ccccc32)cnn1C 120455894 FXNGTHSWMYSFPI-CMDGGOBGSA-N 296.374 2.225 10 20 CECD CC[C@@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 125330910 QWFHPSWXGXJYEQ-CQSZACIVSA-N 289.423 2.101 10 20 CECD CN(C)c1ccc(CNCCCCCS(C)(=O)=O)cc1 185213981 HPGDMTWYWLCFKE-UHFFFAOYSA-N 298.452 2.057 10 20 CECD CC(C)(C)C[C@H](CO)NC(=O)/C=C/c1ccc(O)c(O)c1 181238110 FZARWVATFHOKTQ-HOSRBBHYSA-N 293.363 2.024 10 20 CECD CCc1ccnc(C(=O)NCCc2ccc(O)c(O)c2)c1 181661353 SMMOLJHPWFSZRE-UHFFFAOYSA-N 286.331 2.028 10 20 CECD CSC1(CNCc2cc3c(cc2O)OCO3)CC1 193662716 NJVXZFWHZOCHIS-UHFFFAOYSA-N 267.350 2.106 10 20 CECD Nc1ccc(NC(=O)NC[C@H]2CSCCS2)cc1 229617766 RHEUEKIZCNHFQZ-NSHDSACASA-N 283.422 2.239 10 20 CECD COC[C@@H](C)NCc1cc(Br)ccc1O 163752014 OGUXEQNWORITSU-MRVPVSSYSA-N 274.158 2.279 10 20 CECD CCOC[C@H]1CN(Cc2cc(C)cc(C)c2O)CCO1 530105675 ISZBSSDZMLUXJH-OAHLLOKOSA-N 279.380 2.246 10 20 CECD CC(C)C[C@H](CO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 273300361 BFMPBNBTIPLCHI-GHMZBOCLSA-N 282.340 2.358 10 20 CECD Cc1ccc([C@H](C)NCCNC(=O)C2CC2)c(O)c1C 273386967 JSQKHBDSUITMIA-LBPRGKRZSA-N 276.380 2.186 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccco2)c(O)c1 373709496 ZIHLQPJMSYRHPB-CHWSQXEVSA-N 287.315 2.414 10 20 CECD CC[C@@H](CN[C@H](C)c1cc(C(=O)OC)ccc1O)OC 289599905 BMJICIYXEDVXFR-PWSUYJOCSA-N 281.352 2.254 10 20 CECD C[C@H](O)CNCc1ccc(N(C)C)cc1C(F)(F)F 280069962 XNUKIEZREFFCIE-VIFPVBQESA-N 276.302 2.242 10 20 CECD Cc1cnn(C)c1/C=C1\SC(N2CCCCC2)=NC1=O 285293043 JBICCIWYQMOMJX-WQLSENKSSA-N 290.392 2.185 10 20 CECD CC(=O)C(=O)CSc1nnc(-c2cccc(C)c2)o1 808012154 GHMAHSGEAWYPDA-UHFFFAOYSA-N 276.317 2.295 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCc3cccnc32)c1 819878599 HPRMIIKSANNXHP-CQSZACIVSA-N 298.342 2.142 10 20 CECD C[C@@H](CNCc1c(O)ccc(Cl)c1F)CN(C)C 813785629 FLJPFYBTZCHMQP-VIFPVBQESA-N 274.767 2.472 10 20 CECD COC(=O)C1(C)CN(Cc2cc(Cl)cc(F)c2O)C1 822534469 IANBTYUWGSQNQO-UHFFFAOYSA-N 287.718 2.180 10 20 CECD O=C(c1cc(O)cs1)N1CCOC[C@H](C2CCC2)C1 832811016 PBAHEGOPVWTOQF-LLVKDONJSA-N 281.377 2.342 10 20 CECD C[C@H](N[C@H]1C[C@@H]2CCCCN2C1=O)c1cc(F)ccc1O 834911804 BDONDGDUFBKQSI-JKOKRWQUSA-N 292.354 2.335 10 20 CECD CCONC(=O)N[C@@H](C)Cc1ccc(N(C)C)cc1C 840350623 PVFORTALVJJXQB-LBPRGKRZSA-N 279.384 2.243 10 20 CECD Nc1ccc(CCNC(=O)C2(c3cccnc3)CC2)cc1 843343094 SKQPWDFNXXSFBD-UHFFFAOYSA-N 281.359 2.054 10 20 CECD CC[C@@H](C(=O)NCCCSc1nccs1)[C@@H](C)O 842232963 XNIMVAYBALZFBX-NXEZZACHSA-N 288.438 2.149 10 20 CECD CN(C)c1ccc(CN2CCC3(CCNC3)CC2)cc1F 843127859 UCNOGTCXGYSFKE-UHFFFAOYSA-N 291.414 2.467 10 20 CECD C[C@H](C(=O)NCc1ccc(O)cc1O)C(C)(F)F 910943753 GPEBESXEOYZRPP-SSDOTTSWSA-N 259.252 2.005 10 20 CECD CCOc1cccc(CN[C@@H]2CC[C@H](CN)C2)c1O 841084551 KQASXBZLPFYHSK-WCQYABFASA-N 264.369 2.008 10 20 CECD Cc1ccc(O)c([C@H](C)NCC[C@@]2(O)CCCOC2)c1 846212475 LRVXAEVZOJZKJJ-BBRMVZONSA-N 279.380 2.283 10 20 CECD COc1cc(O)c(CN(C)C2CCC(N)CC2)cc1OC 843055635 IUHLQFSHFNZFPJ-UHFFFAOYSA-N 294.395 2.111 10 20 CECD C[C@@H](NC[C@H]1CC(=O)N(C2CC2)C1)c1cc(F)ccc1O 846205639 IRHPOXZVEQWXBF-GHMZBOCLSA-N 292.354 2.193 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)OCCF 859042622 KRYHAKBXXUSZBE-UHFFFAOYSA-N 268.288 2.058 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](O)COCC2CC2)c(O)c1C 756511027 KXBPDMOFEYEBQY-HIFRSBDPSA-N 293.407 2.447 10 20 CECD CCOc1ccc(CNC2(C)CCOCC2)c(O)c1 752101031 QGJDLORQRMKWDI-UHFFFAOYSA-N 265.353 2.450 10 20 CECD CC(C)OCCCOC(=O)/C=C\c1ccc(O)c(O)c1 759587627 BKXCFNAKWYZVGA-ALCCZGGFSA-N 280.320 2.469 10 20 CECD CC[C@@H](NCCN1CC[C@@H](O)C1)c1cc(Cl)ccc1O 858549653 XZDGYTDVTUEYTG-TZMCWYRMSA-N 298.814 2.153 10 20 CECD CC(=O)NC[C@@H]1CCCCN1Cc1ccc(N(C)C)cc1 860177639 VGYVZCPFEPHXPR-KRWDZBQOSA-N 289.423 2.243 10 20 CECD CC1=C(C(=O)NCc2cc(C)ccc2O)CCCO1 862757976 KTUQDKFLNLEGCO-UHFFFAOYSA-N 261.321 2.401 10 20 CECD Cc1ccc(O)c(CNC(=O)CCCc2nc(C)no2)c1 862759500 GPLMOJSRWYQJMH-UHFFFAOYSA-N 289.335 2.031 10 20 CECD COc1cc(O)c(CN2CCOC(C)(C)[C@@H]2C)cc1OC 768462134 JVPWICPDCNQUNO-NSHDSACASA-N 295.379 2.409 10 20 CECD C[C@@H](NC(=O)c1cncc(O)c1)c1ccc(N(C)C)cc1 776269605 LMTUANQGXSBVOL-LLVKDONJSA-N 285.347 2.344 10 20 CECD CC[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)C(C)=O 873371560 XNRGBUQBFYOEEE-VUDGCMKMSA-N 264.277 2.022 10 20 CECD CO[C@@H]1CCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1O 774830830 DKEJNKXDYZSUGI-QMTHXVAHSA-N 280.324 2.205 10 20 CECD CC[C@@H](N[C@H](CCO)COC)c1cc(Cl)ccc1O 775509668 OGAZRLRUMZKZDR-DGCLKSJQSA-N 287.787 2.484 10 20 CECD CC(C)[C@H](NCc1cc(F)ccc1O)C(=O)N1CCCC1 779086066 TXKPTYVIQUJPIM-HNNXBMFYSA-N 294.370 2.268 10 20 CECD Cc1ccc(CN2CCSC[C@H]2CCO)c(O)c1 876805677 FAVXPUMEOYNLNS-CYBMUJFWSA-N 267.394 2.000 10 20 CECD COCC1(C(=O)NCc2ccc(N3CCCC3)cc2)CC1 778594382 AGBPFEHLAHJUMR-UHFFFAOYSA-N 288.391 2.330 10 20 CECD CC(C)=CCn1cc(COc2ccc(N)cc2)nn1 881035669 GVYFHAUVLRLFKA-UHFFFAOYSA-N 258.325 2.406 10 20 CECD Cc1cc(C)c(O)c(CN2CCC3(CC2)COC(=O)N3)c1 784024272 YLXZVJJMRRPKOV-UHFFFAOYSA-N 290.363 2.083 10 20 CECD CCCn1ccc(CNC(=O)c2c(F)ccc(O)c2O)c1 897540497 VFQJEFGKKCMRBM-UHFFFAOYSA-N 292.310 2.378 10 20 CECD C[C@@H](O)C[C@@H]1CCCN1Cc1cc(F)cc(F)c1O 894035050 XEAGNJIJCUKALV-SKDRFNHKSA-N 271.307 2.406 10 20 CECD COc1ccc(CNC[C@@](C)(OC)C2CC2)c(O)c1OC 894563094 AWQIDYKHBAERRN-MRXNPFEDSA-N 295.379 2.314 10 20 CECD CC(C)(O)CCNCc1c(O)ccc(Cl)c1F 790990013 HYKXHQGMDWRJBI-UHFFFAOYSA-N 261.724 2.435 10 20 CECD Cc1cc(N)nc(NCc2ccc(N(C)C)cc2)n1 891579445 YTHBXYFKPHQVOU-UHFFFAOYSA-N 257.341 2.045 10 20 CECD COc1ccc(O)c(CNC(=O)c2cc(C3CC3)no2)c1 799697216 AZAYTWCSFVZZKE-UHFFFAOYSA-N 288.303 2.196 10 20 CECD CO[C@]1(C)CCCN(C(=O)c2cccc(O)c2O)CC1 280125341 WBNTZWJBCJNTHN-OAHLLOKOSA-N 279.336 2.129 10 20 CECD O=C(Cc1ccsc1)NCCc1ccc(O)c(O)c1 193987445 HPIZIDIBBMNOGG-UHFFFAOYSA-N 277.345 2.061 10 20 CECD Oc1ccccc1CN1CCC([C@@H]2CCCN2)CC1 63197549 KNNOHNKUBAIGKT-HNNXBMFYSA-N 260.381 2.356 10 20 CECD CCC1(N)CCN(Cc2cc(F)ccc2O)CC1 714753591 KPKCXCIXXGJTQA-UHFFFAOYSA-N 252.333 2.235 10 20 CECD C[C@H](O)CCNCc1ccc(Br)cc1O 691413062 GHYOGMCDDRRWGM-QMMMGPOBSA-N 274.158 2.015 10 20 CECD O=C(NCCCSc1nccs1)[C@H]1C[C@H]1F 1346494401 GBCHHECGLOCZOL-JGVFFNPUSA-N 260.359 2.100 10 20 CECD CCCNC(=O)CCN[C@@H](C)c1cc(F)ccc1O 94618007 SWLBYTUYYUWMHW-JTQLQIEISA-N 268.332 2.098 10 20 CECD Cc1nc(CNC(=O)/C=C\c2ccc(O)c(O)c2)oc1C 1347738901 SHKMBIZGADZAEZ-XQRVVYSFSA-N 288.303 2.032 10 20 CECD Cc1ccc(C(=O)O[C@H](CC(C)(C)C)C(=O)O)c(O)c1O 1600364269 YHUGWTWAQKARTD-SNVBAGLBSA-N 296.319 2.452 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)OCC(=O)O)cc1 1607765979 MALVSKLUAJMWBJ-UHFFFAOYSA-N 273.288 2.336 10 20 CECD O=C(O)[C@@]1(F)CCN(Cc2c(O)ccc(Cl)c2F)C1 1610728857 ZEXCAXRCEPDGJL-GFCCVEGCSA-N 291.681 2.183 10 20 CECD CCC(CC)(CN)C(=O)N(C)Cc1ccc(N(C)C)cc1 165257453 WKTXMKAMFUEKSG-UHFFFAOYSA-N 291.439 2.476 10 20 CECD COc1ccc(N(C)C[C@@H]2CCCNC2)cc1OC 258948073 IITBJIJHLKAETL-GFCCVEGCSA-N 264.369 2.140 10 20 CECD COc1cccc(CNC2CCC(OC)CC2)c1O 289383765 CVBZRXZZZGNCNP-UHFFFAOYSA-N 265.353 2.448 10 20 CECD CN(C)C1(CN[C@H]2CCc3cccc(O)c32)CCC1 296533423 RVCKNGOIYDAQPP-ZDUSSCGKSA-N 260.381 2.453 10 20 CECD COc1cccc(CN[C@H]2CCS[C@@H]2C)c1O 310564139 KXXCQSUUOPJVNN-KOLCDFICSA-N 253.367 2.384 10 20 CECD COc1cccc(CN2CC(F)(F)C(F)(F)C2)c1O 313313610 DHGAGZXKNYELIV-UHFFFAOYSA-N 279.233 2.487 10 20 CECD COc1ccc(O)c(CNCCc2ccc(C)cn2)c1 689503575 JUZHKUZXFATBGY-UHFFFAOYSA-N 272.348 2.437 10 20 CECD CN(C)c1ccc(CNc2nnnn2-c2ccccc2)cc1 7366194 XGQWKLWIVVPDHR-UHFFFAOYSA-N 294.362 2.340 10 20 CECD NC1CCC(NCc2cc(Cl)ccc2O)CC1 51693264 AZSZRNHAVSVCMH-UHFFFAOYSA-N 254.761 2.405 10 20 CECD CC[C@@H](C)[C@@](C)(O)CNCc1cc2c(cc1O)OCO2 112380126 VFVSSMSWRNQPDJ-BMIGLBTASA-N 281.352 2.008 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc(C)nc2)c1 114542729 ZVMGOYKPOULBGV-UHFFFAOYSA-N 272.304 2.034 10 20 CECD CCc1nc(CCNC(=O)c2cccc(O)c2O)cs1 188363713 SHQGKTPNWAXGSM-UHFFFAOYSA-N 292.360 2.089 10 20 CECD CC[C@H](SC)C(=O)NCc1cc(OC)ccc1O 125113126 WZCUKFRJGCOYJT-LBPRGKRZSA-N 269.366 2.159 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)[C@@H](C)N2CCOCC2)c(O)c1 185376239 SJIQATRQJDQFLV-RBSFLKMASA-N 292.423 2.460 10 20 CECD COC(C)(C)CNC(=O)NCc1ccc(N(C)C)c(F)c1 75312954 WSLRCZYVKJIMDA-UHFFFAOYSA-N 297.374 2.116 10 20 CECD Cc1ccc([C@H](C)NC[C@H](O)COCC(C)C)c(O)c1 185117366 ADBVXONTKMSKIY-KBPBESRZSA-N 281.396 2.385 10 20 CECD CC[C@@](C)(CCO)NCc1ccc(N2CCOCC2)cc1 134463665 PFHWOXNVUYABDB-KRWDZBQOSA-N 292.423 2.164 10 20 CECD Cc1c(CNC(=O)Cc2ccon2)n(C)c2ccccc12 348664458 WWJKPOSXTLUWJU-UHFFFAOYSA-N 283.331 2.334 10 20 CECD CC1CCN(C(=O)COc2ccc(N(C)C)cc2)CC1 277967338 XGUHBNWPQCJYBU-UHFFFAOYSA-N 276.380 2.390 10 20 CECD CN(C)c1ccc(CNC(=O)C[C@@H]2CCC[C@H]2N)cc1F 294261661 ZZZBKBAUIFBFCZ-GXTWGEPZSA-N 293.386 2.025 10 20 CECD COc1cccc(CN[C@@H](C2CC2)C(C)(C)CO)c1O 290814707 GKIMURTYVZKWTJ-HNNXBMFYSA-N 279.380 2.288 10 20 CECD CC[C@H](C)CONC(=O)NCc1cccc(OC)c1O 291777839 NMHOOWHBJKPVHA-JTQLQIEISA-N 282.340 2.178 10 20 CECD CCCCO[C@H](C)C(=O)NCc1ccccc1O 299555735 MFANKIGLAPWKIF-LLVKDONJSA-N 251.326 2.214 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H]2CCC[C@@H](OC)C2)c1 815835607 ZBNDYSZBMKRQDU-DGCLKSJQSA-N 293.363 2.222 10 20 CECD CCN(CC)c1ccc(CNc2n[nH]c(N(C)C)n2)cc1 818215052 VNDOJNMLABDSPL-UHFFFAOYSA-N 288.399 2.329 10 20 CECD CC(C(=O)NCCc1ccc(O)c(O)c1)=C1CCC1 827294837 STBKGRIEXUUULJ-UHFFFAOYSA-N 261.321 2.257 10 20 CECD Oc1ccccc1CNCc1cc(-c2nn[nH]n2)ccc1F 823731717 DNZRULBILIALIS-UHFFFAOYSA-N 299.309 2.001 10 20 CECD CCN1CCCC[C@H]1C(=O)N[C@H](C)c1ccccc1O 827930113 BMZVQVKHJXGZCJ-OCCSQVGLSA-N 276.380 2.444 10 20 CECD CN(C)c1ccc(CN(C(=O)c2ccn(C)n2)C2CC2)cc1 727302980 OGTZYBKBZOUFJN-UHFFFAOYSA-N 298.390 2.291 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC1Cc2ccccc2C1 588459010 AQZIUEVASUUGBK-VURMDHGXSA-N 295.338 2.395 10 20 CECD CC[C@H](C)[C@](C)(O)CNCc1c(O)cccc1OC 732820589 LVPQROYIDYPNMT-XHDPSFHLSA-N 267.369 2.288 10 20 CECD O=C(O[C@H](Cc1ccccc1)C(=O)O)c1cc(O)cs1 738715235 VKBMDGCMDUVJCQ-LLVKDONJSA-N 292.312 2.306 10 20 CECD CC1(C)NCC[C@H]1NCc1c(O)ccc(Cl)c1F 841085505 FIMCFXNIIRYAHB-LLVKDONJSA-N 272.751 2.415 10 20 CECD CCOc1ccc(CN(C)C2CCC(N)CC2)c(O)c1 843056103 ZGRRJJPUUGNFEI-UHFFFAOYSA-N 278.396 2.493 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CCCNCC1 841058865 WPIPDIFDATYRJN-NSHDSACASA-N 254.761 2.277 10 20 CECD OC[C@H](CCF)NCc1ccc(N2CCCCC2)cc1 846095584 BKWVXEQUJOXZSX-HNNXBMFYSA-N 280.387 2.487 10 20 CECD C[C@H]1C[C@@H](C)CN1C(=O)NCCc1ccc(N)cc1 841955252 XKLJSRJDAPMJHH-NEPJUHHUSA-N 261.369 2.251 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2CNCCCO2)cc1 841085598 IEJHEUVOUPQPHV-QGZVFWFLSA-N 291.439 2.001 10 20 CECD CN(C)c1ccc(CN[C@H](CN)C(C)(C)C)cc1F 841086963 FZIJJQPSYFMCDN-CQSZACIVSA-N 267.392 2.355 10 20 CECD CN(Cc1c(O)ccc(Cl)c1F)C1CCNCC1 843044634 DEYPJWZMUZHKHT-UHFFFAOYSA-N 272.751 2.369 10 20 CECD CN(C(=O)c1cc(O)cs1)[C@H](CO)Cc1ccccc1 855136855 VCJPWEDYLOVYSP-LBPRGKRZSA-N 291.372 2.129 10 20 CECD C[C@@H](NC1COC(C)(C)OC1)c1cc(F)cc(F)c1O 757702847 DYYMDRSRPZIMMV-MRVPVSSYSA-N 287.306 2.473 10 20 CECD C[C@H]1C[C@H](NCC(C)(C)C(N)=O)c2c(O)ccc(F)c21 756782959 XAJUINANMLSZLO-WPRPVWTQSA-N 280.343 2.181 10 20 CECD CN(C)c1ccc(CN2CCC(CCO)CC2)cc1 768238513 ZWBMALBYVDEZKY-UHFFFAOYSA-N 262.397 2.347 10 20 CECD CCCCN(CCOC)Cc1cc2c(cc1O)OC[C@@H]2O 768450546 KGKMNPVRMWXIGG-HNNXBMFYSA-N 295.379 2.067 10 20 CECD COc1cccc(CN(CCO)CC(C)(C)C)c1O 769338594 RBWMNZDCOJFGQF-UHFFFAOYSA-N 267.369 2.241 10 20 CECD Cc1cc(C)c(O)c(CN2CCC3(CCNC3=O)CC2)c1 872788627 PCVFQMHUVOJLSO-UHFFFAOYSA-N 288.391 2.111 10 20 CECD Cc1cccc(O)c1CNC[C@H]1CCN(C2CC2)C1 876929653 LJZJUTJYFZSXKS-CYBMUJFWSA-N 260.381 2.275 10 20 CECD CCC[C@](C)(O)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 775411146 PFTJVUOMFYGXIP-WBMJQRKESA-N 278.396 2.481 10 20 CECD C[C@@H](NCc1cc(=O)c(O)co1)c1ccc(N(C)C)cc1 775832270 XSAFWGSKOBRBOM-LLVKDONJSA-N 288.347 2.262 10 20 CECD Cc1cc(NC(=O)/C=C\c2ccc(O)c(O)c2)cnc1O 779542192 NBQBTGSFYXNWGP-HYXAFXHYSA-N 286.287 2.159 10 20 CECD COc1ccccc1CNC(=O)c1c(F)ccc(O)c1O 789941949 OCIGZPWKPJRYFA-UHFFFAOYSA-N 291.278 2.176 10 20 CECD C[C@H]1C[C@@H](C(=O)NCCCSc2nccs2)CO1 784410610 JRLCKXYRJFECLE-VHSXEESVSA-N 286.422 2.167 10 20 CECD CO[C@@]1(C)C[C@@H](NC(=O)NCc2ccc(N)cc2)C1(C)C 1120611340 QVCBSMQPPCCOHT-CJNGLKHVSA-N 291.395 2.272 10 20 CECD C[C@@H]1C[C@H](C(=O)NCCCSc2nccs2)CO1 784410611 JRLCKXYRJFECLE-ZJUUUORDSA-N 286.422 2.167 10 20 CECD C[C@H](NCCOC[C@H]1CCOC1)c1ccccc1O 783507887 CAIDFDZUUADXNL-STQMWFEESA-N 265.353 2.096 10 20 CECD NC[C@@H]1CCCN(Cc2ccc(N3CCCC3)cc2)C1 1326198892 DNWSHGFDSYUROB-INIZCTEOSA-N 273.424 2.458 10 20 CECD Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2N[C@H](C)C(=O)N(C)C 1320252539 GVCYOPSCDPAFQH-TUAOUCFPSA-N 276.380 2.315 10 20 CECD Cc1cc(NC(=O)c2cccc(O)c2O)sn1 193120193 GPCAYUYASJHJNW-UHFFFAOYSA-N 250.279 2.115 10 20 CECD O=C(OCc1cc(C2CC2)no1)c1cccc(O)c1O 1327967767 SHPSDMXHZSPLJD-UHFFFAOYSA-N 275.260 2.320 10 20 CECD Cc1c[nH]nc1CN1CCCc2cc(CN)ccc21 715446483 MICJCXGJWUWLOX-UHFFFAOYSA-N 256.353 2.130 10 20 CECD O=C(NCc1ccccc1O)c1ncoc1[C@@H]1CCCO1 1339140452 JXDCFUMVRWKYND-LBPRGKRZSA-N 288.303 2.162 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)NCCC(F)F)c1 1346862378 JIGJYBLLPFBQKM-QMMMGPOBSA-N 288.294 2.416 10 20 CECD O=C(O)[C@]1(F)CCN(Cc2cccc(Cl)c2O)C1 1601716664 ACMGDIBNWDHGKC-LBPRGKRZSA-N 273.691 2.044 10 20 CECD CC1(F)CN(c2ccc(/C=C\C(=O)O)cc2[N+](=O)[O-])C1 1604585913 QDGULRNUCWGISU-HYXAFXHYSA-N 280.255 2.241 10 20 CECD COc1cc(CN2CC(C(=O)O)C2)c(O)c(C(C)(C)C)c1 1594056681 TXIQJITXAOHAQT-UHFFFAOYSA-N 293.363 2.215 10 20 CECD CCN1CCc2cc(CNC(C)(C)CC(=O)O)ccc21 1776884681 IGAPABZTMHHNJJ-UHFFFAOYSA-N 276.380 2.412 10 20 CECD C[C@H](Oc1ccccc1)C(=O)NCc1ccc(O)c(O)c1 158933741 XISABPYLCOJRLK-NSHDSACASA-N 287.315 2.182 10 20 CECD COc1cc(O)c(CN2CCO[C@H](C)[C@@H]2C)cc1OC 160432082 BCNOQCBPZBMSJE-WDEREUQCSA-N 281.352 2.019 10 20 CECD COc1cc(C)cc(CN(C)C[C@@H]2CCOC2)c1O 164459876 WJDOVQPINLFFQF-LBPRGKRZSA-N 265.353 2.178 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CNCC1CC1 154143584 IXMJENBLSYRSTB-UHFFFAOYSA-N 276.380 2.130 10 20 CECD CN(C)c1ccc(CNCC2(C(=O)O)CCC2)cc1 854244684 OXDPLMUGADVYIN-UHFFFAOYSA-N 262.353 2.097 10 20 CECD CC(C)(C)C[C@H](O)CNCc1cc(F)ccc1O 226609357 MHVVCAMFGAEVOU-LBPRGKRZSA-N 255.333 2.418 10 20 CECD COC[C@@H](CO)N[C@@H](C)c1ccc2ccccc2c1O 234893908 YNFRMOLLRRAKPX-WCQYABFASA-N 275.348 2.203 10 20 CECD O=C(O)c1ccc2c(c1)-c1ccccc1C(=O)C2=O 13862824 DKIFEYAEWKRYFT-UHFFFAOYSA-N 252.225 2.431 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)C(C)(C)C)c1 273552436 GDFJRVAODNKBNY-HZMBPMFUSA-N 267.369 2.458 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2([S@](C)=O)CCC2)c1 281071297 OGOCLBCPEJUQGK-GIPWTMENSA-N 297.420 2.353 10 20 CECD CCN(C[C@H]1CCCO1)C(=O)Nc1ccc(N)cc1 48967061 GRCCWYONLKRTOY-CYBMUJFWSA-N 263.341 2.302 10 20 CECD Cc1ccc(O)c([C@H](C)NC[C@]2(O)CCSC2)c1 185638513 WDXJKCBEJXTYDL-SMDDNHRTSA-N 267.394 2.219 10 20 CECD CC[C@](C)(CNCc1cc2c(cc1O)OCO2)OC 322793859 OKSOXRVIEUHWIJ-CQSZACIVSA-N 267.325 2.026 10 20 CECD O=C(NCCCSc1nccs1)C(F)(F)F 733972494 SECJTAQMHWOCHH-UHFFFAOYSA-N 270.301 2.304 10 20 CECD CCOCCC(=O)NCc1ccc(N(C)C)cc1C 115281306 UNUZVDLYFCTTHK-UHFFFAOYSA-N 264.369 2.104 10 20 CECD Cc1ccc(C(=O)N2CC[C@@H]3OCCC[C@@H]3C2)c(O)c1O 182839377 XPDSPLHUFDEPBT-YPMHNXCESA-N 291.347 2.047 10 20 CECD CC(C)NC(=O)CN[C@@H](C)c1cc2c(cc1O)CCCC2 184896079 WIWGQHFEXBXCSD-LBPRGKRZSA-N 290.407 2.446 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCCCO1 123572850 GMCHZZUIPNCGKN-HNNXBMFYSA-N 276.380 2.246 10 20 CECD C[C@@H](O)C[C@H]1CCCCCN1C(=O)c1cccc(O)c1O 126645631 ISWNNDCOUCXOFK-VXGBXAGGSA-N 293.363 2.254 10 20 CECD CCOc1ccc(O)c(CN2CCN(C(C)C)CC2)c1 127033836 MUDQPSDCXDRACE-UHFFFAOYSA-N 278.396 2.317 10 20 CECD Nc1ccc(NC(=O)[C@H]2CC(=O)Nc3cc(F)ccc32)cc1 238000102 MAGOBFPVHVQGBA-ZDUSSCGKSA-N 299.305 2.472 10 20 CECD C[C@@H]1[C@H](C(=O)NCc2ccc(O)c(O)c2)[C@H]1C1CC1 528863869 QVIJZSVNRBVKPM-PCTYZZJISA-N 261.321 2.006 10 20 CECD O=C(NCc1ccccc1O)N[C@@H]1CCCSC1 267301605 KRDANAGVLNBWOW-LLVKDONJSA-N 266.366 2.087 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)N1CC[C@H](C2CC2)C1 368049406 VIAFGBUVPOVHQX-NHEDYWLLSA-N 273.332 2.370 10 20 CECD CC[C@H]1CN(Cc2cccc(Cl)c2O)C[C@@H]1O 271993497 SEWYZFPIQKAXKG-CABZTGNLSA-N 255.745 2.248 10 20 CECD CS[C@@H]1CN(Cc2ccc(N(C)C)cc2)C[C@@H]1N(C)C 278845752 LLZZHWHZXDTINE-JKSUJKDBSA-N 293.480 2.230 10 20 CECD Cc1nc(CNCc2ccc(N(C)C)cc2)ccc1C(=O)O 277125663 BGNOIRZYLPDRGK-UHFFFAOYSA-N 299.374 2.444 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)ccc2O)CC[S@](=O)C1 375950183 ZWZBSUYJWDCDMM-MGNBDDOMSA-N 287.812 2.246 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)NCc1ccccc1O)OC 297711029 IAWQFVLAGAYAQV-SMDDNHRTSA-N 280.368 2.253 10 20 CECD O=C(CCN[C@@H]1CCc2cccc(O)c21)N1CCCCC1 296143936 WHMUMQURQOHKDX-CQSZACIVSA-N 288.391 2.372 10 20 CECD CN(C)c1ccc(CNC(=O)c2cnn(C)c2Cl)cc1 294317624 HIZZHSJGRLIYQN-UHFFFAOYSA-N 292.770 2.070 10 20 CECD Cc1cc(C(=O)NCc2ccc3c(c2)CCCN3C)n[nH]1 299458310 QGAWQRDHAJBXMM-UHFFFAOYSA-N 284.363 2.031 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)N[C@@H](C)CCCCN)c1 817976418 LUGJVKKJJCVAOU-NWDGAFQWSA-N 294.395 2.347 10 20 CECD CC[C@H](NC[C@@]1(COC)CCCN1)c1ccccc1O 817973367 DSFRTBPRJLBPTI-GOEBONIOSA-N 278.396 2.202 10 20 CECD O=C(NCCc1ccc(O)c(O)c1)C1(F)CCCCC1 810628933 WWJPWQPQBOVYOO-UHFFFAOYSA-N 281.327 2.429 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H](n3ccnn3)C2)c1 822503987 NZPGIXOWXIXYFF-AWEZNQCLSA-N 272.352 2.129 10 20 CECD CCN(CC)c1ccc(CN(C)C2(CO)CC2)cc1 827904240 XNMDIEWESGRVPV-UHFFFAOYSA-N 262.397 2.490 10 20 CECD CN(Cc1ccc(C(=O)O)[nH]1)c1ccc2c(c1)OCO2 833696220 IGNWQKIOOHJEMR-UHFFFAOYSA-N 274.276 2.078 10 20 CECD C[C@H](NC[C@H](O)C1CCC1)c1cc(F)cc(F)c1O 834904957 CTVMWZLIRMWRGC-SDBXPKJASA-N 271.307 2.482 10 20 CECD Cc1cc(O)c(CN2CC[C@@](F)(C(=O)O)C2)cc1C 832897992 AKLNVZSHVCLECD-AWEZNQCLSA-N 267.300 2.008 10 20 CECD C[C@H]1CCC[C@H](C)N1C(=O)COC(=O)c1cc(O)cs1 731909624 GKSJEZQWNXRTQR-UWVGGRQHSA-N 297.376 2.400 10 20 CECD CO[C@@H]1COC[C@H]1N[C@@H](C)c1ccc(C)c(C)c1O 842909514 IFDXOJKMGPXKFG-IACUBPJLSA-N 265.353 2.073 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1ccc(N(C)C)cc1 840958598 QPKRZYYYQVFMRI-HNNXBMFYSA-N 276.380 2.184 10 20 CECD O=C(C[C@@H]1CCOC1)NCc1cc(Cl)ccc1O 846474985 DBIUXVGGNFTARV-VIFPVBQESA-N 269.728 2.088 10 20 CECD CCN1C[C@H](CN[C@H](C)c2ccc(F)cc2O)CC1=O 846210276 WWTBNRJMXCQUTA-MNOVXSKESA-N 280.343 2.050 10 20 CECD COc1cccc([C@H](C)N[C@@H]2CCc3n[nH]cc3C2)c1O 846152856 FDYOGDGXHXERPG-CMPLNLGQSA-N 287.363 2.332 10 20 CECD CC(=O)NC1CCN(Cc2ccc(N(C)C)cc2C)CC1 840913651 ZPANGIFKHQORGD-UHFFFAOYSA-N 289.423 2.162 10 20 CECD C[C@@H](CCCN)NCc1cccc(Br)c1O 841081333 URUGXWSESKGYEE-VIFPVBQESA-N 287.201 2.372 10 20 CECD COc1cc(Cl)cc(CNCC2(N)CCC2)c1O 841048382 IFTMCWZMYHDWGO-UHFFFAOYSA-N 270.760 2.025 10 20 CECD C[C@H]1Oc2ccccc2O[C@H]1C(=O)NCc1ccccc1O 748345269 BXVOBQABPFHSNU-BDJLRTHQSA-N 299.326 2.237 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)c2csnn2)c1 858543769 WKVINDJMTUOMCV-VIFPVBQESA-N 292.364 2.113 10 20 CECD CCn1nccc1CN[C@H](C)c1cccc(OC)c1O 853239588 IKIOUEHZTADJPL-LLVKDONJSA-N 275.352 2.468 10 20 CECD COc1ccc(N(C)Cc2nccc(C)n2)c(OC)c1 756619601 SMCJFVQWPXCVJE-UHFFFAOYSA-N 273.336 2.439 10 20 CECD Cc1ccc([C@H](C)NC[C@H](O)C2CCOCC2)c(O)c1 756738301 NUMAFTSXYBUJDH-LRDDRELGSA-N 279.380 2.139 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)C1(N(C)C)CCC1 762964755 QULDDVCAKTXHSU-UHFFFAOYSA-N 289.423 2.195 10 20 CECD CN(Cc1cccc(Cl)c1O)CC1(O)CCC1 761220193 VYPDRZMPPTZELF-UHFFFAOYSA-N 255.745 2.392 10 20 CECD COC[C@H](C)NC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773145559 NOLICTTZHSPRBE-RYUDHWBXSA-N 279.384 2.148 10 20 CECD CC(C)CCn1cc(C(=O)N(C)c2ccc(N)cc2)nn1 877078447 PWNNLPITLROXON-UHFFFAOYSA-N 287.367 2.183 10 20 CECD C[C@@H](NC(=O)[C@@H](O)c1cccnc1)c1ccc(N(C)C)cc1 775406928 QIKNJDBYWZVFMC-WBMJQRKESA-N 299.374 2.058 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N[C@H]1CC12CCC2 874786119 YDKDBWVBTWMISK-DXTPNHAXSA-N 259.305 2.170 10 20 CECD CCCn1cc(CNCc2cc(Cl)ccc2O)nn1 877612976 RSBGOQYAXLMIJA-UHFFFAOYSA-N 280.759 2.337 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CC[C@H](C)C2)c1O 776474116 ZCCODJZFLAAZCC-WDEREUQCSA-N 263.337 2.453 10 20 CECD C[C@@H](NC[C@@H](O)c1ccccn1)c1ccccc1O 879649772 GTLCKECKKZMDSG-IAQYHMDHSA-N 258.321 2.171 10 20 CECD CCN(CC)CC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 775408773 BTEXGCZIXSODJB-ZDUSSCGKSA-N 277.412 2.272 10 20 CECD C[C@@H](NCCOC[C@H]1CCCO1)c1c(O)cccc1F 886528803 ROZCEKXEGWRFDU-VXGBXAGGSA-N 283.343 2.378 10 20 CECD CCN(CC)CCCCNC(=O)Cc1ccc(N)cc1 82699542 XVRXFUWIFSNDSL-UHFFFAOYSA-N 277.412 2.050 10 20 CECD C[C@H](N[C@@H](CO)CC(F)F)c1ccc(N(C)C)cc1 717809026 QCYWFMNMIRSBCD-CMPLNLGQSA-N 272.339 2.419 10 20 CECD CC(C)[C@@H]1CN(C(=O)NCc2ccc(N)cc2)CCCO1 1262603748 UFDWQCZIJXIWNF-HNNXBMFYSA-N 291.395 2.225 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@H](N)C(C)(C)C)c1 1340967225 MFBPWKYBARVZRK-YGRLFVJLSA-N 294.395 2.342 10 20 CECD C[C@H](CCC(=O)O)NCc1cc(F)cc(F)c1O 1350653326 NEAXEBXECTVCBW-SSDOTTSWSA-N 259.252 2.013 10 20 CECD O=C(O)[C@H](C[C@H]1CCCO1)NCc1cc(Cl)ccc1O 1601641170 IDVZZLUWKRQTSC-NEPJUHHUSA-N 299.754 2.158 10 20 CECD COc1cccc(CNCc2cc(C(=O)O)c(C)o2)c1O 1610357568 KBLRJLHQNUOIOQ-UHFFFAOYSA-N 291.303 2.290 10 20 CECD CC[C@@H](CNCc1ccc(N(C)C)cc1C)C(=O)O 1589552793 VUZMDQBDRKUCLM-LBPRGKRZSA-N 264.369 2.261 10 20 CECD CCOCCOCCN[C@@H](C)c1ccc(C)cc1O 927086488 GCBPOHFGZPJEMZ-ZDUSSCGKSA-N 267.369 2.404 10 20 CECD Cc1cccc(CN[C@@H]2CCN3CCC[C@@H]3C2)c1O 124712061 GAZMQSQMXSPUKB-HUUCEWRRSA-N 260.381 2.417 10 20 CECD COc1ccc(O)c(CN[C@H]2CCN3CCCC[C@H]23)c1 36996292 RRZMICWWCBZJCV-LSDHHAIUSA-N 276.380 2.117 10 20 CECD CN(Cc1ccccc1O)C(=O)C1(N)CCCCC1 37823745 HAMFAPLMSWBHMV-UHFFFAOYSA-N 262.353 2.012 10 20 CECD O=C(c1cccc(O)c1O)N1C[C@H]2[C@H]3CC[C@@H](C3)[C@@H]2C1 294319064 VQOBVPFPLQEFKG-UKJIMTQDSA-N 273.332 2.216 10 20 CECD OCC[C@@H](NCc1cccc(Cl)c1O)C(F)(F)F 894852787 VZGIHIWMKXYVNT-SECBINFHSA-N 283.677 2.449 10 20 CECD O=[N+]([O-])c1ccn(CCSc2nccs2)n1 178506531 XWXHIKFJJGNIOE-UHFFFAOYSA-N 256.312 2.040 10 20 CECD CN(C)c1ccc(CN2CCC[C@@](C)(CO)C2)cc1F 124891452 IZMFPKIJVOZYSM-MRXNPFEDSA-N 280.387 2.486 10 20 CECD C[C@@H]1CN(Cc2cc(Br)ccc2O)CC[C@@H]1N 220184763 IZVLXPOCYRRLKS-SKDRFNHKSA-N 299.212 2.324 10 20 CECD CC(C)N(C)C(=O)NCc1ccc(N2CCOCC2)cc1 86370794 JOJLXPFFHVZXKA-UHFFFAOYSA-N 291.395 2.073 10 20 CECD Nc1ccc(CCNC(=O)CCCOc2cccnc2)cc1 238122559 OGAHRLJNNOSIJF-UHFFFAOYSA-N 299.374 2.182 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@H]2C[C@H](C)O)c1O 269865253 XAEDWTJQQPEQQD-HZMBPMFUSA-N 295.354 2.469 10 20 CECD Cc1ccc([C@H](C)NCC(C)(C)C(N)=O)c(O)c1C 273477858 LHJGMRGMVQXSCB-NSHDSACASA-N 264.369 2.171 10 20 CECD CN(C)c1ccc(CN(C)S(=O)(=O)CC2CCC2)cc1 271380123 FTBKNQJWEUMWCN-UHFFFAOYSA-N 296.436 2.314 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[S@](=O)C1 277434140 JRAZDKYESPOOOZ-YUNKPMOVSA-N 298.427 2.092 10 20 CECD CN(C)c1ccc(OCc2nnc3n2CCCC3)cc1 289478281 XRAIVCGQMYIQKB-UHFFFAOYSA-N 272.352 2.259 10 20 CECD CCCCOCCOC(=O)/C=C\c1ccc(O)c(O)c1 805507937 CHJFKVLFSMJKCB-ALCCZGGFSA-N 280.320 2.471 10 20 CECD Cc1cc(Cn2cc([N+](=O)[O-])cn2)ccc1N(C)C 292697534 QJXSFCQIGKLFDW-UHFFFAOYSA-N 260.297 2.214 10 20 CECD Nc1ccc(CNC(=O)c2noc3c2CCCC3)cc1 296818327 AIWIARGFGVWEFU-UHFFFAOYSA-N 271.320 2.066 10 20 CECD CNCCCN[C@@H]1C[C@@H](C)c2c(F)ccc(O)c21 817939657 HTAMBKMENKUJCX-MWLCHTKSSA-N 252.333 2.279 10 20 CECD Cc1cc(CN2CC(O)(C(C)C)C2)ccc1N(C)C 815102630 KVLQLWULYUKEBV-UHFFFAOYSA-N 262.397 2.264 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)c2ccccn2)c1 728980500 IBTMXHQZFSJLTG-JTQLQIEISA-N 272.304 2.287 10 20 CECD CN1CC[C@@H]2CN(Cc3cc(Cl)c(F)cc3O)C[C@@H]21 824892905 FCCYFDDLZVZXJH-RNCFNFMXSA-N 284.762 2.321 10 20 CECD CC[C@@H](NCc1cc(Cl)c(F)cc1O)[C@@H](C)O 824921316 ITXDHTDWTPMCMQ-RDDDGLTNSA-N 261.724 2.434 10 20 CECD CC(C)(C)n1[nH]cnc1=NCc1cc(F)cc(F)c1O 905413901 WWKDVIXVKZPDJZ-UHFFFAOYSA-N 282.294 2.051 10 20 CECD Nc1ccc(CC(=O)N2CCC[C@H]2C2CCOCC2)cc1 831522456 MUTOAZXZTCXTCD-INIZCTEOSA-N 288.391 2.229 10 20 CECD Nc1ccc(CC(=O)Nc2cc([C@@H]3CCCO3)[nH]n2)cc1 832135322 PSCAXBPTAVZBDV-ZDUSSCGKSA-N 286.335 2.025 10 20 CECD Cc1cncc(CCC(=O)NCc2ccc(O)cc2O)c1 910944562 OGZATENMXXNRQO-UHFFFAOYSA-N 286.331 2.050 10 20 CECD CCc1cccc(CN(CC(=O)OC)C2CC2)c1O 848891520 ZQWPWDZBFJTSPS-UHFFFAOYSA-N 263.337 2.092 10 20 CECD NC[C@H]1CC[C@@H](NCc2cccc(Cl)c2O)C1 841084964 RBBSGUJFYFPKSU-GXSJLCMTSA-N 254.761 2.263 10 20 CECD C[C@H](N)[C@H]1CCN(Cc2cccc(Cl)c2O)C1 843058485 UIAHEKIYZLQXAF-UWVGGRQHSA-N 254.761 2.215 10 20 CECD NC[C@@H]1CC[C@@H](NCc2c(O)cccc2Cl)C1 841084972 RCQLMGGVADRJTK-NXEZZACHSA-N 254.761 2.263 10 20 CECD CN1CCN(c2ccc(CN3CCC[C@@H](F)C3)cc2)CC1 846121386 YYZCTDUYBZNJOT-MRXNPFEDSA-N 291.414 2.372 10 20 CECD C[C@@H](NC[C@H](O)COCC1CC1)c1ccc(Cl)cc1O 841748811 ZDMXSNRGPDQYPX-MFKMUULPSA-N 299.798 2.484 10 20 CECD CC1(C)[C@H]2OCC[C@@H]2[C@H]1NC(=O)Nc1ccc(N)cc1 841299843 IVVSNMDYZZYVNV-UPJWGTAASA-N 275.352 2.204 10 20 CECD COc1ccc(N(C)CC(=O)NC(C2CC2)C2CC2)cc1 844352726 FBBVURXKLWMBQK-UHFFFAOYSA-N 288.391 2.436 10 20 CECD Oc1ccc(F)cc1CN[C@H]1CCNC2(CCC2)C1 841090453 YCVPTPUGUWRDIO-ZDUSSCGKSA-N 264.344 2.296 10 20 CECD COc1ccccc1CNC(=N)NCc1ccccc1O 849058844 WDBNJNPUBWFCHS-UHFFFAOYSA-N 285.347 2.215 10 20 CECD COc1cccc(O)c1CNCc1cc(C2CC2)n(C)n1 922956799 AMUITPPJISZRCW-UHFFFAOYSA-N 287.363 2.302 10 20 CECD C[C@@H](NCCN(C)CC(F)F)c1ccccc1O 858597623 SGMANHPNAROBAW-SNVBAGLBSA-N 258.312 2.240 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NCCOC(C)C 754291178 JQVPGEXXOUJONX-UHFFFAOYSA-N 293.411 2.285 10 20 CECD C[C@H]1C[C@@H](N[C@@H]2CCNC2)c2c(O)ccc(F)c21 863545938 BSKMDTSUETVQDL-IQJOONFLSA-N 250.317 2.031 10 20 CECD Cc1cc(CNC(=O)[C@@H](C)O)c(C)n1-c1ccccc1 863164596 PHRISKYTTPTNII-CYBMUJFWSA-N 272.348 2.091 10 20 CECD COc1ccc(CNC[C@H]2CCCN2C(C)=O)cc1C 1034834157 HSOUCFARZCLWDL-OAHLLOKOSA-N 276.380 2.104 10 20 CECD CCC(O)(CC)CN(C)Cc1cccc(OC)c1O 862540013 WRYPZDKTUVPDEQ-UHFFFAOYSA-N 267.369 2.384 10 20 CECD Cc1ccc(CN[C@H]2CCC[C@H](S(C)(=O)=O)C2)c(O)c1 877049535 GRFFXTQBOZMGMA-KBPBESRZSA-N 297.420 2.146 10 20 CECD COc1ccc(CNC(=O)c2cnc(C(C)C)[nH]2)c(O)c1 1116885820 CWHVKZZAZPQOOZ-UHFFFAOYSA-N 289.335 2.177 10 20 CECD CC(C)N(C)Cc1ccc(N2CCC(O)CC2)cc1 876527717 KMPMUGYVISIGNH-UHFFFAOYSA-N 262.397 2.488 10 20 CECD Cc1nnc(O)c(CN[C@H](C)c2cc(F)ccc2O)c1C 1116568904 VZIUCXZKDKZOQJ-SNVBAGLBSA-N 291.326 2.495 10 20 CECD O=C(c1cccc(O)c1O)N1CCO[C@H](c2ccccc2)C1 776355597 OWYBRCBNBRRYGL-HNNXBMFYSA-N 299.326 2.312 10 20 CECD COc1cc(Cl)cc(CN2CCC[C@H]2CCO)c1O 779202589 PBEGHHVZVUNCBO-LBPRGKRZSA-N 285.771 2.401 10 20 CECD COc1ccc(CNCCNC(=O)CC(C)C)cc1C 1122795342 USNOHMFYNOPGKW-UHFFFAOYSA-N 278.396 2.256 10 20 CECD Nc1ccc(CN2C[C@H](O)Cc3ccccc32)cc1 1120371067 OLHQSCBLBKRLLW-OAHLLOKOSA-N 254.333 2.192 10 20 CECD COc1ccc(CN2CCC[C@@H]2C[C@H](C)O)c(O)c1OC 892064894 GADYYOKTUVVTOB-WCQYABFASA-N 295.379 2.145 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)CCOC(C)C)c1 788276744 UYANTEQZFMHQDV-QWHCGFSZSA-N 297.395 2.227 10 20 CECD COc1ccc(CN2C[C@H](C)OC(C)(C)C2)c(O)c1OC 891796344 CNTQNXJIEVVYLE-NSHDSACASA-N 295.379 2.409 10 20 CECD CC(C)(NCc1cc(F)ccc1O)C(=O)N1CCCC1 793396362 XEPWIJXMWHPOMX-UHFFFAOYSA-N 280.343 2.022 10 20 CECD O=S(=O)(Nc1ccc(O)c(Cl)c1)N1CCCCC1 85204662 LSLFLDIDIRHWNW-UHFFFAOYSA-N 290.772 2.188 10 20 CECD COCc1ccc(NC(=O)c2cccc(O)c2O)cc1 193028219 GBJNDWPMDMRSMS-UHFFFAOYSA-N 273.288 2.497 10 20 CECD COc1cc(O)c(CNC(C)(C)CF)cc1OC 1255070104 AJEBVELTCFHTNX-UHFFFAOYSA-N 257.305 2.247 10 20 CECD OC[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCCO2 894768874 ILQVPMBJFIVGQV-GJZGRUSLSA-N 261.365 2.262 10 20 CECD COC(=O)C[C@H](NCc1ccc(OC)c(C)c1)C1CC1 1351284465 SDWZYBDZFZRTLZ-AWEZNQCLSA-N 277.364 2.435 10 20 CECD CN(C)c1cc(F)c(CNCC2(CO)CCC2)cc1F 1351331078 POFKILXJKJHTDY-UHFFFAOYSA-N 284.350 2.283 10 20 CECD Nc1ccc(CNC(=O)NCCCCCCC(=O)O)cc1 1608273225 VOMKTJCSUGAZLZ-UHFFFAOYSA-N 293.367 2.103 10 20 CECD CC1(C)NCC[C@H]1NCc1cc(Cl)c(F)cc1O 1576489129 LLMFTNCCYNUFES-GFCCVEGCSA-N 272.751 2.415 10 20 CECD CCN1C(=O)/C(=C/c2ccc(C(=O)O)o2)SC1=S 1596388527 WZEFURYFPKVDKG-YVMONPNESA-N 283.330 2.199 10 20 CECD CN(C)c1ccc(CN=c2cc[nH]cc2C(=O)O)cc1F 1777040334 KFKNBYSLGUSLLN-UHFFFAOYSA-N 289.310 2.019 10 20 CECD Cc1ncsc1CNCc1ccc(C(=O)O)cc1O 1777538609 DOZZWYASLTWOOG-UHFFFAOYSA-N 278.333 2.145 10 20 CECD Cc1cnc([C@@H](C)NC(=O)c2cccc(O)c2O)s1 126525517 OOEZCRXMZQEKML-MRVPVSSYSA-N 278.333 2.354 10 20 CECD CC[C@@H]1COCCN1Cc1cc(F)cc(C(C)=O)c1O 37329004 RCLLFVFTAQPPON-CYBMUJFWSA-N 281.327 2.345 10 20 CECD Cc1cc(CN[C@H](C)c2ccc(F)cc2O)n(C)n1 284408857 QDKXUSMGNGGTMC-SNVBAGLBSA-N 263.316 2.424 10 20 CECD CC[C@@H]1CN(C(=O)Nc2ccc(N)cc2)CCCO1 311262137 OFZXTNIRWHPJOJ-CYBMUJFWSA-N 263.341 2.302 10 20 CECD CS[C@@H](C)C(=O)NCc1ccc(N(C)C)c(F)c1 58733711 QCOWRHIAGKKTGD-VIFPVBQESA-N 270.373 2.259 10 20 CECD COc1cccc(CN[C@H](C)[C@@H]2CCCO2)c1O 20206676 BNZNDJYMDCJRCN-PWSUYJOCSA-N 251.326 2.058 10 20 CECD COCCS(=O)(=O)Nc1cc(C(C)C)c(O)cc1C 123909270 GNRQSMDYNIOGGD-UHFFFAOYSA-N 287.381 2.212 10 20 CECD CNCC1CCN(Cc2c(O)cccc2Cl)CC1 128323127 WOTWQRADWSASGB-UHFFFAOYSA-N 268.788 2.477 10 20 CECD CCOc1cccc(CN[C@H](CC)COC)c1O 79737120 DSTYKXODQMBQIG-GFCCVEGCSA-N 253.342 2.306 10 20 CECD CCNC(=O)C(C)(C)CN[C@H](C)c1cc(OC)ccc1O 186354044 KBMVIXZCCCVLQO-LLVKDONJSA-N 294.395 2.214 10 20 CECD Oc1ccc(F)cc1CN1CC[C@H]([C@H]2CCOC2)C1 361050585 HRSKWOYHYXLUSD-RYUDHWBXSA-N 265.328 2.390 10 20 CECD COc1ccc(O)c(CNC[C@H](C)Cn2ccnc2C)c1 182462029 FETFQIMQDZGUJY-LBPRGKRZSA-N 289.379 2.332 10 20 CECD COCCN(C)CCCN[C@@H](C)c1cc(C)ccc1O 185008490 MXMHEESFVCROCF-AWEZNQCLSA-N 280.412 2.320 10 20 CECD CCCC[C@@H](COC)NC(=O)c1cccc(O)c1O 193078916 CTFLXYVINLZVSA-JTQLQIEISA-N 267.325 2.033 10 20 CECD COC[C@H](CNCc1ccc(N2CCCCC2)cc1)OC 227704578 AMHNECBFGATFAD-KRWDZBQOSA-N 292.423 2.428 10 20 CECD CC[C@H]1CN(Cc2cc(OC)ccc2O)CCO1 132010255 FXBVITYOYBKHEM-LBPRGKRZSA-N 251.326 2.012 10 20 CECD CCN(CC)C(=O)/C=C/c1ccc(N2CCOCC2)cc1 264709364 HIBQAGTYCPEBME-JXMROGBWSA-N 288.391 2.405 10 20 CECD COCCCN(Cc1ccccc1O)C[C@H]1CCCO1 264760743 YREKJQKZGQPARF-OAHLLOKOSA-N 279.380 2.410 10 20 CECD C[C@@H](NCCC(C)(C)O)c1cc([N+](=O)[O-])ccc1O 274805001 SIQPTAHXXQPSDQ-SECBINFHSA-N 268.313 2.112 10 20 CECD COC(=O)[C@@H]1C[C@H](C)CCN1Cc1cccc(C)c1O 274923152 MSMYVFJGEUYBRV-RISCZKNCSA-N 277.364 2.474 10 20 CECD Cc1ncc2c(n1)CC[C@@H](NCc1cc(F)ccc1O)C2 373121954 DHFZKASJRQEMFL-CQSZACIVSA-N 287.338 2.277 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)Cn1cccn1 282601475 YCNYPUNFLXNTOJ-UHFFFAOYSA-N 287.363 2.418 10 20 CECD C[C@@H](N[C@H](C)c1cc(Cl)ccc1O)C(=O)NCCF 282791858 QGWQSNNDESBELX-RKDXNWHRSA-N 288.750 2.170 10 20 CECD CC(=O)C(=O)COC(=O)c1cc2c(s1)CC[C@H](C)C2 808484980 MFAKJQICZWPSBE-QMMMGPOBSA-N 280.345 2.188 10 20 CECD C[C@H](N[C@H](C)[C@H]1CCCNC1)c1cc([N+](=O)[O-])ccc1O 817948297 WUMKMQKYRGQTAD-WOPDTQHZSA-N 293.367 2.339 10 20 CECD O=C1OCc2ccc(NC(=O)c3cccc(O)c3O)cc21 813870136 RXDPGVPGQZYKAZ-UHFFFAOYSA-N 285.255 2.021 10 20 CECD COc1cc(O)c(CNCc2ccnc(C)c2)cc1OC 824596151 GDXFXNXQKBFPOR-UHFFFAOYSA-N 288.347 2.403 10 20 CECD COC(=O)[C@@H](C)N(C(=O)c1cc(O)cs1)C1CCC1 834334901 LKKXGHIQRJMNAC-MRVPVSSYSA-N 283.349 2.010 10 20 CECD Cc1cc(O)c(CN(C)[C@H](COC(C)C)C(=O)O)cc1C 833746492 ATXIMHANERRRQY-CQSZACIVSA-N 295.379 2.319 10 20 CECD CCC[C@H](C)CS(=O)(=O)NCc1ccccc1O 739963757 ZYPUJILWKHDKLD-NSHDSACASA-N 271.382 2.248 10 20 CECD COc1ccc(O)c(CNCc2cnc(C3CC3)nc2)c1 838946232 BYSOMNSPMIVVQN-UHFFFAOYSA-N 285.347 2.358 10 20 CECD Cc1cc(C)c([C@@H](C)NC[C@@]2(C)CCC(=O)N2)c(O)c1 834909633 STKFABQJUNIZJT-MLGOLLRUSA-N 276.380 2.328 10 20 CECD C[C@H]1C[C@@H](CN)CN1Cc1cccc(Cl)c1O 843058521 VBMSODVKMFUOCS-UWVGGRQHSA-N 254.761 2.215 10 20 CECD COc1ccc(N(CC2CC2)C[C@@H]2CCC(=O)N2)cc1 844336935 GYICXJLAGCKLGG-ZDUSSCGKSA-N 274.364 2.190 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)c1cnc(C(C)C)[nH]1 747619259 XZRCJUAAIVXKQW-UHFFFAOYSA-N 295.364 2.348 10 20 CECD COc1cc(O)c(CNc2ccc(CN)cc2)cc1OC 841059056 KXVHGQJQFIDOPS-UHFFFAOYSA-N 288.347 2.480 10 20 CECD COc1ccc(N(C)Cc2oncc2C(=O)O)c(OC)c1 846251159 CDWYSOUOCJNUJY-UHFFFAOYSA-N 292.291 2.026 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCC[C@@H](N)C1 841058493 SANLXSAWVBVTAH-CABCVRRESA-N 261.413 2.421 10 20 CECD CC[C@@H](C)C[C@H](CO)NCc1c(O)cccc1OC 842753376 FEYLCAFIFROCMR-VXGBXAGGSA-N 267.369 2.288 10 20 CECD CC[C@@H](CN(C)CCN(C)c1ccc(OC)cc1)OC 844402247 QVRVJYHTYOPDEL-HNNXBMFYSA-N 280.412 2.488 10 20 CECD C[C@@H](O)CN(Cc1cccc(Cl)c1O)C1CC1 848928968 QNLSPRNSRGQDOT-SECBINFHSA-N 255.745 2.391 10 20 CECD CCC[C@H](O)CC(=O)NCc1ccc(N(C)C)cc1C 750312232 ROCCKVAZWRWZCJ-HNNXBMFYSA-N 278.396 2.228 10 20 CECD COC(=O)CCCCN(C)c1ccc(OC)cc1OC 859204046 AUAXOEBZTQXPBZ-UHFFFAOYSA-N 281.352 2.483 10 20 CECD CCCN1CCC(NC(=O)c2ccc(C)c(O)c2O)CC1 751533825 SHKGJPKNUYRPDA-UHFFFAOYSA-N 292.379 2.010 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CNC(C)C 852800839 STEBKZLSRUUVMM-UHFFFAOYSA-N 264.369 2.129 10 20 CECD CN(C)c1cc(F)c(CN2CCC[C@@](C)(O)C2)cc1F 862247923 OGQPSSYSGYROGY-OAHLLOKOSA-N 284.350 2.378 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1conc1CC 935945404 VZVFIMRZRLDOPH-UHFFFAOYSA-N 295.335 2.358 10 20 CECD CCOc1ccc(CN(C)Cc2cn[nH]c2)c(O)c1 769427305 XOGLNYVVEVNCKW-UHFFFAOYSA-N 261.325 2.146 10 20 CECD Cc1ccc(O)c(CNC(=O)Nc2c(C)nn(C)c2C)c1 860864307 PBWKTUCZOSLWRM-UHFFFAOYSA-N 288.351 2.373 10 20 CECD CCOc1ccc(O)c(CN2CCN(CC)[C@@H](C)C2)c1 769381127 LIWVOUGWKGNEJI-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cnc2ccccn12 761714273 VVZZGRKTXMYELH-UHFFFAOYSA-N 281.315 2.312 10 20 CECD C[C@H](NC(=O)NCC(C)(C)CO)c1ccc(N(C)C)cc1 776245988 IVOFMKQPTYQZPC-LBPRGKRZSA-N 293.411 2.131 10 20 CECD CSCC[C@H](C)NC(=O)/C=C\c1ccc(O)c(O)c1 779519109 NUFKUGOEJHRYKD-OAQKJQOQSA-N 281.377 2.369 10 20 CECD CC[C@H](C)NC(=O)CN[C@@H](C)c1ccc(N(C)C)cc1 775830167 DXOPCCZSOYDGRT-STQMWFEESA-N 277.412 2.318 10 20 CECD Oc1c(F)cc(Cl)cc1CN1CCC[C@H](O)C1 775638523 JNVRLOSADIINSY-JTQLQIEISA-N 259.708 2.141 10 20 CECD COC(=O)[C@H]1CCC[C@@H](C(=O)N(C)c2ccc(N)cc2)C1 877075219 AMOKSFJDBDPIOV-NEPJUHHUSA-N 290.363 2.211 10 20 CECD O=C(OCCOc1ccccc1F)c1cccc(O)c1O 776279014 HCOSGXZCQKWAEO-UHFFFAOYSA-N 292.262 2.473 10 20 CECD CCCNC(=O)CNCc1ccc(OCCC)c(C)c1 873008074 NFEHWFFOOKVEDK-UHFFFAOYSA-N 278.396 2.400 10 20 CECD CC(=O)N1CCC[C@@H](CN[C@H](C)c2c(O)cccc2F)C1 886604686 AQVAJTUMCHRXFR-YPMHNXCESA-N 294.370 2.440 10 20 CECD COc1ccc(O)c(CNCc2ccc(CCO)cc2)c1 898171260 UQTHXOZRTZDTRL-UHFFFAOYSA-N 287.359 2.225 10 20 CECD CN(C)c1ccc(CNCCOCC(F)F)cc1F 788073846 ABXUWRAHXYLGPO-UHFFFAOYSA-N 276.302 2.263 10 20 CECD CCOCc1cc(CN[C@H](C)C[C@@H](C)O)ccc1OC 782978035 JQSVOWKGGTVFCL-CHWSQXEVSA-N 281.396 2.481 10 20 CECD CN1CCC(CN2CCOc3cc(N(C)C)ccc32)CC1 893614419 NNIIYMOCNJXPIE-UHFFFAOYSA-N 289.423 2.293 10 20 CECD CCc1cc(O)ccc1NS(=O)(=O)c1cncc(F)c1 790415710 IKQDTCCHFAWEHQ-UHFFFAOYSA-N 296.323 2.290 10 20 CECD Oc1ccccc1CN1CC[C@H](N2CCCCC2)C1 134116558 XDPDRODSVOIEAB-HNNXBMFYSA-N 260.381 2.452 10 20 CECD CCN(CC)c1ccc(CN(C)CCC(=O)O)cc1 77253403 DFNSHPZKRHTPHV-UHFFFAOYSA-N 264.369 2.439 10 20 CECD CN1CC[C@@]2(CCN(Cc3cc(F)cc(F)c3O)C2)C1 708424628 YYEZGNPIRVJNRS-OAHLLOKOSA-N 282.334 2.198 10 20 CECD COc1ccc(N(C)Cc2cc(C)[nH]n2)cc1OC 1327140381 KPCJZBFLMZZFKA-UHFFFAOYSA-N 261.325 2.372 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@@H]2CCCCCN2)c1 1326319148 VPUVAEYYDKTPCH-RISCZKNCSA-N 292.379 2.110 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@@H](C)c1ccccc1O 760884210 FIXNYMICFTWSDV-NJZAAPMLSA-N 265.353 2.237 10 20 CECD Nc1ccc(CNC(=O)N[C@@H]2CCC[C@@H](F)C2)cc1 1335568216 JIZNFDNYAGQDCW-DGCLKSJQSA-N 265.332 2.349 10 20 CECD Cc1nc(C(=O)O)cn1Cc1ccc(N(C)C)cc1 1607948662 DCRZADJBVJLHBA-UHFFFAOYSA-N 259.309 2.004 10 20 CECD C[C@H](NCCC1(CO)CCC1)c1cc(C(=O)O)ccc1O 1593261117 KPEMEPRAYDXKGD-NSHDSACASA-N 293.363 2.294 10 20 CECD CN(CC(=O)N1CCCCCC1)c1ccc(N)cc1 20374495 KJJVQFMXIFLKLK-UHFFFAOYSA-N 261.369 2.108 10 20 CECD Cc1nc(O)ccc1C(=O)NCc1ccc(N(C)C)cc1 155834862 NGHDFDBVDJQYRZ-UHFFFAOYSA-N 285.347 2.092 10 20 CECD CC(C)(C)n1cc(CNCc2ccccc2O)nn1 232510646 ZIBMYUOTVXAIPM-UHFFFAOYSA-N 260.341 2.029 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H](C)CN2CCOCC2)c1 36933343 DVJPPXAUASXYHM-ZIAGYGMSSA-N 278.396 2.072 10 20 CECD Nc1ccc(CN2CCC[C@H](N3CCCC3)C2)cc1 382552678 JYLONPIQDQSSBT-INIZCTEOSA-N 259.397 2.329 10 20 CECD NC[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2O)C1 50245111 TVSFZEYDOWAEDU-QMMMGPOBSA-N 275.179 2.480 10 20 CECD COc1ccc(N(CC(=O)NC2CC2)C(C)C)cc1F 101567560 LVCBWPYXRCHSAX-UHFFFAOYSA-N 280.343 2.328 10 20 CECD C[C@H]1C[C@@H]1C(=O)N1CCOc2cc(N(C)C)ccc21 173200810 JKJCRVLNFXDAEW-JQWIXIFHSA-N 260.337 2.134 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1ccnn1C 155177104 UNSUXZFPHMEFHN-UHFFFAOYSA-N 258.369 2.118 10 20 CECD CN(Cc1ccncc1)C(=O)/C=C/c1ccc(O)c(O)c1 180617842 PFKTZWIYFWNVBL-HWKANZROSA-N 284.315 2.165 10 20 CECD Oc1cccc(Cl)c1CN[C@H]1CCc2[nH]ncc2C1 124549813 GRBWAUZIMYAYEC-JTQLQIEISA-N 277.755 2.416 10 20 CECD COCC1=CCN(Cc2cc(OC)c(C)cc2O)CC1 185028622 KUJDFBUFAPXMDJ-UHFFFAOYSA-N 277.364 2.488 10 20 CECD COc1cc(Cl)cc(CNC[C@@H]2CCCO2)c1O 76274266 WJWKBOPZOTXACV-NSHDSACASA-N 271.744 2.323 10 20 CECD CCN(CC)c1ccc(CN(C)C[C@@H](C)O)cc1 130667471 WNXPVFUAPQVCSJ-CYBMUJFWSA-N 250.386 2.345 10 20 CECD CN(CC(=O)N(C)C)Cc1cc(Cl)cc(Cl)c1O 132119351 WAVATJMTNMQICQ-UHFFFAOYSA-N 291.178 2.219 10 20 CECD CC(=O)CCC(=O)NCc1ccc2c(c1)CCCN2C 195116849 PDRSRFATRCIHEF-UHFFFAOYSA-N 274.364 2.054 10 20 CECD C[C@@H](CC(=O)N(C)Cc1ccccc1O)C1CCNCC1 237292264 XGUDUQOBDBFMAN-ZDUSSCGKSA-N 290.407 2.376 10 20 CECD CCN(Cc1ccnn1C)c1ccc(OC)c(OC)c1 271465327 UWXSLHLNJAJEBC-UHFFFAOYSA-N 275.352 2.464 10 20 CECD CC[C@@H](NCC(F)(F)CO)c1ccc(F)cc1O 286356815 ZNKBGBKOCQTXFL-SNVBAGLBSA-N 263.259 2.200 10 20 CECD CC[C@H](NCCc1n[nH]c(C)n1)c1ccc(F)cc1O 286035338 JLIPEEBQLGDOJL-LBPRGKRZSA-N 278.331 2.241 10 20 CECD CC[C@@H](NC[C@@H](O)C(F)(F)F)c1ccc(F)cc1O 286339458 YGPOYFXDVGMJQP-MWLCHTKSSA-N 281.249 2.495 10 20 CECD Cc1cc[nH]c1C(=O)N1CCOc2cc(N(C)C)ccc21 280694480 RWPGWRUCYSIUNQ-UHFFFAOYSA-N 285.347 2.428 10 20 CECD COC(=O)N1CC(N[C@@H](C)c2c(C)cc(C)cc2O)C1 294821634 QKCMVLIXHJYLPT-NSHDSACASA-N 278.352 2.110 10 20 CECD C[C@@H]1C[C@@H](NC[C@H]2CNCCCO2)c2c(O)ccc(F)c21 817982505 UFNNYIZWZVEVQT-NQBHXWOUSA-N 294.370 2.048 10 20 CECD COC(=O)c1cnc(S[C@H](C)c2nc(C)no2)s1 829688484 YDCUSJWZKPKYAH-RXMQYKEDSA-N 285.350 2.474 10 20 CECD CCOc1ccc(CN[C@H](C)CC(C)(C)O)c(O)c1 824695748 BZELSQNMZDPCPS-LLVKDONJSA-N 267.369 2.430 10 20 CECD COc1cc(CN2CCC(C(=O)O)CC2)c(O)cc1C 820763941 NPAWZNDCYQOEGC-UHFFFAOYSA-N 279.336 2.006 10 20 CECD CC[C@@](C)(CNCc1ccc([N+](=O)[O-])c(OC)c1O)OC 824743579 GUSSOMMFKDJUTL-AWEZNQCLSA-N 298.339 2.214 10 20 CECD COc1ccc(O)c(CN2CC(CC(F)F)C2)c1 822521040 WDVANAXGBULOAH-UHFFFAOYSA-N 257.280 2.488 10 20 CECD COc1ccc(CCNC(=O)c2cc(O)cs2)cc1 731865301 AUAGWHUGEISSSP-UHFFFAOYSA-N 277.345 2.435 10 20 CECD O=C(NC[C@H]1OCCc2ccccc21)c1cc(O)cs1 733363769 GOEQEBFITBSIIX-CYBMUJFWSA-N 289.356 2.498 10 20 CECD C[C@H](CCO)N(C)Cc1cc(Br)ccc1O 846113067 YTHJVCVGMQCICE-SECBINFHSA-N 288.185 2.357 10 20 CECD C[S@](=O)c1ccc(C(=O)NCc2ccccc2O)cc1 743327389 MNGVJWRMKLVJGP-FQEVSTJZSA-N 289.356 2.060 10 20 CECD CC[C@@H]1OCC[C@H]1N[C@@H](C)c1cc(C(=O)OC)ccc1O 840822842 WNSJTUHQKIQUDK-ZBINZKHDSA-N 293.363 2.397 10 20 CECD CC[C@H](NCc1cc(F)ccc1O)[C@H](O)C(C)C 840967049 CSMABXLGPBWROL-GXTWGEPZSA-N 255.333 2.416 10 20 CECD C[C@H]1C[C@H](NCCN2CCCC2=O)c2c(O)ccc(F)c21 846205113 FAVAIJPBWWLUNQ-JQWIXIFHSA-N 292.354 2.292 10 20 CECD C[C@@H](C[C@@H]1CCC(=O)N1)NCCCSc1nccs1 925104278 WZPYHGMSTNYDIE-QWRGUYRKSA-N 299.465 2.272 10 20 CECD C[C@@H](NC[C@@H](C)S(C)(=O)=O)c1cc(Cl)ccc1O 756768946 BJWXMZDXRWTURX-RKDXNWHRSA-N 291.800 2.129 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](CO)C2CCOCC2)c1 757656641 BVWYKHNKXSOZPK-DOMZBBRYSA-N 279.380 2.139 10 20 CECD C[C@@]1(C(=O)NCc2c(O)ccc3c2CCCC3)CCOC1 755529833 KCYAZEFDQDVYQX-QGZVFWFLSA-N 289.375 2.314 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@@H]2C[C@H]3CC[C@H]2O3)c1 862754532 FMVOTGRURNYTIW-NJZAAPMLSA-N 275.348 2.274 10 20 CECD CCn1nncc1CNCc1cc(Cl)c(C)cc1O 862434012 OVGROIMKXRAYKB-UHFFFAOYSA-N 280.759 2.255 10 20 CECD C[C@@H](O)[C@@H]1CCCN(Cc2ccc(N(C)C)c(F)c2)C1 780891981 FQTKSJZEJRFALO-TZMCWYRMSA-N 280.387 2.485 10 20 CECD CC[C@H](C)NC(=O)CCNCc1cc(C)cc(OC)c1O 894195019 TXLXDMPZNFKQSG-LBPRGKRZSA-N 294.395 2.104 10 20 CECD Cc1ccc(NC(=O)c2c(F)ccc(O)c2O)nc1 789954806 MMJKQCDODYXEIO-UHFFFAOYSA-N 262.240 2.193 10 20 CECD CC[C@@H](C)N(CCO)Cc1cc(F)cc(F)c1O 894919768 UVKISICJNVHAGF-SECBINFHSA-N 259.296 2.263 10 20 CECD C[C@@H](NCc1ccnc(N(C)C)n1)c1ccccc1O 783525756 NVKQPUAZHSVFQA-LLVKDONJSA-N 272.352 2.099 10 20 CECD CC1=NO[C@@H](CNCc2ccc(Br)cc2O)C1 895301430 INPFNIPCHHSIIX-LLVKDONJSA-N 299.168 2.409 10 20 CECD CCC[C@@H](NCc1cccc(Cl)c1O)C(=O)OC 897835380 CALRHNXJBSHKNL-LLVKDONJSA-N 271.744 2.477 10 20 CECD Cc1cnc([C@@H](C)NC(=O)Cc2ccc(N)cc2)s1 135290236 DRUUTNFLMKFGEB-SNVBAGLBSA-N 275.377 2.454 10 20 CECD Cc1ccncc1C(=O)N(C)Cc1ccccc1O 694781130 GGDPTOIRKLLNHN-UHFFFAOYSA-N 256.305 2.368 10 20 CECD CCC[C@@H](CCO)NCc1cccc(OC)c1O 716886632 QHZVJUSNACRXNF-LBPRGKRZSA-N 253.342 2.042 10 20 CECD CC(C)(C)[C@H](NCc1cc(F)cc(F)c1O)C(=O)O 1339241191 PPXICNRUGDXEAA-LLVKDONJSA-N 273.279 2.259 10 20 CECD Oc1cccc(Cl)c1CN1CCO[C@H]([C@H]2CCCO2)C1 770304364 MLNIWOYNVCCFIS-CABCVRRESA-N 297.782 2.425 10 20 CECD CCOc1cccc(CN2CC[C@@H](C(=O)O)[C@@H]2C)c1O 92944245 PVMOALMNGRYNOU-CMPLNLGQSA-N 279.336 2.086 10 20 CECD CC(=O)N1CCC(N[C@H](C)c2cc(F)ccc2O)CC1 94617516 YWTSTDYLOPWYTL-SNVBAGLBSA-N 280.343 2.193 10 20 CECD CC(C)[C@@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C(=O)O 1609943256 MLIKXZJSBKAHBV-PRHODGIISA-N 282.296 2.060 10 20 CECD COc1cccc(O)c1CNC[C@@H](CC(C)C)C(=O)O 1607326451 GXHZZZJLXQJICJ-LLVKDONJSA-N 281.352 2.237 10 20 CECD CC(C)(CNCc1cc(Cl)c(F)cc1O)C(=O)O 1590757783 UYBPOSGQSGIHKG-UHFFFAOYSA-N 275.707 2.385 10 20 CECD COc1cc(C)cc(CN2CCOC(C)(C)C2)c1O 164009917 MALCTELDPMBQRI-UHFFFAOYSA-N 265.353 2.320 10 20 CECD COc1cccc(CN[C@@H]2CCN3CCC[C@H]3C2)c1O 252666924 CUVLSCBCTBJFPJ-KGLIPLIRSA-N 276.380 2.117 10 20 CECD Cc1cccc(CNC(=O)c2cccc(O)c2O)c1 126274165 BPHVFSNTQFMWDP-UHFFFAOYSA-N 257.289 2.336 10 20 CECD C[C@@H](O)C[C@@H](C)CNCc1cc(F)cc(F)c1O 708481394 RTSMLRBBGODRIH-RKDXNWHRSA-N 259.296 2.167 10 20 CECD COc1ccc(CN[C@@H]2C[C@H](C)O[C@H]2C)c(O)c1 384542043 FAFGOTCUDYTRMO-OUJBWJOFSA-N 251.326 2.056 10 20 CECD COc1ccc(CN[C@@H](C(=O)O)C2CCC2)cc1C 399325575 RWEJCADPKLLHMD-CQSZACIVSA-N 263.337 2.347 10 20 CECD C[C@H](CC[S@@](C)=O)N[C@H](C)c1cc(F)ccc1O 252804595 DJEMVQXTELVNAJ-CLFVBBPSSA-N 273.373 2.339 10 20 CECD C[C@@H](NCC1(C)OCCO1)c1cc(Cl)ccc1O 186211569 ADLFEIGXJJWJCP-SECBINFHSA-N 271.744 2.459 10 20 CECD COc1ccccc1OC(=O)c1cccc(O)c1O 188083670 KDTWGFXWWGVWPL-UHFFFAOYSA-N 260.245 2.326 10 20 CECD CC[C@H]1CN(C(=O)c2cccc(O)c2O)CCS1 126565590 ANGTZYSFEKHOGN-VIFPVBQESA-N 267.350 2.065 10 20 CECD Cc1cccc(OCCNC(=O)c2cccc(O)c2O)c1 126347469 LWLUEHFOQPJEBP-UHFFFAOYSA-N 287.315 2.215 10 20 CECD Cc1ccc(CC(=O)N(C)Cc2ccccc2O)cn1 48734893 JPZAESDKHVGRLV-UHFFFAOYSA-N 270.332 2.297 10 20 CECD C[C@@H](CN(C)Cc1cc(Cl)ccc1O)C(=O)O 86806815 UWNJTJOSBPTFIR-QMMMGPOBSA-N 257.717 2.198 10 20 CECD Cc1cc(O)c(CN2CC[S@](=O)[C@H](C)[C@H]2C)cc1C 265663719 XVXDMVZVTMLKFQ-VPZZIHKRSA-N 281.421 2.350 10 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Cc1ccc(O)c([C@H](C)N[C@H]2CCc3c(nnn3C)C2)c1 848565220 VEYJTJQDHDLMPD-RYUDHWBXSA-N 286.379 2.037 10 20 CECD CCc1cccc(CN[C@H]2CC(=O)N(C(C)C)C2)c1O 848896552 CPJZNCXKSYIDQP-AWEZNQCLSA-N 276.380 2.054 10 20 CECD C[C@@H]1CC(NC(=O)NCCc2ccc(N)cc2)C[C@@H](C)O1 841865853 HTCSYNLCTQUMSN-VXGBXAGGSA-N 291.395 2.067 10 20 CECD CCOc1ccc(CN[C@H]2CC[C@H](CN)C2)c(O)c1 841084464 JXFYBLWTAHDUGH-AAEUAGOBSA-N 264.369 2.008 10 20 CECD CCN(CC)c1ccc(CN(C)CCc2cnn[nH]2)cc1 851716759 QRNSYDGKQKRFAD-UHFFFAOYSA-N 287.411 2.325 10 20 CECD CCN(CC)c1ccc(CNCCO[C@H]2CCOC2)cc1 922941118 HDBVHUIGLOQZPU-KRWDZBQOSA-N 292.423 2.428 10 20 CECD CN(CCNCc1c(O)cccc1Cl)CC(F)F 858336473 IXYGHIWCOMHFQS-UHFFFAOYSA-N 278.730 2.332 10 20 CECD COc1ccc(O)c(CNC(=O)NCC2(C)CC2)c1 752969005 XRWXJBZAYLDXOK-UHFFFAOYSA-N 264.325 2.000 10 20 CECD O=C(NCc1ccccc1O)[C@H]1OCCc2ccccc21 750425001 XFNMNRCYIFUXTB-INIZCTEOSA-N 283.327 2.322 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCc2ccccn2)c1 864397496 WLEJRRKSONXACQ-UHFFFAOYSA-N 285.347 2.138 10 20 CECD C[C@H](c1ccc(N(C)C)cc1)N1C(=O)N(C)C(C)(C)C1=O 761579879 PUOSSCPQODDUPZ-LLVKDONJSA-N 289.379 2.486 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)[C@@]1(F)CCOC1 1117705791 VVXOIUQCIYVTQP-MRXNPFEDSA-N 292.354 2.032 10 20 CECD CN(C)c1ccc(CNC(=O)c2nn(C)cc2Cl)cc1 1118860724 XUUNFBPCOUDIOA-UHFFFAOYSA-N 292.770 2.070 10 20 CECD CC[C@@]1(O)CCCN(Cc2cc(OC)ccc2O)C1 877690555 ALOATJRTRLYHQP-OAHLLOKOSA-N 265.353 2.138 10 20 CECD CC[C@@H]1CN(Cc2cc(Cl)cc(F)c2O)C[C@H]1O 775744005 IUZGPEAUTYMTSY-PRHODGIISA-N 273.735 2.387 10 20 CECD CCN(C)c1ccc(CN2CCn3nc(C)nc3C2)cc1 773752492 CIMHYIPTXPUBNI-UHFFFAOYSA-N 285.395 2.058 10 20 CECD CCOCCNC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773207628 CVUAEFQLLIJCJZ-GFCCVEGCSA-N 279.384 2.149 10 20 CECD C[C@H](N[C@H](C)c1c(O)cccc1F)c1nnnn1C1CC1 886598971 OFIVAVGFGAQFBP-BDAKNGLRSA-N 291.330 2.265 10 20 CECD CCc1cccc(CN2CCc3ncncc3C2)c1O 895724806 ULRMXGYUXHRYMA-UHFFFAOYSA-N 269.348 2.303 10 20 CECD Cc1ccc(O)c(CN2CCO[C@H](c3ccnn3C)C2)c1 897559741 ZFQHLWCGZJPZPU-INIZCTEOSA-N 287.363 2.008 10 20 CECD COC(=O)[C@H](CC1CC1)NCc1ccc2c(c1)CCCO2 894897250 LKRSMZUOBUNRJN-HNNXBMFYSA-N 289.375 2.443 10 20 CECD CCOc1ccc(CNCCOC(F)(F)F)c(O)c1 788968444 WTUACSOATJVHQD-UHFFFAOYSA-N 279.258 2.417 10 20 CECD Cc1c[nH]nc1C(=O)N[C@H](C)c1ccc(N(C)C)cc1 799424471 KCZJMHCAGMGYSG-LLVKDONJSA-N 272.352 2.275 10 20 CECD C[C@H](NC[C@@H](C)O)c1cccc(C(F)(F)F)c1O 798179743 LXWQBQVEYSHASD-SFYZADRCSA-N 263.259 2.442 10 20 CECD C[C@@H](NCC(=O)NCc1ccccc1)c1ccccc1O 37908603 SNXKNLQCCLBPKQ-CYBMUJFWSA-N 284.359 2.359 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2ccc(N)cc2)C1 1336285204 JEAHXPUEWGVNAF-HNNXBMFYSA-N 262.353 2.044 10 20 CECD COc1ccc(N2CC[C@H](CNc3cc(N)ncn3)C2)cc1 1337907039 ODGLWKAVJVDXIZ-GFCCVEGCSA-N 299.378 2.006 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2NC[C@@H](C)S(C)(=O)=O 697589169 NHLZDMLNYZOBSV-UTUOFQBUSA-N 297.420 2.272 10 20 CECD CC(C)(CN)CC(=O)NCc1c(O)ccc2c1CCCC2 1357516081 FMSLAAMKKVLHGT-UHFFFAOYSA-N 290.407 2.262 10 20 CECD Cc1cc(COc2ccc(N(C)C)c(C(=O)O)c2)on1 1600215106 WBGMILBIBUYGKR-UHFFFAOYSA-N 276.292 2.326 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H]2CC[C@@]21CN 1579616640 CQEBHQWCYSVUHK-NVXWUHKLSA-N 273.424 2.374 10 20 CECD N[C@H]1CCC[C@H](NCc2ccc3c(c2)CCCO3)C1 904355631 PXCUKVVLEFAQAP-GJZGRUSLSA-N 260.381 2.371 10 20 CECD C[C@H](CCCC(=O)O)NCc1ccc2c(c1)CCO2 1255786501 LGPAXKYXUULOFZ-LLVKDONJSA-N 263.337 2.355 10 20 CECD CON(C)CCN[C@@H]1C[C@H](C)c2c(C)ccc(O)c21 1118426935 FZPRPDQBAXRAFQ-NWDGAFQWSA-N 264.369 2.332 10 20 CECD CC[C@@](C)(OC)C(=O)N(C)Cc1ccccc1O 280107105 VHMVMZSDVLQEFF-CQSZACIVSA-N 251.326 2.166 10 20 CECD C[C@H](NC[C@@H](O)C1CCC1)c1ccc(F)cc1O 316068297 ZJCHXHWVTRURBC-LKFCYVNXSA-N 253.317 2.343 10 20 CECD C[C@@H](NCCOC(=O)N(C)C)c1ccc(N(C)C)cc1 689019629 QATVTCDGPLVZJL-GFCCVEGCSA-N 279.384 2.101 10 20 CECD C[C@@H](O)[C@H]1CCN(Cc2cc(Cl)ccc2O)C1 305824295 BYSFBFVKAHWZIS-ZJUUUORDSA-N 255.745 2.248 10 20 CECD Cc1cccc2c1C(=O)N[C@@H](c1cc3c(cc1O)OCO3)N2 121393343 KELHXSZFUKIBLS-HNNXBMFYSA-N 298.298 2.283 10 20 CECD C[C@@H](NC[C@@H]1CC[C@H](O)C1)c1ccc(F)cc1O 189307760 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CO[C@@H]1CCC[C@H](NC[C@@H](N)c2ccc(N(C)C)cc2)C1 817943277 TWELOXKFWTWTJZ-USXIJHARSA-N 291.439 2.300 10 20 CECD COc1ccc(O)c([C@H](C)NCCC2=CCNCC2)c1 817987133 WODYMFHQWIDXOG-LBPRGKRZSA-N 276.380 2.361 10 20 CECD O=C(c1c(F)ccc(O)c1O)N1C2CCC1CC2 824091552 JOWRHENLVAMESX-UHFFFAOYSA-N 251.257 2.004 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H]2CCNC2)cc1 826019428 FERHCLLBDAGMIM-OAHLLOKOSA-N 289.423 2.101 10 20 CECD CO[C@@H]1COCC[C@H]1CN[C@H](C)c1ccc(F)cc1O 834880642 MHNYGWNRXHRSBA-JRPNMDOOSA-N 283.343 2.233 10 20 CECD CCO[C@@H]1CCCN(C(=O)c2cc(O)cs2)C1 732278179 VMROSDRPQVJFBG-SNVBAGLBSA-N 255.339 2.095 10 20 CECD CCN(CC)c1ccc(CN=c2ncnc3[nH][nH]cc2-3)cc1 917085436 MPVREEMPXDINRE-UHFFFAOYSA-N 296.378 2.185 10 20 CECD C[C@H](NC(=O)N(C)[C@@H](C)CCO)c1ccc(N(C)C)cc1 845123724 DFMXDMMJRVPKGH-STQMWFEESA-N 293.411 2.226 10 20 CECD CC[C@H](CCO)CN[C@H](C)c1cccc(OC)c1O 846148880 IBQFUFIOKLUXBP-VXGBXAGGSA-N 267.369 2.460 10 20 CECD C[C@H]1CN(C(=O)c2cc(O)cs2)CC2(CCC2)O1 844153814 RSFGABFRLNMTDJ-VIFPVBQESA-N 267.350 2.237 10 20 CECD C[C@H](N[C@H](C)C(=O)NCCF)c1ccc(Cl)cc1O 841752252 NWCHLJFMBKOEHT-DTWKUNHWSA-N 288.750 2.170 10 20 CECD CCc1cccc(CN[C@@H](C)c2nnnn2C2CC2)c1O 848906495 VHAODPYWWPVLGB-JTQLQIEISA-N 287.367 2.127 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cc1 841298576 QWFNFUWFACRITP-BFHYXJOUSA-N 287.363 2.348 10 20 CECD CCC1(CNC(=O)C(=O)Nc2ccc(N)cc2)CCCC1 841070286 MVVHYLJRERKOOY-UHFFFAOYSA-N 289.379 2.294 10 20 CECD CC[C@@H](N)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 843486040 OZORYBCGPACTDT-OAHLLOKOSA-N 277.412 2.227 10 20 CECD COc1cccc(CN2CCOC[C@H]2C2CCC2)c1O 843429425 VIYSUMQDVSWCJE-AWEZNQCLSA-N 277.364 2.402 10 20 CECD C[C@@H]1CCCN(Cc2cccc(F)c2O)[C@H]1CCN 844901216 FZCVMLSBEXUJPN-RISCZKNCSA-N 266.360 2.481 10 20 CECD CON(C)C(=O)[C@@H](C)N[C@@H]1C[C@H](C)c2c(F)ccc(O)c21 858588230 XNBBJGTUWVJCSB-IQJOONFLSA-N 296.342 2.078 10 20 CECD CC[C@@H](O)CCCN[C@@H](C)c1cc(C(=O)OC)ccc1O 756731598 CJJLEMOQPOKARN-WCQYABFASA-N 295.379 2.381 10 20 CECD C[C@H](NCCN(C)CC(F)F)c1cc(F)ccc1O 858596120 BFGJXIWUSCDETP-VIFPVBQESA-N 276.302 2.379 10 20 CECD CN(CCN[C@@H]1CCc2cccc(O)c21)CC(F)F 858597211 WWHCTDFYJQOOMW-LLVKDONJSA-N 270.323 2.166 10 20 CECD CC[C@@H](NC(=O)NCc1cc(C)ccc1O)[C@@H]1CCCO1 858323974 KJPHALMDRDGVCD-HIFRSBDPSA-N 292.379 2.457 10 20 CECD COc1cccc(O)c1CN(CCO)CC(C)(C)C 769337845 KPAXTUNVIJZYKG-UHFFFAOYSA-N 267.369 2.241 10 20 CECD COc1ccc(CNCc2nc(C)c(C)[nH]2)c(O)c1 862353666 WCQFELPVAQHHAE-UHFFFAOYSA-N 261.325 2.031 10 20 CECD CCOc1ccc(CN2CCC[C@@H](OC)C2)c(O)c1 768754143 PXJDYGKARSEELL-CQSZACIVSA-N 265.353 2.402 10 20 CECD Cc1cccc(O)c1CN1CC[C@@H](N2CCCC2)C1 876659431 WZZSEDGYVCZNDZ-CQSZACIVSA-N 260.381 2.371 10 20 CECD C[C@@H]1C[C@H](NC[C@H]2C[C@H](O)C2)c2c(O)ccc(F)c21 872127361 VHCGOZYDJTZSCO-BFLSOPEQSA-N 265.328 2.440 10 20 CECD Cc1cccc(N(C)C(=O)/C=C\c2ccc(O)c(O)c2)n1 779518204 KBKFBEGEPRIGCO-CLFYSBASSA-N 284.315 2.477 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H](C)c2ccc[nH]2)c1O 775041891 WBOYQQUGSOGCOH-VIFPVBQESA-N 291.307 2.488 10 20 CECD Cc1cccc(O)c1CNC1CCN(C(=O)C2CC2)CC1 876521640 SCUCPTUKMUELRJ-UHFFFAOYSA-N 288.391 2.191 10 20 CECD Cc1cccc(O)c1CNCCCOC[C@@H]1CCOC1 877060216 VJKNXPCRBRDSPD-AWEZNQCLSA-N 279.380 2.233 10 20 CECD CC[C@H](C[C@@H](C)CO)NCc1cc(OC)ccc1O 776220676 YRKSZVMFPVQDSZ-DGCLKSJQSA-N 267.369 2.288 10 20 CECD CCOc1ccc(N(C)C[C@H](O)CSC)cc1 778091279 XHZOFCZILOAJRR-LBPRGKRZSA-N 255.383 2.245 10 20 CECD Cc1nc2n(n1)C[C@H](N[C@@H](C)c1c(O)cccc1F)CC2 886521133 VBHURTPQGNEDDV-GXSJLCMTSA-N 290.342 2.097 10 20 CECD CNC(=O)[C@@H]1CCC[C@H]1N[C@H](C)c1c(O)cccc1F 886558929 WFOSUTQMKXYTHE-CKYFFXLPSA-N 280.343 2.097 10 20 CECD CCc1cccc(CN[C@@H](CC)CN2CCOCC2)c1O 896616562 FUIHFIBEIZHLQZ-INIZCTEOSA-N 292.423 2.155 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)/C=C/COC 791339853 MVLSPYHRAXMZSW-VOTSOKGWSA-N 276.380 2.304 10 20 CECD CN[C@H](C)CCNCc1cc(Cl)cc(F)c1O 1325628221 XNJYZZMTKCLSEF-MRVPVSSYSA-N 260.740 2.272 10 20 CECD Cc1cc(C)c(O)c(CN2CCc3ncncc3C2)c1 1331065595 FADOAMOTUPJJGZ-UHFFFAOYSA-N 269.348 2.357 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](CC(=O)O)C2)c1 86757532 PSDSHORCEUBJEU-NSHDSACASA-N 279.336 2.088 10 20 CECD COC(=O)CN(Cc1ccc(N2CCCC2)cc1)C1CC1 1339603906 KINCLMWYJBNXBG-UHFFFAOYSA-N 288.391 2.424 10 20 CECD CCN(Cc1ccccn1)C(=O)Cc1ccc(N)cc1 94910276 DGGZBYRNHFYRHY-UHFFFAOYSA-N 269.348 2.255 10 20 CECD Nc1ccc(CN2CCC[C@@H]2[C@H](O)C(F)(F)F)cc1 1345159114 BXOYBCAIRBOXEU-NEPJUHHUSA-N 274.286 2.156 10 20 CECD C[C@@H]1[C@H](C(=O)O)CCN1Cc1ccc(N(C)C)c(F)c1 1609836062 VZOPAOOUVINPFZ-ZYHUDNBSSA-N 280.343 2.187 10 20 CECD C[C@H](N[C@@H]1CSC[C@H]1C)c1cc(C(=O)O)ccc1O 1604328383 DGZURPYZBBDNOI-VDDIYKPWSA-N 281.377 2.493 10 20 CECD CCN[C@H](C)CNCc1cc(Cl)c(C)cc1O 1577887264 ZTWWOQZSHFSXAL-SNVBAGLBSA-N 256.777 2.442 10 20 CECD C[C@@H](CCCO)NCc1cc(Br)ccc1O 165848127 NAVZEDVYQNXICM-VIFPVBQESA-N 288.185 2.405 10 20 CECD CC[C@H](CN1CCOc2cc(N(C)C)ccc21)OC 842151147 AUXOIXGFRNYEIF-CYBMUJFWSA-N 264.369 2.376 10 20 CECD Nc1ccc(CC(=O)NCCCOC2CCCC2)cc1 238111766 RHFUGFIZSFZXLR-UHFFFAOYSA-N 276.380 2.277 10 20 CECD Cc1ccoc1CNCc1cc2c(cc1O)OCO2 291662250 FHDGRPDSPMDHOO-UHFFFAOYSA-N 261.277 2.312 10 20 CECD Nc1ccc(CC(=O)N[C@@H]2CCc3ccccc3C2)cc1 51630396 XWJYYAVNHNHJQG-QGZVFWFLSA-N 280.371 2.485 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cn(C)nc1C 113422555 DIQJXNMWMYXHNS-UHFFFAOYSA-N 287.363 2.487 10 20 CECD Cn1cccc1CNC(=S)NC1CCCCC1 231647868 KIRNOCOCSAKOKG-UHFFFAOYSA-N 251.399 2.322 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1n[nH]c2c1CCC2 126501078 SZBZJZSETZCDGC-UHFFFAOYSA-N 298.390 2.237 10 20 CECD CC1(C)CN(C(=O)c2cccc(O)c2O)CCS1 126565780 DGSKYRHMANZVLK-UHFFFAOYSA-N 267.350 2.065 10 20 CECD CC[C@H]1CCN(CC(=O)NCc2ccc(N(C)C)cc2)C1 125331127 QWFHPSWXGXJYEQ-AWEZNQCLSA-N 289.423 2.101 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cnc(S)[nH]1 186786633 RUDRMLKXZQOGOA-UHFFFAOYSA-N 290.392 2.037 10 20 CECD O=C1CN(Cc2c(O)cccc2Cl)[C@H]2CCCC[C@@H]2N1 123603349 YJKLWJILSXKQAQ-STQMWFEESA-N 294.782 2.289 10 20 CECD CCCN1CCCN(Cc2cc(Cl)ccc2O)CC1=O 189206920 KGDSRGUJVILJDQ-UHFFFAOYSA-N 296.798 2.490 10 20 CECD CC1(C)[C@H]2CN(C(=O)/C=C/c3ccc(O)c(O)c3)C[C@H]21 181126315 OEBPKEIMIKSXCQ-FVSXHXCTSA-N 273.332 2.225 10 20 CECD COc1cccc(CNCC2(OC)CCC2)c1O 181082657 XNTYDVCDFOVIEA-UHFFFAOYSA-N 251.326 2.060 10 20 CECD CCN(C)c1ccc([C@@H](C)NC2CN(C(=O)OC)C2)cc1 181473645 IDFWGFNPSMOEJA-GFCCVEGCSA-N 291.395 2.244 10 20 CECD C[C@@H](CCO)CNCc1cccc(Br)c1O 85126113 NENOQYVYXOKUGY-VIFPVBQESA-N 288.185 2.263 10 20 CECD COc1cccc(CNC[C@@](C)(O)c2ccccc2)c1O 265182773 WXUFQLWQQBAYCJ-QGZVFWFLSA-N 287.359 2.398 10 20 CECD CC[C@@H](NCc1cccc(C)c1O)[C@@H](O)C(F)(F)F 271767600 ATHKFBSDFUCPKD-ZYHUDNBSSA-N 277.286 2.492 10 20 CECD CN(C)c1ccc(CN2C[C@H](O)C(C)(C)C2)cc1F 280464116 MQENVMSYYOVHOJ-AWEZNQCLSA-N 266.360 2.094 10 20 CECD CC(C)S(=O)(=O)CCCOc1ccc(N(C)C)cc1 289384106 LPKJTNIVDRHMJQ-UHFFFAOYSA-N 285.409 2.345 10 20 CECD COC(=O)c1coc(CNCc2cccc(OC)c2O)c1 289409380 HPGJDXJGHFIQAW-UHFFFAOYSA-N 291.303 2.070 10 20 CECD Cc1cnc(C(=O)NCc2ccc(N(C)C)c(F)c2)o1 291680866 DPSUGYVLMLEBOY-UHFFFAOYSA-N 277.299 2.118 10 20 CECD Cc1cc(CN(CCO)Cc2cccnc2)ccc1N(C)C 292835292 PDQSEZSEZNMXGL-UHFFFAOYSA-N 299.418 2.451 10 20 CECD Oc1c(Cl)cccc1CN1CCC[C@H](O)CC1 294098041 RXZWRWNDGBMVAV-NSHDSACASA-N 255.745 2.392 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C[C@@](C)(O)C1CC1 819761280 OKXZQFVFMFPUSF-MRXNPFEDSA-N 298.379 2.045 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2nc(C)oc2C)c1 815835323 PKNBPGXSUSMJBC-MRVPVSSYSA-N 290.319 2.497 10 20 CECD N[C@@H]1CCCC[C@H]1NCc1cccc(Cl)c1O 818431323 JFOMLJLDJAQPFM-VXGBXAGGSA-N 254.761 2.405 10 20 CECD CC(C)OCCCC(=O)NCCc1ccc(N)cc1 818545033 BRDMDCQWPJBNOQ-UHFFFAOYSA-N 264.369 2.133 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCCCNC(C)C)c1 817954281 WZHBNZARHRYDIX-LBPRGKRZSA-N 294.395 2.218 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@@H](C)c1ccc(N(C)C)cc1 724869888 BIAFWDXGJQACBO-APHBMKBZSA-N 278.396 2.207 10 20 CECD C[C@@H]1SCC[C@@H]1NC(=O)N(C)Cc1ccccc1O 828532185 SKVUJJRKNAPDAA-JQWIXIFHSA-N 280.393 2.428 10 20 CECD CN(C)c1ccc(/C=C\CNCC(C)(C)C(=O)O)cc1 901507525 XTGVEYJFDOBZFT-WAYWQWQTSA-N 276.380 2.466 10 20 CECD O=C(c1cccc2c1CCNC2)N1CCNc2ccccc21 662779534 KTOGLOQROPTMDM-UHFFFAOYSA-N 293.370 2.405 10 20 CECD Cc1cc(O)c(CN[C@@H]2C[C@H]3CCCCN3C2=O)cc1C 835073100 KYJJEDBYRVMRGV-HUUCEWRRSA-N 288.391 2.252 10 20 CECD CO[C@@H]1CCOC[C@H]1N[C@@H](C)c1cc(F)cc(F)c1O 903299226 IESWDJSLEGDDKJ-ZEGGKSINSA-N 287.306 2.125 10 20 CECD CC(=O)c1cc(F)cc(CN[C@H](C)c2csnn2)c1O 839661811 GMOOJCZUWKQPKX-SSDOTTSWSA-N 295.339 2.436 10 20 CECD Cc1cc(C(=O)N2CC[C@@H](O)[C@H]2C)c(C)n1-c1ccccn1 837014001 ZFSNRDIVGGSAAY-UKRRQHHQSA-N 299.374 2.084 10 20 CECD Cc1ccc([C@H](C)NC[C@H]2CCCN2CCCO)c(O)c1 834850405 LXWZMWNTEXMLOG-LSDHHAIUSA-N 292.423 2.198 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCCc1cccc(O)c1 588408332 MCQSNWBKEKWHSK-ALCCZGGFSA-N 299.326 2.176 10 20 CECD Cc1cscc1NC(=O)C(=O)NCc1ccccc1O 748763371 YMKUXAGTKITJQC-UHFFFAOYSA-N 290.344 2.017 10 20 CECD CC(=O)Nc1ccccc1CNC(=O)c1cc(O)cs1 743656689 QFDVDOZYXOIZCJ-UHFFFAOYSA-N 290.344 2.342 10 20 CECD COc1cccc([C@@H](C)NC[C@H](O)c2ccco2)c1O 846139739 YNJWPJCJQUAHHA-PWSUYJOCSA-N 277.320 2.378 10 20 CECD C[C@@H]1Oc2ccccc2O[C@H]1C(=O)NCc1ccccc1O 748345271 BXVOBQABPFHSNU-MEDUHNTESA-N 299.326 2.237 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)NCC(C)(C)N 841950251 KURRUAFCLZUFFI-UHFFFAOYSA-N 293.411 2.441 10 20 CECD C[C@@H]1CC[C@H](CN(C)c2ccc(OCC(=O)O)cc2)O1 846280187 UNSLJZPOIPCHSX-BXUZGUMPSA-N 279.336 2.154 10 20 CECD CN(Cc1ccccc1O)C(=O)N[C@@H]1CCCC[C@@H]1CN 841950655 VEGZINYDABREPN-TZMCWYRMSA-N 291.395 2.051 10 20 CECD Cc1ccc(NC(=O)C(=O)NCc2ccccc2O)cc1C 748485102 CPGXLYHBMGVCCB-UHFFFAOYSA-N 298.342 2.264 10 20 CECD C[C@@H]1C[C@@H](NCc2ccc(N(C)C)cc2)c2ncnn21 850352496 YMLXRVPJZRPWOT-BXUZGUMPSA-N 271.368 2.140 10 20 CECD CN(C)c1ccnc(NC(=O)/C=C/c2ccc(O)c(O)c2)c1 753012857 BLEVMGULWQUGQN-GQCTYLIASA-N 299.330 2.211 10 20 CECD C[C@@H]1C[C@H](N[C@@H]2CCCN(C)C2=O)c2c(O)ccc(F)c21 756637192 HCXGVRWFIPUXGB-JLLWLGSASA-N 292.354 2.290 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1C[C@H](N)C1 852883848 PQOTYEBRPPXECJ-SHTZXODSSA-N 289.423 2.227 10 20 CECD CO[C@@]1(C)C[C@H]1NCc1ccc(N(C)C)c(F)c1 850409363 SCLSKLJRMPLOFK-KGLIPLIRSA-N 252.333 2.159 10 20 CECD CCCCN(C)Cc1cc2c(cc1O)OC[C@H]2O 768441769 MTCVSCDAKGBWEB-CYBMUJFWSA-N 251.326 2.050 10 20 CECD O=C(N[C@@H]1CCC[C@@H]2OCC[C@@H]21)c1cc(O)cs1 761607290 GYPXRDDAXZFKFD-MXWKQRLJSA-N 267.350 2.141 10 20 CECD CCN(C(=O)c1cc(O)cs1)C1CCN(C)CC1 861891373 ZJJBVNNAFSHLMH-UHFFFAOYSA-N 268.382 2.010 10 20 CECD Cc1ccc(CNC2CN(C(=O)OC(C)(C)C)C2)c(O)c1 877075116 IKHIAKFGSYBQNK-UHFFFAOYSA-N 292.379 2.410 10 20 CECD Cc1c[nH]cc1C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773740856 PSCLKZXHOLFRAB-SNVBAGLBSA-N 274.320 2.095 10 20 CECD CCCn1cc(CN[C@@H](C)c2cc(OC)ccc2O)nn1 877533706 QHROJEFNDSGEKR-NSHDSACASA-N 290.367 2.253 10 20 CECD CO[C@@H]1[C@@H](C)[C@@H](NC(=O)c2cc(O)cs2)C1(C)C 776249953 AKZGPEWOAFCPLM-WHGOUJPWSA-N 269.366 2.243 10 20 CECD CN(Cc1ccccc1O)C(=O)c1ccn(C(F)F)n1 775771738 BAEJAXYUNYHDCR-UHFFFAOYSA-N 281.262 2.256 10 20 CECD C[C@@H](NCC1([S@](C)=O)CCC1)c1c(O)cccc1F 886605614 VEXJVNARFXQISL-DGIBIBHMSA-N 285.384 2.483 10 20 CECD C[C@@H](N[C@H]1CCc2n[nH]cc2C1)c1c(O)cccc1F 886551052 ANEYMLQKXCWKKY-KOLCDFICSA-N 275.327 2.463 10 20 CECD CCOc1ccc(CN2C[C@@H](COC)O[C@H](C)C2)c(O)c1 784666885 CASHMWALOQFWDR-DOMZBBRYSA-N 295.379 2.027 10 20 CECD COc1cc(C)cc(CNCc2cccnc2O)c1O 895412495 XPAYEOUNZGKCSB-UHFFFAOYSA-N 274.320 2.100 10 20 CECD CC1=NO[C@@H](CNCc2cccc(Br)c2O)C1 895310876 KXAIXEPMSNWDRW-SNVBAGLBSA-N 299.168 2.409 10 20 CECD CCc1cccnc1C(=O)NCc1ccc(OC)cc1O 794372642 BRBGGRPLDAQVRV-UHFFFAOYSA-N 286.331 2.288 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@@H](O)C1CC1 790965253 AHRBRNXJKGJUMY-LLVKDONJSA-N 259.708 2.045 10 20 CECD CCc1occc1C(=O)NCc1cc(OC)ccc1O 797745177 XHTXUNNACBHWTR-UHFFFAOYSA-N 275.304 2.486 10 20 CECD COc1ccccc1C(=O)NCc1ccccc1O 133790008 RXJFSDXGGJTGFE-UHFFFAOYSA-N 257.289 2.331 10 20 CECD COc1ccc(CN[C@@H]2CCCN(C(C)=O)C2)cc1C 998336548 HIJPFQVXBORZIO-OAHLLOKOSA-N 276.380 2.104 10 20 CECD CN(Cc1ccc(Br)cc1O)CC(C)(C)N 691390153 YLFNVNBDRIVQMI-UHFFFAOYSA-N 287.201 2.324 10 20 CECD COc1ccc(O)c([C@H](C)NCC2(C)COC2)c1 94721663 SZSJVBQYBMCELT-JTQLQIEISA-N 251.326 2.088 10 20 CECD CCN(C)C(=O)[C@@H](C)N[C@H](C)c1ccc(C)cc1O 188468480 QZSUNYCROYJZSP-VXGBXAGGSA-N 264.369 2.218 10 20 CECD CC1(C)CC[C@@H](CO)N(C(=O)c2cc(O)cs2)C1 1336076413 UVXDOEROTVPUKG-VIFPVBQESA-N 269.366 2.077 10 20 CECD COC(=O)CN(Cc1ccc(N(C)C)cc1)CC(C)C 1343959483 ITTJUVLALRDQBS-UHFFFAOYSA-N 278.396 2.384 10 20 CECD Cc1ccc(C(=O)N[C@H](CC(=O)O)C(C)(C)C)c(O)c1O 1600338488 XQHUMVISXXGCMS-SNVBAGLBSA-N 295.335 2.025 10 20 CECD CC(C)N1CCC[C@H](C(=O)NCc2ccc(N)cc2)C1 1575701152 WRBZENCZUILURT-AWEZNQCLSA-N 275.396 2.005 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@@H](C)OC[C@@H]2C)c1O 218348581 HGGGFZFMYJEXCI-VHSXEESVSA-N 281.327 2.343 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](CC(=O)O)C2)cc1 1776855621 SLGZKLZKVMMJTM-CQSZACIVSA-N 276.380 2.439 10 20 CECD CN(C)c1ccc(CNC[C@H](CC(=O)O)C(F)F)cc1 1777040291 TXDWCRPIIBZGKH-NSHDSACASA-N 286.322 2.198 10 20 CECD COc1cccc(CN(C)CC2CCOCC2)c1O 156027355 IKHWCASRVCMWTP-UHFFFAOYSA-N 265.353 2.259 10 20 CECD CCc1nc(C(=O)NCc2ccc(N(C)C)c(F)c2)co1 155663073 DNOKOJRKEJGNNY-UHFFFAOYSA-N 291.326 2.372 10 20 CECD Cc1cc(C(=O)N2CCC[C@@H]2CO)c(C)n1-c1ccccn1 154082076 APMKDMCQECNQBH-CQSZACIVSA-N 299.374 2.086 10 20 CECD COc1ccc(CNCc2cc(F)ccc2O)cn1 226584073 DRXUTXVTHCDZCT-UHFFFAOYSA-N 262.284 2.225 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCSCC2)c1 230661627 ZKOJGQVFYWJKMJ-ZDUSSCGKSA-N 280.437 2.400 10 20 CECD CO[C@@]1(CN[C@@H](C)c2ccc(N(C)C)cc2)CCOC1 123250890 PJNYLAHZQKRMEX-XJKSGUPXSA-N 278.396 2.209 10 20 CECD COc1ccc(O)c(CNCC2(CO)CCCCC2)c1 158137193 LMKNIYQPPQWZNA-UHFFFAOYSA-N 279.380 2.433 10 20 CECD COC(=O)[C@@H](CC(C)C)NCc1cccc(F)c1O 158701341 HSKIRHLPWOHTDC-GFCCVEGCSA-N 269.316 2.209 10 20 CECD Cn1ncc2c1CCC[C@H]2NCc1ccccc1O 37087264 WASPSMPNILFIPT-CYBMUJFWSA-N 257.337 2.293 10 20 CECD COc1ccc(O)c(CNCC2(OC)CCCC2)c1 276732379 DWOKBIITCLNEMV-UHFFFAOYSA-N 265.353 2.450 10 20 CECD CCN1C[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 391552897 UUYHGPAROUKKCV-JSGCOSHPSA-N 275.396 2.024 10 20 CECD CN(Cc1ccccc1O)[C@H](C(N)=O)c1ccccc1 109770585 VNQUJVKGSGUZQP-HNNXBMFYSA-N 270.332 2.051 10 20 CECD Oc1ccc(Br)cc1CNCCN1CCCC1 227434925 IDGUEEWNNGUDSE-UHFFFAOYSA-N 299.212 2.340 10 20 CECD C[C@H](N)CN(C)Cc1cc(Cl)cc(Cl)c1O 309406987 IDYHLDCCTXOICK-ZETCQYMHSA-N 263.168 2.478 10 20 CECD COc1cccc(CN[C@H]2c3ccccc3C[C@@H]2O)c1O 119184664 FVBIZQRCYTVAHD-HOCLYGCPSA-N 285.343 2.149 10 20 CECD O=C(C[C@@H]1C=CCCC1)NCc1ccc(O)c(O)c1 186898124 FHSRWYYNENNUKB-LLVKDONJSA-N 261.321 2.460 10 20 CECD CNC(=O)c1ccc(CNCc2cc(C)ccc2O)cc1 71406298 HQJBEMNFNAAFRI-UHFFFAOYSA-N 284.359 2.350 10 20 CECD COCCOCCCNCc1ccc(N2CCCC2)cc1 37237453 USEBCKWZENYDDH-UHFFFAOYSA-N 292.423 2.430 10 20 CECD O=C(NCCCSc1nccs1)C1CCOCC1 78713498 VLIUTSXLXBLTCB-UHFFFAOYSA-N 286.422 2.168 10 20 CECD COc1ccc(O)c(CN(CC(=O)O)C2CCCC2)c1 86749482 QXLSRKHOICLJIK-UHFFFAOYSA-N 279.336 2.230 10 20 CECD O=C(O)CN(Cc1cc(Cl)ccc1O)CC1CC1 86734140 QMBOWDRJRDKCIL-UHFFFAOYSA-N 269.728 2.342 10 20 CECD CCOC(=O)CN(CC)Cc1cc(Cl)ccc1O 92399540 MASFAZHLLQHYFV-UHFFFAOYSA-N 271.744 2.431 10 20 CECD COc1ccc(O)c(CNCCc2scnc2C)c1 295104201 VHMONJGKCGLSOQ-UHFFFAOYSA-N 278.377 2.498 10 20 CECD C[C@H](O)CCCN[C@H](C)c1ccc(N2CCOCC2)cc1 278876903 SFRBBHOMJYDPDM-LSDHHAIUSA-N 292.423 2.335 10 20 CECD COc1cccc(CN(C)C[C@@H]2CCCC[C@H]2O)c1O 272632783 NILHDQHRPQYXIJ-GXTWGEPZSA-N 279.380 2.384 10 20 CECD Oc1cc2c(cc1CN1CC[C@@H](C3CC3)C1)OCO2 371259745 VBFYPFFOGBAOSH-LLVKDONJSA-N 261.321 2.353 10 20 CECD CCc1oc(/C=C2\SC(=S)NC2=O)cc1C(=O)OC 800790193 FVHGWDAXNVQMER-UITAMQMPSA-N 297.357 2.117 10 20 CECD CO[C@H](C)CN(C)C(=O)N[C@H](C)c1ccc(N(C)C)cc1 805310502 YIOMVUROCMQSCL-CHWSQXEVSA-N 293.411 2.490 10 20 CECD CC[C@H](CNC(=O)N(C)Cc1ccc(N(C)C)cc1)OC 290906705 IJNWFQONJPRIBU-OAHLLOKOSA-N 293.411 2.319 10 20 CECD C[C@@H]1CC[C@@H](CNCc2ccc(N3CCOCC3)cc2)O1 398093072 STZMSSKAQBVMHY-PBHICJAKSA-N 290.407 2.180 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)OC[C@@H]2CCCO2)c1 805011556 LKCZQRNOELPTCT-JQWIXIFHSA-N 295.335 2.367 10 20 CECD Cc1ccc(C(=O)N2CCC[C@H](CCO)CC2)c(O)c1O 817698221 RUQGBXDGBYRYMN-LBPRGKRZSA-N 293.363 2.031 10 20 CECD CN(C)CCCCC(=O)N(C)Cc1ccc(N(C)C)cc1 729281965 IAKYWBCBGRAFOR-UHFFFAOYSA-N 291.439 2.443 10 20 CECD C[C@]1(C(=O)NCc2ccc(O)c(O)c2)CC=CCC1 827317087 OBXGCBRDGZHBIB-HNNXBMFYSA-N 261.321 2.460 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NCc1ccsc1 588403351 FSJGFHHRIMIUAX-RQOWECAXSA-N 275.329 2.489 10 20 CECD CC[C@H](O)[C@@H](C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 907494273 XTENROXURWXWLK-XUJVJEKNSA-N 278.396 2.337 10 20 CECD Cc1cc(O)c(CNCCN2CCOC[C@@H]2C)cc1Cl 825425998 SGOHJAPRTUGSAF-LBPRGKRZSA-N 298.814 2.164 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@@H](C)[C@H](C)N)cc1 826020702 WYQXXMWUWIGVKB-KBPBESRZSA-N 291.439 2.475 10 20 CECD COC(=O)[C@@H]1C[C@H]2CC[C@H]1N(Cc1cc(C)ccc1O)C2 839173408 VTJMFDHBMNDXEX-BPLDGKMQSA-N 289.375 2.474 10 20 CECD Nc1ccc(CC(=O)N2CC[C@H](C3CCOCC3)C2)cc1 831452618 QPZHZWUYXYDIHT-HNNXBMFYSA-N 288.391 2.086 10 20 CECD COC[C@@](C)(CC(=O)O)NCc1ccc(N(C)C)cc1C 901792573 DKSOUOPKRZYWRJ-MRXNPFEDSA-N 294.395 2.030 10 20 CECD COCCN(C(=O)/C=C\c1cnn(C)c1)c1ccccc1 836968058 LGNRXFAGLZEWHN-HJWRWDBZSA-N 285.347 2.113 10 20 CECD CC[C@H]1CN([C@H](CC)C(=O)Nc2ccc(N)cc2)CCO1 911660663 MODSIXCEWUJTQW-LSDHHAIUSA-N 291.395 2.097 10 20 CECD CO[C@H]1CCC[C@@H]1CNC(=O)Nc1ccc(N)cc1 841295620 CSMRETHOACJJSY-MFKMUULPSA-N 263.341 2.205 10 20 CECD CC1(S(=O)(=O)NCc2cc(Cl)ccc2O)CC1 845996720 SEIBUKBQJULLEQ-UHFFFAOYSA-N 275.757 2.018 10 20 CECD COc1cccc([C@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)c1O 846155311 POAVJCKMXBKUEY-NWDGAFQWSA-N 292.379 2.061 10 20 CECD COc1ccc2c(c1)CCCN2Cc1cnsn1 846771721 LQYBSQURCYQOPO-UHFFFAOYSA-N 261.350 2.500 10 20 CECD CCc1cccc(CN[C@@H]2CCc3c[nH]nc3C2)c1O 848897989 NYLWPDGNHKPXOQ-CQSZACIVSA-N 271.364 2.325 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@@]3(N)C2)cc1 857230143 ODJANBKOLXDTOA-GOEBONIOSA-N 259.397 2.066 10 20 CECD COc1cc(CN2CCOc3cc(N(C)C)ccc32)on1 851880691 FRRCSHRFCFFVAM-UHFFFAOYSA-N 289.335 2.148 10 20 CECD CCOCCOCCNCc1ccc(N(C)C)c(F)c1 922941007 KINRUWCYCHFAMP-UHFFFAOYSA-N 284.375 2.034 10 20 CECD C[C@H](N[C@H](C)CC[S@](C)=O)c1cc(F)cc(F)c1O 756742356 KYKKMGDOHDIDQU-MGOSUKFUSA-N 291.363 2.478 10 20 CECD COC[C@](C)(O)CN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 756577225 QWVCETGBTNQRQR-CCUNJIBTSA-N 283.343 2.067 10 20 CECD CCC(O)(CC)CN(C)C(=O)c1cc(O)cs1 863620870 RGMXGYXWAUBUCN-UHFFFAOYSA-N 257.355 2.077 10 20 CECD Cc1cc(CNC(=O)[C@@H](O)C2CC2)c(C)n1-c1ccccc1 863164149 CMTDLCCDLCQRCX-KRWDZBQOSA-N 298.386 2.481 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1nccn1CC 935946108 XZJPGGRJMJYUJI-UHFFFAOYSA-N 294.351 2.024 10 20 CECD C[C@H]1C[C@@H](C)CN1Cc1cc2c(cc1O)OC[C@H]2O 768449530 ZYNGKLINLGQFKY-ISTVAULSSA-N 263.337 2.048 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1CSC1 865027017 FDXMTTCZDXRSIJ-UHFFFAOYSA-N 278.421 2.464 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCC[C@@H](N)C1)c1ccccc1O 870988368 NUCWETRAOAJEPM-IJLUTSLNSA-N 262.353 2.087 10 20 CECD C[C@@H](NC(=O)CC(C)(C)C(=O)O)c1ccc(N(C)C)cc1 773897922 KKMSWXXTZNCCMJ-LLVKDONJSA-N 292.379 2.431 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)N[C@H](C)C[C@H](C)O 783229866 KMOXVRVYKGJJSE-OLZOCXBDSA-N 293.411 2.020 10 20 CECD COc1cc(C)cc(CN2CCN(C)[C@@H](C)[C@@H]2C)c1O 894487114 GJFZIOOOYHZVDU-STQMWFEESA-N 278.396 2.234 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)[C@H](C)CN1C 894482279 BJVQHGVLABQZIC-VHSXEESVSA-N 270.323 2.195 10 20 CECD C[C@H](N[C@H](C)CN1CCCC1=O)c1cc(F)ccc1O 94617706 JWQITPJMKIVZKH-MNOVXSKESA-N 280.343 2.193 10 20 CECD CCCN(C)c1nnc(-c2sccc2O)n1C 1339457951 PHVMHAKMMBCZLD-UHFFFAOYSA-N 252.343 2.095 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccnnc1 1344566556 GDQRJTADRQSXAN-UHFFFAOYSA-N 285.351 2.173 10 20 CECD COc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccncc2)c(O)c1 1296968462 OBOITQOPKTYTRX-LSDHHAIUSA-N 298.342 2.216 10 20 CECD CC[C@H](O)CCCN[C@@H](C)c1cc(C(=O)O)ccc1O 1605111941 SPYBFQDYIIJWRY-JQWIXIFHSA-N 281.352 2.292 10 20 CECD C[C@H](NC[C@@H]1CCOC[C@H]1C)c1cc(C(=O)O)ccc1O 1604337654 HZOBFGBPFVFTOU-MDZLAQPJSA-N 293.363 2.414 10 20 CECD CCc1cc(CN[C@H](C)c2cc(C(=O)O)ccc2O)n[nH]1 1597478772 VCMSDYQOHHHPSU-SECBINFHSA-N 289.335 2.227 10 20 CECD CC(C)c1ccc(O)c(CN2CC(C)(C(=O)O)C2)c1 1591974427 WQPBULNWFDABEN-UHFFFAOYSA-N 263.337 2.422 10 20 CECD CN(C)c1ccc2c(c1)CN(CCCC(=O)O)CCC2 1777041267 WRWBXQAGEXKEMQ-UHFFFAOYSA-N 276.380 2.366 10 20 CECD CC[C@@H](NCCS(=O)(=O)C1CC1)c1ccccc1O 840882670 JPOCTGLWGLZKHG-CYBMUJFWSA-N 283.393 2.010 10 20 CECD COc1cc(Cl)cc(CN[C@H](C)CCN(C)C)c1O 228672853 IIVWCVGAGWYJPM-SNVBAGLBSA-N 286.803 2.484 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)c2ncn(C)n2)c1 275726731 OLTQNXVOBFZMKX-MNOVXSKESA-N 260.341 2.241 10 20 CECD CN1CCC[C@@H](CNCc2ccc(N(C)C)cc2)C1 44535801 SKVOFSQEJFTLLW-HNNXBMFYSA-N 261.413 2.184 10 20 CECD CC[C@@H](NCC1([S@](C)=O)CC1)c1ccccc1O 282504008 YIXAUYMSDLWTMN-XIKOKIGWSA-N 267.394 2.344 10 20 CECD COc1ccc(O)c([C@@H](C)NCCSCCCO)c1 185378746 YAVLNVBOAWATMH-LLVKDONJSA-N 285.409 2.167 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H]1CCCOC1 708557840 CHIWZAOVUOUDMS-SECBINFHSA-N 257.280 2.187 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC2CCOCC2)c1 117413678 KKWPMDINLGAYPC-LLVKDONJSA-N 293.363 2.395 10 20 CECD COc1ccc(O)c(CNc2ncncc2Cl)c1 302625452 IAOKCAZMDOAQNQ-UHFFFAOYSA-N 265.700 2.456 10 20 CECD C[C@H](NCC(F)(F)CO)c1ccc(N(C)C)cc1 184691039 VESFMYXIBNZSGO-JTQLQIEISA-N 258.312 2.031 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC2(CS(C)(=O)=O)CC2)c1 186089719 REFKCOPUMYSDEY-GFCCVEGCSA-N 297.420 2.176 10 20 CECD CC(C)N1CCC(N(C)C(=O)Cc2ccc(N)cc2)CC1 37804603 JZDGBHHEZPOWNZ-UHFFFAOYSA-N 289.423 2.143 10 20 CECD Cc1ccc(O)c(CN(C)[C@@H]2CCN(C)C[C@H]2C)c1 290364731 HBPSFSKQBPYTCX-UKRRQHHQSA-N 262.397 2.473 10 20 CECD Oc1ccccc1CN1CCCN(CC(F)(F)F)CC1 179556652 FUZGAKUYKLEFFZ-UHFFFAOYSA-N 288.313 2.462 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H](C)C(=O)NC(C)C)c1 228945965 ILJWXMDBLOGXHB-RYUDHWBXSA-N 264.369 2.264 10 20 CECD CC(C)[C@H]1C(=O)NCCN1Cc1cc(Cl)ccc1O 93054934 BZBAJBQIPMGKGL-ZDUSSCGKSA-N 282.771 2.002 10 20 CECD CCCN(CCC)CCCNC(=O)Cc1ccc(N)cc1 236991539 QZEIOUZMQGTGSV-UHFFFAOYSA-N 291.439 2.440 10 20 CECD COC[C@H](CCO)N[C@H](C)c1cc(Cl)ccc1O 273561422 IHHXLFPNGYJTGG-KOLCDFICSA-N 273.760 2.094 10 20 CECD Cc1ccc(O)c(CN(C)CCCN(C)CCN(C)C)c1 289375647 BHTBDVSOHRDPGM-UHFFFAOYSA-N 293.455 2.016 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](CO)C2CCCC2)c1O 289500566 KUYVWNWYNARSOO-HNNXBMFYSA-N 295.354 2.375 10 20 CECD CCOc1ccc(CN(C)[C@H](CO)COC(C)C)c(O)c1 809768449 LGUDDADGIPKZMQ-CQSZACIVSA-N 297.395 2.009 10 20 CECD CN1C(=O)/C(=C/c2cn(C)nc2C(F)F)SC1=S 291544243 MLUFBSSRAFKIDK-UTCJRWHESA-N 289.332 2.189 10 20 CECD Cc1nnsc1CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 293730196 QACDFVVSUQTOFC-SSDOTTSWSA-N 294.336 2.311 10 20 CECD COc1c([N+](=O)[O-])ccc(CN2CCC[C@H]2CF)c1O 293864891 CGEXWZOZBSVZQV-JTQLQIEISA-N 284.287 2.243 10 20 CECD CO[C@H](C)CN(C)C(=O)N[C@@H](C)c1ccc(N(C)C)cc1 805310503 YIOMVUROCMQSCL-OLZOCXBDSA-N 293.411 2.490 10 20 CECD COc1ccc(O)c(CNCc2nccc(C(F)F)n2)c1 290234045 TWKPVIHQSBZJJM-UHFFFAOYSA-N 295.289 2.418 10 20 CECD N#Cc1cc(F)c(C(=O)NCc2ccccc2O)c(F)c1 393286982 CZPTVNXXWVXVIT-UHFFFAOYSA-N 288.253 2.472 10 20 CECD C[C@H](N[C@@H]1CCC[C@@H](N)C1)c1ccc(F)cc1O 817970508 XTVNDIYGVURCKF-MVWJERBFSA-N 252.333 2.452 10 20 CECD CN(Cc1ccccc1O)C(=O)c1c(F)ccnc1F 816889413 XHSPGLZZVISITB-UHFFFAOYSA-N 278.258 2.338 10 20 CECD CCN(C)c1ccc(CN2CC[C@H](C(=O)N(C)C)C2)cc1 839635345 HISQOGRCGMZUEX-HNNXBMFYSA-N 289.423 2.053 10 20 CECD O=C(O)C1CN(Cc2ccc(N3CCCCC3)cc2)C1 840998896 CKDLHPTXXOQSCZ-UHFFFAOYSA-N 274.364 2.193 10 20 CECD CCN(C)c1ccc(CN(C[C@@H](C)O)C2CC2)cc1 847104678 JEOOQZOPZIGLEZ-CYBMUJFWSA-N 262.397 2.488 10 20 CECD O=C(Nc1cnn(-c2ccccn2)c1)c1cc(O)cs1 740141919 ACIOIIDXVWDZDM-UHFFFAOYSA-N 286.316 2.287 10 20 CECD Oc1c(Cl)cc(Cl)cc1CN[C@H]1CCNC1 841044623 FSWWMIVXBYNODF-VIFPVBQESA-N 261.152 2.151 10 20 CECD CN(C)c1ccc(CNC(=O)OCCCF)cc1 841476271 SYXQVGIGKDEVGO-UHFFFAOYSA-N 254.305 2.338 10 20 CECD COc1cccc([C@H](C)NCCOCC(F)F)c1O 846163956 CTPSCISEWXSBCZ-VIFPVBQESA-N 275.295 2.333 10 20 CECD O[C@]1(CCNCc2ccc3c(c2)CCCO3)CCCOC1 922219858 MLGBTBNALJAGKA-KRWDZBQOSA-N 291.391 2.033 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)CN(C)C(C)C)c1 858467814 UOKGNCLNJHUAMH-ZDUSSCGKSA-N 293.411 2.229 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@H]2C[C@@H](OC(C)C)C2)c1 858532328 MGQGBBKYVWNLNT-OKILXGFUSA-N 292.379 2.456 10 20 CECD CCOc1ccc(CN2CC[C@H](C)[S@@](=O)CC2)c(O)c1 763489598 WGYGJDZCQCTKPD-YUNKPMOVSA-N 297.420 2.134 10 20 CECD CCN(C)C[C@H]1CCN(Cc2ccc(C)cc2O)C1 876779669 BHXWTMAAIABPJU-CQSZACIVSA-N 262.397 2.474 10 20 CECD Cc1cccc(O)c1CNCc1ncnn1C(C)(C)C 877501596 RMUBUKBIFVUWMG-UHFFFAOYSA-N 274.368 2.337 10 20 CECD Cc1ccc2c(c1)N[C@@H](c1cccc(O)c1O)NC2=O 877864526 QFWNDBIEJQMURO-CQSZACIVSA-N 270.288 2.260 10 20 CECD CC(C)c1nsc(NC(=O)c2cccc(O)c2O)n1 874694550 SWNXDKGDJUOMAZ-UHFFFAOYSA-N 279.321 2.325 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@@H]2CCCC[C@@H]2N)c1 1118269364 DLKNCTRPRPKJMR-SUHUHFCYSA-N 292.379 2.096 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)CCCO 779066237 UKVSUKYAAJLFRY-ZDUSSCGKSA-N 250.386 2.312 10 20 CECD C[C@@H](CNCc1cc(F)cc(F)c1O)Cn1cccn1 882905921 ZMDRLZZHMHSMBP-JTQLQIEISA-N 281.306 2.293 10 20 CECD C[C@H](Nc1nccnc1CN)c1ccc(N(C)C)cc1 1120919259 QGRDHRDYFPEVON-NSHDSACASA-N 271.368 2.174 10 20 CECD C[C@H]1SCC[C@@H]1NCc1cc([N+](=O)[O-])ccc1O 783612311 YRKPGXFXURLODD-KCJUWKMLSA-N 268.338 2.284 10 20 CECD COc1ccc(CNC[C@@H]2CC[C@@H](C)O2)c(O)c1OC 894817471 QUTWODGHTLYCHW-PWSUYJOCSA-N 281.352 2.067 10 20 CECD Oc1c(F)cc(F)cc1CN1CCCC[C@@H]1C1OCCO1 893994717 NMYACRZKYDQHMH-CYBMUJFWSA-N 299.317 2.398 10 20 CECD CCOc1ccc(CN2CC[C@@H](C(=O)OC)[C@H]2C)c(O)c1 787420840 KYLZOKDNDKSCTL-BXUZGUMPSA-N 293.363 2.174 10 20 CECD CCC[C@H](CCO)NCc1cc(C)cc(OC)c1O 895418359 NBVFGWVIUVEHCO-CYBMUJFWSA-N 267.369 2.350 10 20 CECD O=C(OCCCC1CCOCC1)c1cccc(O)c1O 790664324 DHDQQIYXHILXLU-UHFFFAOYSA-N 280.320 2.461 10 20 CECD O=C(Nc1ccc(F)cc1O)c1cccc(O)c1O 790890170 GBKLSQMCTMNBSX-UHFFFAOYSA-N 263.224 2.195 10 20 CECD CN(C)Cc1ccc(NC(=O)c2cccc(O)c2O)cc1 790516883 ZCBIGBVBPNLBHQ-UHFFFAOYSA-N 286.331 2.412 10 20 CECD COc1ccccc1CC(=O)NCc1ccccc1O 133795763 JMQRNKQVSVYJDH-UHFFFAOYSA-N 271.316 2.260 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)[C@H]1CCCNC1 699664738 JUGKGWGWIPXFFV-ZFWWWQNUSA-N 261.413 2.230 10 20 CECD CC1CC(NCc2ccc(N3CCN(C)CC3)cc2)C1 1331518882 GFTYNKDCHXOVNV-UHFFFAOYSA-N 273.424 2.327 10 20 CECD COc1ccc(O)c(NC(=O)c2cccc(O)c2O)c1 790882947 TUVKWBUCKWHXDG-UHFFFAOYSA-N 275.260 2.064 10 20 CECD C[C@H](CC(=O)NCc1ccc(N)cc1)c1ccncc1 1341923598 MQMYHYZHBZJTJL-GFCCVEGCSA-N 269.348 2.474 10 20 CECD NC1(CNC(=O)NCc2cc(Cl)ccc2O)CCCC1 1580149686 ZAULZDKVIOFNOY-UHFFFAOYSA-N 297.786 2.116 10 20 CECD COc1ccc(O)c([C@H](C)NCCCn2ccnc2)c1 20506222 RBELSKAVXFANMF-LBPRGKRZSA-N 275.352 2.338 10 20 CECD O[C@H](CNCc1ccc2c(c1)CCCO2)C1CCC1 922167790 FQEAUBRFLRFPPS-OAHLLOKOSA-N 261.365 2.262 10 20 CECD COc1cccc(CN[C@H]2CCN3CCC[C@@H]3C2)c1O 112017188 CUVLSCBCTBJFPJ-UONOGXRCSA-N 276.380 2.117 10 20 CECD O=C(c1cccc(O)c1O)N(CC1CC1)CC1CC1 126431606 XNZDULWCORRSBH-UHFFFAOYSA-N 261.321 2.360 10 20 CECD CN(Cc1ccccc1O)C(=O)CC[C@@H]1CCCO1 77258392 BMOKPFLBWXSSRY-ZDUSSCGKSA-N 263.337 2.310 10 20 CECD CC1(C)CN(Cc2c(O)cccc2Cl)CCN1 396123749 VCSMSGPLEUPFDB-UHFFFAOYSA-N 254.761 2.229 10 20 CECD COc1cccc(CN2CCCOC[C@H]2C)c1O 398932019 PGUDWCHXYUYXPG-LLVKDONJSA-N 251.326 2.012 10 20 CECD C[C@H]1C[C@@H](C(=O)O)CN(Cc2ccc(N(C)C)cc2)C1 399026582 WQOCUBOUZKYWFU-GXTWGEPZSA-N 276.380 2.295 10 20 CECD CC[C@@H](C)N(C)CCNC(=O)N(C)Cc1ccccc1O 171077333 YTQORZORULDCFD-CYBMUJFWSA-N 293.411 2.264 10 20 CECD O=C1CN(Cc2cccc(Cl)c2O)[C@H]2CCCC[C@H]2N1 179921996 KRHPVMARWYUDDK-OLZOCXBDSA-N 294.782 2.289 10 20 CECD COc1ccc(O)c(CNC(=O)CC[C@@H]2CCCCO2)c1 114540797 GGUIKPORQBVEOD-ZDUSSCGKSA-N 293.363 2.366 10 20 CECD Oc1cc2c(cc1CNCCC(F)(F)F)OCO2 63099751 GTIYUVSEJIQHBF-UHFFFAOYSA-N 263.215 2.163 10 20 CECD CN(C)c1ccc(CNC(=O)CC2(O)CCCC2)cc1F 304274979 XLXJVIOJUXRYPN-UHFFFAOYSA-N 294.370 2.203 10 20 CECD CCOC(=O)[C@H]1CCCN1Cc1ccc(N(C)C)cc1 180769720 FRCMNWFDFNTJKD-OAHLLOKOSA-N 276.380 2.280 10 20 CECD CCN1CCN([C@H](C)CN[C@@H](C)c2ccccc2O)CC1 183418357 AWOMZALDZQTHDF-CABCVRRESA-N 291.439 2.069 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)NC(=O)c1ccoc1 183446179 RVYALEZQNWQHEH-SECBINFHSA-N 261.277 2.052 10 20 CECD Oc1ccc(F)cc1CNCCc1cn2c(n1)SCC2 274417200 NMEJLFWKUWVPAO-UHFFFAOYSA-N 293.367 2.166 10 20 CECD Cc1ccc(O)c([C@H](C)NCC2(C(N)=O)CCCC2)c1 273603129 SJOAVRSLWDPHGQ-LBPRGKRZSA-N 276.380 2.397 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CN(C)C 298682500 CPRDGPDTAPCMHS-UHFFFAOYSA-N 277.412 2.051 10 20 CECD C[C@@H](CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O)CN(C)C 293604086 IYYJJECKPPCFQC-QWRGUYRKSA-N 281.356 2.149 10 20 CECD Cn1nc(C(C)(C)C)cc1C(=O)NCc1ccccc1O 299604055 WAWZPMYDGIOTGE-UHFFFAOYSA-N 287.363 2.353 10 20 CECD CC[C@H](C)[C@@H](CNCc1cc([N+](=O)[O-])ccc1O)OC 294919780 YOKKWHVIWIFQDD-IINYFYTJSA-N 282.340 2.451 10 20 CECD C[C@@H](C[S@@](C)=O)NCc1ccc2ccccc2c1O 816568053 VDBVPBNUKLQHIZ-JEOXALJRSA-N 277.389 2.402 10 20 CECD COc1ccc(O)c(CNC(=O)[C@H]2CCCSC2)c1 810403995 AFQUDJNVFXNATF-JTQLQIEISA-N 281.377 2.160 10 20 CECD COC(=O)c1cnc(SC[C@H]2CC3(CC3)C(=O)O2)s1 829677724 JIWXPKCIVUREAP-SSDOTTSWSA-N 299.373 2.118 10 20 CECD CCCONC(=O)N[C@H](C)c1ccc(N(C)C)cc1 828313693 WNMGOGXNWVGXFM-LLVKDONJSA-N 265.357 2.454 10 20 CECD CN(C)c1ccc(/C=C\CN[C@H](CC(F)F)C(=O)O)cc1 901811772 HKEBFYOLRDTGIX-DHCBQETCSA-N 298.333 2.464 10 20 CECD CC[C@H](NC(=O)N[C@H](C)c1ccc(N(C)C)cc1)[C@@H](C)O 838560008 SDZYIBXIPSWZFM-JMSVASOKSA-N 293.411 2.272 10 20 CECD CCC[C@@H](O)CC(=O)N1CCOc2cc(N(C)C)ccc21 676759151 ZACOYGKBGURNHQ-CYBMUJFWSA-N 292.379 2.029 10 20 CECD C[C@@H](N[C@@H](CO)CCF)c1ccc(N(C)C)cc1 846208774 KZGRNKOEEXXRGW-DGCLKSJQSA-N 254.349 2.124 10 20 CECD C[C@H](C(=O)O)N(C)C/C=C/c1ccc(N(C)C)cc1 840995698 LHJIIKVXUKVXFU-BTDICHCPSA-N 262.353 2.171 10 20 CECD CC[C@H](NC(=O)NCCc1ccc(N)cc1)[C@@H]1CCCO1 841865397 RJGCSWZIJQNDSY-GJZGRUSLSA-N 291.395 2.068 10 20 CECD O=C(C[C@H]1CCCOC1)NCc1cc(Cl)ccc1O 846474254 SQKNSALOAKRJDD-SNVBAGLBSA-N 283.755 2.479 10 20 CECD COc1cccc([C@@H](C)NCc2c[nH]nc2C)c1O 846154788 MZVSWLHJCXSQEP-SNVBAGLBSA-N 261.325 2.283 10 20 CECD COCC[C@@H](CO)N[C@@H](C)c1ccc(Cl)cc1O 841751640 IIZZJGHCFJJQLO-ONGXEEELSA-N 273.760 2.094 10 20 CECD Cc1noc(C)c1[C@@H](C)C(=O)NCc1ccc(O)cc1O 910953490 BYENXGUKXQRPPR-MRVPVSSYSA-N 290.319 2.123 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@@H](N)[C@H]3C2)cc1F 843059941 VQTPVOWWXPWHGM-OFQRWUPVSA-N 291.414 2.451 10 20 CECD COc1cccc([C@@H](C)NCCC(C)(C)CO)c1O 846171090 RINTVTRIVPERAA-LLVKDONJSA-N 267.369 2.460 10 20 CECD CO[C@](C)(C1CC1)[C@H](C)NC(=O)NCc1ccccc1O 840276396 JNUMPOWESPUYHQ-ZBEGNZNMSA-N 292.379 2.395 10 20 CECD C[C@@H](NC[C@@H](CO)CC1CC1)c1cc([N+](=O)[O-])ccc1O 850544537 HKIJRRQOEUQIBV-PWSUYJOCSA-N 294.351 2.360 10 20 CECD CN(Cc1ccccc1O)[C@@H]1C[C@H]2CCCC[C@@H]2NC1=O 851841454 SHOPSRWBEUNGJU-VHDGCEQUSA-N 288.391 2.271 10 20 CECD COc1cccc(O)c1CN1CC[C@H](CN2CCCC2)C1 769473531 OWWKYHMTGOXERM-CQSZACIVSA-N 290.407 2.319 10 20 CECD CCOc1cccc(CN(C)C(C)(C)C(=O)OC)c1O 769305240 KNKDYYZTZRRKCO-UHFFFAOYSA-N 281.352 2.174 10 20 CECD CCC[C@H](OC)C(=O)NCc1cc(C)ccc1O 862754787 KIHNNJGBJQVQPF-ZDUSSCGKSA-N 251.326 2.132 10 20 CECD CCc1nncn1CCN[C@@H](C)c1ccc(N(C)C)cc1 766312959 HULXMAOMVMCOBX-ZDUSSCGKSA-N 287.411 2.257 10 20 CECD Cn1ccc(CCNCc2cc(Cl)cc(F)c2O)n1 761225883 JPKNKQBLTPCUFU-UHFFFAOYSA-N 283.734 2.251 10 20 CECD CNC(=O)c1cccc(CCNCc2c(C)cccc2O)c1 877058738 LTLKEMXCKVBXGG-UHFFFAOYSA-N 298.386 2.393 10 20 CECD CC1CCN(C(=O)CN[C@H](C)c2ccccc2O)CC1 879649760 UIEAFOHSQYRUNF-CYBMUJFWSA-N 276.380 2.301 10 20 CECD C[C@@H]1CCN2[C@@H](C1)C(=O)N[C@H]2c1ccc(N(C)C)c(F)c1 777899844 OXEQVLRKIFXTEN-WKPIXPDZSA-N 291.370 2.121 10 20 CECD Cc1cc(NCc2ccc(N3CCN(C)CC3)cc2)no1 777506784 QCKHZMUNGZMPNU-UHFFFAOYSA-N 286.379 2.347 10 20 CECD C[C@H](O)[C@@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 780891916 CNROCUNZDTVTPT-DZGCQCFKSA-N 262.397 2.345 10 20 CECD C[C@@H](CN[C@H](C)c1c(O)cccc1F)CN1CCOCC1 886530362 ISQFJEWTSVUYEC-QWHCGFSZSA-N 296.386 2.150 10 20 CECD CCOC(=O)[C@@H]1CCN(Cc2cc(Cl)ccc2O)C1 896963236 XFCZFAYKZIJNJT-SNVBAGLBSA-N 283.755 2.431 10 20 CECD Cc1ccc(O)c(CNC(=O)c2ccn(CC(C)C)n2)c1 899133231 JCDHRYWXZRTGGT-UHFFFAOYSA-N 287.363 2.483 10 20 CECD COc1cc(C)cc(CN2CC[C@@H](C)[C@H](CO)C2)c1O 895375472 BRHUKEBJDQDNLB-OCCSQVGLSA-N 279.380 2.160 10 20 CECD COc1ccc(CNC(=O)c2cc(C(C)C)no2)c(O)c1 794379279 NYKMTOKOQLTTNP-UHFFFAOYSA-N 290.319 2.442 10 20 CECD C/C=C\C[C@@H](CO)NCc1cc(C)cc(OC)c1O 894480162 MIPYCZHIGGVOQA-ZFDPJTLLSA-N 265.353 2.126 10 20 CECD CCOc1ccc(CNCCC(C)(C)C(=O)OC)c(O)c1 796453482 IIHMFKKLINUDEE-UHFFFAOYSA-N 295.379 2.470 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2cc(Cl)ccc2O)C1 792204155 XIJAOPAAZBSLKK-SKDRFNHKSA-N 283.755 2.477 10 20 CECD OCCCCCNCc1cc(Cl)cc(F)c1O 790931498 ZHQXTHSOFWQICF-UHFFFAOYSA-N 261.724 2.437 10 20 CECD CC(C)N(CCO)Cc1c(O)ccc(Cl)c1F 792156856 OSCZXZRPVQUMNS-UHFFFAOYSA-N 261.724 2.387 10 20 CECD CC(C)N(C)Cc1ccc(N2CCN(C)CC2)c(F)c1 1319923601 RPSYLMJYDFQRHO-UHFFFAOYSA-N 279.403 2.418 10 20 CECD CCN(CC)c1ccc(CN[C@H](CO)CCOC)cc1 282344191 VFIHMQXTNFLZJH-HNNXBMFYSA-N 280.412 2.020 10 20 CECD COc1cccc(CNCCCOCC2CC2)c1O 20190635 DUAFGZYIHYEHCJ-UHFFFAOYSA-N 265.353 2.307 10 20 CECD CN(CCc1cnn[nH]1)Cc1ccc(N2CCCCC2)cc1 1330545837 YTLDZPSKONEYJJ-UHFFFAOYSA-N 299.422 2.470 10 20 CECD CN(C(=O)c1ncoc1[C@@H]1CCCO1)c1ccc(N)cc1 1332979485 AGBASQVSLJMKGT-LBPRGKRZSA-N 287.319 2.385 10 20 CECD CC[C@H](F)C(=O)N[C@H](C)c1ccc(N2CCOCC2)cc1 1336440278 YULKZOVQHQDXQO-DOMZBBRYSA-N 294.370 2.449 10 20 CECD CCOc1nccnc1N(C)Cc1ccccc1O 786797373 VISGGOMXYGVZOE-UHFFFAOYSA-N 259.309 2.217 10 20 CECD COc1cccc(CN[C@@H]2CCCC[C@@H]2N(C)C)c1O 1319832596 BMKAFSNIKSBLJS-KGLIPLIRSA-N 278.396 2.363 10 20 CECD COC[C@@H]1CCCN(Cc2ccc(OC)c(OC)c2O)C1 1335419267 DJCMTXMKFULZHF-GFCCVEGCSA-N 295.379 2.268 10 20 CECD Cc1nc([C@H](C)NCc2ccc(N(C)C)cc2)no1 1347223031 WRGRLSKACPNQQD-JTQLQIEISA-N 260.341 2.295 10 20 CECD CCOc1cc(Sc2ncc(C(=O)O)s2)ncn1 1605674624 AAHGGBLIIOYJHK-UHFFFAOYSA-N 283.334 2.181 10 20 CECD O=C(O)c1ccc([N+](=O)[O-])c(NCc2ccccc2O)n1 1602405665 DYIVBRPQRMMQNN-UHFFFAOYSA-N 289.247 2.006 10 20 CECD Cc1cc(N(C)C)ccc1CNc1cncc(C(=O)O)n1 1610466124 DPKWWKDCIXVLEA-UHFFFAOYSA-N 286.335 2.161 10 20 CECD CN(C)c1ccc(/C=C/CN[C@H]2CNCC23CC3)cc1 1578425600 HYOPIZWSUUVGDO-CWDCEQMOSA-N 271.408 2.107 10 20 CECD CN1CCC[C@@H]1CCSc1ncc(C(=O)O)s1 1598592560 GUOOLCGHSKQVKH-MRVPVSSYSA-N 272.395 2.418 10 20 CECD Cc1ccc(O)c(CN2CCC3(CCNCC3)C2)c1 843120150 CPBYOUMZMKEIFB-UHFFFAOYSA-N 260.381 2.276 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)[C@@H]2CCOC2)c1 168800220 HBFOFZVAXVUPNA-GRYCIOLGSA-N 265.353 2.476 10 20 CECD COc1ccc(CN[C@@H](C)Cn2cccn2)cc1C 35272352 NBQOLPBSRXWFNZ-ZDUSSCGKSA-N 259.353 2.378 10 20 CECD C[C@@H]1C[C@@H](N[C@@H]2CCc3cccc(O)c32)CCN1C 312064492 DXMDSHBESRGEOI-KWCYVHTRSA-N 260.381 2.452 10 20 CECD CCOc1cccc(CN2CC[C@H](OCC)C2)c1O 701661572 NNJSAJFJBMWYOG-ZDUSSCGKSA-N 265.353 2.402 10 20 CECD CC(C)[C@H](CO)CN[C@@H](C)c1ccc(F)cc1O 394044444 HXLJACSHLFCPRM-QWRGUYRKSA-N 255.333 2.446 10 20 CECD CCCCO[C@@H](C)C(=O)NCc1cc(OC)ccc1O 114543324 FTCIMICOPYJEOU-NSHDSACASA-N 281.352 2.222 10 20 CECD CCC[C@@H]1C(=O)NCCN1Cc1cc(C)cc(C)c1O 128689737 USBHSVJQPNJIHP-CQSZACIVSA-N 276.380 2.110 10 20 CECD COC[C@@H](NC(=O)c1ccc(C)c(O)c1O)c1ccco1 182545883 ZYEZLFNACOYPHI-LLVKDONJSA-N 291.303 2.117 10 20 CECD COc1ccc(N(C)C[C@@H](O)COCC(C)C)c(OC)c1 131711061 TWLNVPVAJWSMBM-CYBMUJFWSA-N 297.395 2.174 10 20 CECD Cc1cccc(CN2CCN(CC(C)C)C(=O)C2)c1O 190097281 ZMLCVJPYBNYXKS-UHFFFAOYSA-N 276.380 2.001 10 20 CECD COc1ccc(F)cc1NC(=O)c1cccc(O)c1O 193151542 KLAUYXKLICFQSV-UHFFFAOYSA-N 277.251 2.498 10 20 CECD COc1ccc(CNC(=O)c2ccc(C)c(O)c2O)cc1 146217236 UTIYRCQEXMGIFY-UHFFFAOYSA-N 287.315 2.345 10 20 CECD COCCN1CC[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1 268966083 YMWHPEMLZUMHCZ-HOCLYGCPSA-N 291.439 2.124 10 20 CECD Cc1ccc([C@@H](C)NCC2(O)CCN(C)CC2)c(O)c1C 273609168 VGDNNWCFXMDJKU-CQSZACIVSA-N 292.423 2.116 10 20 CECD CCNC(=O)C(C)(C)CN[C@H]1CCc2cccc(O)c21 296249759 BDFWVIIPJSKKRV-LBPRGKRZSA-N 276.380 2.131 10 20 CECD CNCCN[C@@H](C)c1cc(Br)cc(F)c1O 817952115 NKLHHLCPHCCGOV-ZETCQYMHSA-N 291.164 2.164 10 20 CECD C[C@H](N)CCN[C@H]1C[C@H](C)c2c(F)ccc(O)c21 817953863 VKVUAVCSXLWIKM-QXEWZRGKSA-N 252.333 2.407 10 20 CECD COc1cc(O)c(CN[C@@H](C)[C@H](OC)C2CC2)cc1OC 825099086 UKZKLCOWMGNQOW-QFYYESIMSA-N 295.379 2.313 10 20 CECD Cc1cc(O)c(CN[C@H]2CCCCNC2=O)cc1Cl 825096799 JIHOSOUBNGPDBI-LBPRGKRZSA-N 282.771 2.112 10 20 CECD Cc1cccc(CN2CC[C@H](CN3CCCC3=O)C2)c1O 827633695 BVRBZFNOBYFOLP-AWEZNQCLSA-N 288.391 2.145 10 20 CECD CN(Cc1cscn1)C(=O)/C=C\c1ccc(O)c(O)c1 588406052 BJJRBKTYEWIPDL-HYXAFXHYSA-N 290.344 2.226 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)/C=C\c1ccc[nH]1 588549408 LQXLKFKMBSIBPX-XOIDGJRKSA-N 286.331 2.187 10 20 CECD O=C(NCCOc1ccc(F)cc1)c1cc(O)cs1 731868311 BTQJXLDFOJINDR-UHFFFAOYSA-N 281.308 2.402 10 20 CECD CCC1(C(=O)NC[C@H](N)c2ccc(N(C)C)cc2)CC1 832267228 OMZGUUFZDOVYTJ-AWEZNQCLSA-N 275.396 2.059 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](C(=O)O)[C@H]2C)cc1 846283368 DRQBKNOSBVVEDA-IUODEOHRSA-N 276.380 2.438 10 20 CECD C[C@@H]1CN(Cc2c(O)ccc(Cl)c2F)CC[C@@H]1N 843050948 CGDRAHUVLRCKGR-KCJUWKMLSA-N 272.751 2.354 10 20 CECD CCCN(Cc1cnnn1CC)c1ccc(CN)cc1 841877627 KRIOWRJDIGIQAL-UHFFFAOYSA-N 273.384 2.173 10 20 CECD C[C@H](NCC[C@@]1(O)CCCOC1)c1ccc(F)cc1O 846214709 VPOZFMMSBRSPTP-NHYWBVRUSA-N 283.343 2.114 10 20 CECD CC[C@@H](C(=O)NCc1cc(Cl)ccc1O)[C@@H](C)O 846660828 IROBOPZOHQPVSV-LDYMZIIASA-N 271.744 2.069 10 20 CECD CC(C)N1CC[C@@H](N[C@H](C)c2cc(F)cc(F)c2O)C1=O 756708259 BFPVFCMPDCKRGZ-NOZJJQNGSA-N 298.333 2.330 10 20 CECD COc1ccc2c(c1)CCN(C(=O)Cc1ccc(N)cc1)C2 851646460 XMLRNKZRHUXSCB-UHFFFAOYSA-N 296.370 2.405 10 20 CECD CCOc1ccc(CNC[C@@]2(C)CCCO2)c(O)c1 756133692 BHJJISQVTPLHGI-OAHLLOKOSA-N 265.353 2.450 10 20 CECD Cc1ccc(N(C)C(=O)/C=C\c2cnn(C)c2)cc1 751216747 IRTXAAIAGJCSFB-TWGQIWQCSA-N 255.321 2.405 10 20 CECD CC[C@H](CN1CCCC1)NC(=O)NCc1ccccc1O 758739333 UBUXHRCWJCHJCX-CQSZACIVSA-N 291.395 2.066 10 20 CECD CN(C)c1ccccc1N(C)C(=O)/C=C/c1cn(C)cn1 934993550 HALDPNWNYXFTEU-MDZDMXLPSA-N 284.363 2.162 10 20 CECD COc1ccc(N(C)CCN(C)Cc2nncs2)cc1 930852742 MPGGWQZABJHGPR-UHFFFAOYSA-N 292.408 2.115 10 20 CECD COC(=O)[C@@H](N[C@H](C)c1ccccc1O)c1cccnc1 879649606 XUIQBKHGQOVGNE-ABAIWWIYSA-N 286.331 2.352 10 20 CECD CC(C)SCC(=O)N[C@H](C)Cc1ccc(O)c(O)c1 773768202 CZAOYYIPEHBADY-SNVBAGLBSA-N 283.393 2.287 10 20 CECD O=C(NCc1ccc(N2CCCC2)cc1)N1C[C@@H]2C[C@H]2C1 887767311 HITGHCQJUCPWIC-GJZGRUSLSA-N 285.391 2.448 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@@H]2CCCS2)c1O 775031370 ARSIYEKOOFOAPA-JTQLQIEISA-N 298.364 2.294 10 20 CECD C[C@@H](NCCCCN1CCN(C)CC1)c1ccccc1O 783504299 WYTKYOKTKQKTJY-OAHLLOKOSA-N 291.439 2.070 10 20 CECD CCC[C@](C)(O)CNCc1cc(C)cc(OC)c1O 894253469 CHGLTRJFMNKKDX-HNNXBMFYSA-N 267.369 2.350 10 20 CECD COc1cc(C)cc(CNC[C@@]2(C)CCCO2)c1O 894347683 QDHNBUGDHSPCST-OAHLLOKOSA-N 265.353 2.368 10 20 CECD Cc1cccc(CN2[C@H](C)C(=O)N(C)[C@@H](C)[C@H]2C)c1O 895919264 DZTKFHKSXWQRBO-YNEHKIRRSA-N 276.380 2.140 10 20 CECD CN(C)c1cc(F)c(CNC[C@H]2CC[C@H](O)C2)cc1F 1261813902 JUWSIGBBIIQNJY-JQWIXIFHSA-N 284.350 2.281 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1ccnc(N)c1 1352850481 ZPQIHLUYBBXWDM-UHFFFAOYSA-N 298.390 2.392 10 20 CECD C[C@H](N[C@H]1CSC[C@@H]1C)c1cc(C(=O)O)ccc1O 1604328380 DGZURPYZBBDNOI-AUTRQRHGSA-N 281.377 2.493 10 20 CECD CC[C@H](CNCc1ccc(N(C)C)cc1C)C(=O)O 1589552789 VUZMDQBDRKUCLM-GFCCVEGCSA-N 264.369 2.261 10 20 CECD Nc1ccc(CNC(=O)c2cc3ccccn3c2)cc1 1580445715 RCAQOYIFVJIGEC-UHFFFAOYSA-N 265.316 2.452 10 20 CECD C[C@H](C(=O)O)N(Cc1cc(F)c(F)cc1O)C1CCC1 1589486937 PSWXURYYFMCMAI-MRVPVSSYSA-N 285.290 2.498 10 20 CECD C[C@H]1CN(C(=O)/C=C/c2cncc(F)c2)c2cccnc2O1 158811040 LYUSTINKYLALIX-ZWNMCFTASA-N 299.305 2.443 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]2[C@@H](C)O)c1O 852559188 GZUWALKXARUOPF-QMTHXVAHSA-N 281.327 2.079 10 20 CECD CCC[C@@H](CCO)CNCc1cc(OC)ccc1O 224876578 RXIRSTYMVCMMLA-LBPRGKRZSA-N 267.369 2.289 10 20 CECD CCOc1cccc(CN[C@@]2(C)CCO[C@H]2C)c1O 230153090 KHFYYFRPNDHFIN-NHYWBVRUSA-N 265.353 2.448 10 20 CECD Cc1ccc(O)c(CNCCCCn2ccnc2)c1 71408745 WMYADUIFSYTBKU-UHFFFAOYSA-N 259.353 2.467 10 20 CECD CC(=O)[C@@H](C)SCC(=O)NCc1ccc(N(C)C)cc1 175179679 QALQHKDFCOALMM-GFCCVEGCSA-N 294.420 2.080 10 20 CECD CNC(=O)c1cccc(NCc2cccc(OC)c2O)c1 20124646 DTUJYQPOGULMHN-UHFFFAOYSA-N 286.331 2.373 10 20 CECD COc1ccc(N2CCCN(CCCCCO)CC2)cc1 303368860 JBTUZJQPCYPXHN-UHFFFAOYSA-N 292.423 2.370 10 20 CECD CCOC(C)(C)CNC(=O)NCc1cc(OC)ccc1O 188770528 GXHWXUPJAAMOHW-UHFFFAOYSA-N 296.367 2.015 10 20 CECD Nc1ccc(NC(=O)Cc2ccc3c(c2)OCCO3)cc1 195308767 IATUQSHFUXOBON-UHFFFAOYSA-N 284.315 2.221 10 20 CECD CCC[C@H](N)C(=O)NCc1c(O)ccc2c1CCCC2 236886342 OADRFKMBAIIMMO-AWEZNQCLSA-N 276.380 2.015 10 20 CECD COc1cccc(CNC[C@@]2(C)CCCO2)c1O 94797972 KCGGKRUAOXAREH-CQSZACIVSA-N 251.326 2.060 10 20 CECD CCN(CC(=O)N(C)C1CC1)c1ccc(OC)cc1 264872957 BCGCWGQIGKSGRU-UHFFFAOYSA-N 262.353 2.142 10 20 CECD CC[C@H](N[C@H]1CC(=O)N(C(C)C)C1)c1ccccc1O 274896958 KKEIOEODQYCGTR-JSGCOSHPSA-N 276.380 2.442 10 20 CECD CCNC(=O)C1(CNCc2ccc(N(C)C)cc2)CCC1 277517645 XDLNPTBNVADQJA-UHFFFAOYSA-N 289.423 2.149 10 20 CECD Nc1ccc(CC(=O)N2CC[C@@H](Oc3ccccc3)C2)cc1 371262527 NFVVHPVUZXVMIP-QGZVFWFLSA-N 296.370 2.491 10 20 CECD Cn1nccc1[C@H]1CCCN(C(=O)c2cc(O)cs2)C1 802649129 DHFKUDYOFSCYNS-JTQLQIEISA-N 291.376 2.207 10 20 CECD NC(=O)C[C@@H]1CCN(Cc2ccc3ccccc3c2O)C1 816613479 VYHCBKIIWQNWCN-LBPRGKRZSA-N 284.359 2.243 10 20 CECD Cc1nc(C2(NC(=O)c3cc(O)cs3)CCCC2)no1 822661547 ILZUPFANDUKBGV-UHFFFAOYSA-N 293.348 2.344 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H](C(C)C)[C@H](C)N 829763986 DYDZGMMAVUANHH-BBRMVZONSA-N 291.439 2.297 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@@H]1CCOC1 822834279 WKAWIOKFCSEJGP-UKRRQHHQSA-N 290.407 2.145 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)CCCN)cc1 826019487 GPZUYRVPYPUGLM-UHFFFAOYSA-N 277.412 2.230 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H](N)CC(F)F 903901966 BZENDGXPHPWSHI-NSHDSACASA-N 270.323 2.430 10 20 CECD Cc1cnccc1CNC(=O)/C=C\c1ccc(O)c(O)c1 588531438 BJQNISWSXAWOOE-HYXAFXHYSA-N 284.315 2.131 10 20 CECD Cc1csc(CCC(=O)NCc2ccc(O)cc2O)n1 910946136 IKHTUQUXBXXZDT-UHFFFAOYSA-N 292.360 2.112 10 20 CECD CC[C@@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 843039319 PIFXOSFBIAYMSJ-MRVPVSSYSA-N 261.680 2.138 10 20 CECD Cc1noc(C2CC2)c1C(=O)NCc1ccc(O)cc1O 910949987 RPHQPKRJNYLERV-UHFFFAOYSA-N 288.303 2.202 10 20 CECD CN(Cc1cc(Br)ccc1O)C1CCNCC1 843045078 HRPHNOKJFQBGGO-UHFFFAOYSA-N 299.212 2.339 10 20 CECD Cc1cc(Cl)cc([C@H](C)NC[C@@H]2CNC(=O)C2)c1O 840838030 MBLJAQHWMBQFHD-VHSXEESVSA-N 282.771 2.141 10 20 CECD CCN1C(=O)N(Cc2ccc(N(C)C)cc2)C(=O)C1(C)C 924447083 YASOLCTTZZPWHC-UHFFFAOYSA-N 289.379 2.315 10 20 CECD Cc1cc(C)n(CC(=O)NCc2cc(Cl)ccc2O)n1 846479494 MHDLOEDVRQRUJP-UHFFFAOYSA-N 293.754 2.175 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@H](C)[C@@H]2CN(C)CCO2)c1 756757758 DGCXRHKQJOHDKG-ZENOOKHLSA-N 278.396 2.070 10 20 CECD C[C@@H](N[C@H]1C[C@@H](CO)C1)c1cc(F)cc(F)c1O 866416391 UUNFJJUNSSRACJ-MRTMQBJTSA-N 257.280 2.092 10 20 CECD CSC[C@H]1CCCN1C(=O)c1cc(O)cs1 768347409 GFQFEEZJIWFFKT-MRVPVSSYSA-N 257.380 2.421 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCc2c[nH]nc2C1 877084401 MOAFOVRQRHZDSC-LBPRGKRZSA-N 257.337 2.071 10 20 CECD CCOc1ccc(CN[C@H]2CCn3ccnc3C2)c(O)c1 778187718 KUAMRUOMOWCGAL-ZDUSSCGKSA-N 287.363 2.092 10 20 CECD CC[C@H]1CN(Cc2ccc(C)cc2O)C[C@@H](C)S1(=O)=O 877521652 GFUDVHXVJNGHAM-OCCSQVGLSA-N 297.420 2.098 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1CCO[C@]2(CCOC2)C1 770752355 NMLUBMIOKFMOPD-IAQYHMDHSA-N 297.782 2.473 10 20 CECD CCN1C[C@H](C)N(Cc2cc(F)ccc2O)C[C@H]1C 779018337 FUKDTVGASGXGEA-NEPJUHHUSA-N 266.360 2.446 10 20 CECD CCN(CC)C(=O)CN[C@@H](C)c1c(O)cccc1F 886513122 UPBZJTVBQHMZSG-JTQLQIEISA-N 268.332 2.050 10 20 CECD COc1cc(C)cc(CNCCCn2ccnc2)c1O 894145116 HKHHAVKHUBEPMB-UHFFFAOYSA-N 275.352 2.086 10 20 CECD O=C(CCc1ccco1)OCC(=O)c1ccc(O)c(O)c1 781969660 MOTWLSGJTPNYSS-UHFFFAOYSA-N 290.271 2.050 10 20 CECD C[C@@H]1CCN(Cc2cc(Cl)cc(F)c2O)[C@@H]1CO 785984684 RGYPHHHNCDBFSM-PRHODGIISA-N 273.735 2.387 10 20 CECD COCC1CN(Cc2ccc(N3CCCC3)cc2)C1 1204319719 FXUZZNIJTCSJCU-UHFFFAOYSA-N 260.381 2.365 10 20 CECD O=C(NC[C@@H]1COc2ccccc2C1)c1cccc(O)c1O 790483600 JJOLBJABQQTOEK-LLVKDONJSA-N 299.326 2.079 10 20 CECD Cc1ccc(O)c(CNC(=O)NC/C=C\Cl)c1 899036408 YRPULYILWMPESA-DJWKRKHSSA-N 254.717 2.252 10 20 CECD CC(C)CO[C@H](C)C(=O)NCc1ccccc1O 748347120 VZPWAAOBDNEWKS-LLVKDONJSA-N 251.326 2.070 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC/C=C\C1CC1 1324371710 OVTXKPFBUCFHGR-NGNAIVRQSA-N 259.305 2.193 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(O)CCCC2)c1 87016672 SUZFPAAJLBTCNT-LLVKDONJSA-N 265.353 2.357 10 20 CECD Cn1c(-c2sccc2O)nnc1N1C[C@H]2[C@@H](C1)C2(C)C 1262854151 AFEWJEPVTUNZMX-DTORHVGOSA-N 290.392 2.341 10 20 CECD CC[C@@H](C)n1nccc1C(=O)NCc1ccc(N)cc1 1346221108 PVDRJZXVRYVOKO-LLVKDONJSA-N 272.352 2.366 10 20 CECD CCCN(Cc1ccccc1O)c1cncc(C(=O)O)n1 1605320668 LPODULGYUDUOTR-UHFFFAOYSA-N 287.319 2.297 10 20 CECD CCN1CC[C@@H](CN[C@H](C)c2cc(C(=O)O)ccc2O)C1 1610004882 RJZZQLVHNKHTIN-NEPJUHHUSA-N 292.379 2.083 10 20 CECD COc1cccc(CNCc2cccc3c2CCNC3)c1O 1579277866 OBZUIBCXPSIKSO-UHFFFAOYSA-N 298.386 2.336 10 20 CECD CCCC[C@H](NCc1cccc(OC)c1O)C(=O)O 1595641113 RBTOPHOPVOOLKT-NSHDSACASA-N 267.325 2.134 10 20 CECD COc1ccc(O)c([C@@H](C)NCc2cnsn2)c1 846844000 JWWVRVDKZPLIAF-MRVPVSSYSA-N 265.338 2.103 10 20 CECD CCN(CC(=O)O)Cc1cc(Br)ccc1O 231701965 TUKYXDJDNOSROJ-UHFFFAOYSA-N 288.141 2.061 10 20 CECD COc1cccc(CNC(=O)c2cccc(O)c2O)c1 126276295 DPMBVBAMBDSKIX-UHFFFAOYSA-N 273.288 2.036 10 20 CECD COCCOCCCN[C@H](C)c1cc(C)ccc1O 35628929 BYHKQRVCMCVLCQ-CYBMUJFWSA-N 267.369 2.404 10 20 CECD CC(C)[C@@H](NCc1ccc(N2CCCC2)cc1)C(=O)O 43430884 PZZZVOYDRXPKDT-OAHLLOKOSA-N 276.380 2.486 10 20 CECD COc1cc(Cl)cc(CNC[C@H](O)C2CCC2)c1O 315714916 HWGIPXUIUDLUPO-LBPRGKRZSA-N 285.771 2.305 10 20 CECD CCO[C@@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 58770148 MECQUZQJBMZDIL-LBPRGKRZSA-N 276.380 2.110 10 20 CECD CCN(CC)c1ccc(CNC(=O)Cc2ccn[nH]2)cc1 175529067 ZVNSEPYXVXEFPD-UHFFFAOYSA-N 286.379 2.115 10 20 CECD CN(C)c1ccc(CNc2nccc(N(C)C)n2)cc1 301700891 SJNIAJSRRYCYGW-UHFFFAOYSA-N 271.368 2.221 10 20 CECD O=C(c1cccc(O)c1O)N1CCC[C@@H]1c1ccncc1 186847441 KNTFHGNONHDVGQ-CYBMUJFWSA-N 284.315 2.470 10 20 CECD Cc1nnc([C@H](C)N2CCOc3cc(N(C)C)ccc32)o1 181128146 CFHGLQZTNYBQHV-JTQLQIEISA-N 288.351 2.404 10 20 CECD CCCCO[C@@H](C)C(=O)N[C@H](C)Cc1ccc(O)c(O)c1 183486690 LMKHLZRHTIYWGI-NEPJUHHUSA-N 295.379 2.350 10 20 CECD CC(C)[C@]1(C)C[C@@H]1C(=O)NCCc1ccc(O)c(O)c1 186453492 AJHYPQUWVIUMNW-WBMJQRKESA-N 277.364 2.439 10 20 CECD COC[C@H](C)N[C@@H](C)c1ccc(N2CCOCC2)c(F)c1 131889964 LWRDNYNVFKEPTM-STQMWFEESA-N 296.386 2.348 10 20 CECD CC(C)[C@H](C)C(=O)NCCc1ccc(O)c(O)c1 179088470 LZNQZBOCJFIKTM-JTQLQIEISA-N 251.326 2.049 10 20 CECD Nc1ccc(NC(=O)CC2C[C@@H]3CC[C@H](C2)N3)cc1 237971156 TZPLSFLKOHIYKA-FTNCPSPGSA-N 259.353 2.128 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H]2CC(=O)N(C)C2)cc1 268899186 ZPUMCZSUWPLJEP-TZMCWYRMSA-N 275.396 2.024 10 20 CECD COC(=O)N1CCC(N[C@H](C)c2ccc(F)cc2O)CC1 273432185 VYERSVYUQMZACY-SNVBAGLBSA-N 296.342 2.413 10 20 CECD CCCOc1ccc(CN(CC(=O)OC)C2CC2)c(O)c1 271300856 UEPJKJIMKYVYLO-UHFFFAOYSA-N 293.363 2.318 10 20 CECD Cc1cccc(CN2C[C@H](C)O[C@@]3(CCCOC3)C2)c1O 366489497 POGFJUPFLHSUOD-YOEHRIQHSA-N 291.391 2.471 10 20 CECD Cc1ccccc1[C@H]1C(=O)NCCN1Cc1ccccc1O 368119970 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RKVCKLKCWBWNBW-LLVKDONJSA-N 284.363 2.342 10 20 CECD CCN1C[C@H](N[C@@H](C)c2ccc(C)c(C)c2O)CC1=O 834892382 VCRDIIYKSRMFAF-QWHCGFSZSA-N 276.380 2.280 10 20 CECD CO[C@@H]1COCC[C@@H]1CN[C@H](C)c1ccc(F)cc1O 834880643 MHNYGWNRXHRSBA-UEKVPHQBSA-N 283.343 2.233 10 20 CECD Cc1cc(O)c(CN[C@@H]2CCN(C(C)(C)C)C2=O)cc1C 842720788 LZOICJDTNYNCIQ-CQSZACIVSA-N 290.407 2.498 10 20 CECD Cc1noc(C)c1Cc1nc(Cc2ccc(N)cc2)no1 843160076 VHYIBRNQJPOMAG-UHFFFAOYSA-N 284.319 2.438 10 20 CECD C[C@H](CC(=O)N(CC(=O)O)Cc1ccccc1O)C1CC1 911486478 NWKQUGFVKOPCBE-LLVKDONJSA-N 291.347 2.242 10 20 CECD CCc1cccc(CN[C@@H]2C[C@@H]3CCCCN3C2=O)c1O 848914354 IBEBOBUKRCEBOM-LSDHHAIUSA-N 288.391 2.198 10 20 CECD CCOc1cccc(CN[C@H]2CCN[C@H](C)C2)c1O 841062941 ZNDKBKOEUSIGMF-YPMHNXCESA-N 264.369 2.021 10 20 CECD Cc1cc(N(C)C)ccc1[C@@H]1NC(=O)[C@@H]2C[C@@H](C)CCN21 840819046 KWKKAJGPVQNUEO-KNXALSJPSA-N 287.407 2.290 10 20 CECD Clc1cnc(SCc2nnnn2C2CC2)s1 849998107 ATZMFIHHEOXSMD-UHFFFAOYSA-N 273.774 2.410 10 20 CECD COc1ccc(O)c(CNC[C@H](C)C(=O)OC(C)(C)C)c1 848926055 KGUDTURZCBVRHK-NSHDSACASA-N 295.379 2.468 10 20 CECD COc1ccc(O)c(CNC[C@@H](N)c2ccccc2)c1 841034111 ALMFMWMMNQMCHB-OAHLLOKOSA-N 272.348 2.190 10 20 CECD CCc1cccc(CN2C[C@@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c1O 848915228 DYRHAZBRWOYKBV-CAOSSQGBSA-N 271.360 2.340 10 20 CECD CC[C@H]1CN(C(=O)c2cc(O)cs2)[C@H](C)CO1 846660007 SLJOZVCOFFGTLQ-SCZZXKLOSA-N 255.339 2.093 10 20 CECD CC1(CNCc2cccc(F)c2O)CCNCC1 841058389 XCLJYVUXXODQGI-UHFFFAOYSA-N 252.333 2.011 10 20 CECD Cc1ccc(O)c(CNC(=O)NCc2cccn2C)c1 858263895 RMHDSJUIAAUEED-UHFFFAOYSA-N 273.336 2.039 10 20 CECD CO[C@H]1C[C@H](NC(=O)NCc2cc(C)ccc2O)C1(C)C 858273831 IIHBOKHKUHDZCC-KBPBESRZSA-N 292.379 2.313 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1NCCC1(C)C 852870194 BNBAFIACMKWPTR-HNNXBMFYSA-N 289.423 2.065 10 20 CECD CCSC1(CNC(=O)c2c(F)ccc(O)c2O)CC1 857329810 CMOLPEKFXNYBGW-UHFFFAOYSA-N 285.340 2.252 10 20 CECD Cc1nnc(C(=O)NCc2ccc(N(C)C)cc2C)s1 758356224 HJKRULHCWPMLBZ-UHFFFAOYSA-N 290.392 2.151 10 20 CECD C[C@@H](NC(=O)NCCC1(O)CCC1)c1ccccc1O 868591516 SKRFKGVYTNRLHM-LLVKDONJSA-N 278.352 2.058 10 20 CECD CCN(CC)c1ccc(CN(C)[C@]2(CO)CCOC2)cc1 862426801 OZEHLOLRKYVASA-KRWDZBQOSA-N 292.423 2.116 10 20 CECD CCOc1ccc(CN(CC(=O)OC)C(C)C)c(O)c1 768688434 PQGJXWLKPOFTQV-UHFFFAOYSA-N 281.352 2.174 10 20 CECD COc1ccc(N(C)Cc2cc(C)n(C)n2)cc1OC 767888204 AGMZRQHCKWGEKP-UHFFFAOYSA-N 275.352 2.382 10 20 CECD CC[C@H]1COCCN1CCNCc1ccc(OC)c(C)c1 873189473 UAZUNONHKPSUQB-INIZCTEOSA-N 292.423 2.204 10 20 CECD CCN(Cc1cnn(C)c1)Cc1cc(C)cc(OC)c1O 1119446021 PKIQVRSIYFQUDG-UHFFFAOYSA-N 289.379 2.465 10 20 CECD COc1cccc(CNC(=O)[C@H]2CC[C@H](C)C2)c1O 776474114 ZCCODJZFLAAZCC-QWRGUYRKSA-N 263.337 2.453 10 20 CECD CCN(C)c1ccc(CN2CCN(C)C(=O)C2(C)C)cc1 773765407 JEIUNKIROPVBFY-UHFFFAOYSA-N 289.423 2.195 10 20 CECD CCOc1ccc(N(C)Cc2nc(COC)no2)cc1 777589142 QNTLMAFYRXINEX-UHFFFAOYSA-N 277.324 2.251 10 20 CECD C[C@H](NCCCC(=O)N(C)C)c1c(O)cccc1F 886515504 JPOHTSQMMZKFMF-JTQLQIEISA-N 268.332 2.050 10 20 CECD COc1ccc(CNCCNC(=O)CC2CC2)cc1C 1122546788 YOTSFXYKISAAOF-UHFFFAOYSA-N 276.380 2.010 10 20 CECD CCOC1(C(=O)NCc2cccc(O)c2O)CCCC1 1123888399 ITGLGUOSVVAHQO-UHFFFAOYSA-N 279.336 2.063 10 20 CECD C[C@@]1(NCc2cc([N+](=O)[O-])ccc2O)CCO[C@H]1C1CC1 784592775 MVSUWGIBYRAKFC-LSDHHAIUSA-N 292.335 2.348 10 20 CECD CC1(C)CO[C@@H](CCC(=O)NCc2cccc(O)c2O)C1 1123888820 LSOXZUYEUIKWEC-LBPRGKRZSA-N 293.363 2.309 10 20 CECD CC[C@@H]1C(=O)NCCCN1Cc1cccc(Cl)c1O 898544992 FHELWPDSMZQLPT-GFCCVEGCSA-N 282.771 2.146 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1[C@H]2[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]42)[C@@H]1[C@@H]53 793683781 YIADGTBJDVSAHG-JFKOBQNLSA-N 295.382 2.402 10 20 CECD Cc1nc(CN(C)Cc2ccc(N(C)C)cc2)no1 45943677 YFVDCWUAAHLXAY-UHFFFAOYSA-N 260.341 2.076 10 20 CECD CCO[C@H](C(=O)NCc1ccc(N(C)C)c(F)c1)C1CC1 1329777443 KBEVQSQFMDOBDN-HNNXBMFYSA-N 294.370 2.323 10 20 CECD COCCN(Cc1ccccc1O)C[C@H]1CCCO1 109761938 DZDJCIBAIWPVCK-CQSZACIVSA-N 265.353 2.020 10 20 CECD Cn1ccnc1[C@H]1CCCN(Cc2ccc(N)cc2)C1 1335287800 BLXQCJJVJYWYNK-AWEZNQCLSA-N 270.380 2.382 10 20 CECD C[C@@H](NC(=O)[C@H](O)c1ccccn1)c1ccc(N(C)C)cc1 1346993441 QBJDJOFJXVCLCU-MLGOLLRUSA-N 299.374 2.058 10 20 CECD CN(C)[C@@H]1CCCC[C@H]1NC(=O)c1cc(O)cs1 1350552919 JVVMWGOKKCCREG-GHMZBOCLSA-N 268.382 2.056 10 20 CECD Oc1c(Cl)cccc1CN1CCO[C@H](CF)C1 840954978 OLQVTUKIENMYGC-SNVBAGLBSA-N 259.708 2.216 10 20 CECD CN1C(=O)c2ccccc2[C@H]1CNCc1ccc(N)cc1 1578516146 YTCVNLBHWNDCIG-MRXNPFEDSA-N 281.359 2.185 10 20 CECD COc1cccc(CNCc2cc(C(=O)O)cs2)c1O 1599674637 UNPXPZHMWDDTEK-UHFFFAOYSA-N 293.344 2.450 10 20 CECD C[C@@H]1CCO[C@@H]1CCN(C)c1ccc(OCC(=O)O)cc1 1776650046 UTSKFUPKQMUFRD-IUODEOHRSA-N 293.363 2.401 10 20 CECD CCN1CCc2cc(CN[C@H]3CC=C(C(=O)O)C3)ccc21 1776877456 KWGBTQKOIINJQR-HNNXBMFYSA-N 286.375 2.332 10 20 CECD Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)CC2 160382600 RUUITOTZUWMONO-WFASDCNBSA-N 299.422 2.318 10 20 CECD CCNC(=O)C(C)(C)NCc1ccc(OC)c(C)c1 312874599 FOWBBVODKZSWJS-UHFFFAOYSA-N 264.369 2.008 10 20 CECD COc1cccc(CNC(=O)c2ccc(Cl)cn2)c1O 126605057 IBYAJJQNCFYKCY-UHFFFAOYSA-N 292.722 2.379 10 20 CECD CC(=O)Nc1ccc(NC(=O)c2cccc(O)c2O)cc1 126196032 GHNRJIXYCHAJFS-UHFFFAOYSA-N 286.287 2.309 10 20 CECD OCC[C@@H](NCc1cc(F)ccc1O)c1ccco1 187528272 UFTYXENGSRJBPU-GFCCVEGCSA-N 265.284 2.338 10 20 CECD C[C@H](NCCCCCS(C)(=O)=O)c1ccccc1O 186857664 YWCDXBYJGQBXJI-LBPRGKRZSA-N 285.409 2.258 10 20 CECD CC1(C)CCN(C(=O)/C=C/c2ccc(O)c(O)c2)C1 180826935 PUZPWNWWRCIYPC-GQCTYLIASA-N 261.321 2.370 10 20 CECD C[C@H](CO)CN[C@@H](C)c1cc(Br)ccc1O 134914431 CIIQXKAZLGMDRG-IUCAKERBSA-N 288.185 2.434 10 20 CECD Cn1cc(Cl)cc1C(=O)NCc1ccccc1O 133767667 UAQAGRFFTYHMRF-UHFFFAOYSA-N 264.712 2.314 10 20 CECD CCOc1cccc(CN(C)C[C@H](C)C(=O)OC)c1O 91985871 ZSXKNXPQBUJVBX-NSHDSACASA-N 281.352 2.032 10 20 CECD Cc1cccc(CN2CC[C@H](Cc3cnn(C)c3)C2)c1O 362044186 HGJHLSUCRQCOLY-CQSZACIVSA-N 285.391 2.499 10 20 CECD O=C1CCCN1[C@H]1CCN(Cc2cccc(Cl)c2O)C1 276856050 VYZYEHOQUHTYGC-LBPRGKRZSA-N 294.782 2.242 10 20 CECD CCCCN(Cc1ccccc1O)C(=O)COC 282545151 RUGNALPDIGMNKB-UHFFFAOYSA-N 251.326 2.167 10 20 CECD COCC[C@H](CO)N[C@H](C)c1cc(Cl)ccc1O 281587932 LMJNZTBEWUDCCL-MWLCHTKSSA-N 273.760 2.094 10 20 CECD CC[C@H](N[C@@H](CO)CCOC)c1ccc(N(C)C)cc1 281616304 NHVGZGCTHAPXMN-ZBFHGGJFSA-N 280.412 2.191 10 20 CECD CCCCNC(=O)CN(CC)c1ccc(OC)c(OC)c1 299291998 UOHJSGCUAVNXTL-UHFFFAOYSA-N 294.395 2.446 10 20 CECD COc1cc(O)c(CNC[C@@]2(O)CCC[C@@H]2C)cc1OC 293828766 AMQGYGXFXQGBIQ-ZBEGNZNMSA-N 295.379 2.050 10 20 CECD CC(C)(CNC(=O)c1cccc(O)c1O)c1ccccn1 295476772 NUDZQNGVVUJIAL-UHFFFAOYSA-N 286.331 2.200 10 20 CECD Oc1cc2c(cc1CN1CCC[C@H](C3CC3)C1)[C@H](O)CO2 808230835 RBAQYQOZOGFQKZ-BLLLJJGKSA-N 289.375 2.440 10 20 CECD CCOc1cccc(CN(C)C[C@@H](O)C(F)(F)F)c1O 809750791 IBEGXNBCHDBKTB-LLVKDONJSA-N 293.285 2.146 10 20 CECD CCN(Cc1ccc(N(C)C)c(F)c1)[C@@H](C)CO 293562509 GEMSIJMHGUNTSI-NSHDSACASA-N 254.349 2.094 10 20 CECD Cc1cc(C)c([C@H](C)NC[C@H](C)S(C)(=O)=O)c(O)c1 815598247 QBYIXZWRXWRWLV-RYUDHWBXSA-N 285.409 2.093 10 20 CECD C[C@@H]1Cc2c[nH]nc2[C@@H](C(=O)NCc2ccccc2O)C1 816911965 FQAVWAYIRVGWBC-MFKMUULPSA-N 285.347 2.098 10 20 CECD Cc1cc(O)c(CN(C)[C@@H]2CCCCNC2=O)cc1Cl 824645394 HLXJXJHLLPNIII-CYBMUJFWSA-N 296.798 2.455 10 20 CECD COC(=O)N(C)CCNCc1ccc2ccccc2c1O 827376816 IDPBATUBDBCJBJ-UHFFFAOYSA-N 288.347 2.333 10 20 CECD C[C@H](C(=O)NCCc1ccc(O)c(O)c1)C(C)(C)C 270565146 WLAIBBDXYWIVSB-SNVBAGLBSA-N 265.353 2.439 10 20 CECD CC(C)(C)OCC[C@@H](NCc1ccccc1O)C(=O)O 901762901 PVZVKKGLTXFTMK-GFCCVEGCSA-N 281.352 2.140 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)C1(C)CCOCC1 734406221 QXTDKZOEZMZGEJ-UHFFFAOYSA-N 290.407 2.494 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC2(CC1)OCCO2 840910633 UMPCYPKGNOQNSF-UHFFFAOYSA-N 290.407 2.400 10 20 CECD Oc1ccc(Cl)cc1CN[C@H]1CCCNCC1 841058876 WSWCAFCNOICFFD-LBPRGKRZSA-N 254.761 2.277 10 20 CECD NCC[C@@H]1CCCCN1Cc1cccc(F)c1O 843123227 JBPHLBBTWHZGNV-LBPRGKRZSA-N 252.333 2.235 10 20 CECD COc1cccc([C@H](C)NC[C@H](C)CN(C)C)c1O 846170246 MVPDPCQLGCXWCC-RYUDHWBXSA-N 266.385 2.249 10 20 CECD C[C@@H](Cc1ccccn1)NCc1cc([N+](=O)[O-])ccc1O 848566569 BCXIVFHIXGZISL-NSHDSACASA-N 287.319 2.416 10 20 CECD C[C@H]1CCN1C(=O)NCc1ccc2c(c1)CCCN2C 746981507 UZKUOESLTRYBLW-LBPRGKRZSA-N 273.380 2.373 10 20 CECD COc1ccc2c(c1)CCCN2CCCN1CCCC1=O 920084908 BODQTPBOURJVKH-UHFFFAOYSA-N 288.391 2.460 10 20 CECD O=C(CC1(O)CCCC1)NCc1cc(Cl)ccc1O 846478063 YULRTKAMVVPLCY-UHFFFAOYSA-N 283.755 2.357 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCN[C@H](C)[C@H]1C 843057237 HEHMSXPZAYGVTI-ZIAGYGMSSA-N 261.413 2.243 10 20 CECD CO[C@@H](CNC(=O)NCc1ccccc1O)C1CCCC1 852655932 GBUUTBFPIROSEC-HNNXBMFYSA-N 292.379 2.397 10 20 CECD CCN(CC)c1ccc(CNC[C@@H]2CCN2C)cc1F 922575269 FTCLMCAGBCIJHH-AWEZNQCLSA-N 279.403 2.466 10 20 CECD CCCN(Cc1ccccc1O)C(=O)N[C@H]1COC[C@H]1C 926001432 ZRZYHIPKPASYSS-OCCSQVGLSA-N 292.379 2.349 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)Nc1ccon1 757852502 SLTZGTNOEYQZJJ-UHFFFAOYSA-N 274.324 2.371 10 20 CECD Cc1cnc(N(C)Cc2ccc(N(C)C)cc2)nc1 758146605 WIFDFDUUMZKZGZ-UHFFFAOYSA-N 256.353 2.487 10 20 CECD CO[C@@]1(C)C[C@H]1NCc1cc(Cl)cc([N+](=O)[O-])c1O 850409370 SEXSDIXLHDKVGD-PWSUYJOCSA-N 286.715 2.221 10 20 CECD COCC1(N[C@@H](C)c2cc(OC)ccc2O)CC1 756849927 HGVBMGBSRZBOBB-JTQLQIEISA-N 251.326 2.230 10 20 CECD CCOc1ccc(O)c(CN[C@H]2CCOC[C@H]2OCC)c1 759173898 QOOBGJYEYIMGNQ-GOEBONIOSA-N 295.379 2.075 10 20 CECD Oc1cc2c(cc1CN(CC(F)F)C1CC1)[C@@H](O)CO2 768451027 LKUZLPGNUPJYEZ-LBPRGKRZSA-N 285.290 2.048 10 20 CECD CC(C)Oc1ccc(N(C)CC(=O)N=S(C)(C)=O)cc1 878513117 VHVYKVFJURZNRW-UHFFFAOYSA-N 298.408 2.164 10 20 CECD CN(C)c1ccc(CNC(=O)CCNC(C)(C)C)cc1F 931147198 WLFHUBBCYWATEC-UHFFFAOYSA-N 295.402 2.286 10 20 CECD CCN1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccccc1O 868013449 HMCNXQDQEZZNQF-CHWSQXEVSA-N 291.395 2.237 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCN2CCC[C@@H]2C1 876940795 XTQMKNTZOYPKSY-UONOGXRCSA-N 260.381 2.417 10 20 CECD Cc1ccnc(NCc2ccc(N3CCN(C)CC3)cc2)n1 882880238 IUZQYHFAUFFOBD-UHFFFAOYSA-N 297.406 2.149 10 20 CECD O=C1N[C@H](c2cccc(F)c2O)Nc2ccccc21 778519525 HJKUNDZBCAJTAT-CYBMUJFWSA-N 258.252 2.385 10 20 CECD COc1ccc(O)c(CN2CCCC[C@@H]2C2OCCO2)c1 775674664 IEVFWXNMUAYACW-CQSZACIVSA-N 293.363 2.128 10 20 CECD C[C@@H](NC1COC(C)(C)OC1)c1c(O)cccc1F 886589686 BOMYCBMRNUVMEI-SECBINFHSA-N 269.316 2.333 10 20 CECD CCOC(=O)/C(=C/c1cn(CC)nc1C)c1nccn1C 899349377 BKTXSXJJQBUSJJ-UKTHLTGXSA-N 288.351 2.049 10 20 CECD C[C@@H]1CC[C@H](NC(=O)/C=C\c2ccc(O)c(O)c2)C1 781617088 ACSMKLQXRWAKLX-BABHQGDISA-N 261.321 2.416 10 20 CECD O[C@H]1c2ccccc2C[C@@H]1NCc1ccc2c(c1)CCO2 898392442 GJDYSOIJHPKKBL-WMZOPIPTSA-N 281.355 2.369 10 20 CECD CO[C@@H](C(=O)NCCCSc1nccs1)C1CC1 792166223 RNXSHLHPNKMSNF-SNVBAGLBSA-N 286.422 2.167 10 20 CECD O=C(NC[C@H](CO)CC1CCCC1)c1cc(O)cs1 799182428 FXLUTCXEJUJVRR-LLVKDONJSA-N 283.393 2.372 10 20 CECD COc1ccc(CNC(=O)C(C2CC2)C2CC2)c(O)c1 794377848 LKXZVMJQGZHJHI-UHFFFAOYSA-N 275.348 2.453 10 20 CECD COc1ccc(CN[C@H]2CCN(C(C)=O)[C@@H]2C)cc1C 985871079 NQKAQSJAVKYXJJ-DOMZBBRYSA-N 276.380 2.103 10 20 CECD COc1cccc(O)c1CN1CCN(C(C)(C)C)CC1 1337020722 ZHOKATMCKZJDLR-UHFFFAOYSA-N 278.396 2.317 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H](N)C2CCCCC2)cc1 1346104177 QISOGYJQEHLSCU-INIZCTEOSA-N 289.423 2.276 10 20 CECD O=C1NC(=S)S/C1=C\c1cc(C(=O)O)ccc1F 1777698917 MFARWFJPYVLQPZ-YWEYNIOJSA-N 283.305 2.013 10 20 CECD Oc1cccc(Cl)c1CNCCCO[C@@H]1CCOC1 153031510 CUGOIKUPLQOODL-LLVKDONJSA-N 285.771 2.331 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H]1CCCSC1 810156862 XBWPTWZUZPXLDK-GFCCVEGCSA-N 265.378 2.494 10 20 CECD CON1CCC(NCc2ccc3c(c2)CCCO3)CC1 922193818 GQQJFLAZKQYHHC-UHFFFAOYSA-N 276.380 2.127 10 20 CECD Cc1noc(C)c1CNCc1cc2c(cc1O)OCO2 112017526 ZVSOZUOCANSXMQ-UHFFFAOYSA-N 276.292 2.016 10 20 CECD Oc1cccc(Cl)c1CN[C@@H]1C[C@H]2CC[C@@H]1O2 152850269 YDTOCJLMXUXRIZ-DYLAAIIWSA-N 253.729 2.455 10 20 CECD CC[C@@H](NCC1(S(C)(=O)=O)CC1)c1ccccc1O 281203103 SEMTYNCSGDGFAQ-GFCCVEGCSA-N 283.393 2.010 10 20 CECD C[C@H](CN[C@H]1CCc2cccc(O)c21)N(C)C1CC1 297776134 PLLHELHKQBBQFV-RISCZKNCSA-N 260.381 2.452 10 20 CECD C[C@@H]1NC[C@@H](C)N(Cc2cc(F)ccc2O)[C@@H]1C 401202619 ANXPKMXJPOQPJD-OUAUKWLOSA-N 252.333 2.102 10 20 CECD C[C@@H](NCCc1cncn1C)c1cc(F)ccc1O 401746396 KOWTUAPBBKBUIA-SNVBAGLBSA-N 263.316 2.158 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@]3(CN)C2)cc1 313002067 NJASTLJGQKPRAP-RDJZCZTQSA-N 273.424 2.313 10 20 CECD Cc1ccccc1-n1c(C)cc(C(=O)N[C@@H]2CCNC2)c1C 127745678 ORSRPUQRRZVFJL-OAHLLOKOSA-N 297.402 2.494 10 20 CECD Cc1ccc(C(=O)Nc2cccc(CO)c2)c(O)c1O 181778900 UQUCOESONWOFJS-UHFFFAOYSA-N 273.288 2.151 10 20 CECD CN(C)c1ccc(CNC(=O)Nc2ccon2)cc1 180496333 UJILYUCXYKDAKY-UHFFFAOYSA-N 260.297 2.062 10 20 CECD CC[C@]1(C)CN(Cc2cc(OC)c(OC)cc2O)CCO1 190326907 ZDJMDKFDDUGOJS-MRXNPFEDSA-N 295.379 2.410 10 20 CECD COCCC1(C(=O)NCc2ccc(N(C)C)c(F)c2)CC1 131206096 MWHYDMCXAGDFLP-UHFFFAOYSA-N 294.370 2.325 10 20 CECD CCOCCNC(=O)CN(C)c1ccc(OC(C)C)cc1 191586428 OYTVGXCCCAKETL-UHFFFAOYSA-N 294.395 2.063 10 20 CECD CN1CCN(Cc2cc(Cl)ccc2O)C(C)(C)C1=O 93642619 ZUICKAFAIZDRHU-UHFFFAOYSA-N 282.771 2.098 10 20 CECD CCO[C@H]1C[C@@H](N(C)C(=O)Cc2ccc(N)cc2)C1(C)C 236966935 JSAZKYOTQKZORY-CABCVRRESA-N 290.407 2.473 10 20 CECD C[C@@H]1CC[C@@H](CCC(=O)NCCc2ccc(N)cc2)O1 237378757 FALJBZHXVAGNLM-DOMZBBRYSA-N 276.380 2.275 10 20 CECD CCNC(=O)[C@H](C)N[C@H](C)c1ccc(C)c(C)c1O 273414873 QPWVFEVMCXYDGC-NEPJUHHUSA-N 264.369 2.184 10 20 CECD CN(Cc1nc(-c2ccccn2)no1)Cc1ccccc1O 365216453 FNGAURUBBGPTQE-UHFFFAOYSA-N 296.330 2.469 10 20 CECD COc1ccc(O)c(CN2CCC[C@@H](N3CCCC3)C2)c1 378439142 MJZGLTXWXLJNNB-OAHLLOKOSA-N 290.407 2.461 10 20 CECD CC[C@@H](N[C@H](CCO)COC)c1cccc(Cl)c1O 287740484 PQLNGJJXAPRRGW-ZWNOBZJWSA-N 287.787 2.484 10 20 CECD Cc1cc(O)c(CN2CCOC[C@H]2[C@H]2CCCO2)cc1C 377702057 UAMHVTWTYRPWEO-DOTOQJQBSA-N 291.391 2.389 10 20 CECD CC[C@H](N[C@H]1CCC[C@@H]1O)c1ccc(F)cc1O 286316427 XTSZBCSOYSNFIK-AVGNSLFASA-N 253.317 2.485 10 20 CECD CC[C@@H](NCCN1CCC(O)CC1)c1ccc(F)cc1O 296015256 RKFCWULIUADGOE-OAHLLOKOSA-N 296.386 2.029 10 20 CECD COC[C@H](O)CCN[C@@H](C)c1cc(Cl)cc(C)c1O 808709938 JIMLKGZUGNTZQW-CMPLNLGQSA-N 287.787 2.402 10 20 CECD C[C@@H]1CN(Cc2cc(Cl)c(F)cc2O)C[C@H]1CO 294526151 CXNLMKFWZJFXPW-SCZZXKLOSA-N 273.735 2.245 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@@H](N3CCCC3)C2)cc1 394555988 FELFAEGQVFYMJV-OAHLLOKOSA-N 288.395 2.361 10 20 CECD CC[C@@H](NC[C@H]1CNCCCO1)c1cc(Cl)ccc1O 817982703 VNUDWIDPBFUMDX-TZMCWYRMSA-N 298.814 2.465 10 20 CECD C[C@H](NC(=O)CC(C)(C)C)C(=O)Nc1ccc(N)cc1 818556348 NPBGPQDNJAEZMC-JTQLQIEISA-N 277.368 2.148 10 20 CECD CCOC(=O)[C@@H](C(=O)N[C@H](C)c1ccccc1O)C(C)C 827917249 LUBLMQAFLGNNRE-BXUZGUMPSA-N 293.363 2.405 10 20 CECD CCc1cc(=NCc2ccc(OC)cc2O)cc[nH]1 828068051 SEQWQDRPDWTZPN-UHFFFAOYSA-N 258.321 2.392 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NCc1cocn1 730829651 HBQVCRKRTSNZFK-UHFFFAOYSA-N 288.351 2.082 10 20 CECD C[C@@H](NCc1ccc(N(C)C)c(F)c1)[C@@H](C)C(=O)O 901447875 JWLAIBZGHPSNFA-NXEZZACHSA-N 268.332 2.091 10 20 CECD CN(C)c1cccc(NC(=O)/C=C\c2ccc(O)c(O)c2)n1 588420823 SCHSMVVRRAUVLZ-CLFYSBASSA-N 299.330 2.211 10 20 CECD Cc1ccc(O)c([C@@H](C)NCCN2C[C@@H]3CC[C@H](C2)O3)c1 834890655 LOQKOQFPQBZRDC-KFWWJZLASA-N 290.407 2.214 10 20 CECD CC[C@@H](O)CN1CCCc2cc(OC)cc(OC)c21 839656990 XNJZWBLTQZGNTL-GFCCVEGCSA-N 265.353 2.227 10 20 CECD CC(C)(CNCc1c(O)cccc1Cl)N1CCOCC1 83551401 OIFFWLAKPPYAPO-UHFFFAOYSA-N 298.814 2.246 10 20 CECD CN(C)[C@@H]1CCCN(Cc2c(O)ccc3ccncc23)C1 738143192 JTOXUVUUOGHSDB-CQSZACIVSA-N 285.391 2.466 10 20 CECD CCC(C)(C)OCC(=O)NCc1ccc(OC)cc1O 837592140 KHJTZKQOZGVVPR-UHFFFAOYSA-N 281.352 2.222 10 20 CECD Cc1ccc(C(=O)N2CCC=C(Cl)C2)c(O)c1O 911831904 SJUUCBXRHFNSMO-UHFFFAOYSA-N 267.712 2.375 10 20 CECD C[C@@H]1CN(C(=O)NCCc2ccc(N)cc2)C[C@@H]1C 841958339 PIVRTAIQQGQXHG-TXEJJXNPSA-N 261.369 2.109 10 20 CECD COCCC1(c2nc(Cc3ccc(N)cc3)no2)CC1 843158344 BPXGILWPORAZNO-UHFFFAOYSA-N 273.336 2.311 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@H](O)C(C)(C)C1 840941167 UOTZJNLLQVGKBN-HNNXBMFYSA-N 262.397 2.264 10 20 CECD Nc1ccc(NC(=O)NCC(=O)OC2CCCCC2)cc1 841299520 IFLNVTXSZCWESM-UHFFFAOYSA-N 291.351 2.266 10 20 CECD CC(=O)C(=O)COc1ccc(C(C)=O)cc1Br 845330034 GQWMNJKDDXZZSB-UHFFFAOYSA-N 299.120 2.189 10 20 CECD CN(Cc1cccc(Cl)c1O)CC(C)(C)CN 843056686 WKQIBGGERCRPMA-UHFFFAOYSA-N 256.777 2.462 10 20 CECD COc1cccc([C@H](C)NCc2nc(C(C)C)n[nH]2)c1O 846170272 NFPANZZHBQDHFW-JTQLQIEISA-N 290.367 2.493 10 20 CECD COc1cccc([C@@H](C)NCC2(CO)CCC2)c1O 846161707 BFGBRIXULWOFTH-LLVKDONJSA-N 265.353 2.214 10 20 CECD CO[C@@H](C(=O)N[C@H](C)c1ccccc1O)C(C)C 827941453 RZONDUYHRPBIRS-ZWNOBZJWSA-N 251.326 2.240 10 20 CECD Cc1ccc([C@H](C)N[C@@H]2CC[C@H](C(N)=O)C2)c(O)c1 834906522 FYYCSNMJBMOBDI-SDDRHHMPSA-N 262.353 2.005 10 20 CECD CCCSC[C@@H](NCc1ccc2c(c1)CCO2)C(=O)O 756341325 WIYGCFFKMULNSI-CYBMUJFWSA-N 295.404 2.308 10 20 CECD CC(C)(CO)CNCc1ccc(Br)cc1O 691452069 CCEAKMJPSQPOEC-UHFFFAOYSA-N 288.185 2.263 10 20 CECD CO[C@@H](CNC(=O)N[C@H](C)c1ccccc1O)C1CC1 868652086 AFOMVFUGTIOPOK-YGRLFVJLSA-N 278.352 2.177 10 20 CECD C[C@@H](NS(=O)(=O)CCCCF)c1ccccc1O 867834830 OVBSAGXHNYOTCS-SNVBAGLBSA-N 275.345 2.122 10 20 CECD O=C(Cn1cc2ccccc2n1)NCc1ccccc1O 769364339 FBLBAVVOQYHSLL-UHFFFAOYSA-N 281.315 2.058 10 20 CECD Cc1cccc(O)c1CN1CC[C@H](CN2CCCC2=O)C1 877639128 WJHZZPMLLVTNLK-AWEZNQCLSA-N 288.391 2.145 10 20 CECD CN(Cc1ccc(N2CCC(O)CC2)cc1)CC1CC1 876623122 VKHINFCGGOYVPW-UHFFFAOYSA-N 274.408 2.490 10 20 CECD C[C@H](NC(=O)c1cccnc1O)c1ccc(N(C)C)cc1 775406229 WEVGHWCEXFJCSD-NSHDSACASA-N 285.347 2.344 10 20 CECD CO[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 775702285 NLKMLUOZKVJBPG-JTQLQIEISA-N 259.708 2.405 10 20 CECD CC[C@@H](C)C(=O)NCCNCc1ccc(OC)c(C)c1 1123747012 JARWJIDNZNTHHI-GFCCVEGCSA-N 278.396 2.256 10 20 CECD N=C(NCc1ccc(N2CCCC2)cc1)NCC1CC1 887349834 KXDONNXMAFMDQQ-UHFFFAOYSA-N 272.396 2.311 10 20 CECD COCCCN(C)CCN[C@H](C)c1c(O)cccc1F 886532884 QGOJRGFLFMZXMH-GFCCVEGCSA-N 284.375 2.150 10 20 CECD CCOc1ccc(CNC[C@H]2CC[C@@H](O)C2)c(O)c1 788971055 ANOFTWQARCLTTG-WCQYABFASA-N 265.353 2.042 10 20 CECD CC[C@H](C(=O)N(C)Cc1ccc(N(C)C)cc1)[C@@H](C)O 789950583 RLOWAFPYLCRGNC-DOMZBBRYSA-N 278.396 2.118 10 20 CECD COC(=O)[C@@H](NCc1cc(Cl)cc(F)c1O)C1CC1 789573511 KJRZQSUELWQKQL-NSHDSACASA-N 287.718 2.226 10 20 CECD COc1ccc(CNC[C@]2(C)CCCO2)c(O)c1OC 893148166 LQOXKRUSIPKWQY-HNNXBMFYSA-N 281.352 2.068 10 20 CECD COc1ccc(CN[C@@H](C)c2cnccn2)c(O)c1 894638735 TXBNGGVNGISDKU-JTQLQIEISA-N 259.309 2.042 10 20 CECD CCN(CC)c1ccc(CNC(=O)NCCCCN)cc1 1325349246 MHFSDFIYPJKYJH-UHFFFAOYSA-N 292.427 2.071 10 20 CECD Cc1ccc(O)c(CNS(=O)(=O)CCC(C)C)c1 1329238766 MIKHFMHZXCQNMU-UHFFFAOYSA-N 271.382 2.166 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccn(CC)n1 1334719795 YPPQRKKZJFLWRV-UHFFFAOYSA-N 294.351 2.024 10 20 CECD O=C(O)[C@H](CC(F)F)NCc1cc(Cl)ccc1O 1601638999 CBLMSBKEEHUSRM-QMMMGPOBSA-N 279.670 2.244 10 20 CECD COc1cccc(O)c1CN[C@H](C)CC(C)(C)O 824695679 BCIMPDQOKYHTJJ-SNVBAGLBSA-N 253.342 2.040 10 20 CECD Cc1ccc(O)c(CN(C)C(C)(C)CC(=O)O)c1 1600465222 TVYKHAHREDOGKD-UHFFFAOYSA-N 251.326 2.386 10 20 CECD CCOc1ccc(CN[C@H](C(=O)O)C(C)(C)C)c(O)c1 1597101475 VQNSEEWLQILADX-CYBMUJFWSA-N 281.352 2.380 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1ccc(C(=O)O)cn1 1598519255 MTZGKFYXZPNATE-UHFFFAOYSA-N 299.374 2.478 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@@H](CC(=O)O)C2)c1O 1776210813 UOJCEMOOSVQILL-JTQLQIEISA-N 295.310 2.031 10 20 CECD CCN(C)c1ccc(CNCCCOCC(=O)O)c(C)c1 1776856308 IVIMOZZTTDGBRQ-UHFFFAOYSA-N 294.395 2.032 10 20 CECD C[C@H]1CCC[C@]1(NCc1ccc2c(c1)CCO2)C(=O)O 1776639643 PSDZAOCJGXGTMD-MEDUHNTESA-N 275.348 2.355 10 20 CECD Cc1ccc(O)c(CN2CCN(c3ccccn3)CC2)c1 158900490 FOYGNEDKJDFORH-UHFFFAOYSA-N 283.375 2.418 10 20 CECD C[C@@H](NCC(C)(C)O)c1ccc(N2CCOCC2)c(F)c1 160655275 MPUJLWDDEMGGDQ-GFCCVEGCSA-N 296.386 2.084 10 20 CECD CCNC(=O)CN(c1ccc(OC)c(F)c1)C(C)C 156776317 NZFULURKGNOBMC-UHFFFAOYSA-N 268.332 2.185 10 20 CECD COc1ccc(CNC[C@@H]2CN(C(C)=O)C[C@H]2C)cc1C 1048092540 PHKJCIMWJQVKCJ-CZUORRHYSA-N 290.407 2.208 10 20 CECD COc1cccc(O)c1CNC[C@H]1CC[C@@H](C)O1 835088531 SLMILJBYLGOENU-GHMZBOCLSA-N 251.326 2.058 10 20 CECD c1cc2c(cc1CNCCN1CCCC1)CCCO2 228828454 OFAPKCKIHCAXFE-UHFFFAOYSA-N 260.381 2.197 10 20 CECD CC[C@@H](C)N1CCN(Cc2cc(F)ccc2O)CC1 233854190 PKXMQYZRUWZUCS-GFCCVEGCSA-N 266.360 2.447 10 20 CECD Oc1cccc(Cl)c1CNCC[C@H](O)C1CC1 898202794 NACGFYRRXZCORC-LBPRGKRZSA-N 255.745 2.296 10 20 CECD CCN(Cc1ccccc1O)[C@H](C)CS(=O)(=O)CC 179575261 DGSRYLAUPYWZHJ-GFCCVEGCSA-N 285.409 2.037 10 20 CECD CC(=O)NC[C@@H]1CCCN(Cc2cc(C)c(C)cc2O)C1 67382637 MZLZQJGBBDMULN-HNNXBMFYSA-N 290.407 2.357 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nc1ccc2[nH]nnc2c1 181165603 SMDRPLWZPIVBNE-QHHAFSJGSA-N 296.286 2.021 10 20 CECD CO[C@@H](C)CN[C@H](C)c1ccc(N2CCOCC2)cc1 182431092 WVAFCWFNBOYPBC-UONOGXRCSA-N 278.396 2.209 10 20 CECD COc1cc(O)c(CN(C)Cc2cccnc2)cc1OC 182027587 PPOYWHXVFLIFSL-UHFFFAOYSA-N 288.347 2.436 10 20 CECD Oc1ccccc1CNCc1cnc2n1CCCC2 376729105 OAGTXPNLCRKYEU-UHFFFAOYSA-N 257.337 2.215 10 20 CECD CCO[C@@H]1C[C@](CO)(NCc2cccc(C)c2O)C1(C)C 188908053 VREXSYRLETYNSF-RHSMWYFYSA-N 293.407 2.356 10 20 CECD COc1ccccc1NC[C@H](O)COc1ccc(C#N)cc1 315098854 NQBYDCBCXHEJNQ-AWEZNQCLSA-N 298.342 2.419 10 20 CECD COc1ccc(CN[C@@H](C)CCN(C)C)cc1C 49554268 OYZZFWQJDDIPJW-ZDUSSCGKSA-N 250.386 2.433 10 20 CECD Cc1noc(C)c1CN(C)Cc1cc2c(cc1O)OCO2 46478230 ILRGYCSRIZJXTO-UHFFFAOYSA-N 290.319 2.358 10 20 CECD Cc1ccc(CCNC(=O)c2cccc(O)c2O)cc1 193074059 CXRDCLWCZAFRTQ-UHFFFAOYSA-N 271.316 2.379 10 20 CECD CC[C@@H](NC[C@@H]1COCCN1)c1cc(Cl)ccc1O 530223915 IXPUBWKDZYKBMV-DGCLKSJQSA-N 284.787 2.075 10 20 CECD C[C@@H]1OCC[C@@]12CN(Cc1c(O)cccc1Cl)CCO2 279745847 XZBIFOWSHVFIRA-XHDPSFHLSA-N 297.782 2.425 10 20 CECD CCN(CC)c1ccc(CN[C@H](CO)CCOC)cc1F 282104362 DJCCZXDBTSSRTA-AWEZNQCLSA-N 298.402 2.159 10 20 CECD Cc1cc(O)c(CN(C)CCCN(C)C)cc1C 809729936 TUVYAAVECDOLDY-UHFFFAOYSA-N 250.386 2.393 10 20 CECD Cc1nsc(C)c1C(=O)NCCc1ccc(O)c(O)c1 293797193 VDUAPEKKTMEXER-UHFFFAOYSA-N 292.360 2.144 10 20 CECD O=C(O)c1cc(NS(=O)(=O)C2=CCCCC2)ccc1O 296126274 YTYAXJZULLCYRZ-UHFFFAOYSA-N 297.332 2.290 10 20 CECD CCCN[C@H](C)C(=O)NCc1ccc2c(c1)CCCN2C 295142356 IWNDVABVQXIMKT-CYBMUJFWSA-N 289.423 2.073 10 20 CECD CCC[C@H](C)C(=O)NCCNCc1cccc(C)c1O 816626149 WYODGWBKTDZKCJ-ZDUSSCGKSA-N 278.396 2.343 10 20 CECD C[C@@H](N[C@H]1CCNC1)c1cccc(C(F)(F)F)c1O 817945272 YSIHXDKKYWHDAB-BDAKNGLRSA-N 274.286 2.424 10 20 CECD CCCN(CC(N)=O)Cc1ccc(N(CC)CC)cc1 814177535 GKEXQWZYJRGPKR-UHFFFAOYSA-N 277.412 2.230 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1cc(Cl)c(C)cc1O 824547987 HBNPCNLPIGAOKG-LBPRGKRZSA-N 283.755 2.491 10 20 CECD COc1ccc(N(C)C(=O)/C=C\c2cncc(F)c2)nc1 492957107 SRTNMKYGLIFECT-UTCJRWHESA-N 287.294 2.301 10 20 CECD COC1(CO)CCN(Cc2cc(Cl)c(C)cc2O)CC1 825715569 AULNWAOFXBCTDD-UHFFFAOYSA-N 299.798 2.327 10 20 CECD COc1cccc(CNC(=O)C[C@@H]2CC[C@H]3C[C@@H]23)c1O 825703484 VMJZHNPFPXIUAM-GMXVVIOVSA-N 275.348 2.453 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CC1(O)CCC1 825678951 LMRDUILCDKFWLY-UHFFFAOYSA-N 277.364 2.436 10 20 CECD C[S@](=O)[C@@H]1CCC[C@@H](NCc2cc(F)ccc2O)C1 826910301 DWOUTBXIHRIADO-VPZZIHKRSA-N 285.384 2.311 10 20 CECD Cc1sccc1/C=C1\SC(N2CCOCC2)=NC1=O 834412651 MYQRNBUBMFRNFG-FLIBITNWSA-N 294.401 2.359 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCC2(C)C)cc1 747444125 PCJSZDVUMWMIMI-UHFFFAOYSA-N 261.369 2.447 10 20 CECD CCOc1ccc(CNC(C)(C)CC(=O)OC)c(O)c1 741254810 FSUWJUKQGZPZSO-UHFFFAOYSA-N 281.352 2.222 10 20 CECD Cc1ccc([C@H](C)NCCS(=O)(=O)C2CC2)c(O)c1C 840882853 KJRGMJIYSAOTKK-LBPRGKRZSA-N 297.420 2.237 10 20 CECD N[C@H]1Cc2ccccc2N(Cc2cc3c(cc2O)OCO3)C1 841105895 BNVYMLBNSTWMIC-ZDUSSCGKSA-N 298.342 2.011 10 20 CECD COc1cccc([C@@H](C)NCCc2nnc(C)s2)c1O 846174052 WJKDOSFFDRWRDD-SECBINFHSA-N 293.392 2.454 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H]1CCC(=O)O1 851792780 SRJQOHQBUUMDNQ-ZDUSSCGKSA-N 263.337 2.310 10 20 CECD CC[C@@H](N[C@@H]1CCN(C(C)=O)C1)c1ccc(C)cc1O 857084528 UQAJKLREQJJUKF-UKRRQHHQSA-N 276.380 2.362 10 20 CECD CN(C)CCCNCc1cc(F)c(N(C)C)cc1F 858086588 KYNWVHVUMVEQCU-UHFFFAOYSA-N 271.355 2.072 10 20 CECD COc1cccc([C@H](C)N[C@@H]2C[C@]2(C)OC)c1O 850570947 KSYPCTBHWVDFJD-BHYNMZESSA-N 251.326 2.229 10 20 CECD CN(Cc1ccccc1O)S(=O)(=O)CCC(C)(F)F 866834071 INNLGWJMBNBWDX-UHFFFAOYSA-N 293.335 2.199 10 20 CECD CCN(CC)c1ccc(CN(C)C2CC(O)C2)cc1 761223361 PXJJWBNTROYJEP-UHFFFAOYSA-N 262.397 2.488 10 20 CECD OCC[C@@H](NCc1cc(Cl)ccc1O)C1CCOCC1 763468366 XOWBVQAJBZEVSE-CQSZACIVSA-N 299.798 2.313 10 20 CECD CCOc1ccc(CN2CCOC[C@@H](C)C2)c(O)c1 769455680 ICVUNVIXDZYSHF-LBPRGKRZSA-N 265.353 2.259 10 20 CECD CC(C)CC[C@@H](N)C(=O)N[C@H](C)c1ccccc1O 877256233 PYLOIQRDNCWWEL-DGCLKSJQSA-N 264.369 2.333 10 20 CECD COCC(C)(C)N1CCN(Cc2c(C)cccc2O)CC1 877597191 CLXPOCMGEUSUME-UHFFFAOYSA-N 292.423 2.243 10 20 CECD CN1CCN(C(=O)/C=C\[C@@H]2CCCNC2)c2ccccc21 876731213 GJHBCOZWOXHRJG-CKXPSTMWSA-N 285.391 2.025 10 20 CECD C[C@@H](NC(=O)c1ccncn1)c1ccc(N(C)C)cc1 777793062 CFGACCCGWQEYDN-LLVKDONJSA-N 270.336 2.034 10 20 CECD Cc1cccc(CN[C@H](C(=O)N2CCCC2)C(C)C)c1O 776178042 YTMIWZWWPKCAAQ-HNNXBMFYSA-N 290.407 2.437 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1CCC=CO1 777860850 QNWSJXBXQUSJFN-JTQLQIEISA-N 284.406 2.434 10 20 CECD C[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)[C@@H]1CCCOC1 781028987 NGWTXRDSTBAPGF-PDCNKGEESA-N 291.347 2.042 10 20 CECD C[C@H](O)[C@H]1CCN(Cc2cc(Cl)cc(F)c2O)C1 780787561 VYBROLNIGNDUBS-IUCAKERBSA-N 273.735 2.387 10 20 CECD C[C@H](NC[C@H]1CC[C@H](O)C1)c1cc(F)cc(F)c1O 788984320 KNXPSXHCAJWXTA-QXEWZRGKSA-N 271.307 2.482 10 20 CECD C[C@@H]1C[C@H](O)CN1Cc1c(O)ccc(Cl)c1F 792178050 BMONHJFPXHJTOK-SFYZADRCSA-N 259.708 2.140 10 20 CECD COC1CCC(CCNC(=O)c2cccc(O)c2O)CC1 790930739 CNYRQQJOMQDAID-UHFFFAOYSA-N 293.363 2.423 10 20 CECD C[C@H](Cc1ccco1)NCc1cc2c(cc1O)OCO2 42879916 PAONOWQDUZHWKD-SNVBAGLBSA-N 275.304 2.435 10 20 CECD CCOc1ccc(CN2CC[C@@](O)(C3CC3)C2)c(O)c1 1326657518 NHGLJNBMBGWVBX-INIZCTEOSA-N 277.364 2.138 10 20 CECD Cc1ccc(O)c(CNc2ccc(S(C)(=O)=O)nc2)c1 71407209 XLYGGRXLERAVTR-UHFFFAOYSA-N 292.360 2.111 10 20 CECD C[C@H](Nc1cc(N)ncn1)c1ccc(N(C)C)cc1 1337828521 BENMZQAVRIAEJQ-JTQLQIEISA-N 257.341 2.298 10 20 CECD CC[C@H]1CN(Cc2cccc(OC)c2O)C[C@H](C)O1 92487379 MZLCGXNSFACEQF-AAEUAGOBSA-N 265.353 2.400 10 20 CECD O=C(NCc1ccc(O)cc1O)c1cc2c(o1)CCCC2 1349951376 NMROZZIHFQUIOP-UHFFFAOYSA-N 287.315 2.500 10 20 CECD C[C@@H]1CN(c2nnc(-c3sccc3O)n2C)CCS1 1350467932 BIUZFTHZWHMNIC-MRVPVSSYSA-N 296.421 2.191 10 20 CECD CO[C@H](C)[C@H](C)N[C@@H](C)c1cc(C(=O)O)ccc1O 1606666632 OBGRDSYFTVYDON-LPEHRKFASA-N 267.325 2.164 10 20 CECD Cc1nn(CCC(=O)O)c(C)c1CNc1ccc(N)cc1 1610570432 ARIYUOQPQGOZEW-UHFFFAOYSA-N 288.351 2.169 10 20 CECD CC[C@H]1CN(Cc2cc(F)c(F)cc2O)CC[C@@H]1N 1577279214 ALMWYTBGQOCWCD-ZANVPECISA-N 270.323 2.230 10 20 CECD C[C@H](N[C@@H]1C[C@@H]2CCC[C@@H]21)c1cccc(-c2nn[nH]n2)c1O 1589957710 SJJUVCQDWUMCRZ-JYYRZZBQSA-N 299.378 2.412 10 20 CECD N[C@H]1C[C@@H](CNCc2cc(Cl)c(F)cc2O)C1 1580421926 WPCKZSZZGPWWAT-OTSSQURYSA-N 258.724 2.012 10 20 CECD CCN1CCCc2cc(CNCC[C@@H](F)C(=O)O)ccc21 1776875591 TUQJURNGLDKMJM-CQSZACIVSA-N 294.370 2.362 10 20 CECD Cc1ccc(O)c(CN[C@H](C)C2CCS(=O)(=O)CC2)c1 862478443 HNYJHEACJCTIHS-GFCCVEGCSA-N 297.420 2.004 10 20 CECD Cc1cccc(CNCCCOC[C@H]2CCCO2)c1O 158080520 QDTJUSRBODRFCU-OAHLLOKOSA-N 279.380 2.376 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H](C)CC[S@@](C)=O)c1 168840240 RCYJNUVGLHCXJD-FDMGOTLNSA-N 285.409 2.209 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](N)C(C)C 37807400 PISKJHGXCXKXKR-HNNXBMFYSA-N 277.412 2.084 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CC[C@@H]([C@H](C)O)C2)c1O 167857896 GBQVITFSKDDJOC-GXSJLCMTSA-N 297.782 2.451 10 20 CECD CCN(CC)[C@@H]1CCN(Cc2cc(F)ccc2O)C1 179915597 JHTPNUKDYIMTEX-CQSZACIVSA-N 266.360 2.447 10 20 CECD CCc1nn(C)cc1C(=O)N[C@H](C)c1ccccc1O 1119276670 VFYQBGZFNBAYRK-SNVBAGLBSA-N 273.336 2.179 10 20 CECD COc1ccc(O)c(CN[C@H](C(=O)O)c2ccccc2)c1 50509097 ZTCBNFHRKDSJBQ-HNNXBMFYSA-N 287.315 2.316 10 20 CECD CN(CCc1ccccc1)CC(=O)N(C)c1ccc(N)cc1 316606101 QBCCEXUHGJGKGK-UHFFFAOYSA-N 297.402 2.406 10 20 CECD Cc1cc(CN2CCOc3cc(N(C)C)ccc32)no1 175027688 LODJDUJZTMXVTO-UHFFFAOYSA-N 273.336 2.448 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)[C@H]1CCCCN1 37807395 JBGJWNTTXYTKMI-MRXNPFEDSA-N 289.423 2.243 10 20 CECD COc1ccc(N2CCN(c3nc(C)ns3)CC2)cc1 266175987 SXSLGUAEJHFSBI-UHFFFAOYSA-N 290.392 2.182 10 20 CECD CCOC1CC(O)(CN[C@@H](C)c2cc(C)ccc2O)C1 278547856 VOTBWOIXMMYVPW-FUJMWEONSA-N 279.380 2.281 10 20 CECD C[C@H]1CCN(Cc2cccc(Cl)c2O)CC[S@@]1=O 277601070 LEKKNYUEPPUNOO-YPMLDQLKSA-N 287.812 2.389 10 20 CECD C[C@H](N[C@@H](C)c1cc(Cl)ccc1O)C(=O)NCCF 282791853 QGWQSNNDESBELX-IUCAKERBSA-N 288.750 2.170 10 20 CECD Cc1cc(O)c(CN2CCC[C@@](F)(CO)C2)cc1C 289789017 LSYKNIFTTKLQDQ-HNNXBMFYSA-N 267.344 2.305 10 20 CECD C[C@H](CC(C)(C)O)NCc1ccc(N2CCOCC2)cc1 385222379 RUIUDOSRHWSCGL-CQSZACIVSA-N 292.423 2.162 10 20 CECD COC(=O)c1cnc(SCC(=O)c2cc(C)no2)s1 295403212 WNBCDIIJCOSNKV-UHFFFAOYSA-N 298.345 2.201 10 20 CECD Cc1cc(Cn2nccc2[N+](=O)[O-])ccc1N(C)C 292795605 ZVOFMXCBCOPWHA-UHFFFAOYSA-N 260.297 2.214 10 20 CECD C[C@H](N[C@@H]1CC[C@H](CN)C1)c1cc(F)ccc1O 817982236 PRJCKKCOFDHBSZ-JBLDHEPKSA-N 252.333 2.309 10 20 CECD CCOc1ccc(CNCC[C@H](C)OC)c(O)c1 726607567 QGGAXMAQTQGTSS-NSHDSACASA-N 253.342 2.306 10 20 CECD C[C@@H](O)CN(Cc1ccc(N(C)C)c(F)c1)CC(F)F 825098825 OTOJPQCSWMXJBF-SNVBAGLBSA-N 290.329 2.340 10 20 CECD CCCCN(CC[S@@](C)=O)Cc1ccccc1O 829515751 GEMKMTYGBQITDC-GOSISDBHSA-N 269.410 2.373 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)[C@H]2C[C@H]3CC[C@H]2O3)c1 733806435 CQRWBTGWSHZFTF-ZOUAZZMLSA-N 291.347 2.146 10 20 CECD O=C(c1cc(O)cs1)N1CC2(CCOCC2)[C@@H]1C1CC1 832899302 SNNSZMPERHKGOL-ZDUSSCGKSA-N 293.388 2.485 10 20 CECD C[C@@H]1C[C@@H](NC(=O)/C=C\c2ccc(O)c(O)c2)CS1 840510208 MZUNFUITUKFVOB-VVCGMDSISA-N 279.361 2.121 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@@H](C)c1cc(Cl)cc(C)c1O 840826559 OCJPZGZVZCVYSX-TVYUQYBPSA-N 285.771 2.418 10 20 CECD COc1cccc(O)c1CNC[C@@H]1NCCc2ccccc21 841068637 FREPNCBLFZSBHM-INIZCTEOSA-N 298.386 2.377 10 20 CECD O=C(OCC[C@H]1CCCC1=O)c1cc(O)cs1 748187684 FJSXWWNZSZEQQH-MRVPVSSYSA-N 254.307 2.370 10 20 CECD CC[C@@H](NCc1cc([N+](=O)[O-])ccc1O)[C@H](O)C(C)C 840966169 CXGMHLPUHUDFOV-TZMCWYRMSA-N 282.340 2.186 10 20 CECD Cc1cc(O)c(CN2CC[C@@H]3NCC[C@@H]3C2)cc1C 843126037 FEZDFWKHXGCKMT-HIFRSBDPSA-N 260.381 2.193 10 20 CECD CN(C)c1ccc(CNCCC(=O)Nc2ccccn2)cc1 742696873 OIPHXXXHJNPFPQ-UHFFFAOYSA-N 298.390 2.266 10 20 CECD CCc1cccc(CN2CCc3c[nH]nc3C2)c1O 848888100 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CCN(C)c1ccc(CN2CC[C@H](C)[S@@](=O)CC2)cc1 773888649 LEHUWWJCMCMIRO-XOBRGWDASA-N 294.464 2.486 10 20 CECD CO[C@H](C)CN(C)Cc1ccc(N2CCC(O)CC2)cc1 877522110 APIXZHNYUATRME-CQSZACIVSA-N 292.423 2.114 10 20 CECD CO[C@H](CC(=O)N(C)c1ccc(N)cc1)C(F)(F)F 877074981 XAYPXVLCLLPZPQ-SNVBAGLBSA-N 276.258 2.199 10 20 CECD Oc1ccccc1CN1CCC(O[C@H]2CCOC2)CC1 779023970 AEVVDJBYAYXUOV-HNNXBMFYSA-N 277.364 2.162 10 20 CECD CC1=NO[C@@H](CNCc2ccc3c(c2)CCCO3)C1 895428529 IADTZTRUKZLHMG-CQSZACIVSA-N 260.337 2.266 10 20 CECD CC[C@H](C)[C@H](O)CNCc1cc(C)cc(OC)c1O 894250052 CZKBWGALAGSRLS-WCQYABFASA-N 267.369 2.206 10 20 CECD COc1cc(C)cc(CN(C)CCCN(C)C)c1O 894761912 AREQIGJLJYUCIG-UHFFFAOYSA-N 266.385 2.093 10 20 CECD COc1cc(C)cc(CN[C@H]2C[C@@H](C)N(C3CC3)C2)c1O 894340512 OZMVJLXNXNFGLH-OCCSQVGLSA-N 290.407 2.424 10 20 CECD O=C1C(=O)c2c(nc3ccccn23)-c2ccc([N+](=O)[O-])cc21 98178771 SIQNPNRHNKQHFN-UHFFFAOYSA-N 293.238 2.289 10 20 CECD CC(C)(C)N1CCN(C(=O)c2cc(O)cs2)CC1 1327764921 DCCVNVKHZONRJD-UHFFFAOYSA-N 268.382 2.010 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2C[C@@H](O)C2)cc1 720964044 YDPAYENOIFRFGT-FZNQNYSPSA-N 262.397 2.393 10 20 CECD CC[C@H]1CO[C@H](C)CN1Cc1c(O)cccc1OC 768172226 NSHGCIMMFVURDH-NEPJUHHUSA-N 265.353 2.400 10 20 CECD COc1ccc(CN[C@@H]2CC[C@@H](CC(=O)O)[C@@H]2C)c(O)c1 1607259939 GZKJSNYFYBXKJR-COPLHBTASA-N 293.363 2.380 10 20 CECD Cc1ccc(CN[C@@H]2C[C@H]3CC[C@@H](N3)[C@H]2C)c(O)c1 1579696905 LUZZPJXHHIBPME-NMFUWQPSSA-N 260.381 2.319 10 20 CECD C[C@H]1CN(Cc2ccc3ccccc3c2O)CCN1 1579489505 ISKSGSBHJYFCQZ-LBPRGKRZSA-N 256.349 2.339 10 20 CECD Cc1cc(CCNC(=O)[C@H](C)CN)c(C)n1-c1ccccc1 1579592777 LFAZNPWWTJCNHG-CYBMUJFWSA-N 299.418 2.348 10 20 CECD Nc1ccc(CN[C@@H]2CCN(c3ccccc3)C2=O)cc1 1580445792 WDNFFBGXRHGIBN-MRXNPFEDSA-N 281.359 2.164 10 20 CECD CS[C@@H](CO)[C@H](C)NCc1ccc(N2CCCC2)cc1 219077361 BSPSVACXIPBTIX-BBRMVZONSA-N 294.464 2.489 10 20 CECD C[C@H]1COCCN1Cc1cc2c(cc1O)CCCC2 159775280 KUYRVXPDPBKXJV-LBPRGKRZSA-N 261.365 2.492 10 20 CECD Oc1cc2c(cc1CNCC1(C3CC3)CC1)OCO2 130731244 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20 CECD C[C@@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(Cl)cc1O 841752547 UFNJJZXDNOUCPB-RKDXNWHRSA-N 291.800 2.129 10 20 CECD CSC(C)(C)CNC(=O)NCCc1ccc(N)cc1 841957189 GIRLTOKWNDFCOC-UHFFFAOYSA-N 281.425 2.252 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H](N)C(C)C 841944430 HVODKUGHKXQFCS-AWEZNQCLSA-N 293.411 2.297 10 20 CECD CCOc1cccc(CNC[C@@]2(C)CCCNC2)c1O 841057931 SLQBVEOWGAFDSC-INIZCTEOSA-N 278.396 2.270 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)C[C@@H](C)N)c1O 843129890 SRXJBXQYGXYVLA-BDAKNGLRSA-N 272.776 2.270 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CC[C@@H](CN)C1 841083276 AKSYMQHCLAWDBS-UKRRQHHQSA-N 261.413 2.278 10 20 CECD C[C@@H]1O[C@H](C)C[C@@H]1CNC(=O)/C=C/c1ccc(O)c(O)c1 840514059 CVRMMAIQCXPMNX-YYRASVQTSA-N 291.347 2.041 10 20 CECD C[C@H](NC[C@@H](O)C(F)(F)F)c1cc(F)cc(F)c1O 756450594 SUKUHUMKPAWQQU-SSDLBLMSSA-N 285.212 2.244 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NCC(C)(C)OC)c1 756645415 FUBKZIJBUMVEDE-JTQLQIEISA-N 281.352 2.254 10 20 CECD N[C@]12CCC[C@@H]1CN(Cc1c(O)ccc(Cl)c1F)C2 857226146 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CCN(CC)c1ccc(CNCc2ncnn2CC)cc1 793346953 WJYDVKUJLGBMJL-UHFFFAOYSA-N 287.411 2.434 10 20 CECD CN(Cc1ccccc1O)C(=O)Cc1ccc(O)cc1 133273053 CEDPAOUMYSJSEX-UHFFFAOYSA-N 271.316 2.299 10 20 CECD Nc1ccc(CC(=O)Nc2ccc3c(c2)CCC(=O)N3)cc1 84844036 CDECFLCLWLLUND-UHFFFAOYSA-N 295.342 2.335 10 20 CECD Cn1nc(-c2ccco2)cc1NC(=O)c1cccc(O)c1O 1326775087 HNRSJVMOXRXXHS-UHFFFAOYSA-N 299.286 2.344 10 20 CECD C[C@@H](NC(=O)NC1CC2(CC(N)C2)C1)c1ccccc1O 1336290285 BPOAIVAKAWUNNC-CUMPHSRVSA-N 289.379 2.022 10 20 CECD COc1cc(C)cc(CN2CCC[C@]2(C)CO)c1O 1331569604 QACSAXSWDZTDCZ-OAHLLOKOSA-N 265.353 2.056 10 20 CECD CCc1nc(C)c(CNC(=O)NCc2ccc(N)cc2)o1 1346439776 CZBAWZNWBNXORY-UHFFFAOYSA-N 288.351 2.127 10 20 CECD O=C(O)[C@H]1CC[C@H](NCc2cc(Cl)ccc2O)C1 1601794591 LXUXGUBHCFIGRX-KWQFWETISA-N 269.728 2.389 10 20 CECD C/C(=C\CN[C@H](C)c1ccc(N(C)C)cc1)C(=O)O 1609503416 NRSBNNREVJBDSC-LMMOQWNQSA-N 262.353 2.434 10 20 CECD O=C(O)[C@H]1CCC[C@H]1NCc1cccc(Cl)c1O 1610742178 OHQOCUKZIVNAGL-GXSJLCMTSA-N 269.728 2.389 10 20 CECD Oc1ccc(Br)cc1CNCCCNC1CC1 841093871 VLAPQRWQNIAGGS-UHFFFAOYSA-N 299.212 2.386 10 20 CECD COc1cc(C)c(CNCCCCC(=O)O)c(O)c1 1574182158 PTGHRYHFIGIKCN-UHFFFAOYSA-N 267.325 2.054 10 20 CECD C[C@@H](NC(=O)C1(C(=O)O)CCC1)c1ccc(N(C)C)cc1 1589090323 QCAJLOKEKFJZSO-LLVKDONJSA-N 290.363 2.185 10 20 CECD Cc1nc(CNCc2ccc(C(=O)O)cc2O)sc1C 1777502373 VABYOHWKKKRHRB-UHFFFAOYSA-N 292.360 2.454 10 20 CECD COc1cccc(COCC(=O)Nc2ccc(N)cc2)c1 19512358 GWOLMJCFJSZNGH-UHFFFAOYSA-N 286.331 2.433 10 20 CECD COc1cccc(/C=C2/SC(=S)NC2=O)c1F 206404007 NOKBRDDRRYHJNR-VMPITWQZSA-N 269.322 2.323 10 20 CECD CC(C)S(=O)(=O)CCCSc1nccs1 158552401 AOSZBVGNIXWIIA-UHFFFAOYSA-N 265.425 2.449 10 20 CECD CSC[C@](C)(O)CNCc1ccc2c(c1)CCCO2 921767773 SIHIJQAFKDRIJJ-OAHLLOKOSA-N 281.421 2.215 10 20 CECD COc1cccc(CN2CC[C@@H](OC)[C@H](C)C2)c1O 824814713 DUNRWSBJLLUGNF-DGCLKSJQSA-N 265.353 2.258 10 20 CECD CO[C@]1(CN[C@H](C)c2ccc(N(C)C)cc2)CCOC1 123251547 PJNYLAHZQKRMEX-CJNGLKHVSA-N 278.396 2.209 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](C)Cn2ccnc2)c1 37157739 IKGIKPQDVNQYCH-VXGBXAGGSA-N 275.352 2.337 10 20 CECD C[C@@H]1C[C@H](CNC(=O)Nc2ccc(N)cc2)CCO1 388927399 BJOOXROQNWDXMT-GHMZBOCLSA-N 263.341 2.205 10 20 CECD CC(C)[C@H](N[C@@H](C)c1ccc(F)cc1O)C(=O)O 62748313 MYFNFACYXWIMPA-UFBFGSQYSA-N 255.289 2.291 10 20 CECD COCC(C)(C)NC(=O)NCc1ccc(N(C)C)c(F)c1 119282943 BLORBVHREIPHFV-UHFFFAOYSA-N 297.374 2.116 10 20 CECD COc1cc(O)c(CN(C)CC2(O)CCCC2)cc1OC 180314727 PPDZICGAXRRBAX-UHFFFAOYSA-N 295.379 2.146 10 20 CECD CCCCCOCC(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 186395150 NGHLRIWTDMGWPO-LBPRGKRZSA-N 295.379 2.352 10 20 CECD CC(C)(C)[C@@H](CCO)NC(=O)/C=C/c1ccc(O)c(O)c1 181309660 CCKABWRHSLOPFD-HZRUHFOJSA-N 293.363 2.024 10 20 CECD Cc1cc(O)c(CN2CCS(=O)(=O)[C@H](C)[C@@H]2C)cc1C 122526540 CGUAVLZGRVCDAM-QWHCGFSZSA-N 297.420 2.016 10 20 CECD Cc1ccc([C@@H](C)N[C@@H](C)C[S@](C)=O)c(O)c1 186540789 ZTOHUEWDQBRXIX-RVPKQNPDSA-N 255.383 2.118 10 20 CECD COc1ccc(N(C)C[C@@H](O)COCC(C)C)cc1F 131428062 GSDZJACUFSUJNF-CYBMUJFWSA-N 285.359 2.304 10 20 CECD NCCCCCC(=O)NCc1ccc(N2CCCC2)cc1 195171387 BJGFOEYLIMFSCC-UHFFFAOYSA-N 289.423 2.422 10 20 CECD CCOc1ccc(O)c(CN2CCC[C@H](N(C)C)C2)c1 92938767 UMLDEABKXWGIAP-AWEZNQCLSA-N 278.396 2.317 10 20 CECD CN(C)Cc1ccccc1CNC(=O)Cc1ccc(N)cc1 237038883 DLHBBKWVWOGTTP-UHFFFAOYSA-N 297.402 2.189 10 20 CECD CN(C)c1ccc(CNC(=O)C2(CN)CCCC2)cc1F 237081535 VIQVLMGENWCJJP-UHFFFAOYSA-N 293.386 2.027 10 20 CECD CCO[C@@H]1C[C@@H](NCc2ccc(N(C)C)c(F)c2)[C@@H]1OC 272683487 TWIOIYQQONZKDW-BMFZPTHFSA-N 296.386 2.174 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCc3c[nH]nc3C2)cc1 371141421 YPWUDKQIMIERFE-CQSZACIVSA-N 270.380 2.123 10 20 CECD COCC1(CCNC(=O)c2cccc(O)c2O)CCC1 293891638 LXIFGGLMSCLWMZ-UHFFFAOYSA-N 279.336 2.034 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CC[C@@H]3CNC[C@@H]3C1)CC2 817985576 FPCIBZVLIUYVMA-LXTVHRRPSA-N 272.392 2.357 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2ccc(C)cc2O)n1 818344233 AJLPJFGPDNWEEM-NSHDSACASA-N 274.368 2.471 10 20 CECD CC[C@H](NC[C@H](N)c1ccc(N(C)C)cc1)[C@@H]1CCOC1 817940427 GEWXFPVDAFAPBK-PVAVHDDUSA-N 291.439 2.157 10 20 CECD Cc1cc(CN2CC[C@H](C)[S@](=O)CC2)ccc1N(C)C 815103731 XRLJRZJFQAOQAS-VBKZILBWSA-N 294.464 2.404 10 20 CECD COC[C@]1(CN[C@H](C)c2ccc(C)c(C)c2O)CCCN1 817974470 MMWJLMHATRSFCC-RHSMWYFYSA-N 292.423 2.428 10 20 CECD Cc1nsc(C)c1C(=O)NCc1ccc(O)c(O)c1 815835903 IYXCOBHWQGZAFZ-UHFFFAOYSA-N 278.333 2.101 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)C1(O)CCC1 813683146 UZWVJALGXZELEN-UHFFFAOYSA-N 290.146 2.230 10 20 CECD C[C@@H]1C[C@H](O)CN(Cc2cc(Cl)c(F)cc2O)C1 825315446 AUIDHNGDPCIFKL-SCZZXKLOSA-N 273.735 2.387 10 20 CECD CC[C@H](OC)C(=O)N[C@H](C)c1cc(OC)ccc1O 728983059 SWRIVRQDROBIEU-RNCFNFMXSA-N 267.325 2.003 10 20 CECD CN(Cc1ccccc1O)C(=O)/C=C\c1ccc[nH]1 588549182 IQVZDEYHLVJPAN-HJWRWDBZSA-N 256.305 2.392 10 20 CECD COC(=O)c1cnc(SCc2csnn2)s1 829677697 IRTQUGLPYAMARF-UHFFFAOYSA-N 273.364 2.074 10 20 CECD CC[C@H](CN1CCOCC1)N[C@@H](C)c1cc(F)ccc1O 903343181 NJCZFRCMHLGPMO-GXTWGEPZSA-N 296.386 2.293 10 20 CECD O=C1CCC[C@@H]1[C@@H]1CCCN1C(=O)c1cc(O)cs1 831433361 FXIAAIXJNBOVSY-MNOVXSKESA-N 279.361 2.428 10 20 CECD Cc1c(C)n(C)c2ccc(OC[C@@H]3CNC(=O)C3)cc12 902442768 DENVHKKINXZHIW-LBPRGKRZSA-N 272.348 2.310 10 20 CECD C[C@H](NC(=O)N[C@@H]1CCC[C@H]1O)c1ccc(N(C)C)cc1 838560244 VFROEEXBDTZGHJ-NILFDRSVSA-N 291.395 2.026 10 20 CECD COc1cc2c(c(OC)c1)N(Cc1nccn1C)CCC2 839656441 LIIFZFFOBGDLJO-UHFFFAOYSA-N 287.363 2.390 10 20 CECD CN(CCOCCN)Cc1ccc(N2CCCCC2)cc1 844221080 SPCMZNFIAINODO-UHFFFAOYSA-N 291.439 2.084 10 20 CECD CN1CCN(c2ccc(CN3CCC[C@H](F)C3)cc2)CC1 846121384 YYZCTDUYBZNJOT-INIZCTEOSA-N 291.414 2.372 10 20 CECD C(=C\c1cnccn1)\c1ccc(N2CCOCC2)cc1 849247101 ZAHRSANMIMKSMB-RJRFIUFISA-N 267.332 2.484 10 20 CECD CCOc1cccc(CN[C@@H]2CC[C@@H](CN)C2)c1O 841084550 KQASXBZLPFYHSK-DGCLKSJQSA-N 264.369 2.008 10 20 CECD CC(C)(N)CCC(=O)NCc1ccc(N2CCCC2)cc1 844172709 HICZNJBCHMUDIQ-UHFFFAOYSA-N 289.423 2.421 10 20 CECD COc1cc(O)c(CNC[C@@H]2C[C@@H](C)O[C@H]2C)cc1OC 840963976 PSINRNLSTQPAPH-WOPDTQHZSA-N 295.379 2.313 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1CCN(CC(F)F)C1)CC2 841762524 PUPZDXMEUHUKPP-NWDGAFQWSA-N 282.334 2.309 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCN[C@@H](C(C)C)C1 843105844 XJGQCMYUZUEZJA-QGZVFWFLSA-N 275.440 2.491 10 20 CECD CCOc1cccc(CN[C@@H](C)[C@H]2CCCNC2)c1O 841033086 KGJIVTATVGTQFD-STQMWFEESA-N 278.396 2.269 10 20 CECD COc1cc(CN2C[C@H]3[C@H]4C=C[C@@H](O4)[C@H]3C2)c(O)cc1C 840131220 UIUMECOYBWAISS-OCVGTWLNSA-N 287.359 2.094 10 20 CECD Cc1cc(CN[C@H](C)[C@H](C)C(=O)O)ccc1N(C)C 846229661 XEMMVPVYHCZRNS-NWDGAFQWSA-N 264.369 2.260 10 20 CECD CN(Cc1ccccc1O)C(=S)NC[C@@H]1CCCCO1 758197732 KPLOGRXGLJPCDV-ZDUSSCGKSA-N 294.420 2.268 10 20 CECD CC(=O)N1CC[C@@H](N[C@H]2C[C@@H](C)c3c(F)ccc(O)c32)C1 857084289 LNHZRPQLJXKUBG-XWIASGKRSA-N 292.354 2.290 10 20 CECD CCC[C@H](O)CNCc1cc(F)c(N(C)C)cc1F 858134417 BXIVMBMHQCOJIK-NSHDSACASA-N 272.339 2.281 10 20 CECD Oc1ccc(Cl)cc1CNCCCNc1ncccn1 751505237 AESTUHPVSVVWPA-UHFFFAOYSA-N 292.770 2.427 10 20 CECD C[C@H](CCS(C)(=O)=O)N[C@H](C)c1ccc(F)cc1O 185790678 DBHUPHHFCCJRHJ-NXEZZACHSA-N 289.372 2.005 10 20 CECD C[C@H](NC[C@H](C)CCO)c1cc(F)cc(F)c1O 756617647 JRUHXBIIIRDWKG-BDAKNGLRSA-N 259.296 2.340 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)/C=C/SC)c1 761973170 NCNKWZACOBNXJD-XCODYQFDSA-N 267.350 2.455 10 20 CECD CN(C)c1ccc(CN2CCC[C@@H]2C2OCCO2)cc1 933898908 ITGXKXRDYRISHI-OAHLLOKOSA-N 276.380 2.090 10 20 CECD C[C@H](Cc1ccc(O)c(O)c1)Nc1cccnc1[N+](=O)[O-] 762799789 AXKDZEULARSVQI-SECBINFHSA-N 289.291 2.444 10 20 CECD COC(=O)[C@@H](CC(F)(F)F)NCc1ccc(C)cc1O 877470025 XDLGSAYGAMVZAE-SNVBAGLBSA-N 291.269 2.284 10 20 CECD COc1ccc2c(c1)CCCN2CC(=O)Nc1ccccn1 877943964 IBSZQZMOCNDOOF-UHFFFAOYSA-N 297.358 2.482 10 20 CECD CN(C(=O)c1cccc(O)c1O)c1ccc2c(c1)OCO2 776677978 ZOGQCOQLURAPSB-UHFFFAOYSA-N 287.271 2.103 10 20 CECD O=C(c1cc(O)cs1)N(C[C@@H]1CCOC1)C1CC1 771051797 WSMTYGWJFCXUSS-VIFPVBQESA-N 267.350 2.095 10 20 CECD COCn1ncc(C)c1CNCc1ccc2c(c1)CCO2 1117696818 QTDOWBKRBJRIQQ-UHFFFAOYSA-N 287.363 2.020 10 20 CECD COC[C@@H](C)NC(=S)N[C@H](C)c1ccc(N(C)C)cc1 774248734 HNRIXPDLRGELLP-VXGBXAGGSA-N 295.452 2.313 10 20 CECD C[C@H](NC(=O)N[C@H](C)c1ccc(N(C)C)cc1)C(C)(C)O 776237184 DYDPGQCHAAPNNU-NEPJUHHUSA-N 293.411 2.272 10 20 CECD C[C@H](N[C@H](C)C(=O)NC(C)(C)C)c1c(O)cccc1F 886516539 MSYSIUAMONUZNN-VHSXEESVSA-N 282.359 2.485 10 20 CECD O=C(N[C@@H]1CCCc2cccnc21)c1cccc(O)c1O 885365554 WTYQMLMVDOZWMG-GFCCVEGCSA-N 284.315 2.300 10 20 CECD COC(=O)[C@@H](CC(F)F)NCc1ccc2c(c1)CCCO2 893955200 BFOGVFAOYJTEAB-GFCCVEGCSA-N 299.317 2.298 10 20 CECD CC(=O)NC[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 893864798 DKZFWCGWCIGGTJ-NSHDSACASA-N 298.333 2.019 10 20 CECD CCN(CCCN(C)C)Cc1ccc(OC)c(OC)c1O 894472016 QAYSRQDIHHFVCO-UHFFFAOYSA-N 296.411 2.183 10 20 CECD COc1cc(C)cc(CNCCc2nccs2)c1O 894210462 BRPCPOXEWAIRIY-UHFFFAOYSA-N 278.377 2.498 10 20 CECD C[C@@H]1CN(Cc2cc(F)cc(F)c2O)C[C@@]2(CCOC2)O1 894629669 MCJNWNWTFJDRBZ-MEBBXXQBSA-N 299.317 2.050 10 20 CECD C[C@@H]1C[C@H](NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CO1 898447924 NFCAIXKGMCTFRW-UKPHBRMFSA-N 291.439 2.122 10 20 CECD CCC(O)(CC)CNCc1cc(C)cc(OC)c1O 894207997 CHLGRKQXHJROEZ-UHFFFAOYSA-N 267.369 2.350 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cn(C(C)C)nn2)c1 794461428 JPCBWDCMTPALKI-NSHDSACASA-N 290.367 2.424 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)COC(F)F 795752279 JGERSBGBRIUDFH-UHFFFAOYSA-N 286.322 2.340 10 20 CECD CCC[C@@H](CNC(=O)c1cc(O)cs1)C(=O)OCC 791044763 NSSCKWRACDVIMH-VIFPVBQESA-N 285.365 2.163 10 20 CECD C[C@H](N[C@H](C)c1ncnn1C)c1ccc(N(C)C)cc1 276592865 JKYVVSXEUHZQDE-NWDGAFQWSA-N 273.384 2.293 10 20 CECD COc1cc(O)c(CNCCC2CCOCC2)cc1OC 1320081228 KAUZTDPIKCIBHN-UHFFFAOYSA-N 295.379 2.316 10 20 CECD COc1ccc(CN[C@H](C)C[C@@H]2CCOC2)c(O)c1OC 1335478343 GPCBZYKFRFMNTE-NEPJUHHUSA-N 295.379 2.314 10 20 CECD C[C@H](NC/C=C/Cl)c1cc(C(=O)O)ccc1O 1593256461 IAGLOEPIRJJPOY-NCJLJLRUSA-N 255.701 2.494 10 20 CECD CCOCCN(CC)Cc1cc(OC)ccc1O 156022293 WIROZGVAXFDGPI-UHFFFAOYSA-N 253.342 2.259 10 20 CECD COc1ncc(Cl)c(NCCc2ccc(O)c(O)c2)n1 811811505 WJDPMXJXTHZDFL-UHFFFAOYSA-N 295.726 2.204 10 20 CECD C[C@H](NCCCn1cccn1)c1cc(F)ccc1O 126309621 XXGRSVARVKDPAV-NSHDSACASA-N 263.316 2.469 10 20 CECD COC(=O)[C@H](C)NCc1ccc(N2CCCCC2)cc1 37073703 HAVCUUOJDBOBBW-ZDUSSCGKSA-N 276.380 2.328 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](N)C(C)(C)C 40464524 LEJBRKRXKXAPME-CQSZACIVSA-N 277.412 2.084 10 20 CECD C[S@@](=O)C1(CN[C@@H]2CCc3cccc(O)c32)CCC1 296240962 AUUXTQBWMRWVEP-CWTRNNRKSA-N 279.405 2.270 10 20 CECD C[C@H]1OCC[C@]1(C)NCc1cc(F)cc(F)c1O 708438537 WITQWWDZZMHQGV-OQPBUACISA-N 257.280 2.328 10 20 CECD C[C@H](N[C@H]1CCO[C@H]1C)c1ccc(N2CCOCC2)cc1 120534249 RGOGXEUQFWRWQE-ZQIUZPCESA-N 290.407 2.351 10 20 CECD CCC(O)(CC)CNCc1cc(OC)c(OC)cc1O 181255487 KVFIEHCTLCMVLZ-UHFFFAOYSA-N 283.368 2.050 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CC[C@H](O)CC1 252740190 IRJLCBVTOLYMRL-XYPYZODXSA-N 255.745 2.439 10 20 CECD Cc1ccc(O)c([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)c1 185317385 MEVRBKFAIOPGEU-WCQYABFASA-N 286.379 2.266 10 20 CECD CC[C@@H](NCC(F)(F)CO)c1ccc(N(C)C)cc1 184715293 ZFRMKHANPGGVQQ-CYBMUJFWSA-N 272.339 2.421 10 20 CECD CC(C)(CCO)CNCc1ccc(N2CCOCC2)cc1 80534963 SGJKPBURAPIONV-UHFFFAOYSA-N 292.423 2.021 10 20 CECD CC[C@H]1CC[C@H](C(=O)N(C)Cc2ccccc2O)O1 268201643 GFAZZQDPEHWNTQ-GXTWGEPZSA-N 263.337 2.308 10 20 CECD CN(C)c1ccc(CN2CCC(c3nncn3C)CC2)cc1 91794729 DZXMTLSYUKSMOS-UHFFFAOYSA-N 299.422 2.261 10 20 CECD OC[C@@H](CNCc1ccccc1O)Cc1ccc(F)cc1 263727054 XMXCBTHVAAWTDX-CQSZACIVSA-N 289.350 2.472 10 20 CECD Cc1ccc(C(=O)N2CCOCC23CCCC3)c(O)c1O 273019222 RDXBRMCBLNZCBH-UHFFFAOYSA-N 291.347 2.191 10 20 CECD CN(C)[C@H]1CCCN(Cc2cc3c(cc2O)OCO3)CC1 277406901 IBUVLFCVACRFQW-ZDUSSCGKSA-N 292.379 2.037 10 20 CECD C[C@@H]1C[C@@H](CNC(=O)N(C)Cc2ccccc2O)CCO1 271491390 FOCCDGYRNQJJOO-OLZOCXBDSA-N 292.379 2.349 10 20 CECD C[C@@H]1[C@@H](C)[S@@](=O)CCN1Cc1ccc(N(C)C)c(F)c1 271200518 PSPXTASXTPLJFS-HTGLOVNISA-N 298.427 2.233 10 20 CECD CC[C@@H](CCO)CN[C@H](C)c1cc([N+](=O)[O-])ccc1O 273591875 PJIRFFAKRGITOL-MNOVXSKESA-N 282.340 2.360 10 20 CECD COc1ccc(O)c(CN[C@]2(C)CCO[C@H]2C2CC2)c1 273175734 NHPSVCBYGHDANU-JKSUJKDBSA-N 277.364 2.448 10 20 CECD COC[C@@H](O)CN[C@H](C)c1cc(Cl)c(Cl)cc1O 278680501 JVERQGHXSRKFKE-SFYZADRCSA-N 294.178 2.357 10 20 CECD CCCCN(CCO)Cc1ccc(N(C)C)cc1 270981284 CYERQCHOXPSNJF-UHFFFAOYSA-N 250.386 2.347 10 20 CECD Cc1ccc(C(=O)NC[C@H]2CCCSC2)c(O)c1O 292190423 FYDJNCLSAMLYGT-SNVBAGLBSA-N 281.377 2.279 10 20 CECD C[C@@H]1CN(C(=O)c2c(F)ccc(O)c2O)CC[C@H]1C 297299879 YMEWILQHJZGTDF-RKDXNWHRSA-N 267.300 2.355 10 20 CECD CNc1c(Cl)ncnc1NCc1cc(OC)ccc1O 811805521 VQOQDUMQJWBLLA-UHFFFAOYSA-N 294.742 2.498 10 20 CECD CNC[C@H](C)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 818608078 LIASQXGNALLGAR-AWEZNQCLSA-N 291.439 2.345 10 20 CECD CCCC[C@@H](CN)N[C@@H](C)c1cc([N+](=O)[O-])ccc1O 817962745 NWQRCSVHZWTGHJ-QWRGUYRKSA-N 281.356 2.469 10 20 CECD Cc1ccc(O)c(CNC(=O)CCc2cc(C)on2)c1 827165952 CZNWZNOSGVDPOM-UHFFFAOYSA-N 274.320 2.246 10 20 CECD CCn1nnc(C)c1CN(C)c1ccc(OC)c(OC)c1 824159621 CJGOBQHTKYSBKW-UHFFFAOYSA-N 290.367 2.260 10 20 CECD O=C(O)CCCCNCc1cccc(Cl)c1O 821521757 KLXAMDWTRCLKMB-UHFFFAOYSA-N 257.717 2.390 10 20 CECD OC[C@@H](C1CC1)[C@@H](NCc1cc(F)ccc1O)C1CC1 824846437 SCGIWWTUMNMUOO-HOCLYGCPSA-N 279.355 2.418 10 20 CECD CC(C)[C@@H](C)C(=O)NC[C@@H](N)c1ccc(N(C)C)cc1 832272295 DUZCMNIMNRMUPT-IUODEOHRSA-N 277.412 2.161 10 20 CECD Cc1ncc(C(=O)N(C)Cc2ccc(N(C)C)cc2)n1C 900028063 YXFQRSOBEUVAOP-UHFFFAOYSA-N 286.379 2.067 10 20 CECD O=C(N[C@H]1COc2ccccc2C1)c1cc(O)cs1 732270783 KAZHZMZZYGXDCF-SNVBAGLBSA-N 275.329 2.187 10 20 CECD C[C@@H](O)CNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1 743510945 BFYVODTZIYWFHS-GFCCVEGCSA-N 293.367 2.056 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)Cc2cscn2)c1 830540408 JBADEFRCXZQKPV-SECBINFHSA-N 292.360 2.277 10 20 CECD C[C@H]1OCC[C@H]1CN1CCCc2cc(CN)ccc21 866659934 YGJPNOWMWWNNAY-DOMZBBRYSA-N 260.381 2.323 10 20 CECD Cc1cc(N(C)C)ccc1CNc1nccn2c(C)nnc12 745973012 KXTZNEYKTGKSDZ-UHFFFAOYSA-N 296.378 2.419 10 20 CECD CCN(CC)c1ccc(CN[C@H]2CCCN(C)C2=O)cc1 748242806 RDMRPSHHUDXMPE-INIZCTEOSA-N 289.423 2.243 10 20 CECD CCCN1CCC[C@@H](C(=O)NCc2cc(C)ccc2O)C1 912999968 AXFFNRBMBMWCJB-CQSZACIVSA-N 290.407 2.439 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@]1(C)CCNC1 843070678 WTOIPQCKTQBLIC-INIZCTEOSA-N 260.381 2.447 10 20 CECD CN(C)c1ccc(CN2CC[C@H](N)C2)c(C(F)(F)F)c1 843047547 VRXXHGMEBBEQES-NSHDSACASA-N 287.329 2.304 10 20 CECD COc1cc(N2CC[C@H]3C[C@@H]3C2)c([N+](=O)[O-])cc1OC 853901756 JPINZUUHLKRSDL-VHSXEESVSA-N 278.308 2.458 10 20 CECD C[C@@H](NCCCSc1nccs1)c1cc(CO)on1 925101407 HDKIVTBIWYGHRJ-SECBINFHSA-N 299.421 2.456 10 20 CECD O=C(O[C@@H]1Cc2ccccc2C1=O)c1cccc(O)c1O 758548214 QGULFPGOOQEMMH-CYBMUJFWSA-N 284.267 2.062 10 20 CECD O=C(/C=C\c1ccsc1)NCc1ccc(O)c(O)c1 768914698 FIZAFNLSUDMZBW-RQOWECAXSA-N 275.329 2.489 10 20 CECD CCN1C[C@H](C)N(Cc2cc(OC)ccc2O)C[C@@H]1C 775711881 JOPFFTROXUFGCX-STQMWFEESA-N 278.396 2.315 10 20 CECD C[C@@H](C[C@@H]1CCCC(=O)N1)NCc1ccc(N(C)C)cc1 876905546 IODFHPFGNXFZBF-ZFWWWQNUSA-N 289.423 2.290 10 20 CECD CN[C@H](C)CCNCc1ccc(N2CCCC2)cc1 1117953711 MZSVKYDQMZTMRC-CQSZACIVSA-N 261.413 2.374 10 20 CECD Nc1ccc(CCNC(=O)c2ocnc2C2CC2)cc1 876527445 FOBXHMWOJVTBQL-UHFFFAOYSA-N 271.320 2.107 10 20 CECD Cc1occc1CNC(=O)/C=C/c1ccc(O)c(O)c1 779500448 SGZRPEMRMVIRKB-HWKANZROSA-N 273.288 2.329 10 20 CECD C[C@@H](NC(=O)NCCc1ccncc1)c1ccccc1O 875384758 PNYFSAONCFMZJE-GFCCVEGCSA-N 285.347 2.390 10 20 CECD Cc1ccc(O)c(CN(C)[C@H](C)C(=O)NC(C)(C)C)c1 777219706 MUJIQMLAXZVBRI-GFCCVEGCSA-N 278.396 2.436 10 20 CECD CCOC(=O)CCN(Cc1ccccc1O)C1CC1 770511068 YKWSHNDLDNZGLX-UHFFFAOYSA-N 263.337 2.310 10 20 CECD C[C@H](N[C@@H](C)c1nncn1C)c1c(O)cccc1F 886523299 ZXWPIIXPAGMGRA-IUCAKERBSA-N 264.304 2.072 10 20 CECD Cc1cc(O)c(CNC[C@@H]2CCN2C)cc1Cl 896595802 OVHNSEYCMVWGCV-NSHDSACASA-N 254.761 2.148 10 20 CECD CCOc1cccc(CNCCO[C@H]2CCCCO2)c1O 894801145 WBCULWFDMQXHIT-HNNXBMFYSA-N 295.379 2.424 10 20 CECD O=C1C[C@@H]2CC[C@H](C1)N2Cc1cc(F)cc(F)c1O 894969981 OQETZBVOJIECHU-PHIMTYICSA-N 267.275 2.366 10 20 CECD CC[C@H](N[C@@H]1CCC[C@@H]1C(=O)NC)c1ccc(F)cc1O 796853065 KKKSNRBGRFQCIS-MELADBBJSA-N 294.370 2.487 10 20 CECD COc1ccccc1CN(CCO)Cc1ccc(N)cc1 1334774772 NIJWEPOWAQTTDP-UHFFFAOYSA-N 286.375 2.272 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccns1 1337177145 MFRGEEDMVKWPPD-UHFFFAOYSA-N 289.360 2.248 10 20 CECD C[C@@H](OC1CCCCC1)C(=O)NCc1cccc(O)c1O 1347542775 RHBCQKAVZKZVKF-LLVKDONJSA-N 293.363 2.452 10 20 CECD O=C(NCc1cccc(O)c1O)c1ccnc(C2CC2)c1 1520510273 XWPZOKQVGFSGMD-UHFFFAOYSA-N 284.315 2.300 10 20 CECD C/C(=C/C(=O)N1CCCc2cc(N)ccc21)c1cnccn1 1574971896 HRFTZJWBSOJKIH-XFXZXTDPSA-N 294.358 2.442 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1C[C@@H]1C(=O)O 1593297844 ARTPTRXPRLCVAX-DLOVCJGASA-N 280.343 2.091 10 20 CECD CC[C@@H]1COCCN1Cc1cc(OC)c(OC)cc1O 160232609 VCKQKQKVFCEYOA-GFCCVEGCSA-N 281.352 2.020 10 20 CECD CCn1c(C)nc([N+](=O)[O-])c1NCc1ccccc1O 288209165 UHPGYDVKOAMZMS-UHFFFAOYSA-N 276.296 2.437 10 20 CECD COc1cccc(CN[C@@H](CO)c2ccccc2)c1O 62999391 GIIUBTLZDKDYHE-AWEZNQCLSA-N 273.332 2.224 10 20 CECD COc1ncccc1C(=O)N(C)Cc1ccccc1O 77258373 OBLVHIUWTNQSQQ-UHFFFAOYSA-N 272.304 2.068 10 20 CECD CCOc1cccc(CNC[C@@](C)(O)CC)c1O 106448924 ZBXJFVQLVKIRTO-AWEZNQCLSA-N 253.342 2.042 10 20 CECD Cc1cc(CC(=O)NCc2ccc(N3CCCC3)cc2)no1 172050107 WLFYABWZPMCUFO-UHFFFAOYSA-N 299.374 2.442 10 20 CECD O=C(NCc1ccccc1O)[C@H]1CCC(F)(F)C1 302196500 KEECNSFQDARYAJ-VIFPVBQESA-N 255.264 2.444 10 20 CECD C[C@H](O)CCCNCc1cccc(Br)c1O 227958399 OCDFVZVZWCJQNV-VIFPVBQESA-N 288.185 2.405 10 20 CECD CCn1ccnc(NCc2ccc(N(C)C)c(F)c2)c1=O 91008929 DXYMWHAVTVYEGY-UHFFFAOYSA-N 290.342 2.080 10 20 CECD O=C1NC(=S)S/C1=C\c1cc(F)c(O)c(F)c1 255216605 FMOXPNURWJZUOX-CLTKARDFSA-N 273.285 2.159 10 20 CECD Oc1ccc(F)cc1CNCC1CCN(C2CC2)CC1 278607546 GGZSNHNPQWKCDD-UHFFFAOYSA-N 278.371 2.495 10 20 CECD CN(C)c1ccc(CN(C(=O)C2(C)COC2)C2CC2)cc1 272745969 JKEKMDRTMZUDHM-UHFFFAOYSA-N 288.391 2.280 10 20 CECD CCOc1ccc(CN2CCN(CC)C[C@H]2C)c(O)c1 809697322 DULDPOWFXFVKAN-CYBMUJFWSA-N 278.396 2.317 10 20 CECD Cn1ccc(CCNCc2cc(Cl)c(F)cc2O)n1 816569295 GOXJJTXIYBLWCQ-UHFFFAOYSA-N 283.734 2.251 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)c1cocn1 729305322 JNDIPGYWMGIUDX-UHFFFAOYSA-N 259.309 2.013 10 20 CECD COC(=O)c1cc(C)n(-c2ccc(-c3nn[nH]n3)cc2)c1C 736938632 AHEIVJACRIJTSK-UHFFFAOYSA-N 297.318 2.061 10 20 CECD CCOc1ccc(O)c(CN(C)C(C)(C)C(=O)O)c1 833662361 CMUWIIKLQLTJHE-UHFFFAOYSA-N 267.325 2.086 10 20 CECD CCN(CCC(=O)O)Cc1cc(C)c(C)cc1O 737097393 ZCZTZJGZJUPGFE-UHFFFAOYSA-N 251.326 2.306 10 20 CECD Oc1ccnc(/C=C\c2ccc(N3CCC(O)CC3)cc2)n1 905072406 DSGRTCBAMZIHLK-UTCJRWHESA-N 297.358 2.314 10 20 CECD Cn1cncc1/C=C1/C(=O)N2CCCc3cccc1c32 901521921 JZAJFYWGZMWTCI-RIYZIHGNSA-N 265.316 2.254 10 20 CECD CCOC[C@H](O)CN(Cc1ccc(N(C)C)cc1)C(C)C 733609803 LSRHWUZZXSBYPZ-QGZVFWFLSA-N 294.439 2.360 10 20 CECD NC1(CNCc2cc(Cl)cc(F)c2O)CCC1 841048570 KFGVXFULQYPXGJ-UHFFFAOYSA-N 258.724 2.156 10 20 CECD CC(=O)c1cc(F)cc(CN(C)C2(CN)CCC2)c1O 843388887 CKOUJXYJQSYPTI-UHFFFAOYSA-N 280.343 2.047 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)C(C)(C)O 840933123 LVYUGVYUWKXJAX-LBPRGKRZSA-N 250.386 2.310 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2c(O)cccc2OC)C1 840975161 MBXBGVJKWMCUTR-INIZCTEOSA-N 293.363 2.176 10 20 CECD COc1cc(O)c(CN2CC[C@@H]3C[C@@H]3C2)cc1OC 853576793 QVJWWQKMDVOEAU-GHMZBOCLSA-N 263.337 2.251 10 20 CECD CC[C@@H](NC)C(=O)N(Cc1ccc(N(C)C)cc1)C(C)C 852884406 XTIYCNWMGBCSLS-MRXNPFEDSA-N 291.439 2.488 10 20 CECD C[C@H]1COCCN1CCN[C@H](C)c1cc(Cl)ccc1O 756535698 PUYJDHVVGCDDSJ-NWDGAFQWSA-N 298.814 2.417 10 20 CECD Cc1nn(C)c(Cl)c1COC(=O)c1cccc(O)c1O 758557916 LEYRJCUOQJKWKC-UHFFFAOYSA-N 296.710 2.150 10 20 CECD C[C@@H](NCc1cc(F)c(N(C)C)cc1F)c1ncnn1C 858160022 NSOQIOKXNZUOTI-SECBINFHSA-N 295.337 2.010 10 20 CECD CCN(C)c1ccc([C@H](C)NCCN(C)OC)cc1 850481131 XMOMXWKCZAFNCG-ZDUSSCGKSA-N 265.401 2.287 10 20 CECD Nc1ccc(CCNC(=O)NCC2=CCCC2)cc1 851663123 TXMPNUJSFPAHQF-UHFFFAOYSA-N 259.353 2.221 10 20 CECD C[C@@H](NC(=O)CCCCCCN)c1ccccc1O 870988531 RUUBXYVSHBEVCF-GFCCVEGCSA-N 264.369 2.479 10 20 CECD COCC1(C)CN(Cc2cc(F)c(N(C)C)cc2F)C1 862390242 UULKEHDLAFRHFG-UHFFFAOYSA-N 284.350 2.499 10 20 CECD C[C@@H]1[C@@H](C)[S@](=O)CCN1Cc1cc(Cl)ccc1O 769464729 AABIPSPIBYVNPX-CLFVBBPSSA-N 287.812 2.387 10 20 CECD CCN1CCC(NC(=O)N[C@H](C)c2ccccc2O)CC1 868352006 NEZKXIAEYCNIDH-GFCCVEGCSA-N 291.395 2.237 10 20 CECD O=C(NCCOc1ccc(Cl)cn1)c1cc(O)cs1 761590676 HFYWABUVEGFMAP-UHFFFAOYSA-N 298.751 2.311 10 20 CECD C[C@@H](N[C@H](CCO)C1CCOCC1)c1ccccc1O 763558443 PNICNWADXJXHPG-IUODEOHRSA-N 279.380 2.220 10 20 CECD CC(C)N1CC(=O)N([C@H](C)c2ccc(N(C)C)cc2)C1=O 761577984 ISIDKKWFEFBYDX-GFCCVEGCSA-N 289.379 2.486 10 20 CECD Cc1cccc(O)c1CN(CCN(C)C)C[C@@H]1CCCO1 877525237 WESBRJDYBFODNN-HNNXBMFYSA-N 292.423 2.243 10 20 CECD Cc1ccc(CNCc2ccccc2CO)c(O)c1 876968214 PHDIGWSOWZZRME-UHFFFAOYSA-N 257.333 2.483 10 20 CECD CCOc1ccc(CNc2nc3ccccn3n2)c(O)c1 775172388 OCJDWEVHJPIKHF-UHFFFAOYSA-N 284.319 2.446 10 20 CECD OCC[C@@H](NCc1cc(F)cc(F)c1O)c1ccco1 883089955 YFGFFOZGGLEEQL-GFCCVEGCSA-N 283.274 2.477 10 20 CECD C[C@@H]1CCN(CCNCc2cc(F)cc(F)c2O)C1 883026657 AWSZGQVBZUWWGK-SNVBAGLBSA-N 270.323 2.102 10 20 CECD Cc1c(C(=O)NCc2cccc(O)c2O)cnn1C(C)C 1123890369 XTPSFUBPOOYESJ-UHFFFAOYSA-N 289.335 2.114 10 20 CECD COCC[C@H](C)CNCc1cc(F)cc(F)c1O 883145442 AQMNPSWIIAJCEE-VIFPVBQESA-N 259.296 2.433 10 20 CECD CC[C@@H]1C[C@H]1C(=O)NCCNCc1ccc(OC)c(C)c1 1134069742 GFMWIKMJTBAYJF-HUUCEWRRSA-N 290.407 2.256 10 20 CECD CC1(C)CN(Cc2cc(Cl)cc(F)c2O)C[C@@H]1O 790937121 ILEWJOYIRCRQCV-NSHDSACASA-N 273.735 2.387 10 20 CECD O=C(Cc1ccc2n[nH]cc2c1)NCc1ccccc1O 793680809 LCQNXPPSPYWYMP-UHFFFAOYSA-N 281.315 2.127 10 20 CECD O=C(Nc1nc(Cl)ccc1O)c1cccc(O)c1O 790050681 HCRGKBMBAKBIEO-UHFFFAOYSA-N 280.667 2.104 10 20 CECD CC(C)(C)NC(=O)CCNCc1c(O)cccc1Cl 134653620 IDQKSBWTFKTEEG-UHFFFAOYSA-N 284.787 2.440 10 20 CECD CN(C)c1ccc(CNC(=O)NC2(C)CC2)cc1F 1318639937 LAGSRISKMIJPIP-UHFFFAOYSA-N 265.332 2.243 10 20 CECD O=C(Nc1cccc2c[nH]nc12)c1cccc(O)c1O 1321437900 QJMSIMQSHYEXKX-UHFFFAOYSA-N 269.260 2.226 10 20 CECD C[C@@H](N[C@H](C)c1ncnn1C)c1cc(F)ccc1O 276605540 KTBUECQUUILUHK-RKDXNWHRSA-N 264.304 2.072 10 20 CECD CN(Cc1ccccc1O)c1ccccc1S(C)(=O)=O 302605145 CYQCJPVFOLVETM-UHFFFAOYSA-N 291.372 2.432 10 20 CECD Oc1cc2c(cc1CN[C@H]1CCC[C@@H](F)C1)OCO2 1328512104 PXENJKILKDBLOJ-MNOVXSKESA-N 267.300 2.491 10 20 CECD CO[C@@H]1CC[C@@H](NC(=O)NCc2cc(Cl)ccc2O)C1 1329778312 FNKRJZPOJVJRPY-VXGBXAGGSA-N 298.770 2.412 10 20 CECD C[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)[C@H]1CO 1321701265 JRPOTLAVJJSAKH-YOEHRIQHSA-N 274.408 2.490 10 20 CECD COC(=O)CC(C)(C)N(C)Cc1cc(C)ccc1O 1254010873 OQJLJWPZFCSGKU-UHFFFAOYSA-N 265.353 2.474 10 20 CECD Nc1ncnc(NCc2ccccc2O)c1Cl 764808243 XASHNYHPWXAPTN-UHFFFAOYSA-N 250.689 2.030 10 20 CECD COc1ccc(CNC2(C3CC3)CC2)c(O)c1OC 1334981455 BVIRQQLTSRZSBM-UHFFFAOYSA-N 263.337 2.442 10 20 CECD CC[C@@H](C)[C@H](C)C(=O)NCc1cccc(O)c1O 1347542922 SWGCQRNDTVNOTC-ZJUUUORDSA-N 251.326 2.396 10 20 CECD COc1cc(N2CCCO[C@@H](C)C2)c([N+](=O)[O-])cc1OC 1354043003 YYXZBEBBEAIROT-JTQLQIEISA-N 296.323 2.227 10 20 CECD Cc1ccc(C(=O)OCc2occc2C(=O)O)c(O)c1O 1600365277 JUADPZQEDYUCAQ-UHFFFAOYSA-N 292.243 2.054 10 20 CECD CC[C@H](NCC[C@H](C)F)c1cccc(-c2nn[nH]n2)c1O 1590468144 SWPSFSPKHGHQLP-CABZTGNLSA-N 293.346 2.361 10 20 CECD COc1cc(CN(C)Cc2cnn(C)c2)c(O)cc1C 159785250 GUUQFXJVQYXLBK-UHFFFAOYSA-N 275.352 2.075 10 20 CECD C[C@@H](CC[S@](C)=O)NCc1ccc2c(c1)CCCO2 921831465 WIYVHAMWXUXNGI-BUXKBTBVSA-N 281.421 2.258 10 20 CECD O[C@H]1CC[C@H](CNCc2ccc3c(c2)CCCO3)C1 922043990 IMXBVCSMKWOHOF-ZFWWWQNUSA-N 261.365 2.262 10 20 CECD CN(Cc1ccccc1O)C(=O)[C@@H](N)c1ccccc1 37823749 KEMFMWLUOHXEAY-HNNXBMFYSA-N 270.332 2.051 10 20 CECD COc1cccc(CNCCN2CCC(C)CC2)c1O 40771358 MQXMVXFUQCAINF-UHFFFAOYSA-N 278.396 2.222 10 20 CECD O=C(O)[C@@]12CCC[C@@H]1CN(Cc1ccccc1O)C2 701548584 JBADHVNPCHHDQZ-IUODEOHRSA-N 261.321 2.079 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(N(C)C)CC2)c1 397972211 IERKBQDJMKYSBF-LLVKDONJSA-N 264.369 2.146 10 20 CECD Cc1nccn1C[C@H](C)CNCc1ccccc1O 105442921 BVLHDPZTYGPMNQ-GFCCVEGCSA-N 259.353 2.323 10 20 CECD Cc1c(/C=C/C(=O)N2CCc3ccc(F)cc32)cnn1C 179272984 UBFREBRJOKPNSC-GQCTYLIASA-N 285.322 2.470 10 20 CECD CCCN(Cc1ccccc1O)c1ncnc2c1cnn2C 178787294 SRYWFJLROCYZMR-UHFFFAOYSA-N 297.362 2.486 10 20 CECD CCN(CC)c1ccc(CNC(=O)N[C@@H](C)CCO)cc1 172555796 HDSJPYYQEPOKQQ-ZDUSSCGKSA-N 293.411 2.103 10 20 CECD Cn1cc(CCNCc2cccc(Cl)c2O)cn1 124721543 MOSALPYXXPQXBM-UHFFFAOYSA-N 265.744 2.111 10 20 CECD Cc1ccc(C(=O)Nc2cnn(CC(F)F)c2)c(O)c1O 177686700 MDOVIHKKXZFLGN-UHFFFAOYSA-N 297.261 2.120 10 20 CECD COCCC(C)(C)CNC(=O)c1ccc(C)c(O)c1O 185025683 PGEFIMVSBBHFEH-UHFFFAOYSA-N 281.352 2.199 10 20 CECD Cc1ccc(C)n1-c1ccc(C(=O)NN2CCOCC2)cc1 72967237 GSXFJVMEECATDV-UHFFFAOYSA-N 299.374 2.071 10 20 CECD C[C@H](NCc1cc(F)ccc1O)C(=O)OC(C)(C)C 133691429 BYWXVLPLBIDRJW-VIFPVBQESA-N 269.316 2.351 10 20 CECD CN(C)c1ccc(CN2CCC3(CC2)OCCO3)cc1F 126085804 QUKFQGRGHBKOGU-UHFFFAOYSA-N 294.370 2.231 10 20 CECD COc1ccccc1NC[C@@H](O)COc1ccc(C#N)cc1 315098856 NQBYDCBCXHEJNQ-CQSZACIVSA-N 298.342 2.419 10 20 CECD Cc1cccc(-n2c(C)cc(C(=O)Nn3cnnc3)c2C)c1 180724021 MYWXQRZVSKDHNI-UHFFFAOYSA-N 295.346 2.378 10 20 CECD C[C@@H](CO)N[C@@H](C)c1cc(Br)cc(F)c1O 134925922 OEWSZEMGQZUQTB-BQBZGAKWSA-N 292.148 2.325 10 20 CECD CCCN(Cc1ccccc1O)Cc1nnnn1C1CC1 130730381 DCHLECLSCMHPAK-UHFFFAOYSA-N 287.367 2.126 10 20 CECD COc1ccc(O)c(CN[C@H](C)C(=O)OC(C)(C)C)c1 181404256 BKXPAFBWCGDOBE-SNVBAGLBSA-N 281.352 2.221 10 20 CECD Cc1c(CNC(=O)Cc2cnn(C)c2)n(C)c2ccccc12 348663597 VFBNOQKBJOZOCS-UHFFFAOYSA-N 296.374 2.079 10 20 CECD CN(C)c1ccc(CN2CCC[C@]23CCOC3=O)cc1F 275137981 MXLSJSRCOCFOCZ-MRXNPFEDSA-N 292.354 2.173 10 20 CECD O=C1NCCN(Cc2ccccc2O)[C@H]1c1cccs1 376166477 LZDRGPYAXGCDIF-AWEZNQCLSA-N 288.372 2.127 10 20 CECD COc1ccc(CNC(=O)C2CC(C)(C)C2)c(O)c1 803292892 ZIDLCWKVAKEBHC-UHFFFAOYSA-N 263.337 2.453 10 20 CECD CCCCN(Cc1nc(O)n[nH]1)Cc1ccccc1O 801596178 RNFIOUVXCPBMKZ-UHFFFAOYSA-N 276.340 2.018 10 20 CECD COc1cccc(CNCc2cnc3ccccn23)c1O 809740178 NSKGLTBYLWUXGV-UHFFFAOYSA-N 283.331 2.338 10 20 CECD CC[C@H](C)[C@@H](CNC(=O)c1c(F)ccc(O)c1O)OC 295844366 VVVSLEIDLUQMFD-GZMMTYOYSA-N 285.315 2.028 10 20 CECD C[C@H]1C[C@@H](O)CCN1Cc1cccc(Cl)c1O 292824723 QKKTVMDWAXOHKX-ONGXEEELSA-N 255.745 2.391 10 20 CECD CC[C@H](NCc1cnnn1C)c1ccc(C)cc1O 806660220 TVCGWVAYEZJJRR-ZDUSSCGKSA-N 260.341 2.070 10 20 CECD C[C@@H](NCCOCCO)c1cccc(C(F)(F)F)c1O 815553428 ACJLJQTVVVTJNR-SECBINFHSA-N 293.285 2.071 10 20 CECD COCC1(COC(=O)c2ccc(C)c(O)c2O)CCC1 812581629 FABZKXPLWFPUDN-UHFFFAOYSA-N 280.320 2.380 10 20 CECD CSC[C@H](O)CN[C@H](C)Cc1ccc(N(C)C)cc1C 819377350 QGDDXEGVPDADNW-CZUORRHYSA-N 296.480 2.306 10 20 CECD C[C@@H]1C[C@H](NCc2cc([N+](=O)[O-])ccc2O)c2nccn21 825017918 ZVHGVAUKFHEACN-SKDRFNHKSA-N 288.307 2.293 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1cnn2c1CCC2 825874332 ZNEWAMXAONAQFW-UHFFFAOYSA-N 298.390 2.134 10 20 CECD Oc1c(Cl)cccc1CN1C[C@@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 824839401 YJGCOOHCLMXDJG-CDGCEXEKSA-N 277.751 2.431 10 20 CECD O=C(CN[C@H]1CCc2cccc(O)c21)NC1CCCC1 834645717 JVWRQRBISBENIE-ZDUSSCGKSA-N 274.364 2.028 10 20 CECD COc1ccc(N(C)CCC2(O)CCC2)c(OC)c1 839528370 QZOBUUZUVJVFCF-UHFFFAOYSA-N 265.353 2.445 10 20 CECD CCc1cccc(CN2CCC[C@H](CNC(C)=O)C2)c1O 848877865 VDPZANRSLGPHPN-CQSZACIVSA-N 290.407 2.303 10 20 CECD COCCCCCN(C)c1ccc(OCC(=O)O)cc1 846280270 WMAZKYSBNLUKKE-UHFFFAOYSA-N 281.352 2.403 10 20 CECD COc1cccc(O)c1CN1CCC[C@H]([C@@H]2CCNC2)C1 843125189 NRLQZEAPUYUNBL-KGLIPLIRSA-N 290.407 2.222 10 20 CECD O=C(CCCn1cccn1)NCc1cc(Cl)ccc1O 846472347 ILNQYVGIKDONTL-UHFFFAOYSA-N 293.754 2.339 10 20 CECD C[C@@H]1C[C@H](N)CCN1Cc1cccc(Br)c1O 846698335 FULPRVFFAUMJLL-MWLCHTKSSA-N 299.212 2.466 10 20 CECD C[C@@H]1C[C@@H](NCc2cc(Cl)cc(F)c2O)CCN1 841062836 YHLORBPXJAURFS-KCJUWKMLSA-N 272.751 2.415 10 20 CECD Cc1ccc(C(=O)OCC[C@@H]2CCCCN2C)c(O)c1O 840218545 BENLKRHRSSPGJT-LBPRGKRZSA-N 293.363 2.437 10 20 CECD CCCC[C@@H](CN)NCc1ccc(N2CCOCC2)cc1 841029008 LEITZRIPJBSUHV-INIZCTEOSA-N 291.439 2.130 10 20 CECD CCC(=O)CCCOC(=O)/C=C/c1ccc(O)c(O)c1 759595594 KMAAUICDOLZPMM-SOFGYWHQSA-N 278.304 2.414 10 20 CECD CCOc1cncc(/C=C2/SC(=S)N(C)C2=O)c1 856717685 HHMVLUOKORTAKQ-BJMVGYQFSA-N 280.374 2.311 10 20 CECD COCc1ncsc1C(=O)NCc1cc(C)ccc1O 862756415 XQMMSMGBQUSAOJ-UHFFFAOYSA-N 292.360 2.234 10 20 CECD COc1ccc2c(c1)CCCN2Cn1ncn(C)c1=S 766340305 GODKKVBIWVJPLW-UHFFFAOYSA-N 290.392 2.370 10 20 CECD CCC[C@H](OCC)C(=O)NCc1cccc(OC)c1O 860241471 RSFYVUPCKIWHOE-ZDUSSCGKSA-N 281.352 2.222 10 20 CECD Oc1cc2c(cc1CN(CC1CC1)CC1CC1)[C@H](O)CO2 768448771 WKZNIDRAQKINMG-MRXNPFEDSA-N 289.375 2.440 10 20 CECD COc1ccc(N(Cc2cn(C)nn2)CC(C)C)cc1 761674472 FPESEIMGFVSTKR-UHFFFAOYSA-N 274.368 2.486 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CN1CCCC1 874231393 KTKKNHXRYQHNOB-UHFFFAOYSA-N 289.423 2.197 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)cc2)[C@@H](C)CN1C 775986252 QOUNBRDGGGNPSG-KBPBESRZSA-N 261.413 2.277 10 20 CECD C[C@H](Cc1ccco1)NC(=O)/C=C\c1ccc(O)c(O)c1 779502361 YPRRPDFEFIBGMW-JPVGGKMYSA-N 287.315 2.451 10 20 CECD C[C@@H](CO)N[C@H](C)c1cccc(C(F)(F)F)c1O 788629709 CUPZYONWPRCIMY-JGVFFNPUSA-N 263.259 2.442 10 20 CECD CC(C)C[C@@H](CN)NC(=O)N[C@H](C)c1ccccc1O 892037920 PBBYBOUDMBJUKF-NEPJUHHUSA-N 279.384 2.126 10 20 CECD COc1ccc(CNC(=O)/C=C\c2cccc(O)c2)c(O)c1 794391150 USTGDMQSACGPHM-YVMONPNESA-N 299.326 2.436 10 20 CECD CC(C)n1cnnc1CN(C)Cc1cc(F)cc(F)c1O 894849914 FOEBELFJAIQFRH-UHFFFAOYSA-N 296.321 2.475 10 20 CECD C[C@]1(NCc2c(O)ccc(Cl)c2F)CCOC1 790979684 GEYURVKVQGIJKS-LBPRGKRZSA-N 259.708 2.453 10 20 CECD CO[C@@H](C)CN(C)Cc1c(O)ccc2ccncc12 795750689 VADHFDQHIHNMNT-NSHDSACASA-N 260.337 2.407 10 20 CECD C[C@@H]1CSCCN(Cc2cc3c(cc2O)OC[C@H]3O)C1 792724734 DCTGVPFECBYCFP-IINYFYTJSA-N 295.404 2.003 10 20 CECD COc1ccc(CNC[C@@H]2CC[C@H](NC(C)=O)C2)cc1C 994567149 CBYRURCADOOZJI-CVEARBPZSA-N 290.407 2.398 10 20 CECD CC[C@@H](OC)C(=O)Nc1c(Cl)ccc2nonc12 1323415998 BYQYNYSLRWQAHH-MRVPVSSYSA-N 269.688 2.240 10 20 CECD CCC(CC)(NCc1ccc(N(C)C)cc1)C(=O)O 789902343 MJNUXFIVQAOSPA-UHFFFAOYSA-N 264.369 2.486 10 20 CECD Nc1ccc(CNC(=O)N2C[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2)cc1 1357791862 QDAXKKLAFATFHH-DARAHFNDSA-N 283.375 2.232 10 20 CECD O=C(O)c1ccc2c(c1)CCN2C(=O)c1cc(O)cs1 1608921739 RRVTWAQIKVMGDD-UHFFFAOYSA-N 289.312 2.355 10 20 CECD Cc1ccc(CN2C[C@@H](C(=O)O)[C@H](C3CC3)C2)c(O)c1 1600415112 BFHFONGYRAMNCH-UONOGXRCSA-N 275.348 2.243 10 20 CECD O=C(O)c1ccc2c(c1)N(C(=O)c1cc(O)cs1)CC2 1608924016 GBTLOKIYICCZPP-UHFFFAOYSA-N 289.312 2.355 10 20 CECD CSc1cccc(C(=O)NCCc2ccc(N)cc2)n1 1579393276 MNVOWQKBIUEPKN-UHFFFAOYSA-N 287.388 2.358 10 20 CECD CN(C)CCN(Cc1ccc(N)cc1)Cc1ccccn1 1578416767 ATLWJDCYJDNFOI-UHFFFAOYSA-N 284.407 2.228 10 20 CECD C[C@H](N[C@H](C)c1cc(C(=O)O)ccc1O)c1csnn1 1593199702 YPUNRSBLCNQCLQ-SFYZADRCSA-N 293.348 2.354 10 20 CECD COc1cc(C)c(CN(CC(=O)O)CC2CC2)c(O)c1 1594054076 FKCZEWQTIMCTDN-UHFFFAOYSA-N 279.336 2.006 10 20 CECD CC(=O)NCC1CCN(Cc2cc(Cl)ccc2O)CC1 219487708 FEIWAGMXAJYNCQ-UHFFFAOYSA-N 296.798 2.394 10 20 CECD CCN1CCc2cc(CNCC3(C(=O)O)CCC3)ccc21 1776877402 ZYPIRRWIUFLKAJ-UHFFFAOYSA-N 288.391 2.414 10 20 CECD CCC[C@H](CC(=O)O)NCc1cc([N+](=O)[O-])ccc1O 1776828991 MUQKZQBYXJSNNS-SNVBAGLBSA-N 282.296 2.033 10 20 CECD CN1CCC[C@@H]2CN(Cc3ccccc3O)CC[C@H]21 228183294 QLPCLSCAAFVWKM-UKRRQHHQSA-N 260.381 2.308 10 20 CECD COc1cccc(CNC[C@H]2CCC[C@@H](O)C2)c1O 230670215 HFHPMVXHSOALPS-WCQYABFASA-N 265.353 2.042 10 20 CECD COc1cc(C(=O)NCc2ccccc2O)ccc1F 127828266 QKRHQZDCZRHUIS-UHFFFAOYSA-N 275.279 2.470 10 20 CECD Oc1cc2c(cc1CNCCSC(F)(F)F)OCO2 171128295 HUYSTRADGZMZFQ-UHFFFAOYSA-N 295.282 2.464 10 20 CECD CCc1nc(CN(C)C(=O)c2cccc(O)c2O)cs1 381394093 NGMPHNNBXGJNOF-UHFFFAOYSA-N 292.360 2.389 10 20 CECD COC[C@@H]1CCCCN1C(=O)Nc1ccc(N)cc1 395990901 CJNRUTABNYSCTA-ZDUSSCGKSA-N 263.341 2.302 10 20 CECD CSCCCNC(=S)NCc1ccc(N(C)C)cc1 7371678 AXNUDKNTZNUWAL-UHFFFAOYSA-N 297.493 2.470 10 20 CECD COc1ccc(O)c(CNC(=O)c2ccc[nH]c2=S)c1 114540639 ZJXMOPFUHDWPIS-UHFFFAOYSA-N 290.344 2.388 10 20 CECD COC(=O)[C@]1(C)CCN(Cc2cc(OC)c(C)cc2O)C1 179447307 RUVANYNPRPFZBH-MRXNPFEDSA-N 293.363 2.094 10 20 CECD COc1ccc(O)c(CNC(=O)CC[C@@H]2CC[C@H](C)O2)c1 173579414 PCESSTIRBWTKBV-AAEUAGOBSA-N 293.363 2.365 10 20 CECD CCS(=O)(=O)CCN[C@@H](C)c1cc(Cl)ccc1O 185330717 OMQAUYKWUZEKOY-VIFPVBQESA-N 291.800 2.131 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC(CCO)CC2)c1O 401032655 LTHHFTBUJWRRDS-UHFFFAOYSA-N 295.354 2.328 10 20 CECD Cc1noc(C)c1[C@@H](C)CNC(=O)c1cccc(O)c1O 185881755 NYBSOWSSWJPEMW-QMMMGPOBSA-N 290.319 2.236 10 20 CECD COCCN(C)CCCN[C@@H](C)c1ccccc1O 183415133 ZHNXJGFVBUQDBM-ZDUSSCGKSA-N 266.385 2.011 10 20 CECD CCN(CC)c1ccc(CNC(=O)NC[C@@H](C)OC)cc1 190359021 VTGRVAHHEMWRKX-CYBMUJFWSA-N 293.411 2.367 10 20 CECD Cn1cc(NC(=O)NCc2ccc(N3CCCC3)cc2)cn1 192769289 CMTBQMXCFBOQSM-UHFFFAOYSA-N 299.378 2.342 10 20 CECD CC(=O)C1=NN(c2ccc(C(F)(F)F)cc2)C(=O)C1 199872907 XPGDATNPMLIFNI-UHFFFAOYSA-N 270.210 2.387 10 20 CECD COc1ccccc1C(=O)NCCc1ccc(O)c(O)c1 98074434 KNAWUGJENMMWPN-UHFFFAOYSA-N 287.315 2.079 10 20 CECD CCN(CC)c1ccc(CNC(=O)c2c[nH]c(C)n2)cc1 264883526 TYMXHTAQFODHOZ-UHFFFAOYSA-N 286.379 2.494 10 20 CECD C[C@H]1COCC[C@@H]1CNCc1ccc2c(c1)CCO2 285556852 REKRXFKRERLNLW-SWLSCSKDSA-N 261.365 2.384 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NCCC(C)(C)CO)c1 296262357 DIXHCLAOSCAEFO-LLVKDONJSA-N 295.379 2.238 10 20 CECD Cc1cnc(C(=O)N(C)Cc2ccc(N(C)C)cc2)o1 291858720 VQPFQUQNGOJGNK-UHFFFAOYSA-N 273.336 2.321 10 20 CECD COc1cncc(COC(=O)c2ccc(C)c(O)c2O)c1 808513021 URGQUUUNVSVNEO-UHFFFAOYSA-N 289.287 2.167 10 20 CECD COC1CCN(c2ccc(CN(C)C[C@H](C)O)cc2)CC1 295205875 OGYPYTXBLDCFAS-AWEZNQCLSA-N 292.423 2.114 10 20 CECD CCOc1ccc(CN2CCN(CC)C[C@@H]2C)c(O)c1 809697324 DULDPOWFXFVKAN-ZDUSSCGKSA-N 278.396 2.317 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cscn1 808097179 TXUMDKGATDHWIV-UHFFFAOYSA-N 283.349 2.264 10 20 CECD CCN(C)c1ccc(CN(C)CCOCCOC)cc1 815120048 MZYNVSJBVZZIRA-UHFFFAOYSA-N 280.412 2.238 10 20 CECD Cc1cccc(CN(CC(F)F)C[C@@H](C)O)c1O 825098200 CUJGGJQUJOCWKW-SNVBAGLBSA-N 259.296 2.149 10 20 CECD COC(=O)[C@H]1C[C@H](NCc2cc(Cl)c(C)cc2O)C1 827812935 ZYGBHIOZBCOEFU-HOMQSWHASA-N 283.755 2.395 10 20 CECD C[C@@H](NCC1(N)CC1)c1ccc(Br)cc1O 902408152 XHBJWGDDKMZZRA-MRVPVSSYSA-N 285.185 2.297 10 20 CECD CC[C@@H](NC[C@H]1CCN1C)c1ccc(N(C)C)cc1 903321428 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CN(Cc1ccccc1O)C(=O)C[C@@H](N)C(C)(C)C 136891754 YFCUMYZBNHAMQU-CYBMUJFWSA-N 264.369 2.114 10 20 CECD CNC(=O)Cc1ccc(NCc2cc(F)ccc2O)cc1 226580683 XYESUTKGESJCHU-UHFFFAOYSA-N 288.322 2.432 10 20 CECD C[C@@H]1O[C@H](C)[C@@H](C(=O)N(C)Cc2ccccc2O)[C@@H]1C 383981632 SESPYOXHGMUYBY-ZAZJYDDPSA-N 277.364 2.410 10 20 CECD C[C@@H](NCCN1CCCC1)c1cc(F)ccc1O 94616870 MQFIOHKQKDSXEU-LLVKDONJSA-N 252.333 2.278 10 20 CECD CC(C)N1C[C@H](N[C@@H](C)c2ccc(N(C)C)cc2)CC1=O 271554016 WLEHMXLDYZPZQK-DZGCQCFKSA-N 289.423 2.413 10 20 CECD COC[C@H](N[C@@H](C)c1cc(F)ccc1O)[C@H]1CCCO1 278620808 CFVMYACKCUKUTE-VZJVUDMVSA-N 283.343 2.376 10 20 CECD COCCn1cc(CN[C@H](C)c2ccc(C)cc2O)cn1 281945973 BTCSVEQMPNECPX-CYBMUJFWSA-N 289.379 2.394 10 20 CECD CC[C@H](N[C@@H]1CCCCNC1=O)c1ccc(F)cc1O 285489988 CBGIPHRMMODYDU-QWHCGFSZSA-N 280.343 2.241 10 20 CECD Cc1cc(C)c([C@@H](C)NCC(=O)NCC2CC2)c(O)c1 294381248 RLPZDNMCHOCKBA-GFCCVEGCSA-N 276.380 2.186 10 20 CECD COc1cccc2c(C(=O)NCc3ccccc3O)n[nH]c12 809644105 VZFIYJUXXVQKMG-UHFFFAOYSA-N 297.314 2.207 10 20 CECD C[C@H](NCCOCCO)c1cccc(C(F)(F)F)c1O 815553429 ACJLJQTVVVTJNR-VIFPVBQESA-N 293.285 2.071 10 20 CECD C[C@@H](NC[C@H]1CCCCN1)c1cc([N+](=O)[O-])ccc1O 817950026 QHEMOVVKBSBLIT-GHMZBOCLSA-N 279.340 2.093 10 20 CECD COC(=O)c1cnc(SCc2cnc(C)nc2)s1 829677519 ATMUNQRSERVANQ-UHFFFAOYSA-N 281.362 2.320 10 20 CECD Cc1cc(C)n([C@@H](C)CC(=O)NCc2ccc(N)cc2)n1 837303088 UMSLDJRRYKEERF-ZDUSSCGKSA-N 286.379 2.350 10 20 CECD C[C@@H]1CN(Cc2ccc(N(C)C)c(F)c2)C[C@H]1C(=O)O 833630334 RONPZFSGTHBFRZ-ZYHUDNBSSA-N 280.343 2.044 10 20 CECD CCC(CC)(CNC(=O)c1cc(O)cs1)OC 832819879 YEZAURGRELOBAU-UHFFFAOYSA-N 257.355 2.389 10 20 CECD CC[C@](C)(OC)C(=O)NCc1cc(Cl)ccc1O 846472980 HHTDYFLSKZWZCF-ZDUSSCGKSA-N 271.744 2.477 10 20 CECD O=C1CC[C@@H](C(=O)NCCCSc2nccs2)C1 843797464 WEASWPGIZVGGES-SECBINFHSA-N 284.406 2.111 10 20 CECD Cc1nc2ccccc2n1CC(=O)NCc1ccccc1O 748346357 VPUGSJCFZMSXQH-UHFFFAOYSA-N 295.342 2.367 10 20 CECD CC(C)=CCC[C@@H](C)NC(=O)C(=O)Nc1ccc(N)cc1 841137649 MZRUUCBPLHZYPS-GFCCVEGCSA-N 289.379 2.458 10 20 CECD C[C@H]1C[C@H](NCc2cc(Cl)cc(F)c2O)CO1 843432999 TUZPDRZHDCLMPA-XVKPBYJWSA-N 259.708 2.452 10 20 CECD CCOc1cccc(CNC[C@@H](C(=O)O)C(C)C)c1O 848640565 RWUCZYJFQOSKFI-GFCCVEGCSA-N 281.352 2.237 10 20 CECD CC(C)C[C@H]1CCCN1C(=O)C(=O)Nc1ccc(N)cc1 841026084 ROVZZXFOQZTVKR-CQSZACIVSA-N 289.379 2.244 10 20 CECD COc1cccc([C@H](C)NC[C@H](CO)C(C)C)c1O 846169867 GNMFGKWGFYTXKV-NWDGAFQWSA-N 267.369 2.316 10 20 CECD C[C@@H](NCCNc1cnccn1)c1cc(F)cc(F)c1O 756644932 DGXKRKIEENXHAD-SECBINFHSA-N 294.305 2.223 10 20 CECD CCOc1ccc(CNC[C@]2(C)CCCO2)c(O)c1 756133690 BHJJISQVTPLHGI-HNNXBMFYSA-N 265.353 2.450 10 20 CECD Cc1ccc(O)c(CNC(=O)C2(O)CCCCC2)c1 862758296 VYFUMRXICOXQLS-UHFFFAOYSA-N 263.337 2.012 10 20 CECD COc1ccc(N(C)C[C@@H]2CC3(CC3)C(=O)O2)cc1OC 763672216 NAPHWZLDJBHPMT-LBPRGKRZSA-N 291.347 2.236 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2conc2C)c1 866765661 YLACBFKJNZLTIX-MRVPVSSYSA-N 276.292 2.188 10 20 CECD C[C@H](c1ccc(N(C)C)cc1)N1C(=O)[C@H]2CCCN2C1=O 761577950 ILYAKNRKJBOETC-BXUZGUMPSA-N 287.363 2.240 10 20 CECD CC(C)OCCONC(=O)N[C@H](C)c1ccccc1O 868638689 ZFEBWCLXOPNDFG-LLVKDONJSA-N 282.340 2.109 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)N1CC[C@@H](C2CC2)C1 779540979 VIAFGBUVPOVHQX-IUAZIXFQSA-N 273.332 2.370 10 20 CECD C[C@H]1CCN(S(=O)(=O)Nc2ccc(O)c(Cl)c2)C1 777939238 KIPOQCPIGWANLS-QMMMGPOBSA-N 290.772 2.044 10 20 CECD COC(=O)[C@@H]1C[C@@H](C)CCN1Cc1cc(OC)ccc1O 775997071 BFOLWVYQZHUHKZ-FZMZJTMJSA-N 293.363 2.174 10 20 CECD Cc1cccc(O)c1CN(C)C[C@H](O)C(F)(F)F 877528299 WWDGHWCBDPWJAQ-NSHDSACASA-N 263.259 2.056 10 20 CECD CCOc1ccc(CN2CCC[C@]23CCOC3=O)c(O)c1 779198693 KIENMVZXUCKWPZ-MRXNPFEDSA-N 291.347 2.072 10 20 CECD COc1cc(O)c(CN2CCO[C@H](C(C)C)C2)cc1OC 777967688 FIHABWTYMJXXIJ-INIZCTEOSA-N 295.379 2.266 10 20 CECD COc1ccc(CNC(=O)[C@H]2Cc3ccccc32)c(O)c1 794373823 MSTRMQRJJHDLLP-HNNXBMFYSA-N 283.327 2.357 10 20 CECD CCCN(Cc1cn(CC)nn1)c1ccc(CN)cc1 894047346 TZFMRGLIXWJLEJ-UHFFFAOYSA-N 273.384 2.173 10 20 CECD Nc1ccc(NC(=O)CN2CCCCCCC2=O)cc1 19387267 KRQDSADMXJJMRK-UHFFFAOYSA-N 275.352 2.000 10 20 CECD COc1nc(Cl)c(CNc2ccc(N)cc2)n1C 1327416355 REPAQPSFSOCJPF-UHFFFAOYSA-N 266.732 2.276 10 20 CECD C[C@H]1C[C@@H](NCc2c(O)cccc2Br)CO1 706835614 CEMZIDMGYNCVSM-DTWKUNHWSA-N 286.169 2.422 10 20 CECD CO[C@@H](CNCc1cc(F)ccc1O)C(F)(F)F 779077587 LHMNYTZPCIABFY-JTQLQIEISA-N 267.222 2.198 10 20 CECD Cc1cc(C(=O)NCCc2ccc(N)cc2)cc(C)n1 1339715163 HYHVGVPLNKQXJK-UHFFFAOYSA-N 269.348 2.253 10 20 CECD C[C@@H]1C[C@H]2CC[C@H](C(=O)NCc3ccccc3O)CN2C1 1521266158 MMENUIMBAGZACF-VHDGCEQUSA-N 288.391 2.129 10 20 CECD CN(C)c1ccc(CNC(=O)c2cccc(C(=O)O)c2)cc1 1573996681 BRGWPZDKMJCLIP-UHFFFAOYSA-N 298.342 2.381 10 20 CECD CN(C)c1cc(F)c(CN2C[C@H]3CCC[C@]3(N)C2)cc1F 1578423121 PNSRNHBTQBLIEJ-WBMJQRKESA-N 295.377 2.344 10 20 CECD CCc1cccc(CN[C@]2(CC(=O)O)CCCOC2)c1O 1597586264 DCLATOHQDSTLCI-INIZCTEOSA-N 293.363 2.068 10 20 CECD CCCC[C@@H](NCc1cc(OC)c(OC)cc1O)C(=O)O 1595637976 ALZTZSVKGODSKU-LLVKDONJSA-N 297.351 2.142 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCNC(C)C 169101994 BSVSOJMSSWCUIO-UHFFFAOYSA-N 277.412 2.065 10 20 CECD C[C@@H](CNCc1cc(Br)ccc1O)N(C)C 163888948 PPNSKYLRDJPJBO-VIFPVBQESA-N 287.201 2.194 10 20 CECD C[C@@H](CCO)N[C@H](C)c1ccc(N2CCOCC2)c(F)c1 151989857 ICOHEOSWTODZBO-QWHCGFSZSA-N 296.386 2.084 10 20 CECD CC(=O)NC[C@H]1CCCN(Cc2ccc(N(C)C)cc2)C1 155602232 UGTJWMXOTSDPRL-MRXNPFEDSA-N 289.423 2.101 10 20 CECD Nc1ccc(CN2CCN(C3CCCC3)CC2)cc1 19726899 NFKYRFGQWGYXEI-UHFFFAOYSA-N 259.397 2.329 10 20 CECD C[C@H]1CCCN(Cc2cc(F)ccc2O)[C@H]1C(=O)O 818631660 MHQDYYGGBCFASS-TVQRCGJNSA-N 267.300 2.216 10 20 CECD COc1ccc(CN[C@H](C)Cn2ccnc2)cc1C 35275346 FOPXPUCQYRXFDR-CYBMUJFWSA-N 259.353 2.378 10 20 CECD OC[C@H](C[C@H]1CCCO1)NCc1c(O)cccc1Cl 886226835 SCLWMXXUDORGGU-WDEREUQCSA-N 285.771 2.065 10 20 CECD COc1ccc(N2CCCN(C(=O)[C@@H]3C[C@@H]3C)CC2)cc1 55877684 WHCQHPCQDNNITR-XJKSGUPXSA-N 288.391 2.390 10 20 CECD Cc1ccc(C(=O)NC[C@]2(C)CCCC[C@@H]2O)c(O)c1O 179535760 XAMGGNAJOYEBEW-LRDDRELGSA-N 293.363 2.077 10 20 CECD COc1cccc(CNC(=O)c2ccc3c(c2)CCO3)c1O 105651762 LCWOFWKXXUFAAR-UHFFFAOYSA-N 299.326 2.266 10 20 CECD CCCCNC(=O)CN(C)c1ccc(OC)c(OC)c1 63616774 KLXAFSUHENTDPX-UHFFFAOYSA-N 280.368 2.056 10 20 CECD C[C@@H]1CCN(C(=O)/C=C/c2ccc(O)c(O)c2)[C@@H]1C 181159396 LAIKIUNKBCDKQU-JYBZGJHDSA-N 261.321 2.368 10 20 CECD CCN(CC)c1ccc(CNCC(C)(C)C(=O)NC)cc1 120335450 OULWSOKKDUKDJM-UHFFFAOYSA-N 291.439 2.395 10 20 CECD CCOC(=O)[C@H](C)NCc1ccc(N2CCCC2)cc1 49371376 OHBYVRSRZNYTGM-ZDUSSCGKSA-N 276.380 2.328 10 20 CECD C[C@H](O)CN(Cc1ccco1)Cc1ccccc1O 192756679 AUKZENSUTCKEJB-LBPRGKRZSA-N 261.321 2.368 10 20 CECD O=C(Nc1cccc2c1OCCC2=O)c1cccc(O)c1O 366172025 OZTJAETXQDVVIB-UHFFFAOYSA-N 299.282 2.315 10 20 CECD C[C@]1(NCc2cc3c(cc2O)OCO3)CCO[C@H]1C1CC1 273133950 NCZGNVASYIBBNV-HOTGVXAUSA-N 291.347 2.168 10 20 CECD CC[C@H](C)CONC(=O)c1ccc(C)c(O)c1O 293826443 VLOZXJUECMPNCH-QMMMGPOBSA-N 253.298 2.114 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1ccnc(F)c1 808093912 ZDXCRSJLOULFTB-UHFFFAOYSA-N 295.310 2.342 10 20 CECD CN(Cc1cccc(Cl)c1O)CC(C)(C)CO 294932367 ZPCFZAZAROBZGV-UHFFFAOYSA-N 257.761 2.496 10 20 CECD CC(C)Cc1cc(C(=O)NCc2ccc(N)cc2)cc(O)n1 296875950 FFNBMXYUVYLLCT-UHFFFAOYSA-N 299.374 2.498 10 20 CECD C[C@@H](NC[C@H]1CCCNC1)c1cc(F)cc(F)c1O 817946282 VEIUSOQIPROIJD-ZJUUUORDSA-N 270.323 2.321 10 20 CECD CCN(C)c1ccc([C@@H](C)NCC(F)(F)CN)cc1 817966492 PAZGGCQBBXIISX-LLVKDONJSA-N 271.355 2.387 10 20 CECD C[C@H]1CC[C@H](NC(=O)c2c(F)ccc(O)c2O)C1 829680868 GSKLEENOMXHZJI-YUMQZZPRSA-N 253.273 2.155 10 20 CECD Cc1cc(CN2C[C@@H]3[C@@H](C2)[C@H]2C=C[C@H]3O2)ccc1N(C)C 831632527 VJZJFSWQGAGWCL-JOCBIADPSA-N 284.403 2.446 10 20 CECD COc1cc2c(c(OC)c1)N(C[C@H](C)OC)CCC2 839654950 CSJPUXWQFKICRR-NSHDSACASA-N 265.353 2.491 10 20 CECD O=C(NCc1ccccc1O)Nc1cc(C(=O)O)cs1 833147022 RCEXSQJBHZZLMF-UHFFFAOYSA-N 292.316 2.474 10 20 CECD CO[C@@H]1COC[C@@H]1N[C@@H](C)c1ccc(C)c(C)c1O 840826220 IFDXOJKMGPXKFG-FPMFFAJLSA-N 265.353 2.073 10 20 CECD C[C@H](N[C@H](C)[C@@H]1CN(C)CCO1)c1ccc(Cl)cc1O 841747807 DPLLQRQHFYGNDX-RWSFTLGLSA-N 298.814 2.415 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H]1CCN(CC(F)F)C1 841897631 HDBXYNIJUOQUTJ-AWEZNQCLSA-N 297.393 2.490 10 20 CECD CCCN(Cc1ccccc1O)C(=O)[C@H](C(=O)O)C(C)C 911324070 RDXFMLOILWSQNL-CQSZACIVSA-N 293.363 2.488 10 20 CECD C[C@@H](NC(=O)[C@@]1(Cl)C[C@H]2CC[C@H]1O2)c1ccccc1O 913763509 IWIIIILQHNKCIQ-HMYIPDOQSA-N 295.766 2.498 10 20 CECD CCN(CC)CCN[C@H](C)c1cccc(OC)c1O 846135713 FTGLIRMDFONSNP-GFCCVEGCSA-N 266.385 2.393 10 20 CECD C[C@H]1CN(Cc2cc(Cl)cc(F)c2O)CC[C@@H]1N 843052218 PLMIXPLVQROOPZ-UFBFGSQYSA-N 272.751 2.354 10 20 CECD CCc1cccc(CN[C@](C)(COC)CC(=O)OC)c1O 848902114 KTGNSGPIMZSFRR-INIZCTEOSA-N 295.379 2.012 10 20 CECD CCCN1CCCN(Cc2cccc(CC)c2O)CC1=O 848905276 FYIHOXZTWQAYJH-UHFFFAOYSA-N 290.407 2.399 10 20 CECD CC(=O)c1cc(F)cc(CN2CC[C@H](C(=O)O)[C@@H]2C)c1O 846283362 DQOBBXRMGJFGSQ-UFBFGSQYSA-N 295.310 2.029 10 20 CECD Nc1ccc(CCNC(=O)NC[C@@H]2CCCS2)cc1 841857193 FUCLRWBIPHICPI-ZDUSSCGKSA-N 279.409 2.006 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@]2(C)C(=O)O)c1O 846273503 YFZPWDSABRNNFY-HNNXBMFYSA-N 295.310 2.173 10 20 CECD CO[C@@H](CNC(=O)NCc1ccccc1O)CC(C)C 841589033 BXTDRXOPWXIXEB-CYBMUJFWSA-N 280.368 2.253 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCC[C@@H]1CCCC1=O 759598405 WSYCZVNZFFSWOK-HWPRWLFBSA-N 290.315 2.414 10 20 CECD CCOc1ccc(CN2CC[C@@H](COC)C2)c(O)c1 769398088 FXUYEJKWUDKFMX-GFCCVEGCSA-N 265.353 2.259 10 20 CECD COc1cccc(O)c1CN(C)Cc1cscn1 769125641 QNEZLMKQRJUQAI-UHFFFAOYSA-N 264.350 2.489 10 20 CECD COC(=O)NC1CCN(Cc2c(C)cccc2O)CC1 877645068 ZYKCDWCFFJYSOE-UHFFFAOYSA-N 278.352 2.021 10 20 CECD CN(CCC(F)(F)F)C(=O)c1cc(O)cs1 1118618233 KYNMDCXGAUEARE-UHFFFAOYSA-N 253.245 2.478 10 20 CECD C[C@H](NC(=O)Nc1cnn(C)c1)c1ccc(N(C)C)cc1 775459060 QHOWWGHMKSUTNQ-NSHDSACASA-N 287.367 2.369 10 20 CECD CC(C)OCC(=O)N[C@H](C)c1ccc(N(C)C)cc1 773001696 WNWHKOLSAFAUCG-GFCCVEGCSA-N 264.369 2.355 10 20 CECD CC(C)(O)CCC(=O)NCCCSc1nccs1 787350178 YUJMCXQXPJKLDE-UHFFFAOYSA-N 288.438 2.293 10 20 CECD Cc1cccc(O)c1CN1CCc2ncncc2C1 895723983 LAOCBFJPXBZNAJ-UHFFFAOYSA-N 255.321 2.049 10 20 CECD Oc1cc2c(cc1CN1CCO[C@@H]3C[C@H]31)CCCC2 793608710 WXBZBYSXHSVQFK-GDBMZVCRSA-N 259.349 2.244 10 20 CECD CC[C@H]1CO[C@@H](C)CN1Cc1ccc(OC)c(OC)c1O 891475487 GLXYSRKSSRENTE-AAEUAGOBSA-N 295.379 2.409 10 20 CECD CC[C@H](NCCN1CCOC[C@@H]1C)c1ccc(C)cc1O 794809083 QGEFLXLYNCWPQD-HOCLYGCPSA-N 292.423 2.462 10 20 CECD C[C@@H](CCCO)NCc1cccc(Br)c1O 87358188 LNFZNLDCFOTFRS-VIFPVBQESA-N 288.185 2.405 10 20 CECD CCCn1ncnc1CN(C)Cc1ccccc1O 279091766 NOUNJSMUEJOWMQ-UHFFFAOYSA-N 260.341 2.026 10 20 CECD COc1ccc(CNC[C@@H](O)C(F)(F)F)cc1C 219442753 DDCBJORMKRPUAK-LLVKDONJSA-N 263.259 2.016 10 20 CECD COC[C@@]1(C(F)(F)F)CCN(CCN=[N+]=[N-])C1 409435924 XIVHPMKDESJTOU-MRVPVSSYSA-N 252.240 2.198 10 20 CECD CC(C)Oc1ccc(N(C)C[C@H]2CN(C)C(=O)O2)cc1 1324488500 MDGUPHQKMQDXPC-AWEZNQCLSA-N 278.352 2.361 10 20 CECD CN(C)c1ccc(CN[C@@H]2CCC[C@H](C(=O)O)C2)cc1 86786069 LQZXZOLQQGTTHA-UONOGXRCSA-N 276.380 2.486 10 20 CECD CCc1cccc(CN2CC[C@@H](C)[C@@H](C(=O)O)C2)c1O 1603975070 CPOUONYNVDSMDJ-RISCZKNCSA-N 277.364 2.497 10 20 CECD O=C(O)/C=C\c1ccc(N2C[C@H](F)[C@H](F)C2)c([N+](=O)[O-])c1 1601882629 LCWAFBHQQWMALY-PGMMKWOSSA-N 298.245 2.189 10 20 CECD C[C@@H](NC(=O)CCNC1CC1)c1ccc(N(C)C)cc1 1576194977 HLVIZAFKQUZIEO-GFCCVEGCSA-N 275.396 2.072 10 20 CECD Nc1ccc(CCNC(=O)[C@]23CCCC[C@@H]2OCC3)cc1 1580443327 XYDJIZFKUHDHRG-RDJZCZTQSA-N 288.391 2.277 10 20 CECD CCN(C)c1ccc(Cn2cc(C(=O)O)nc2C)cc1 1596197189 DCYQXHJCYGASTH-UHFFFAOYSA-N 273.336 2.394 10 20 CECD COc1ccc(O)c(CN[C@@H](C)CCn2cccn2)c1 159045640 MIQXHNMCTKZDJX-LBPRGKRZSA-N 275.352 2.166 10 20 CECD NC1C[C@@H]2CC[C@H](C1)C2NCc1ccc2c(c1)CCO2 841073613 HWRXASISBPFXAG-KWOWKCNFSA-N 272.392 2.227 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H](N)C[C@H]2C)c1O 252856638 LZNIGIMYPJFGHQ-SKDRFNHKSA-N 284.787 2.366 10 20 CECD C[S@@](=O)C1(CNCc2cccc(Cl)c2O)CC1 281655118 BWBLDJHQAOCKHU-QGZVFWFLSA-N 273.785 2.046 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](OC)C[C@@H]2C)c1 282127240 BDVRIPFMPWNPSO-SMDDNHRTSA-N 265.353 2.400 10 20 CECD CN(C)c1ccc(CNCc2ccc(O)nc2)cc1 392682483 ALTOMOJJNVTGDA-UHFFFAOYSA-N 257.337 2.143 10 20 CECD C[C@@H](CCO)NCc1cc(Br)cc(F)c1O 715719975 HWLBEHWLPBOUSZ-ZETCQYMHSA-N 292.148 2.154 10 20 CECD COc1ccc(O)c(CNC(=O)CC[C@H]2CCCCO2)c1 114540799 GGUIKPORQBVEOD-CYBMUJFWSA-N 293.363 2.366 10 20 CECD Cc1ccc(C(=O)NCC[C@@H]2CCCCO2)c(O)c1O 183226112 ODNNLIVSNDWLJJ-NSHDSACASA-N 279.336 2.095 10 20 CECD CCC[C@@](C)(CO)NCc1cc(OC)c(OC)cc1O 182212610 JLOOQVGIKWIQNH-HNNXBMFYSA-N 283.368 2.050 10 20 CECD CC[C@H](COC)NC(=O)N[C@H](C)c1cc(OC)ccc1O 129454296 HTLANOXDUNCYGC-GHMZBOCLSA-N 296.367 2.186 10 20 CECD COc1ccccc1CN(C)C(=O)c1cccc(O)c1O 126282047 PIGANCYPXUHQEX-UHFFFAOYSA-N 287.315 2.379 10 20 CECD CNC[C@H]1CCN(Cc2c(O)cccc2Cl)C1 128326379 YGYRBHKHCCQPKH-SNVBAGLBSA-N 254.761 2.087 10 20 CECD COCCCCN[C@@H](C)c1cc(OC)ccc1O 44655752 XDSYDXFYXZQLNX-NSHDSACASA-N 253.342 2.478 10 20 CECD CCCn1c(C)nnc1CN(C)Cc1ccccc1O 163003508 SKPARWOPNKKRGZ-UHFFFAOYSA-N 274.368 2.334 10 20 CECD COc1cc(N2CCSCC2)c([N+](=O)[O-])cc1OC 271018256 ISXPQOWSPRERAI-UHFFFAOYSA-N 284.337 2.165 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)C1(O)CCCC1 299213485 HBZBHLPJVNGKTM-UHFFFAOYSA-N 290.407 2.406 10 20 CECD CCNC(=O)OC[C@H]1CCCCN1Cc1ccccc1O 809691955 USBGSBHUGZHZGV-CQSZACIVSA-N 292.379 2.493 10 20 CECD CCO[C@H]1COCC[C@H]1NCc1ccc(N(C)C)c(C)c1 815094462 BURGVDIUFJMTON-WBVHZDCISA-N 292.423 2.345 10 20 CECD COC[C@@]1(CO)CCN(Cc2cc(Cl)c(C)cc2O)C1 826096738 BEXRGHHAYUNINY-HNNXBMFYSA-N 299.798 2.185 10 20 CECD CCn1nc(C2CC2)cc1C(=O)NCc1ccccc1O 907057833 ZFZFSDNXKBTREH-UHFFFAOYSA-N 285.347 2.416 10 20 CECD O=C1CC[C@@H]2CN(Cc3cc(Cl)ccc3O)CC[C@@H]2N1 827140148 IFXABRRMONNGTE-MFKMUULPSA-N 294.782 2.146 10 20 CECD O=C(NCCCN1CCCCCC1)c1cc(O)cs1 732265005 MFMDQCBMCFEOGN-UHFFFAOYSA-N 282.409 2.450 10 20 CECD Oc1cc2c(cc1CN1C[C@H]3CCC[C@H]1C3)[C@H](O)CO2 902661481 ZKVIRSWJEMBLJK-ITDIGPHOSA-N 275.348 2.192 10 20 CECD Cc1ccc(O)c(CNCCC(=O)Nc2ccccn2)c1 733325597 LZSJWPDGNVVNJU-UHFFFAOYSA-N 285.347 2.214 10 20 CECD CC(=O)c1cc(F)cc(CN[C@@H](CN)C(C)(C)C)c1O 842475941 YLILSJNXVUIAFE-ZDUSSCGKSA-N 282.359 2.197 10 20 CECD CCc1cccc(CNC(C)(C)CCS(C)(=O)=O)c1O 848897037 DHQSPBJCUSKORK-UHFFFAOYSA-N 299.436 2.258 10 20 CECD Cc1cc(N(C)C)ccc1CNC1COC(C)(C)OC1 840938409 DJHIJZLQMIEXLE-UHFFFAOYSA-N 278.396 2.302 10 20 CECD CCOc1ccc(CN2CCC[C@H](CO)[C@@H]2C)c(O)c1 840977467 IHIGSUCJVVZIRP-GXTWGEPZSA-N 279.380 2.384 10 20 CECD CCCNC(=O)CN[C@H](C)c1ccc(Cl)cc1O 841744176 MQBPCWMEHAXHAQ-SECBINFHSA-N 270.760 2.222 10 20 CECD Cc1cc(Br)c(O)c(CNC[C@H](N)C2CC2)c1 841048960 IDMPBVDBLRWYMN-LBPRGKRZSA-N 299.212 2.290 10 20 CECD CCC[C@]1(NC(=O)NCCc2ccc(N)cc2)CCOC1 841961738 HCGPHBBUKZYAGI-INIZCTEOSA-N 291.395 2.070 10 20 CECD COCC1(O)CCN(Cc2ccc(N(C)C)cc2C)CC1 840918201 PSHKFYFVOGOPQV-UHFFFAOYSA-N 292.423 2.034 10 20 CECD CO[C@@H]1C[C@@H](NCc2cc([N+](=O)[O-])ccc2O)C1(C)C 753375010 XQGBJGOTKXLTRZ-CHWSQXEVSA-N 280.324 2.204 10 20 CECD CN(C)c1ccc(CN2C[C@H]3CCC[C@@]3(N)C2)cc1F 857225907 AFIKYEQGVHFBQB-CZUORRHYSA-N 277.387 2.205 10 20 CECD COCCOC[C@@H](C)N[C@@H](C)c1cc(OC)ccc1O 756731549 CAWPDJSDTLJFIS-NEPJUHHUSA-N 283.368 2.103 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@](C)(O)COC)cc1 765934749 CRLDIFBROSLOKD-XJKSGUPXSA-N 280.412 2.191 10 20 CECD CC(=O)NCCCCCC(=O)NCc1cc(C)ccc1O 862759731 KCVLPNYFNVPNGA-UHFFFAOYSA-N 292.379 2.013 10 20 CECD C[C@H]1CC(NC(=O)c2cc(O)cs2)C[C@H](C)O1 768575539 LJTRVYDHIZZORX-YUMQZZPRSA-N 255.339 2.140 10 20 CECD Cc1ccc(O)c(CNC(=O)N=c2cc(C)[nH]cc2C)c1 860850210 BIVPAHCKRLZOSS-UHFFFAOYSA-N 285.347 2.456 10 20 CECD COc1cc(C)cc(CN2CCO[C@@H]3CCC[C@@H]32)c1O 863306712 OVIVDOBNSRMJNY-UONOGXRCSA-N 277.364 2.463 10 20 CECD CO[C@@H]1CCC[C@H]1CNC(=O)/C=C/c1ccc(O)c(O)c1 779545110 QEJIRQHJLIUDDM-KUELQNGQSA-N 291.347 2.042 10 20 CECD Cc1cccc(CN[C@H](C)Cc2cnccn2)c1O 776065967 MVSKWOFWPJLXSN-GFCCVEGCSA-N 257.337 2.211 10 20 CECD CCO[C@@H]1COCC[C@@H]1N[C@@H](C)c1c(O)cccc1F 886590435 VGJCTPUNYLUZKD-VHRBIJSZSA-N 283.343 2.376 10 20 CECD OCC[C@@H]1CCCN(Cc2cc(F)cc(F)c2O)C1 894004259 LJUIZKPGLUNWRB-JTQLQIEISA-N 271.307 2.265 10 20 CECD C[C@H]1CN(Cc2cc(F)cc(F)c2O)C[C@]2(CCOC2)O1 894629667 MCJNWNWTFJDRBZ-BONVTDFDSA-N 299.317 2.050 10 20 CECD CC[C@H](NC(=O)/C=C\c1ccc(O)c(O)c1)c1ncc[nH]1 785420989 JBHTVDRJHRKTPB-QZPNVGJNSA-N 287.319 2.102 10 20 CECD COc1ccc(CN[C@H](C)[C@@H](OC)C2CC2)c(O)c1OC 894755450 QVDUTJUORPTRKY-MEBBXXQBSA-N 295.379 2.313 10 20 CECD COc1ccc(CNC[C@@H]2CCCS2)c(O)c1OC 893110013 FBFUGKDNZRZJEQ-NSHDSACASA-N 283.393 2.395 10 20 CECD COc1cc(C)cc(CNC[C@H](OC)C(F)(F)F)c1O 894251822 QFKLCBJNILMZKY-NSHDSACASA-N 293.285 2.376 10 20 CECD O=[N+]([O-])c1cnc(Sc2nnnn2C2CCCC2)s1 799926725 DRJXHNAFQIQICE-UHFFFAOYSA-N 298.353 2.304 10 20 CECD CCOC(=O)CN(C)Cc1ccc(N2CCCC2)cc1 1204328124 ONMFGSAPOGXKJL-UHFFFAOYSA-N 276.380 2.282 10 20 CECD COc1cccc(CN(CCO)[C@H]2C[C@H]3CC[C@H]2C3)c1O 793329832 YGPSZMNARNSIAK-YDHLFZDLSA-N 291.391 2.384 10 20 CECD CN(Cc1cc(Cl)ccc1O)C(C)(C)C(=O)O 86762031 OELYHHOSDPTQNV-UHFFFAOYSA-N 257.717 2.341 10 20 CECD CC[C@H](CCO)CNCc1cc(F)cc(F)c1O 708455883 ZRIBAOFFRDVTRI-SECBINFHSA-N 259.296 2.169 10 20 CECD C[C@@H](CCC(=O)O)CNCc1ccc2c(c1)CCO2 1326324161 UJFFPBDIYIWJNI-NSHDSACASA-N 263.337 2.212 10 20 CECD COc1ccc(S(=O)(=O)Nc2ccc(O)cc2)cc1F 192747668 XHHLEDZZJDMNPE-UHFFFAOYSA-N 297.307 2.341 10 20 CECD O=C(O)[C@H]1C[C@@H](NCc2ccc(N3CCCC3)cc2)C1 1348922838 JNJBMWQJZCWORN-OKILXGFUSA-N 274.364 2.240 10 20 CECD C[C@H]1CN(CCSc2nccs2)C[C@H](C)O1 1346808396 NNVIWAKKBKCDTP-UWVGGRQHSA-N 258.412 2.344 10 20 CECD Cc1noc(C2CCN(Cc3ccc(N)cc3)CC2)n1 1352788689 QJJBTYZCCKSPIX-UHFFFAOYSA-N 272.352 2.340 10 20 CECD C[C@H](NCCC[C@@H]1CCCN1)c1cc(C(=O)O)ccc1O 1609781341 WGTWDAOSKPFCEI-WCQYABFASA-N 292.379 2.273 10 20 CECD CCOC(=O)CCCOc1ccc(N(C)C)c(C(=O)O)c1 1596607107 HLBDGRZYBLMHMH-UHFFFAOYSA-N 295.335 2.173 10 20 CECD CN(C)c1ccc(CNCc2ccc(C(=O)O)[nH]2)cc1 1598320687 MUQLBCDWTVXRKL-UHFFFAOYSA-N 273.336 2.069 10 20 CECD CCCOc1ccc(CNCCOCCC(=O)O)cc1C 1776820943 CBGCNNPTGRZHDR-UHFFFAOYSA-N 295.379 2.365 10 20 CECD CCN(Cc1cc(C)c(C)cc1O)[C@H]1CCS(=O)(=O)C1 16839692 VBRDRJRLRNPYFY-AWEZNQCLSA-N 297.420 2.018 10 20 CECD C[C@@H](NCc1ccc2c(c1)CCCO2)[C@@H]1CCCNC1 904353025 GKVSTLKBTVXNAT-CZUORRHYSA-N 274.408 2.489 10 20 CECD CCn1cc(C(=O)N(C)Cc2ccccc2O)c(C)n1 860047831 MRASXRYRWFMEDE-UHFFFAOYSA-N 273.336 2.189 10 20 CECD COc1cccc(CN2CCO[C@@H]3CCC[C@H]32)c1O 228144228 YHKJPXVBHSRNLB-CHWSQXEVSA-N 263.337 2.154 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2NCC(C)(C)C(N)=O 230670432 PCIWXUOFOLFWIN-GHMZBOCLSA-N 276.380 2.350 10 20 CECD Cc1ccccc1CCNC(=O)c1cccc(O)c1O 126477950 OAWLYSISOVZHFB-UHFFFAOYSA-N 271.316 2.379 10 20 CECD c1cncc(CCNCc2ccc3c(c2)CCO3)c1 37718243 ITMQFJDUFVOYOW-UHFFFAOYSA-N 254.333 2.349 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@@H]1CCC=CO1 708553368 BMPKMMGNMYVYBH-NSHDSACASA-N 255.264 2.453 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1ccccc1O 175425716 BETGREPQMSHKNJ-UHFFFAOYSA-N 298.342 2.497 10 20 CECD COc1cccc(CNC(=O)CCc2ccoc2)c1O 175542109 YQEWJOIPKKWEJE-UHFFFAOYSA-N 275.304 2.243 10 20 CECD COc1ccc(O)c(CN[C@H](CO)Cc2ccccc2)c1 63218419 YMCSHWQDFYPPSC-HNNXBMFYSA-N 287.359 2.094 10 20 CECD C[C@@H](N[C@H](C)[C@@H](C)N1CCOCC1)c1ccc(F)cc1O 185375874 NIPUSZWDPYICIS-JHJVBQTASA-N 296.386 2.291 10 20 CECD CCO[C@H](CCN(C)C)CN[C@H](C)c1ccccc1O 183548620 PHUWVXPGMQQKDJ-ZIAGYGMSSA-N 280.412 2.400 10 20 CECD CCOc1ccc(O)c(CNC[C@](C)(O)c2ccco2)c1 266165102 PBWVOMOAGWKXFB-INIZCTEOSA-N 291.347 2.381 10 20 CECD C[C@H](N[C@H](C)CC[S@@](C)=O)c1ccc(F)c(F)c1O 276896448 IIGAOVKVBSVUIF-BLBZPCKPSA-N 291.363 2.478 10 20 CECD Cc1ccc(C(=O)Nc2c(C)c(C)nn2C)c(O)c1O 272814108 NTNFDNQARVMHQY-UHFFFAOYSA-N 275.308 2.009 10 20 CECD C[C@H]1CCC[C@@H]1NCC(=O)NCc1ccc(N(C)C)cc1 282062691 MSCYQWVEDQHAPV-BBRMVZONSA-N 289.423 2.147 10 20 CECD CN(C)c1ccc(CNC(=O)CCc2cscn2)cc1 299342536 FMWZVNXEGRFILS-UHFFFAOYSA-N 289.404 2.458 10 20 CECD NCCN(Cc1ccccc1O)c1ccccc1[N+](=O)[O-] 809728304 RVVYTSAMJQFKAE-UHFFFAOYSA-N 287.319 2.266 10 20 CECD COC(=O)c1cnc(S[C@@H](C)c2nnc(C)o2)s1 295267213 JFMUHYZXNLEVRQ-YFKPBYRVSA-N 285.350 2.474 10 20 CECD CCOc1ccc(CN2C[C@@H](C)C[C@@H](C(=O)O)C2)c(O)c1 817881840 PTDSIZIPEATBHL-WCQYABFASA-N 293.363 2.334 10 20 CECD COCCn1nc(C)c(NC(=O)c2cc(O)cs2)c1C 829796357 YZRVUBJQJYEXKU-UHFFFAOYSA-N 295.364 2.166 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCn2cncc2C1)c1ccccc1O 827941460 SAFJLXRTESGFGY-VXGBXAGGSA-N 285.347 2.029 10 20 CECD COc1ccc(N(C)C(=O)/C=C\c2cccnc2)cn1 491280746 YVRPMLOQGVHUNY-YVMONPNESA-N 269.304 2.161 10 20 CECD CCCCCOC1CN(C(=O)c2c(F)ccc(O)c2O)C1 826584708 IALIWHLCVWUOND-UHFFFAOYSA-N 297.326 2.268 10 20 CECD Cc1ccc(O)c(CN2CCC(N3CCOC3=O)CC2)c1 827740593 CUBOGRVPBBGOCP-UHFFFAOYSA-N 290.363 2.117 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CC[C@H]1CCNC1 829764753 WHYIOFPIXOBVPD-AWEZNQCLSA-N 289.423 2.067 10 20 CECD COc1ncc(/C=C/C(=O)N2CCCc3ccccc32)cn1 492701679 FCBMSECEBDMSQC-CMDGGOBGSA-N 295.342 2.478 10 20 CECD CN(CCCCNCc1cc([N+](=O)[O-])ccc1O)C1CC1 835061570 IBVQXNLMAVVZKX-UHFFFAOYSA-N 293.367 2.264 10 20 CECD CN(C)c1ccc(CN[C@H]2C[C@H](N)C2)c(C(F)(F)F)c1 906518010 MVIIKWFNGFCYSG-XYPYZODXSA-N 287.329 2.351 10 20 CECD O=C(NCC1CC(F)(F)C1)c1c(F)ccc(O)c1O 832437924 WZVGHUNYJWWQTM-UHFFFAOYSA-N 275.226 2.012 10 20 CECD Nc1ccc(NC(=O)NC[C@@H](O)C2CCCCC2)cc1 841300281 OWMORAZEBZVAEE-CQSZACIVSA-N 277.368 2.332 10 20 CECD Cc1cc(N(C)C)ccc1CNCC1(N)CCCC1 849349999 MWDYBPBHTMRGCE-UHFFFAOYSA-N 261.413 2.422 10 20 CECD CC(C)c1nocc1C(=O)NCc1ccc(O)cc1O 910957319 RGNGUAMKIPUPBJ-UHFFFAOYSA-N 276.292 2.139 10 20 CECD CS[C@H]1CC[C@@H](NC(=O)c2cc(O)cs2)C1 743729393 ZNOMKMHAWVCANX-APPZFPTMSA-N 257.380 2.468 10 20 CECD COC(=O)C1CCN(Cc2ccc(N(C)C)cc2C)CC1 840908295 RNFMXLGQMCIOBD-UHFFFAOYSA-N 290.407 2.446 10 20 CECD Cc1ccc(C(=O)N=[S@](C)(=O)C(C)C)c(O)c1O 926056200 JDILYZCMRKTJQE-GOSISDBHSA-N 271.338 2.053 10 20 CECD Cc1c[nH]ccc1=NCc1ccc(N2CCC(O)CC2)cc1 853955347 MBVYNUXYLFGTHO-UHFFFAOYSA-N 297.402 2.385 10 20 CECD CCC[C@@H](O)CN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 756575555 HNCOPQCIYWQGPZ-GXSJLCMTSA-N 268.313 2.112 10 20 CECD CO[C@@H](CNC(=O)NCc1cc(C)ccc1O)C(C)C 858287735 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229946613 JRONWELJLLKZDT-UHFFFAOYSA-N 276.384 2.122 10 20 CECD Cc1ccc(O)c([C@H](C)NCCc2cnn(C)c2)c1 128119860 WNVYOIFFEFVXDG-LBPRGKRZSA-N 259.353 2.327 10 20 CECD COc1cc(Cl)cc(CN[C@H]2C[C@@H](O)C2(C)C)c1O 128219788 PLNOHVBZBSVPQD-NWDGAFQWSA-N 285.771 2.303 10 20 CECD C[C@@H](NCCCC(=O)N(C)C)c1cc(F)ccc1O 185194579 HKWUJPVJGVOZDQ-SNVBAGLBSA-N 268.332 2.050 10 20 CECD C[C@H]1C[C@@H](NCc2ccc(N(C)C)cc2)CCN1C 90720999 PCOSUZSMJNLATG-ZFWWWQNUSA-N 261.413 2.325 10 20 CECD COc1ccc(CN[C@@H]2C[C@@H](C)O[C@@H]2C)c(O)c1 384541762 FAFGOTCUDYTRMO-GIPNMCIBSA-N 251.326 2.056 10 20 CECD CCOc1cccc(CNCc2c(C)nn(C)c2C)c1O 112018087 QZGYUJXQUIVNGD-UHFFFAOYSA-N 289.379 2.431 10 20 CECD O=C1CN(C(=O)/C=C/c2cccnc2)c2ccccc2N1 60820782 WCMOBVSTHQXYGH-BQYQJAHWSA-N 279.299 2.080 10 20 CECD O=[N+]([O-])c1ccc(O)c(CNCC2(O)CCCCCC2)c1 117947067 PBIXDLXPUUTTFE-UHFFFAOYSA-N 294.351 2.475 10 20 CECD CCC[C@@H]1C[C@@H](C(=O)NCc2ccc(O)c(O)c2)CCO1 182838297 KYRLZJOZSPLBSX-QWHCGFSZSA-N 293.363 2.309 10 20 CECD Cc1ccc(O)c([C@@H](C)NCC(C)(C)N2CCOCC2)c1 35628755 AAZGADVOPWPRPZ-CQSZACIVSA-N 292.423 2.462 10 20 CECD CCN(Cc1cc(F)ccc1O)C[C@H](O)C(F)(F)F 189880063 WTFYOCGXODQDBT-NSHDSACASA-N 281.249 2.276 10 20 CECD O=C(O)[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NCc1ccc2c(c1)CCO2 226458825 DMFSQNUGQYVSEJ-UGQVUOCMSA-N 287.359 2.210 10 20 CECD CCOC(=O)[C@H](C)N(Cc1cc(OC)ccc1O)C1CC1 191714626 YSWGCAGYAWOWEU-NSHDSACASA-N 293.363 2.317 10 20 CECD CCn1nc(C)c(C(=O)Nc2ccc(N)cc2)c1C 269124490 LOWOOMVLQYACHL-UHFFFAOYSA-N 258.325 2.354 10 20 CECD CO[C@H](C(=O)N1CCOc2cc(N(C)C)ccc21)C(C)C 356049946 ZDVOLCGUDGESOQ-HNNXBMFYSA-N 292.379 2.149 10 20 CECD Nc1ccc(CCNC(=O)Cc2ccc3c(c2)CCO3)cc1 269153140 VJCMLLMZYOMEPV-UHFFFAOYSA-N 296.370 2.105 10 20 CECD C[C@@H](NCc1ccn(C)c1)c1cc([N+](=O)[O-])ccc1O 273557682 HFAPTJLNYDBUFA-SNVBAGLBSA-N 275.308 2.490 10 20 CECD COCC[C@@H]1COCCN1Cc1cccc(Cl)c1O 291162114 CPQMVNFMIBREGG-GFCCVEGCSA-N 285.771 2.283 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)c1cc(C)on1 808094569 VABNJJIEDYDHLE-UHFFFAOYSA-N 281.308 2.104 10 20 CECD Cc1ccc(C(=O)Nc2cc(C3CC3)n(C)n2)c(O)c1O 292517315 BKZHQGZYAUSWJQ-UHFFFAOYSA-N 287.319 2.269 10 20 CECD CCCc1nc(C)c(C(=O)NCc2ccc(O)c(O)c2)o1 293577629 CAWLTEGGOYFCGH-UHFFFAOYSA-N 290.319 2.277 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)NOCC1CC1 297464406 RDYZEJVDLUZSDG-UHFFFAOYSA-N 277.368 2.236 10 20 CECD CC(C)(CCNCc1cccc(F)c1O)C(=O)O 818629087 ORWLOIOPUZBCIZ-UHFFFAOYSA-N 255.289 2.122 10 20 CECD C[C@@H](N[C@@H]1CCCNC1)c1cc(F)cc(F)c1O 817942490 ZZWDYNHNNAVDCA-PSASIEDQSA-N 256.296 2.073 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCCN1 817901733 XTFCRDHAQHBQBF-FZMZJTMJSA-N 265.376 2.122 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H](O)CCOC(C)C 819076436 BYXKPGUYMKRRHI-QGZVFWFLSA-N 294.439 2.327 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC[C@H]3CNC[C@@H]3C2)c1 817987594 UNMIOBBGBFSKIH-XDQVBPFNSA-N 290.407 2.440 10 20 CECD O=C(O)C1CCN(Cc2cccc(Cl)c2O)CC1 821511263 FPHGSYQGNMVPAR-UHFFFAOYSA-N 269.728 2.342 10 20 CECD CN(C)c1ccc(CN(CC[S@@](C)=O)C2CC2)cc1 827443153 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C[C@@H](NC(=O)N(C)[C@H](C)CCO)c1ccc(N(C)C)cc1 845123718 DFMXDMMJRVPKGH-CHWSQXEVSA-N 293.411 2.226 10 20 CECD CC(=O)c1cc(F)cc(CN2[C@H](C)CN[C@@H](C)[C@H]2C)c1O 923446331 YGUGNBAIYUNQHQ-OUAUKWLOSA-N 294.370 2.305 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@H]1CO 856796010 MXALOZWQBPCNQL-HIFRSBDPSA-N 262.397 2.203 10 20 CECD CCCn1ncnc1COc1ccc(N(C)C)cc1 853693660 SRDAKWKCPHWLHZ-UHFFFAOYSA-N 260.341 2.333 10 20 CECD Cc1ccc(C(=O)N[C@@H](C)CC(F)(F)F)c(O)c1O 768575061 FNVVLMQZSZDRKH-ZETCQYMHSA-N 277.242 2.477 10 20 CECD Cc1ccc(O)c(CNC(=O)CCc2cccnc2)c1 862761053 BUNGBJDUHIZZTG-UHFFFAOYSA-N 270.332 2.345 10 20 CECD Cc1ccc(CN2C[C@H](C)O[C@@]3(CCOC3)C2)c(O)c1 877491994 DSZUPFDFAZHKHB-BBRMVZONSA-N 277.364 2.080 10 20 CECD CCN(C)c1ccc(CN2CC[S@](=O)[C@@H](C)[C@H]2C)cc1 773756759 ZLIJHKILJRYDPR-CKNLXJGOSA-N 294.464 2.484 10 20 CECD CC[C@@H](N[C@H](CO)C1CCOCC1)c1ccccc1O 775551295 LZNMFBUBJPAWQW-HUUCEWRRSA-N 279.380 2.220 10 20 CECD CCN(CC)c1ccc(CN2CCO[C@H](OC)C2)cc1 895968342 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60942075 WOUUYLXNZACMOM-UHFFFAOYSA-N 258.321 2.394 10 20 CECD Nc1ccc(NC(=O)N2CCC[C@@H](CF)C2)cc1 711430087 MVXVRELPONLMRG-JTQLQIEISA-N 251.305 2.482 10 20 CECD CCCN(Cc1ccccc1O)C(=O)Cn1nccc1C 1331796873 PUJHHZYWPNUVKC-UHFFFAOYSA-N 287.363 2.336 10 20 CECD C[C@H]1C[C@H](NCc2ccc3c(c2)CCO3)CCN1C 90720250 FNDIGJYMDPSVHM-SWLSCSKDSA-N 260.381 2.194 10 20 CECD CN(C[C@@H]1CC12CC2)c1ccc(OCC(=O)O)cc1 1777051431 GPGGZTLBKYFNCV-NSHDSACASA-N 261.321 2.386 10 20 CECD Cc1c(CNc2ncn(C)n2)n(C)c2ccccc12 292425273 LCKCELDPRWEIOE-UHFFFAOYSA-N 255.325 2.227 10 20 CECD COc1ccc(O)c(CN[C@@H]2CCS[C@H]2C)c1 310528700 YQQRPEAOPOZIPA-JOYOIKCWSA-N 253.367 2.384 10 20 CECD COc1ccncc1CNCc1cc(F)ccc1O 688953962 IJIIAVLSJAVMFW-UHFFFAOYSA-N 262.284 2.225 10 20 CECD C[C@@H](NC(=O)[C@@H](N)C1CCCCC1)c1ccccc1O 1119241596 HRVLHTYVUZUTFK-ABAIWWIYSA-N 276.380 2.477 10 20 CECD Cc1ccc(C(=O)NCCOc2ccccc2)c(O)c1O 177657939 AAFLRQKJFODADL-UHFFFAOYSA-N 287.315 2.215 10 20 CECD CC1=C(C(=O)N[C@@H](C)Cc2ccc(O)c(O)c2)CCCO1 186398282 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2.095 10 20 CECD Cc1cc(Cl)cc([C@@H](C)NC[C@]2(O)CCOC2)c1O 808708175 IZTVRFNZKCYAAV-QMTHXVAHSA-N 285.771 2.156 10 20 CECD COc1ncccc1CCNCc1cccc(C)c1O 290908641 MXUMQGBLGBRYRQ-UHFFFAOYSA-N 272.348 2.437 10 20 CECD Cc1nccnc1CCNCc1ccc(N(C)C)c(F)c1 292897079 DLLVEJUKXXPZCN-UHFFFAOYSA-N 288.370 2.322 10 20 CECD Cc1nc(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)c(C)o1 293471007 MGOVPJGMTSHESW-MRVPVSSYSA-N 290.319 2.064 10 20 CECD CC[C@H](N[C@@H](C)C(=O)NCCF)c1ccc(C)cc1O 800498476 LCIVVKOZGWIATI-AAEUAGOBSA-N 282.359 2.216 10 20 CECD CC(=O)C(=O)COC(=O)Cc1coc2cc(C)c(C)cc12 808484582 QQIJGRBDUYPCRB-UHFFFAOYSA-N 288.299 2.293 10 20 CECD CCN(Cc1c(O)ccc(Cl)c1F)[C@H](C)CO 814169621 KOWOFAZXNFTPJW-MRVPVSSYSA-N 261.724 2.387 10 20 CECD Cc1ccc(O)c(CN[C@H](CC(N)=O)c2ccccc2)c1 815154055 JVIRAHHNXGZUKY-OAHLLOKOSA-N 284.359 2.407 10 20 CECD Cc1ccc([C@H](C)NC[C@@H]2C[C@H](F)CN2)c(O)c1 817976421 LVBVKULVVBKKOG-SRVKXCTJSA-N 252.333 2.051 10 20 CECD COc1ccc2c(c1)CCCN2Cc1ccnc(OC)n1 824131077 NLEGQVRMLHKWDJ-UHFFFAOYSA-N 285.347 2.447 10 20 CECD CC[C@H](O)[C@H](C)C(=O)NCc1ccc(N2CCCC2)cc1 822575908 BMLLUCXYHOLHTF-BBRMVZONSA-N 290.407 2.310 10 20 CECD COc1ccc(CNC(=O)[C@H](C)C2CCC2)c(O)c1 837592067 JOFXLHBPMIHIJO-SNVBAGLBSA-N 263.337 2.453 10 20 CECD CN(C)c1ccc(CNC(=O)Nc2cnsn2)cc1F 839111893 HOORKLSYLRPCEJ-UHFFFAOYSA-N 295.343 2.065 10 20 CECD COCCOc1ccc(/C=C2/SC(=S)NC2=O)cc1 730464073 FQWFTSBOBHEYHQ-DHZHZOJOSA-N 295.385 2.201 10 20 CECD COc1ccc(O)c(CNC(=O)CCc2nccs2)c1 734019148 ZRTXQTQTXKAQST-UHFFFAOYSA-N 292.360 2.106 10 20 CECD Oc1c(F)cccc1CN1CCC2(CCNCC2)C1 843120145 AMJRHFCTJNZZJM-UHFFFAOYSA-N 264.344 2.107 10 20 CECD COc1cccc(CNC(=O)[C@H](C)C(F)(F)F)c1O 743332714 FKNRDUWUGCKHMX-ZETCQYMHSA-N 277.242 2.215 10 20 CECD O=C(C=C1CCSCC1)NCc1ccc(O)cc1O 910950599 XZHAFPCIXDFNLV-UHFFFAOYSA-N 279.361 2.167 10 20 CECD COc1cccc(CN2CCC[C@H]([C@@H]3CCNC3)C2)c1O 843124844 JCJJIAVCWCKWFX-KGLIPLIRSA-N 290.407 2.222 10 20 CECD CCOc1ccc(O)c(CN(C)CC(C)(C)CN)c1 843056708 XIAQNJIERGECFQ-UHFFFAOYSA-N 266.385 2.208 10 20 CECD COc1cccc([C@@H](C)NC2CCOCC2)c1O 846142251 ZBRMUCQQBJKWBA-SNVBAGLBSA-N 251.326 2.230 10 20 CECD c1cc(N2CCCC2)ccc1CN[C@@H]1[C@H]2C[C@@H]3CN[C@@H]1[C@H]3C2 925542003 FOJXWRICAVDVLP-BSWVEEBUSA-N 297.446 2.373 10 20 CECD CC[C@H](NCc1c(O)ccc(Cl)c1F)C(=O)O 843039321 PIFXOSFBIAYMSJ-QMMMGPOBSA-N 261.680 2.138 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H](O)CC(C)C)c1 756496336 GOKCJXPXMMQYRB-DGCLKSJQSA-N 295.379 2.236 10 20 CECD Cc1nnc(CNCc2cc(F)c(N(C)C)cc2F)s1 858157895 SZLJWWXPDHXLHN-UHFFFAOYSA-N 298.362 2.481 10 20 CECD C[C@@H](N[C@H](C(N)=O)c1ccccc1)c1cc(F)ccc1O 756382789 UJASNNUALBNBNP-BMIGLBTASA-N 288.322 2.409 10 20 CECD CC(C)OCCCOC(=O)c1cccc(O)c1O 758563663 YVMKJGNQRJRUST-UHFFFAOYSA-N 254.282 2.070 10 20 CECD COc1cc(CN2CC[S@](=O)[C@@H](C)[C@H]2C)c(O)cc1C 768444570 CZZZSHDNBDVIEM-JGRMJRGVSA-N 297.420 2.051 10 20 CECD Cc1ccc(O)c(CNC(=O)C[C@@H](C)c2cnn(C)c2)c1 862754548 FZVBPBMSASOYTO-GFCCVEGCSA-N 287.363 2.244 10 20 CECD CC(C)CCN(C)Cc1cc2c(cc1O)OC[C@@H]2O 768439258 FEMGRIBFCYHKLC-AWEZNQCLSA-N 265.353 2.296 10 20 CECD C[C@@H](NC(=O)c1cc(O)cs1)[C@@H](O)Cc1ccccc1 764996848 DGYKEVLHQCHLTN-MFKMUULPSA-N 291.372 2.176 10 20 CECD COC(=O)CN(Cc1cc(F)cc(F)c1O)CC(C)C 1119507262 CKTGQIYITCOVHU-UHFFFAOYSA-N 287.306 2.301 10 20 CECD O=C(Nc1ccc2c(c1)CCO2)c1c(F)ccc(O)c1O 764444472 ZYTOISBPXNRKIY-UHFFFAOYSA-N 289.262 2.424 10 20 CECD Oc1ccc2ccncc2c1CN1C[C@H]2COC[C@H]2C1 872785532 TWHIZVPEOTUTBG-BETUJISGSA-N 270.332 2.019 10 20 CECD CCCN(CCO)Cc1ccc(N(C)CC)cc1 773728666 FDCHZZJUBHFFDY-UHFFFAOYSA-N 250.386 2.347 10 20 CECD CC[C@H](NCCN1CCOC[C@@H]1C)c1ccccc1O 775499179 PJOPINMQSJBBRM-ZFWWWQNUSA-N 278.396 2.154 10 20 CECD COc1cccc(CN2CCC[C@H](C(C)(C)O)C2)c1O 877796930 NIRXWXOVRMRAIR-ZDUSSCGKSA-N 279.380 2.384 10 20 CECD COc1ccc(CN[C@H]2CCN(C(C)=O)[C@H](C)C2)cc1C 1044391922 AIGBKMDZMVZKMS-CJNGLKHVSA-N 290.407 2.493 10 20 CECD CN(C)c1ccc([C@@H](CNc2ncccn2)N(C)C)cc1 897522366 MTXJKAZLYBXEDZ-OAHLLOKOSA-N 285.395 2.257 10 20 CECD CO[C@@]1(CN[C@H](C)c2c(C)cc(C)cc2O)CCOC1 788748761 AJRKNGIZHQTDNV-CZUORRHYSA-N 279.380 2.465 10 20 CECD CO[C@@]1(C(=O)N[C@H](C)c2ccccc2O)CCSC1 899181644 IYNPHGDXIUVNIY-YGRLFVJLSA-N 281.377 2.092 10 20 CECD COc1ccc(CNc2cccnc2[N+](=O)[O-])c(O)c1 795291933 IFCXLTHSEHLWSX-UHFFFAOYSA-N 275.264 2.316 10 20 CECD COc1ccc(CNC(=O)C2[C@H]3CCC[C@H]23)c(O)c1 794378485 VZCTZJGURBJDRO-RYUDHWBXSA-N 261.321 2.063 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@@H](CO)CC(C)C)c1 40774040 KNIBODOAPATVDJ-VXGBXAGGSA-N 267.369 2.458 10 20 CECD CC[C@@H](F)C(=O)N1CCN(c2ccc(OC)c(F)c2)CC1 1337183122 LNAAHVQKJSPGPT-GFCCVEGCSA-N 298.333 2.231 10 20 CECD CCN(C)c1ccc(Cn2cc(CNCC3CC3)nn2)cc1 1333535514 FKOATZSBFAAZCR-UHFFFAOYSA-N 299.422 2.282 10 20 CECD C[C@@H](O)CCN(Cc1ccccc1O)C[C@H]1CCCO1 798195252 DMIRFVZAVIGFBK-UKRRQHHQSA-N 279.380 2.144 10 20 CECD COc1ccc(N(C)C[C@H]2CCNC2)cc1Cl 215272251 HPIHEPQTMLCENL-JTQLQIEISA-N 254.761 2.394 10 20 CECD CC(C)c1ccc(O)c(CN[C@@H](C)c2cnn[nH]2)c1 1575452914 AHHMZXVSOQOPTQ-JTQLQIEISA-N 260.341 2.485 10 20 CECD COc1ccc(CNc2nc(C(=O)O)c(C)s2)c(O)c1 1599574436 GUXORECVMLGFSD-UHFFFAOYSA-N 294.332 2.476 10 20 CECD CCn1cc(N[C@@H](C)c2cc(C(=O)O)ccc2O)cn1 1597896422 IBUOUWDNQFMCEF-VIFPVBQESA-N 275.308 2.480 10 20 CECD OC[C@@H]1CCCN(Cc2c(O)cccc2Cl)C1 154597549 ADIQKCAZCFJNSG-SNVBAGLBSA-N 255.745 2.250 10 20 CECD CCS(=O)(=O)CCN[C@H]1C[C@H](C)c2c(C)ccc(O)c21 230660586 VRDYBWGYNGEUEW-RYUDHWBXSA-N 297.420 2.273 10 20 CECD Cc1ccc(NC(=O)c2cccc(O)c2O)c(C)n1 126481413 KCUVVCGVAFHXMU-UHFFFAOYSA-N 258.277 2.362 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCN(C3CC3)C2)c1 44684596 KKJKXXVIDBPJAT-RYUDHWBXSA-N 276.380 2.288 10 20 CECD c1c[nH]c(CNCc2ccc(N3CCCC3)cc2)n1 67693688 XDVQIFWQPISHBU-UHFFFAOYSA-N 256.353 2.300 10 20 CECD C[C@]1(CN)CCN(Cc2cc(Br)ccc2O)C1 310104944 ZRULGBGDJHFWLT-CYBMUJFWSA-N 299.212 2.325 10 20 CECD CN(Cc1ccccc1O)[C@H]1CCCC[C@@H]1S(C)(=O)=O 179560784 RRVNNBMKZFSZFA-ZFWWWQNUSA-N 297.420 2.180 10 20 CECD COc1cccc(CNC(=O)c2ccc(C)nc2)c1O 68489256 FCARONLCJPJGRB-UHFFFAOYSA-N 272.304 2.034 10 20 CECD CCOCCN(C)c1cc(OC)c(OC)c(OC)c1 125753385 KCQJEPAIZJQNEO-UHFFFAOYSA-N 269.341 2.185 10 20 CECD CCC[C@]1(C)C(=O)NCCN1Cc1cc(F)ccc1O 189038187 AYEZAVFSGNKBKM-OAHLLOKOSA-N 280.343 2.022 10 20 CECD OC[C@H](NCc1cc(Br)ccc1O)C1CC1 381487807 KGUDXUKWGICSLV-NSHDSACASA-N 286.169 2.015 10 20 CECD O=C(NC1CC1)N(Cc1ccccc1O)C[C@@H]1CCCO1 42933355 VHADIDPUXSYIJG-AWEZNQCLSA-N 290.363 2.245 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)NC1CC1 49126862 ZDRHVKPMYOHSQD-UHFFFAOYSA-N 261.369 2.447 10 20 CECD Cc1cc(O)c(CN(C)[C@H](C)[C@H](C)S(C)(=O)=O)cc1C 245721814 HYXXTXKRLIBERI-OLZOCXBDSA-N 299.436 2.262 10 20 CECD C[C@@H](NCCCn1ccnc1)c1cc([N+](=O)[O-])ccc1O 273298355 AQEKASMIVSVIOE-LLVKDONJSA-N 290.323 2.238 10 20 CECD C[C@@H]1C[C@H](NC(=O)N(C)Cc2ccccc2O)CCO1 271422473 ZSLGNTLBOAWIBT-DGCLKSJQSA-N 278.352 2.101 10 20 CECD CC[C@H](NC[C@]1(O)CCO[C@H]1C)c1ccc(C)cc1O 280277968 YGPSQPAXCNQPHK-DUVNUKRYSA-N 279.380 2.281 10 20 CECD CCCCN(CC(=O)NCC)Cc1ccccc1O 282490538 PVOLVZLJRYTHJY-UHFFFAOYSA-N 264.369 2.130 10 20 CECD Cc1cccc(CN2C[C@@H](C)O[C@]3(CCOC3)C2)c1O 280137711 CTLVFXDTCDKNQV-CZUORRHYSA-N 277.364 2.080 10 20 CECD CN(C)c1ccc(CN(Cc2cnn(C)n2)C2CC2)cc1 290042174 RBJLECNQOUOIKC-UHFFFAOYSA-N 285.395 2.046 10 20 CECD CC(C)OC[C@@H](CO)N(C)Cc1cccc(Cl)c1O 809768727 VIZICQVTKKPPPM-GFCCVEGCSA-N 287.787 2.263 10 20 CECD O=C(NCc1cc(Cl)cc(Cl)c1O)c1ccnnc1 807838009 IVXSLOXHRDUGLU-UHFFFAOYSA-N 298.129 2.419 10 20 CECD Cc1cc(CN(CC(N)=O)C(C)(C)C)ccc1N(C)C 815062905 DCOFBEMSHIXAGH-UHFFFAOYSA-N 277.412 2.147 10 20 CECD CC(C)[C@@H](C(=O)O)[C@@H](C)NCc1ccc2c(c1)CCO2 819163579 KXVOBPALTWGOGT-IAQYHMDHSA-N 277.364 2.456 10 20 CECD Oc1c(CN2C[C@@H]3CNC[C@@H]3C2)ccc2ccccc12 816522371 WCDHJCHOOZGXMI-GASCZTMLSA-N 268.360 2.197 10 20 CECD COC(=O)[C@@H](C)N(C)Cc1cc(Cl)c(F)cc1O 816596315 XOFHYTQBITXXHD-SSDOTTSWSA-N 275.707 2.178 10 20 CECD CN(C)c1ccc([C@H](N)CN[C@H]2CCCCC[C@H]2N)cc1 817942127 MLTFTXUKFXQRFW-ZACQAIPSSA-N 290.455 2.002 10 20 CECD C[C@H](NC[C@@H](C)N)c1cccc(C(F)(F)F)c1O 817973282 SJJDJLWSRVZRRS-SFYZADRCSA-N 262.275 2.409 10 20 CECD O=C(NCCC[C@@H]1CCOC1)NCc1ccccc1O 836646130 DDGYPZMEEALSDZ-GFCCVEGCSA-N 278.352 2.008 10 20 CECD Cc1cc(C)c([C@H](C)NCCN2CCCOCC2)c(O)c1 903228964 URBFFEGSBJHACZ-HNNXBMFYSA-N 292.423 2.382 10 20 CECD C[C@@H](Cc1cnccn1)NCc1ccc(N(C)C)c(F)c1 733326122 KAYZHHRSSIONDG-LBPRGKRZSA-N 288.370 2.403 10 20 CECD Cc1ccc(C(=O)N(C)[C@H](CO)CC(C)(C)C)c(O)c1O 836972096 OCZZPTUOHPQUGW-NSHDSACASA-N 295.379 2.275 10 20 CECD C[C@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1ccccc1O 846205515 HTCFKGFJSBZDRU-RYUDHWBXSA-N 274.364 2.054 10 20 CECD CC(C)[C@H](C)N(C(=O)C(=O)Nc1ccc(N)cc1)C1CC1 841101335 UCEJBWVDGOOMTL-NSHDSACASA-N 289.379 2.243 10 20 CECD C[C@H]1CC[C@H](C)N1C(=O)NCCc1ccc(N)cc1 841956437 BATWROOAFOBQSE-RYUDHWBXSA-N 261.369 2.394 10 20 CECD Cc1cc(O)c(CN[C@H](C)[C@H]2CCCNC2)cc1C 841032396 BSNODWGIPIUBBH-KGLIPLIRSA-N 262.397 2.487 10 20 CECD Oc1ccccc1CN1CCC[C@H](N2CCOCC2)CC1 848930845 XQWGJSMDGUXGFG-INIZCTEOSA-N 290.407 2.079 10 20 CECD NC[C@@H]1CCCN(Cc2cccc(Cl)c2O)C1 843047788 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CC(C)[C@@H](CN)CN1CCCc2cc(CN)ccc21 873202339 XMTMFJDMNVPDDU-HNNXBMFYSA-N 261.413 2.129 10 20 CECD Cc1cccc(O)c1CN[C@@H]1C[C@@H](C)N(C2CC2)C1 877094151 NRNNIQPPLJLADC-CHWSQXEVSA-N 260.381 2.415 10 20 CECD CCOc1ccc(CN2C[C@H](C)N(C)C[C@@H]2C)c(O)c1 775981509 QXZNMJNIKLRUMQ-STQMWFEESA-N 278.396 2.315 10 20 CECD CC[C@H](NCc1cc(F)cc(F)c1O)[C@@H](O)C(F)(F)F 883079085 JRBRJZFYEYWYRB-GXSJLCMTSA-N 299.239 2.462 10 20 CECD CCOc1ccc(CN2CCN(C)C(C)(C)C2)c(O)c1 895564223 BJSXCTHLHHRXFP-UHFFFAOYSA-N 278.396 2.317 10 20 CECD Cc1cccc(CNC(=O)c2c(F)ccc(O)c2O)c1 789955092 QBOSSSXCXHJNBR-UHFFFAOYSA-N 275.279 2.475 10 20 CECD COc1cc(C)cc(CNC2(CO)CCSCC2)c1O 894985481 PZSBWTGRSFDKOW-UHFFFAOYSA-N 297.420 2.057 10 20 CECD COCCCCCNC(=O)NCc1ccc(OC)cc1O 792876194 MAKVFYVCEIKHSB-UHFFFAOYSA-N 296.367 2.017 10 20 CECD COc1ccc(CNC(=O)[C@@H](C)OCC(C)C)c(O)c1 794388425 SWWKNVXNMLFWPC-LLVKDONJSA-N 281.352 2.078 10 20 CECD CN(Cc1ccccc1O)c1ccncc1C(=O)O 1777076925 UBCGRVYSMCNWKH-UHFFFAOYSA-N 258.277 2.122 10 20 CECD CS[C@H](CO)[C@H](C)NCc1cc(Cl)ccc1O 219079465 PXKDMIKATLSBNK-QPUJVOFHSA-N 275.801 2.248 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CC(C)(C)N 84181383 JAYCACJEEZJMEI-UHFFFAOYSA-N 277.412 2.229 10 20 CECD COc1ccc(CN[C@H]2CCCC[C@@H]2C(N)=O)cc1C 757911526 YTZZXKQTYSNGSH-KBPBESRZSA-N 276.380 2.137 10 20 CECD CC(C)[C@H]1C[C@H](NC(=O)NCc2ccc(N)cc2)CCO1 1335546102 MPEIAGTWKNPMAG-HUUCEWRRSA-N 291.395 2.272 10 20 CECD CC[C@@H]1C[C@H](CC(=O)NCc2cccc(O)c2O)CCO1 1263894554 LMUYGZNNPYIFQE-DGCLKSJQSA-N 293.363 2.309 10 20 CECD COc1ccc(N2CCCN(C(=O)[C@H]3C[C@H]3F)CC2)cc1 1348487399 LMVQYSQARVWNBD-LSDHHAIUSA-N 292.354 2.092 10 20 CECD Nc1ccc(CNC(=O)[C@H]2CC2(Cl)Cl)cc1 1356239365 RAPPDKNQZBDOKQ-SECBINFHSA-N 259.136 2.079 10 20 CECD CC[C@@H](F)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C 1514664257 SMEXSNSUJWOEHP-HUUCEWRRSA-N 295.402 2.220 10 20 CECD O=C(CSc1ncc(C(=O)O)s1)CC1CC1 1608355812 XVNNUUVDEWLPNM-UHFFFAOYSA-N 257.336 2.303 10 20 CECD C[C@H](NCCN1CC=CCC1)c1cc(C(=O)O)ccc1O 1604343934 YBPAZESDKJSVCE-LBPRGKRZSA-N 290.363 2.003 10 20 CECD COc1cccc(CNCCC2CCN(C)CC2)c1O 105454232 KTHSYJJLJNPKKG-UHFFFAOYSA-N 278.396 2.222 10 20 CECD COC[C@]1(C(=O)O)CCCN1Cc1cccc(Cl)c1O 1599192967 NMOYZEFECFFNFT-AWEZNQCLSA-N 299.754 2.111 10 20 CECD CC[C@H](NCC1(C)CC1)c1cccc(-c2nn[nH]n2)c1O 1590464426 OLSZTKDFLKBKMS-LBPRGKRZSA-N 287.367 2.413 10 20 CECD CCOCCN[C@@H](C)c1ccc(N2CCOCC2)cc1 161878766 GKMLSVBVAYJOAC-AWEZNQCLSA-N 278.396 2.210 10 20 CECD COCCCN(C)CCN[C@@H](C)c1ccc(N(C)C)cc1 166744778 YUPINNXHPUBDEC-HNNXBMFYSA-N 293.455 2.372 10 20 CECD COc1ccc(N2CCC(NCC3(CO)CC3)CC2)cc1 157348306 IFDXEYVCDPVXTI-UHFFFAOYSA-N 290.407 2.026 10 20 CECD CN(C)c1ccc(CN(C)[C@H](CC(=O)O)C(F)F)cc1 1777039608 GUCDNQVRURBSIP-GFCCVEGCSA-N 286.322 2.293 10 20 CECD C[C@H](CC(N)=O)N[C@H](C)c1ccc2ccccc2c1O 168829867 AJWOOUTWBJPOIL-GHMZBOCLSA-N 272.348 2.460 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CNC(C)C 37807420 ZEAJBJSGLNIXRJ-UHFFFAOYSA-N 277.412 2.099 10 20 CECD CC[C@@H]1CCCCN1C(=O)CN(C)c1ccc(N)cc1 702068724 CMTNPTPMCLZJIC-CQSZACIVSA-N 275.396 2.496 10 20 CECD Oc1cc2c(cc1CN1CCC(F)CC1)OCO2 689913953 UUDHOVDTPDOQCA-UHFFFAOYSA-N 253.273 2.055 10 20 CECD COc1cccc(CN[C@H]2CCCOCC2)c1O 386534701 PVAXXYDSSGSWHV-LBPRGKRZSA-N 251.326 2.060 10 20 CECD COc1ccc(CNCc2cc(C)ccc2O)nc1 895581688 PZPAEYLCXWOCHU-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CCOC(=O)N[C@H]1CCCN(Cc2ccccc2O)C1 179557437 ZMGHEDSENPOPRU-ZDUSSCGKSA-N 278.352 2.103 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CN(C)C(C)C 170731715 IFHQVCZQWVGINF-UHFFFAOYSA-N 278.396 2.471 10 20 CECD CC[C@H](CCO)NCc1cccc(Br)c1O 125787955 HWHYDJBYUKTVKO-SNVBAGLBSA-N 288.185 2.405 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H]([C@@H](C)O)C2)c1O 184744390 CKMBZUWKEFSKKA-ZJUUUORDSA-N 285.771 2.257 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)CCCC(C)=O)c1 184979339 BOZKOJIFJNBJMF-NSHDSACASA-N 279.336 2.337 10 20 CECD COc1cccc(CNC(=O)NC(C2CC2)C2CC2)c1O 73584839 IYSAFYVOSGRHSU-UHFFFAOYSA-N 290.363 2.389 10 20 CECD COCC1=CCN(Cc2cc(OC)ccc2O)CC1 187623088 VLTOLOADGXSGNI-UHFFFAOYSA-N 263.337 2.179 10 20 CECD Cc1ccc([C@@H](C)NC[C@H](O)COCC(C)C)c(O)c1 185117352 ADBVXONTKMSKIY-KGLIPLIRSA-N 281.396 2.385 10 20 CECD CC[C@H](NC(=O)c1ccc(C)c(O)c1O)[C@@H]1CCCO1 182905394 METHRJGKNZCNPX-RYUDHWBXSA-N 279.336 2.094 10 20 CECD CN1CC[C@@H](NCc2ccc(N3CCCC3)cc2)C1 49084906 UFMGUNMPPBJWLH-OAHLLOKOSA-N 259.397 2.081 10 20 CECD C[C@@H](NCCCN(C)C)c1ccc(F)c(F)c1O 191181524 GTTGTFSAYUBDTA-SECBINFHSA-N 258.312 2.273 10 20 CECD COc1ccc(O)c(CNCc2cn(C(C)(C)C)nn2)c1 191057696 PVUGLPNNFRUWQX-UHFFFAOYSA-N 290.367 2.037 10 20 CECD CSC1(C(=O)N[C@H](C)Cc2ccc(O)c(O)c2)CC1 191007800 YEXSHKAROZGSHS-SECBINFHSA-N 281.377 2.041 10 20 CECD CCOC[C@H]1CN(Cc2cc(C)c(C)cc2O)CCO1 529666382 KFFAUCRSVUIGSN-OAHLLOKOSA-N 279.380 2.246 10 20 CECD CC[C@H](C(=O)NCc1c(C)c2ccccc2n1C)N(C)C 352125909 NSVCYCFOYDLQJF-CQSZACIVSA-N 287.407 2.443 10 20 CECD CN(C)C/C=C/C(=O)NCc1ccc(N2CCCC2)cc1 264645726 RMCKPTNFRJMSLA-AATRIKPKSA-N 287.407 2.021 10 20 CECD Cc1cnc(NCc2ccc(N3CCOCC3)cc2)nc1 270230897 JFVZSVPATCCHDO-UHFFFAOYSA-N 284.363 2.234 10 20 CECD O=C(c1cccc(O)c1O)N1CC(Cc2ccccc2)C1 369094590 KMRIFEUIWXGAKW-UHFFFAOYSA-N 283.327 2.413 10 20 CECD C[C@@H]1CCN(Cc2c(O)cccc2Cl)CC[S@@]1=O 277766786 VVHSPLFDWUCVNX-MGNBDDOMSA-N 287.812 2.389 10 20 CECD Oc1ccccc1CN1C[C@H](O)Cc2ccccc21 279426634 NTMYQHUFZZEOOG-CQSZACIVSA-N 255.317 2.316 10 20 CECD CN(C)c1ccc(CN2CCCOCC2)cc1F 374325989 QRECGUXSDFPPHP-UHFFFAOYSA-N 252.333 2.114 10 20 CECD Oc1ccc(Cl)cc1CN1CCOC[C@H]1[C@@H]1CCCO1 377707915 WIZHMHRYUQUIMP-ZFWWWQNUSA-N 297.782 2.425 10 20 CECD CC[C@@H](N[C@@H](C)c1nncn1C)c1ccc(F)cc1O 286375905 ZUMJPFQEUZUFHG-JOYOIKCWSA-N 278.331 2.462 10 20 CECD CC(C)(C)OCCCC(=O)NCCc1ccc(O)c(O)c1 802778609 GAWMJEXYZXWJID-UHFFFAOYSA-N 295.379 2.352 10 20 CECD Cc1ccc(C(=O)OCCOCC(C)C)c(O)c1O 800156791 ABQGXWIFWROMFP-UHFFFAOYSA-N 268.309 2.236 10 20 CECD Cc1ccc(C)n1-c1ccsc1C(=O)NCCCO 298805311 ZAWRGOXXMJJWLZ-UHFFFAOYSA-N 278.377 2.268 10 20 CECD CCN(C)c1ccc(CN2CCOC[C@]23CCOC3)cc1 815108216 SIUKQJHUKFESQD-QGZVFWFLSA-N 290.407 2.134 10 20 CECD Cc1ccc(/C=C/C(=O)N(C)c2ccc([N+](=O)[O-])nc2)cn1 493305776 STFPCVXEBZUGOF-VMPITWQZSA-N 298.302 2.369 10 20 CECD CCOc1ccc(CN2CC[C@H](CCCO)C2)c(O)c1 825338667 SWDSQVAALZTBQJ-ZDUSSCGKSA-N 279.380 2.385 10 20 CECD Cc1cc(Cl)cc(CN(C)[C@H](C)C(=O)O)c1O 820976812 SDGUITNRIZVBKP-MRVPVSSYSA-N 257.717 2.259 10 20 CECD Cc1cc(O)c(CNc2cnn(CCO)c2)cc1Cl 825385167 SZFFISBBQDVNSC-UHFFFAOYSA-N 281.743 2.155 10 20 CECD O=C(/C=C\c1cncc(F)c1)N1C[C@H](O)Cc2ccccc21 493248995 BQOAWRVSSNMICV-IYKSTZQJSA-N 298.317 2.184 10 20 CECD Cc1ccc(O)c([C@H](C)NCCN2CCCOCC2)c1 903226516 GNSODLIPIUNGGA-AWEZNQCLSA-N 278.396 2.074 10 20 CECD CC[C@@H](N[C@@H]1COCC[C@H]1OC)c1ccc(F)cc1O 903296571 JLUFZHPHTQSJDY-UMVBOHGHSA-N 283.343 2.376 10 20 CECD C[C@@H](NC(=O)c1cnc2n1CCC2)c1ccc(N(C)C)cc1 832436912 SVHXCKIEAZOFFS-GFCCVEGCSA-N 298.390 2.386 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)NCC(C)(F)F)c1 836483032 ZGVUIRCHGPLDRZ-MRVPVSSYSA-N 288.294 2.416 10 20 CECD C[C@H](N[C@@H]1CCc2cccc(O)c21)c1nnnn1C1CC1 834784035 QYUNUTKEIHIAEN-JOYOIKCWSA-N 285.351 2.052 10 20 CECD Cn1ncc2c1CCC[C@@H]2NC(=O)Nc1ccc(N)cc1 841302071 KRRXWWDCJMEAKT-ZDUSSCGKSA-N 285.351 2.201 10 20 CECD COc1cccc([C@H](C)N[C@H]2CC(=O)N(C(C)C)C2)c1O 846155315 POAVJCKMXBKUEY-RYUDHWBXSA-N 292.379 2.061 10 20 CECD CCSCCN(C)c1ccc(OCC(=O)O)cc1 846280265 WIMFZESCLXZMOH-UHFFFAOYSA-N 269.366 2.339 10 20 CECD Cc1cc(Br)cc(CNCC2(N)CCC2)c1O 841049661 VAGQOKQRPJRHIX-UHFFFAOYSA-N 299.212 2.434 10 20 CECD CC[C@@H](C)[C@@H](OC(=O)c1cc(O)cs1)C(=O)OC 922437618 JVROYQJTOOZPMZ-GMSGAONNSA-N 272.322 2.198 10 20 CECD CC(=O)c1cc(F)cc(CN2CCCC[C@@H]2CN)c1O 843347180 BTBOGMVDMOMTMU-CYBMUJFWSA-N 280.343 2.047 10 20 CECD C[C@@H](NCC(=O)NC1CCCC1)c1ccc(F)cc1O 756704019 DIDYINKZWVLOMF-SNVBAGLBSA-N 280.343 2.241 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)OCc1cscn1 759593969 KPWKSQDEMLHFHU-RQOWECAXSA-N 277.301 2.311 10 20 CECD CCC[C@@H](CCO)N[C@@H](C)c1cc(C(=O)OC)ccc1O 866415597 ZMFFCQAHLCMVIH-AAEUAGOBSA-N 295.379 2.381 10 20 CECD Cc1cc(Br)cc(CN(C)C[C@@H](C)N)c1O 863652798 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894745194 BPRWVPGEUAHWJZ-SNVBAGLBSA-N 270.323 2.196 10 20 CECD C[C@H](NCc1cc(Cl)cc(Cl)c1O)C(=O)N(C)C 36794309 PTMQEVNEGRCWMM-ZETCQYMHSA-N 291.178 2.265 10 20 CECD CN(C)[C@H](CNCc1ccccc1O)c1ccco1 20122157 VGHPRDDZCHQYNU-CYBMUJFWSA-N 260.337 2.378 10 20 CECD COC(=O)CN(Cc1cccc(OC)c1O)CC(C)C 1254018957 PFRNSLQVKTUVOM-UHFFFAOYSA-N 281.352 2.032 10 20 CECD COc1ccc(O)c([C@H](C)NCCOC2CC2)c1 714982090 IHJWNWWUCXZVJA-JTQLQIEISA-N 251.326 2.230 10 20 CECD CC(C)n1ccc(C(=O)N(C)Cc2ccccc2O)n1 733360204 PFDJPDCJWAPUQG-UHFFFAOYSA-N 273.336 2.442 10 20 CECD COC[C@H](CNC(=O)NCCc1ccc(N)cc1)C(C)C 1336125675 VTLRQQGMMVIJLM-AWEZNQCLSA-N 293.411 2.029 10 20 CECD Nc1ccc(CN2CCC[C@H]2CN2CCCC2)cc1 1336284743 CMMUEWSBCZMUHD-INIZCTEOSA-N 259.397 2.329 10 20 CECD NCC[C@@H]1CCN(Cc2ccc(N3CCCC3)cc2)C1 1334753271 BNVXCWJODBONSH-MRXNPFEDSA-N 273.424 2.458 10 20 CECD CN(C)c1ccc([C@H](N)CNC(=O)[C@@]23CCC[C@@H]2C3)cc1 1353201544 RDHPWQPMCVZGMN-FRFSOERESA-N 287.407 2.059 10 20 CECD O=C(O)c1cnc(CCNCc2cccc(F)c2O)s1 1608970855 IOLHTRBGVSLNQV-UHFFFAOYSA-N 296.323 2.018 10 20 CECD CN(C)C(=O)CCCCSc1ncc(C(=O)O)s1 1598124789 PJGNKTUHLQOILY-UHFFFAOYSA-N 288.394 2.192 10 20 CECD COc1cc2c(c(OC)c1)N(C/C=C(\C)C(=O)O)CCC2 1599462618 CFLJDEYEKGLFND-IZZDOVSWSA-N 291.347 2.487 10 20 CECD Cn1cc(CNCc2ccc3c(c2)CCCO3)cn1 921583673 YREMWFYJWGUIBR-UHFFFAOYSA-N 257.337 2.035 10 20 CECD C[C@@H](NC(=O)[C@@H](C)n1cccn1)c1ccccc1O 827922925 DISZQBOPEDAQHH-GHMZBOCLSA-N 259.309 2.027 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CCC(C)(C)N 70087462 NIKOXKNKKNAAJN-UHFFFAOYSA-N 277.412 2.229 10 20 CECD C[C@@H]1CC[C@@H](CNCc2cc(F)cc(F)c2O)O1 708481865 VEYYINNGQBPOJT-KCJUWKMLSA-N 257.280 2.328 10 20 CECD C[C@H]1CCC[C@@]1(O)CNCc1cc(F)cc(F)c1O 708516308 GSSIVUVXPGHUOD-LKFCYVNXSA-N 271.307 2.311 10 20 CECD CCOc1cccc(CN[C@H](C)C2(CO)CC2)c1O 696064985 YATJUCLBBWOLFD-LLVKDONJSA-N 265.353 2.042 10 20 CECD NCCC1CCN(Cc2cc(F)ccc2O)CC1 236165516 WQMIYLQQOVOTKA-UHFFFAOYSA-N 252.333 2.092 10 20 CECD CC(C)(CCO)NCc1cc(Cl)cc([N+](=O)[O-])c1O 174579276 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CCOc1cccc(CN[C@@H]2C[C@@H](OCC)[C@@H]2OC)c1O 274965496 VFQNHEVUTMQPNM-XNRPHZJLSA-N 295.379 2.073 10 20 CECD CN1CC[C@H]2CCN(Cc3cc(F)ccc3O)[C@@H]2C1 272611760 KMDFKDDCTRXLOP-SMDDNHRTSA-N 264.344 2.057 10 20 CECD COCC1(CNCc2cc(F)ccc2O)CCOCC1 292888484 YQNUIFLZNTUQDK-UHFFFAOYSA-N 283.343 2.064 10 20 CECD COc1cccc(O)c1CNC[C@H](O)Cc1ccccc1 808420567 IZANQGHVIKDFNK-CQSZACIVSA-N 287.359 2.094 10 20 CECD CCOc1ccc(O)c(CNCc2cnccc2OC)c1 292814913 WNPGNTYVVUJXQG-UHFFFAOYSA-N 288.347 2.484 10 20 CECD C[C@@H](NC(=O)CCc1ncc[nH]1)c1ccc(N(C)C)cc1 807274221 LPGNEFTWEGOZKO-GFCCVEGCSA-N 286.379 2.286 10 20 CECD Oc1cccc2c1[C@H](N[C@H]1COc3ccccc3[C@H]1O)CC2 297217563 HBEICNJLIOQONH-QWQRMKEZSA-N 297.354 2.464 10 20 CECD CON1CCC(N[C@@H](C)c2cc(F)cc(F)c2O)CC1 817589109 UGZYEIAUOFHYII-VIFPVBQESA-N 286.322 2.347 10 20 CECD COc1ccc(O)c(CNc2nc(OC)ncc2Cl)c1 811805357 QVFQWAUUKZADCO-UHFFFAOYSA-N 295.726 2.465 10 20 CECD O=C(NCc1ccccc1O)[C@H](O)c1ccc(Cl)cc1 813489355 WTLMAOIHAXRUSL-CQSZACIVSA-N 291.734 2.395 10 20 CECD CCC[C@@H](OC)C(=O)N[C@H](C)c1cc(OC)ccc1O 825736528 BKASWKVXGPAWQS-QMTHXVAHSA-N 281.352 2.393 10 20 CECD C[C@@H](NC(=O)C1(C(=O)C2CC2)CC1)c1ccccc1O 827952393 QUESHUSSSMYRLJ-SNVBAGLBSA-N 273.332 2.329 10 20 CECD Oc1c(Cl)cccc1CN1C[C@H]2[C@H]3C=C[C@@H](O3)[C@H]2C1 824839403 YJGCOOHCLMXDJG-ZMJPVWNMSA-N 277.751 2.431 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)CNc1ccccn1 900026137 JSTCADIIXOTFGX-UHFFFAOYSA-N 298.390 2.218 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)NC1[C@@H]2[C@H]3CC[C@@H](C3)[C@@H]12 588407484 WOUPWVZQJRJQQT-FDNLLRBQSA-N 285.343 2.272 10 20 CECD CCOc1cccc(CN2C[C@@H](C)[C@@](C)(CO)C2)c1O 827699256 FUMZEXZIAVVANV-MLGOLLRUSA-N 279.380 2.241 10 20 CECD C[C@@H](CC(=O)O)N[C@H](C)c1ccc(N2CCOCC2)cc1 820072805 YISAXDVJGKJFRW-QWHCGFSZSA-N 292.379 2.037 10 20 CECD CCSc1ccccc1C(=O)N1CCS(=O)CC1 731007741 GLGYQUMFCMPMNA-UHFFFAOYSA-N 283.418 2.003 10 20 CECD CCC/C=C/[C@H](O)C(=O)N(C)Cc1ccccc1O 901055010 KCNPDBPOXQNKNI-SEIPJRMCSA-N 263.337 2.068 10 20 CECD CCC(F)(F)C(=O)NCc1cccc(OC)c1O 830540508 LGONHAANRBWGFM-UHFFFAOYSA-N 259.252 2.062 10 20 CECD C[C@H](NCc1ccc(N(C)C)c(F)c1)[C@@H]1CCCNC1 841032352 BMMJMXDAOYUVEZ-GXTWGEPZSA-N 279.403 2.369 10 20 CECD C[C@H](CCN(C)C)NC(=O)NCc1cc(Cl)ccc1O 844932080 CAHIUHKQNOMNIR-SNVBAGLBSA-N 299.802 2.185 10 20 CECD O=C(O)[C@H]1C[C@H](NCc2c(O)ccc(Cl)c2F)C1 849232123 REUKMAQDAVZWJV-LJGSYFOKSA-N 273.691 2.138 10 20 CECD C[C@H](NC[C@H](O)COCC1CC1)c1ccc(Cl)cc1O 841748809 ZDMXSNRGPDQYPX-GWCFXTLKSA-N 299.798 2.484 10 20 CECD COc1ccc(O)c(CN[C@@H](C)C2(OC)CCC2)c1 840970022 OERURGMBUGDBCT-NSHDSACASA-N 265.353 2.448 10 20 CECD CCc1cccc(CNC(C)(C)CN2CCOCC2)c1O 848916334 GNXYXQKJOVFFBK-UHFFFAOYSA-N 292.423 2.155 10 20 CECD Cc1ccc([C@@H](C)NCCOC[C@H]2CCOC2)c(O)c1 756564169 QQITVXULXPJXBM-KGLIPLIRSA-N 279.380 2.404 10 20 CECD O=C(NCCCc1ccco1)NCc1ccccc1O 852680756 YRSCFKSVFARDIC-UHFFFAOYSA-N 274.320 2.417 10 20 CECD CCO[C@@H]1COCC[C@H]1NCc1ccc(OC)c(C)c1 759173561 QBOWMISSNDHGEC-GDBMZVCRSA-N 279.380 2.287 10 20 CECD Cc1cc(CN2CCC(CN)CC2)ccc1N(C)C 923277718 RGEDENDIVAQQNC-UHFFFAOYSA-N 261.413 2.232 10 20 CECD O=C(OC[C@H]1CC1(Cl)Cl)c1cccc(O)c1O 758571576 GUNFTKSBFLHOKO-ZCFIWIBFSA-N 277.103 2.448 10 20 CECD CCOC(=O)CC(C)(C)CC(=O)C(=O)C1(O)CCCCC1 935948398 LSIYIAKVDICJKI-UHFFFAOYSA-N 298.379 2.189 10 20 CECD COc1ccc(N(C)Cc2ncc(C)[nH]2)cc1OC 862326624 RCWPVAFNOJHAAA-UHFFFAOYSA-N 261.325 2.372 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H](C)c2ccc[nH]2)c1 760831465 DWRQWLDGIIRLKB-JTQLQIEISA-N 289.335 2.289 10 20 CECD COc1ccc(O)c([C@H](C)NCc2cnc(C)nc2)c1 775361149 CEPWYHAIJVTQOP-JTQLQIEISA-N 273.336 2.350 10 20 CECD CC[C@@]1(O)CCN(Cc2cccc(Cl)c2O)C1 779219805 WDXWIOPGLOTDBJ-CYBMUJFWSA-N 255.745 2.392 10 20 CECD CN1CCN(c2ccc(CNCCc3ccco3)cc2)CC1 771824197 UMYIUXNMXVKGPI-UHFFFAOYSA-N 299.418 2.364 10 20 CECD CC[C@@H]1CN(Cc2ccc(N(C)CC)cc2)C[C@@H]1O 773827167 VYKAUAKKVHZSNY-ZBFHGGJFSA-N 262.397 2.345 10 20 CECD CCN(C)c1ccc(CNC2(C(=O)NC)CCCC2)cc1 773774260 SQYXCLQRQCDHFS-UHFFFAOYSA-N 289.423 2.291 10 20 CECD Cc1nc(C)c(C(=O)N[C@H](C)c2ccccc2O)[nH]1 881440533 FHFMCSNERJBRDO-MRVPVSSYSA-N 259.309 2.223 10 20 CECD CC(=O)c1cc(Cl)cc(CN[C@H]2C[C@H](N)C2(C)C)c1O 883442915 VWHJRZDGMIUNNC-STQMWFEESA-N 296.798 2.464 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CO)C[C@@H]1CCCO1 895749436 QZPCZWFNOINWKT-RDJZCZTQSA-N 292.423 2.081 10 20 CECD CC[C@](C)(OC)C(=O)NCc1ccc(N(C)C)cc1C 795102989 AEXMYERFFYOURE-INIZCTEOSA-N 278.396 2.492 10 20 CECD C[C@@H](NCc1c(O)ccc(Cl)c1F)c1ncn(C)n1 790992488 LPLLVGVOAGYHNB-SSDOTTSWSA-N 284.722 2.164 10 20 CECD COc1ccc(CNC(=O)CCC(F)(F)F)c(O)c1 794373116 GWZYHGRDUSIZOM-UHFFFAOYSA-N 277.242 2.360 10 20 CECD O=C(NCc1ccccc1O)[C@@H]1Cc2ccccc21 135358714 WCLCIIAJHAYGSU-CQSZACIVSA-N 253.301 2.348 10 20 CECD COc1ccc(O)c([C@@H](C)NCCN2CCCC2)c1 20126893 GZGYILQXFZUZAC-GFCCVEGCSA-N 264.369 2.147 10 20 CECD C[C@@H](Cn1cccn1)NCc1cc(F)cc(F)c1O 708494294 FAUWRIPOVIVWSF-VIFPVBQESA-N 267.279 2.045 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@H]2N[C@@H](C)C(=O)NCCF 1322652751 PWUSZINSXXQVGA-GRYCIOLGSA-N 294.370 2.313 10 20 CECD Cc1ccc(O)c(CN2CCO[C@@H](C(F)(F)F)C2)c1 698953999 VWUICFJHYPAUAQ-GFCCVEGCSA-N 275.270 2.464 10 20 CECD CC(C)OCCOc1ccc(N(C)C)c(C(=O)O)c1 1603925673 OGONMEFHALDPLE-UHFFFAOYSA-N 267.325 2.255 10 20 CECD CCCCN(CCC(=O)O)Cc1ccccc1O 1603647419 NCAXYKOOHASNJL-UHFFFAOYSA-N 251.326 2.469 10 20 CECD C[C@H](NC1C[C@H]2C[C@@H]2C1)c1cccc(-c2nn[nH]n2)c1O 1589955874 NBAIXZSJOAFGKK-IVZWLZJFSA-N 285.351 2.021 10 20 CECD CC[C@@H](C)NC(=O)[C@H](C)Sc1ncc(C(=O)O)s1 1594988079 WQLKYICXQWGNGK-RQJHMYQMSA-N 288.394 2.237 10 20 CECD CCOc1ccc(N(C)CC(=O)NCc2cccnc2)cc1 150729591 UJTSXKZCDLZXCF-UHFFFAOYSA-N 299.374 2.233 10 20 CECD CC1([C@@H](NCc2cc(F)cc(F)c2O)C(=O)O)CC1 1776514302 ZXYUHVRHMCPMNB-NSHDSACASA-N 271.263 2.013 10 20 CECD CCCN(Cc1ccccc1O)C[C@@H]1COCCO1 827938775 RZVUTUWMVIPMLP-CQSZACIVSA-N 265.353 2.020 10 20 CECD CNC(=O)c1ccc(NCc2ccccc2O)cc1 36957665 RWLQFVMRLOGXMX-UHFFFAOYSA-N 256.305 2.364 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)OCO3)CCCO1 281113789 BNDDLWOFBFTNRH-LBPRGKRZSA-N 279.336 2.122 10 20 CECD CC[C@@H]1CC(=O)N(CN(C)Cc2ccc(N(C)C)cc2)C1 119154719 RWBUYWAMGDBXMN-CQSZACIVSA-N 289.423 2.400 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)c1cscn1 173208772 OEUOVYABGXVTAU-UHFFFAOYSA-N 289.360 2.248 10 20 CECD CC[C@@H](C)NC(=O)CCN[C@@H](C)c1cc(OC)ccc1O 38013623 YKRZPQFRVKIPIC-NEPJUHHUSA-N 294.395 2.356 10 20 CECD CCOc1cccc(CN2CCOC[C@H]2CC)c1O 132346557 RENUKPLDJDRUKI-CYBMUJFWSA-N 265.353 2.402 10 20 CECD Cc1cccc(N(C)C(=O)/C=C/c2cnn(C)c2C)n1 121885167 WWSZKTLQJBJCSU-CMDGGOBGSA-N 270.336 2.108 10 20 CECD Cc1ncsc1/C=C/C(=O)N1CCOc2ccncc21 186732761 NHPSXVVIFWDFKC-NSCUHMNNSA-N 287.344 2.285 10 20 CECD Cc1n[nH]c(C)c1CCC(=O)N(C)Cc1ccccc1O 193946047 NHNLTKUQTJZICE-UHFFFAOYSA-N 287.363 2.323 10 20 CECD Oc1c(Br)cccc1CN[C@H]1CCC[C@@H]1O 164224166 PWPNVNCBQMASPW-QWRGUYRKSA-N 286.169 2.158 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@](C)(N)c2ccccc2)cc1 237084322 ZXNBQMZMKGONFE-SFHVURJKSA-N 297.402 2.243 10 20 CECD COc1ccc(CNC(=O)/C=C/c2ccc(O)c(O)c2)cc1 140033405 ASNPOZQAIYGUKX-WEVVVXLNSA-N 299.326 2.436 10 20 CECD NCC[C@H]1CCCCN1Cc1cc(F)ccc1O 236253573 OGVVPKCXVYEGRN-CYBMUJFWSA-N 252.333 2.235 10 20 CECD CN(C)c1ccc(CNCCC(C)(C)O)cc1F 274724099 FSGZQCLLMZPMKQ-UHFFFAOYSA-N 254.349 2.142 10 20 CECD COc1cc(O)c(CN2CCC(OC)CC2)cc1OC 271090697 KUFWCNVXRWLMPV-UHFFFAOYSA-N 281.352 2.020 10 20 CECD Cc1ccccc1[C@H](N)C(=O)NCc1ccc(N(C)C)cc1 294833591 SOSYDXXMGQKGSV-KRWDZBQOSA-N 297.402 2.377 10 20 CECD COc1ccc(O)c(CN[C@H](C2CC2)[C@H](CO)C2CC2)c1 824845563 MEFKMEALFXPVGP-NVXWUHKLSA-N 291.391 2.288 10 20 CECD Cc1cc(O)c(CNCC2(CO)CC2)cc1Cl 825327050 UWTUHMKCDLIHBC-UHFFFAOYSA-N 255.745 2.216 10 20 CECD O=C1CC[C@H]2CN(Cc3cccc(Cl)c3O)CC[C@H]2N1 827133051 QVWZBCKVDCVYCV-GXFFZTMASA-N 294.782 2.146 10 20 CECD CCn1nc(C)c(CN[C@@H](C)c2cc(OC)ccc2O)n1 828682189 KJHWYWASEITIGL-JTQLQIEISA-N 290.367 2.171 10 20 CECD COCC(COC)NCc1cc(Cl)c(C)cc1O 826064674 MXSPXQXTUJTOHW-UHFFFAOYSA-N 273.760 2.105 10 20 CECD CN(C)c1ccc(CNC(=O)NCC(C)(F)F)cc1 836214148 MIVMLJZJKMVRBA-UHFFFAOYSA-N 271.311 2.207 10 20 CECD O=C(c1cc(O)cs1)N1CCc2ccccc2[C@@H]1CO 831278711 KYDFDJZEWNNLTN-ZDUSSCGKSA-N 289.356 2.186 10 20 CECD C[C@@H](NC[C@H]1CCN1C)c1cc(Cl)ccc1O 903316301 DFDNFRMPFRKSLY-MWLCHTKSSA-N 254.761 2.400 10 20 CECD Cc1ccc2nc(CNC(=O)c3cc(O)cs3)cn2c1 732276134 SKOVDIFYVBRLDC-UHFFFAOYSA-N 287.344 2.340 10 20 CECD Cc1cc(N(C)C)ccc1CNCCCO[C@H]1CCOC1 840939458 USTJCLZZQSFCRW-KRWDZBQOSA-N 292.423 2.346 10 20 CECD Cc1cc(Br)c(O)c(CNCC2(N)CCC2)c1 841050198 ZNXBHNZURQANMV-UHFFFAOYSA-N 299.212 2.434 10 20 CECD CN[C@@H]1CCCN(Cc2cc(Cl)cc(F)c2O)C1 843048507 DHOHSGWPCFJDTA-LLVKDONJSA-N 272.751 2.369 10 20 CECD COc1cccc(CN2C[C@H](N)Cc3ccccc32)c1O 841106263 IOPQJVDKYWGOHY-CQSZACIVSA-N 284.359 2.291 10 20 CECD CO[C@H](CN(C)c1ccc(OCC(=O)O)cc1)C1CC1 846280477 XPIOLIVKJDPVCU-CQSZACIVSA-N 279.336 2.011 10 20 CECD COC[C@@H](C)CC(=O)NCc1ccc(N(C)C)cc1C 755327121 OFCOIZFYWGPYCS-LBPRGKRZSA-N 278.396 2.350 10 20 CECD C[C@H](NCc1ccon1)c1cc([N+](=O)[O-])ccc1O 756638998 XVDJZDHVQNNPNR-QMMMGPOBSA-N 263.253 2.139 10 20 CECD Cc1ccc(O)c(CNC(=O)N[C@@H](C)[C@H]2CCCOC2)c1 858355709 VZYWWSXAPMMJOG-STQMWFEESA-N 292.379 2.315 10 20 CECD CC(=O)c1cc(F)cc(CN2C[C@H](C)[C@](C)(CO)C2)c1O 852701915 VTONRMMJIFCCOI-QFYYESIMSA-N 295.354 2.184 10 20 CECD O=C(NCc1c(O)ccc2c1CCCC2)C1CSC1 866771423 SNYLYESQOSLFIP-UHFFFAOYSA-N 277.389 2.250 10 20 CECD CCN(C)c1ccc([C@@H](C)N[C@@H]2CCCN(C)C2=O)cc1 766437534 PAZXPFKBNLCGHK-CZUORRHYSA-N 289.423 2.414 10 20 CECD Cc1cccc(O)c1CN[C@H]1CCc2n[nH]cc2C1 877053714 XGOZUBWJJMDYSF-LBPRGKRZSA-N 257.337 2.071 10 20 CECD COc1ccc(O)c(CNC(C)(C)c2cnn(C)c2)c1 776177489 PSSVYMFCCHMDOA-UHFFFAOYSA-N 275.352 2.159 10 20 CECD Cc1cccc(O)c1CN1CC[C@@H](c2nccn2C)C1 877528572 DUSURNLQBXJJRQ-CYBMUJFWSA-N 271.364 2.424 10 20 CECD CCCN1CCCC[C@H]1C(=O)NCc1ccc(N)cc1 1122536359 ZPKJSZCWGCFJFE-HNNXBMFYSA-N 275.396 2.150 10 20 CECD COc1cccc(CNC(=O)c2ccc(O)c(C)c2)c1O 779538577 WRUZKXSSJXDKEH-UHFFFAOYSA-N 287.315 2.345 10 20 CECD COc1ccc(CN2CCO[C@H](C(C)C)C2)c(O)c1OC 893403532 TXMYMULHGGJZSF-AWEZNQCLSA-N 295.379 2.266 10 20 CECD COC(=O)[C@@H](NCc1ccc2c(c1)CCCO2)C1CC1 893952047 UBLHGWQKHBAJHO-HNNXBMFYSA-N 275.348 2.053 10 20 CECD Nc1ccc(CN2CC[C@H](CN3CCCC3)C2)cc1 1352788308 OHBBDSOJIAVFPO-OAHLLOKOSA-N 259.397 2.187 10 20 CECD COc1ccc(CN[C@H](C)[C@@H]2CCCO2)c(O)c1 40906049 KVIHTKYZBCPCHP-YGRLFVJLSA-N 251.326 2.058 10 20 CECD CN(Cc1ccccc1O)Cc1ncc(Cl)n1C 171936775 JPYCIPPPCHMZGM-UHFFFAOYSA-N 265.744 2.411 10 20 CECD CCOc1cccc(CN[C@@H]2CCC[C@@H]2CCO)c1O 189974839 HFRRMVPZTWZJHW-TZMCWYRMSA-N 279.380 2.432 10 20 CECD OCCN(Cc1ccc(N2CCCC2)cc1)C1CC1 1324716172 HKUCBFPUETZOHA-UHFFFAOYSA-N 260.381 2.244 10 20 CECD C[C@H](O)C[C@H](C)NCc1cc(F)c(N(C)C)cc1F 1335157289 SMWMQCYANCOOCJ-UWVGGRQHSA-N 272.339 2.280 10 20 CECD O=S(=O)(Nc1ccc(O)cc1)c1cncc(Cl)c1 776745274 VEXUCFBDIKKYOC-UHFFFAOYSA-N 284.724 2.241 10 20 CECD COc1cccc(CNC(=O)[C@@H]2CCOC(C)(C)C2)c1O 1262614282 CRUUBCDGCSOTCL-LLVKDONJSA-N 293.363 2.222 10 20 CECD COc1cccc(O)c1CNCCCOC(F)F 800895660 UBQMPZVGZTXXHG-UHFFFAOYSA-N 261.268 2.120 10 20 CECD Nc1ccc(CN2CCN(c3ncccc3F)CC2)cc1 1356083357 NNZWTUIWLOGXCQ-UHFFFAOYSA-N 286.354 2.125 10 20 CECD C[C@@H](NCC(C)(C)CCO)c1cc(C(=O)O)ccc1O 1604332809 LUXOMRZYJQBTKR-SNVBAGLBSA-N 281.352 2.150 10 20 CECD CC(C)(C)[C@H](CC(=O)O)NC(=O)c1cc(O)cs1 1589704115 AIAWGIAPQYAABN-VIFPVBQESA-N 271.338 2.073 10 20 CECD CCN(CC)C(=O)CN(C)Cc1ccc(N(C)C)c(F)c1 155097138 ADABEHCYSBNKMY-UHFFFAOYSA-N 295.402 2.192 10 20 CECD COc1cccc(CN2CCC[C@H](CC(=O)O)C2)c1O 86757127 COXUZENQRCDAEY-LLVKDONJSA-N 279.336 2.088 10 20 CECD CS[C@@H]1CCN(C(=O)Nc2ccc(N)cc2)C1 383135738 DWVFYSLFHRMXHX-LLVKDONJSA-N 251.355 2.238 10 20 CECD CN(C)c1ccc(CNC(=O)N2CCSCC2)cc1F 57647499 SUFFROWHFHCVON-UHFFFAOYSA-N 297.399 2.150 10 20 CECD O=C(NCCCSc1nccs1)[C@@H]1C[C@H]2CC[C@@H]1O2 114375311 NEPRISVUIJROKU-MXWKQRLJSA-N 298.433 2.309 10 20 CECD CC(C)COC[C@H](O)CN[C@@H](C)c1ccc(F)cc1O 185116959 OTZQTMLLTLWDGV-WCQYABFASA-N 285.359 2.215 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)c1cn(C)cn1 178714643 KQQSUUDTPFXSQA-UHFFFAOYSA-N 286.379 2.148 10 20 CECD Oc1ccc(Cl)cc1CNC[C@@H](O)c1ccco1 304498860 FRENAVJCQXPUSC-GFCCVEGCSA-N 267.712 2.462 10 20 CECD COc1ccc(N(C)CC(=O)NCC(C)C)cc1F 121820839 VIZVYAPPSHSLMV-UHFFFAOYSA-N 268.332 2.043 10 20 CECD C[C@@H](NC1CCN(CCN(C)C)CC1)c1ccccc1O 183408864 DLYZAMKLQQDBMH-CQSZACIVSA-N 291.439 2.069 10 20 CECD CCCCCN1CC(=O)N[C@@H]1c1ccc(N(C)C)cc1 182331713 FSKVAUXMRBKJNC-INIZCTEOSA-N 275.396 2.373 10 20 CECD COc1ccc(N(C)CC[C@H]2CCOC2=O)c(OC)c1 132062464 GDEAYXVVDTYICJ-NSHDSACASA-N 279.336 2.093 10 20 CECD CCC[C@@H](N)C(=O)NCc1c(O)ccc2c1CCCC2 236969192 OADRFKMBAIIMMO-CQSZACIVSA-N 276.380 2.015 10 20 CECD CC(=O)c1cc(F)cc(CN2CCC[C@@H]2C[C@@H](C)O)c1O 269865263 XAEDWTJQQPEQQD-QMTHXVAHSA-N 295.354 2.469 10 20 CECD CCCCOCCCNC(=O)c1c(F)ccc(O)c1O 276495896 HDDQYDFIIWWOKN-UHFFFAOYSA-N 285.315 2.174 10 20 CECD CCOc1cccc(CN2CC[C@@H]3CCN(C)C[C@H]32)c1O 272700950 YQMGXUFWANMAGS-DZGCQCFKSA-N 290.407 2.317 10 20 CECD COC[C@@H](CO)N[C@H](C)c1ccc(Cl)c(Cl)c1O 280840388 AMUACHAAKABINP-HTQZYQBOSA-N 294.178 2.357 10 20 CECD COCC[C@@H](CO)N[C@H](C)c1cc(Cl)ccc1O 281587931 LMJNZTBEWUDCCL-KOLCDFICSA-N 273.760 2.094 10 20 CECD Oc1cc2c(cc1CN1CCC[C@@H]1[C@@H]1CCCO1)OCO2 284025527 IFRGIFZBKWDIBU-OCCSQVGLSA-N 291.347 2.264 10 20 CECD C[C@@H]1OCC[C@@]12CN(Cc1ccccc1O)C[C@@H](C)O2 280570362 VSUIHONQSOKDCM-DVOMOZLQSA-N 277.364 2.161 10 20 CECD O=C(c1cccc(O)c1O)N1CCC2(CCOCC2)CC1 285834359 YXRKLJRKNUCKME-UHFFFAOYSA-N 291.347 2.131 10 20 CECD CCC[C@@]1(NC(=O)/C=C/c2ccc(O)c(O)c2)CCOC1 287847273 MEPUBBMJBCPVFZ-MQDFFIGUSA-N 291.347 2.186 10 20 CECD C[C@H](NCc1nc(C2CC2)n[nH]1)c1cc(F)ccc1O 296355099 IKZZSKCDSBOREV-QMMMGPOBSA-N 276.315 2.378 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2CC[C@@H](CO)O2)cc1 292528747 FLUGUVKAWRPKDF-SJORKVTESA-N 292.423 2.162 10 20 CECD COC(=O)c1ccc(O)c([C@H](C)NC[C@@H](OC)C2CC2)c1 293647305 HOKXJVVQKBVGHV-ZUZCIYMTSA-N 293.363 2.254 10 20 CECD COC[C@@H](O)CCNCc1ccc2ccccc2c1O 816559616 PJJNYUFMMLCOIL-AWEZNQCLSA-N 275.348 2.032 10 20 CECD COc1ccc(O)c(CN2CC[C@@H](O)C23CCCC3)c1 816630854 UWLBWIKXQKBSOJ-OAHLLOKOSA-N 277.364 2.280 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)[C@H](C)SC)c1 728977795 DEWJEQUYBPGVLI-IUCAKERBSA-N 269.366 2.330 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cnc[nH]1 839917449 DEBOLWPHSHKQRU-LBPRGKRZSA-N 286.379 2.145 10 20 CECD CCOc1ccc(O)c(CN2CC[C@@](C)(C(=O)O)C2)c1 833662950 OEOBNNOCYFVKTO-OAHLLOKOSA-N 279.336 2.088 10 20 CECD CCOc1ccc(O)c(CN2[C@H]3CC[C@H]2COC3)c1 839181223 WUGBPLYBZDOAMP-STQMWFEESA-N 263.337 2.154 10 20 CECD C[C@@H](C(=O)NC(C)(C)C)N1CCCc2cc(CN)ccc21 843349727 JVJFYJQLLSENES-LBPRGKRZSA-N 289.423 2.201 10 20 CECD Cc1cc(N(C)C)ccc1CN1C[C@@H](C)S(=O)[C@H](C)C1 840941813 MREMCYGPNSLNNA-ZIAGYGMSSA-N 294.464 2.402 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCS[C@@H]2C)c(O)c1O 844109084 VDAMNRLIHYFEGE-SCZZXKLOSA-N 267.350 2.030 10 20 CECD O=C(COC(=O)[C@@H]1C[C@H]1C1CCC1)c1ccc(O)c(O)c1 845225319 VDEHYERQLMAARB-NWDGAFQWSA-N 290.315 2.260 10 20 CECD Cc1ccc(CCNC(=O)NCCc2ccc(N)cc2)cn1 841806331 FTIFDNUJAOVTEL-UHFFFAOYSA-N 298.390 2.057 10 20 CECD CO[C@@]1(C)C[C@H]1NC(=O)N[C@H](C)c1ccc(N(C)C)cc1 852262120 ZASVPEHVVLSXKD-XFJVYGCCSA-N 291.395 2.290 10 20 CECD Oc1cc2c(cc1CNCc1cccc3c1OCC3)OCO2 922944102 JWJSHFZOENUFNV-UHFFFAOYSA-N 299.326 2.346 10 20 CECD CCC[C@@H](O)CCNCc1ccc(N2CCOCC2)cc1 922825842 QFNNZKRANLFKGH-QGZVFWFLSA-N 292.423 2.164 10 20 CECD C[C@@H](CN1CCCC1=O)N[C@H](C)c1cc(F)cc(F)c1O 756450964 WWRLDNHOQXPOOA-VHSXEESVSA-N 298.333 2.332 10 20 CECD COC(=O)CN(Cc1cc2c(cc1O)CCCC2)C1CC1 768465311 ZLTGIWAOGPNQKU-UHFFFAOYSA-N 289.375 2.408 10 20 CECD CCO[C@@H]1COCC[C@H]1N[C@@H](C)c1cc(OC)ccc1O 760890389 XDDAFZINNRVPCD-SGIREYDYSA-N 295.379 2.245 10 20 CECD C[C@H]1C[C@@H](NCC(F)(F)CO)c2c(O)ccc(F)c21 768285118 DVKWCTYIDNOBGG-IONNQARKSA-N 275.270 2.297 10 20 CECD Cc1ccc(O)c2c1[C@H](C)C[C@@H]2N[C@H]1CCCN(C)C1=O 1118797351 HMSVCAJKRZYEDZ-AGIUHOORSA-N 288.391 2.459 10 20 CECD CC[C@@H](C[C@H](C)CO)NCc1cc(OC)ccc1O 776220675 YRKSZVMFPVQDSZ-AAEUAGOBSA-N 267.369 2.288 10 20 CECD COC1(CN[C@@H](C)c2c(O)cccc2F)CCOCC1 886553785 VMFUJTHHSZMHPT-NSHDSACASA-N 283.343 2.378 10 20 CECD Oc1c(F)cc(F)cc1CNC[C@H](O)Cc1ccccc1 882987016 QJZIQXMXHWQJIC-CQSZACIVSA-N 293.313 2.364 10 20 CECD Cl/C=C/CNCc1ccc(N2CCOCC2)cc1 898435579 JJHKEESZEPYIHI-LZCJLJQNSA-N 266.772 2.365 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@H](CCO)C(F)(F)F 894849350 CHZZVXZGZLYOQW-CYBMUJFWSA-N 290.329 2.464 10 20 CECD COc1cc(C)cc(CNc2ccc(CCO)nc2)c1O 894784217 ILJILYIMOYIRQE-UHFFFAOYSA-N 288.347 2.251 10 20 CECD COc1ccc(CNC(=O)c2ccc(F)cc2)c(O)c1 794389039 HOPSIJAMJIOZRM-UHFFFAOYSA-N 275.279 2.470 10 20 CECD Oc1ccccc1CN1CCCC[C@@H]1[C@H]1CCCN1 250091021 VIBSKIJIGGZIKY-HUUCEWRRSA-N 260.381 2.499 10 20 CECD C[C@H](N[C@H](CO)CC(F)(F)F)c1cc(F)ccc1O 717774002 PGUCCXTYXAYOCZ-CBAPKCEASA-N 281.249 2.495 10 20 CECD COc1cc(CN2C[C@H]3CC[C@H]2[C@@H](O)C3)c(O)cc1C 1331061951 OBGIWBATBJOBPO-WHOFXGATSA-N 277.364 2.054 10 20 CECD COc1ccc(O)c([C@H](C)NC(=O)C[C@H](N)C(C)(C)C)c1 1340967218 MFBPWKYBARVZRK-HZMBPMFUSA-N 294.395 2.342 10 20 CECD C[C@H](CNCc1c(O)ccc(Cl)c1F)[C@H](F)C(=O)O 1776423153 BAWNAMWNZYSLBO-LDWIPMOCSA-N 293.697 2.333 10 20 CECD COc1cc(C)cc(CN2C[C@@H](C)OC[C@@H]2C)c1O 163953433 VHLLDWGBZOCDJC-NWDGAFQWSA-N 265.353 2.318 10 20 CECD COc1ccc(O)c([C@H](C)NC2CCN(C)CC2)c1 37267114 KOCSLGHGYMKVHA-NSHDSACASA-N 264.369 2.146 10 20 CECD CCN1CC[C@H](CNCc2ccc3c(c2)CCO3)C1 37644659 PQEWTYIRLBBURD-CQSZACIVSA-N 260.381 2.053 10 20 CECD COc1ccc(O)c(CN[C@H]2COC(C)(C)C2)c1 396517089 DZUHQSALCCDNMM-LLVKDONJSA-N 251.326 2.058 10 20 CECD C[C@@H]1CSC[C@@H]1NC(=O)Nc1ccc(N)cc1 397900727 SHSJTZYOHSGBPV-KCJUWKMLSA-N 251.355 2.142 10 20 CECD COC(=O)[C@@H]1CCCN1Cc1cccc(Cl)c1O 179661135 BSPYDBYYVPSOMT-NSHDSACASA-N 269.728 2.183 10 20 CECD O=C(COCC1CC1)NCc1ccc(N2CCCC2)cc1 60630502 FGLXLCRCJJUXQQ-UHFFFAOYSA-N 288.391 2.330 10 20 CECD Cc1ccc(C(=O)N(C)Cc2cscn2)c(O)c1O 182230504 YUMZHFZYVNTFLC-UHFFFAOYSA-N 278.333 2.135 10 20 CECD CC(C)[C@@H](O)CN[C@H](C)c1ccc(N(C)C)cc1 131276708 WWQDPRRVXYHHOF-DOMZBBRYSA-N 250.386 2.420 10 20 CECD COc1ccc(O)c([C@@H](C)NCC2(C(N)=O)CCCC2)c1 273562959 IQKKBMWVZMSRST-LLVKDONJSA-N 292.379 2.097 10 20 CECD C[C@@H](N[C@@H]1CCCC[C@H]1O)c1cc([N+](=O)[O-])ccc1O 274774969 IPKNBTBSRWOXOZ-GAJTVXKRSA-N 280.324 2.255 10 20 CECD CN(C)c1ccc(CNC(=O)[C@@H](F)C(F)(F)F)cc1 277483382 OFCBCFLWJQVDER-SNVBAGLBSA-N 278.249 2.269 10 20 CECD C[C@@H]1CN(Cc2c(O)cccc2Cl)C[C@]2(CCOC2)O1 280331011 RELRTFUZPIUTKB-ABAIWWIYSA-N 297.782 2.425 10 20 CECD CCCOc1ccc(CN2C[C@@H](O)C(C)(C)C2)c(O)c1 280568732 VPZBNBPMFBVCJH-OAHLLOKOSA-N 279.380 2.384 10 20 CECD C[C@@H](CF)NC(=O)/C=C/c1ccc(N2CCOCC2)cc1 288875818 DABNAUDOVJBEAG-LVDDQXARSA-N 292.354 2.011 10 20 CECD Cc1cc(O)c(CNC[C@H](CO)C(C)C)cc1C 808421603 OPRNRIKITHYBSH-CQSZACIVSA-N 251.370 2.363 10 20 CECD C[C@H](N[C@@H](CN)C1CC1)c1cc(Cl)ccc1O 817959430 FWPAWXKWAIFRKX-UFBFGSQYSA-N 254.761 2.434 10 20 CECD CN(C)c1ccc(CNC2CCC(CN)CC2)cc1F 817901237 UJBSQERDQLVDQM-UHFFFAOYSA-N 279.403 2.499 10 20 CECD COC(=O)C[C@@H]1CC[C@@H](NCCc2ccc(N)cc2)[C@H]1C 817956784 CXTNHIRFQWPODR-DUVNUKRYSA-N 290.407 2.379 10 20 CECD CCc1ncsc1C(=O)NCCc1ccc(N)cc1 818544872 UAYVXSFDHWUCJM-UHFFFAOYSA-N 275.377 2.260 10 20 CECD CC[C@@H](O)CN[C@@H](C)Cc1ccc(N(C)C)cc1C 819376761 IUELXBBVTYSHHS-XJKSGUPXSA-N 264.413 2.353 10 20 CECD Cc1ccc(O)c(CN2CCC[C@H]3CN(C)C[C@H]32)c1 822520410 ABHKKKREWFOEOY-DZGCQCFKSA-N 260.381 2.227 10 20 CECD CCn1cc(CNCc2cc(Cl)cc(F)c2O)nn1 827086816 DPFVOYQDVGFAJX-UHFFFAOYSA-N 284.722 2.086 10 20 CECD C[C@H](NC(=O)N[C@H]1CO[C@H](C)C1)c1ccc(N(C)C)cc1 826532229 STCKQVCXNBNAFX-MBNYWOFBSA-N 291.395 2.290 10 20 CECD COc1cccc(COC(=O)c2cc(O)cs2)n1 733015427 YVJGZQOCMJNRSY-UHFFFAOYSA-N 265.290 2.214 10 20 CECD CCn1nncc1CN1CCCc2cc(OC)ccc21 838791712 UMZMNVGQLQSEHI-UHFFFAOYSA-N 272.352 2.259 10 20 CECD CC[C@@H](CN1CCOCC1)N[C@H]1CCc2cccc(O)c21 903342011 AREQRFXZVABMNJ-GJZGRUSLSA-N 290.407 2.080 10 20 CECD COc1cc2c(c(OC)c1)N(CC1(C)COC1)CCC2 839656483 NDPVKCCHEJGPRN-UHFFFAOYSA-N 277.364 2.493 10 20 CECD CC[C@H](NC[C@@]1(C)CCC(=O)N1)c1ccc(N(C)C)cc1 834909595 SOCJZVYJMCQTJT-DOTOQJQBSA-N 289.423 2.462 10 20 CECD C[C@H]1CN(Cc2cc3c(cc2O)OCO3)C[C@@H](C)S1 743373869 DIURSCVAGUGVHP-AOOOYVTPSA-N 281.377 2.447 10 20 CECD N=C(NCc1ccc(N2CC=CC2)cc1)NC1CCC1 849009805 RAZHIWOHZFBTEF-UHFFFAOYSA-N 270.380 2.229 10 20 CECD COC[C@@H](N[C@@H](C)c1cccc(OC)c1O)C1CC1 846157672 OAHRJPHVABLYJQ-GXFFZTMASA-N 265.353 2.476 10 20 CECD CCCN(CC(F)F)C(=O)NCCc1ccc(N)cc1 841956803 IWBFYCNMJBUPJQ-UHFFFAOYSA-N 285.338 2.498 10 20 CECD CCOCc1cc(CN[C@@H]2CCCNCC2)ccc1OC 841057365 JMMPLPVACFXTOO-MRXNPFEDSA-N 292.423 2.463 10 20 CECD NCC[C@H](NCc1cc(Cl)ccc1O)C(F)(F)F 841090912 QKIUYNLWBYGHJL-JTQLQIEISA-N 282.693 2.415 10 20 CECD C[C@@H](NCCc1cnccn1)c1cc(F)cc(F)c1O 756787075 NXFFABMVXLXVIS-SECBINFHSA-N 279.290 2.354 10 20 CECD C[C@@H](Cc1ccc(O)c(O)c1)NC(=O)CC1(C)CC1 760492834 UIOLFCXIAKEAQB-JTQLQIEISA-N 263.337 2.335 10 20 CECD Cc1ccc(O)c(CNC(=O)c2cnc(C)nc2C)c1 862757559 YOHRTZFWDFOKOU-UHFFFAOYSA-N 271.320 2.037 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@H]1C[C@@]12CCOC2 763478136 AJOHGRCGSGHMIN-NVXWUHKLSA-N 288.391 2.104 10 20 CECD COCCOC1CCN(Cc2c(O)cccc2OC)CC1 769402169 CNALFMWNAAKIAB-UHFFFAOYSA-N 295.379 2.028 10 20 CECD CC(=O)NC[C@@H]1CCCCN1Cc1cccc(C)c1O 877673706 HJKZHDAPXLLSFA-HNNXBMFYSA-N 276.380 2.191 10 20 CECD CCNC(=S)N[C@H](C)c1ccc(N(C)C)cc1 774256721 NVJLFBYOSLWGRJ-SNVBAGLBSA-N 251.399 2.298 10 20 CECD Cc1cccc(CNCCCNc2ncccn2)c1O 775760161 WNBNDGVGJHRQDK-UHFFFAOYSA-N 272.352 2.082 10 20 CECD COC(=O)[C@@]1(C)CN(Cc2c(O)cccc2OC)C[C@@H]1C 877666801 NWQMRJUMPULUNO-ZBEGNZNMSA-N 293.363 2.032 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H]([C@@H](C)O)C2)cc1 773834900 VJPHDZQXKIQPIY-UKRRQHHQSA-N 262.397 2.345 10 20 CECD COCCCOC1CCN(Cc2ccc(N)cc2)CC1 1120371423 YHWWWHVLIMXWPM-UHFFFAOYSA-N 278.396 2.286 10 20 CECD Cc1nonc1CN[C@@H](C)c1c(O)cccc1F 886650510 YCTAWGQQOJHPPY-QMMMGPOBSA-N 251.261 2.074 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@@H]1CCOC1 790950146 LWFQVEAZPOUTBU-QMMMGPOBSA-N 259.708 2.311 10 20 CECD Oc1c(F)cc(Cl)cc1CNCC[C@H](O)C1CC1 898202812 NQSGBDUWLATMBH-LBPRGKRZSA-N 273.735 2.435 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCC(=O)[C@@H](C)C2)c(O)c1 794386777 AEOBCKZSPVEEEV-QWRGUYRKSA-N 291.347 2.022 10 20 CECD Cc1ccc(C(=O)OC[C@@H]2CCC[C@@H](O)C2)c(O)c1O 795375066 UBBRIPWTXYBTNV-GHMZBOCLSA-N 280.320 2.114 10 20 CECD OCC1(CCNCc2cc(Cl)ccc2O)CC1 395895708 JOEVSKWLZKFESQ-UHFFFAOYSA-N 255.745 2.298 10 20 CECD O=C(Nc1c(Cl)ccc2nonc12)[C@H]1CCCCO1 1325345934 POJPNKYVWOUJFJ-SECBINFHSA-N 281.699 2.384 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)CS(C)(=O)=O)cc1 78640513 GTQOWKXHRAFBOO-ZDUSSCGKSA-N 298.452 2.056 10 20 CECD Cc1cc(O)ccc1NS(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 743259480 AESRRHUZHCHSHX-PHIMTYICSA-N 298.408 2.335 10 20 CECD C[C@@H](C(=O)O)C1(NCc2cc(F)cc(F)c2O)CC1 1332017787 SPFCTYXUBGTTLX-ZETCQYMHSA-N 271.263 2.013 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CCO[C@H](C)C1 770745342 GRVDJOIUNBTYMG-VXGBXAGGSA-N 265.353 2.306 10 20 CECD CC[C@@H](C)C[C@H](N)C(=O)NCc1ccc(N(C)C)c(F)c1 1340839042 NGOMQEVLYOMALO-RISCZKNCSA-N 295.402 2.271 10 20 CECD CC(C)CN1CCC[C@H]1C(=O)NCc1ccccc1O 1262614920 VEHNZWGEXCIWNC-AWEZNQCLSA-N 276.380 2.129 10 20 CECD O=C(O)C1=CC[C@H](NCc2cccc(Cl)c2O)C1 1608586852 QKCLXGRLQOFEHL-JTQLQIEISA-N 267.712 2.309 10 20 CECD COc1ccc(N(C)Cc2c[nH]c(C(=O)O)c2)cc1 1607267942 NMGILNQZIGTYPW-UHFFFAOYSA-N 260.293 2.358 10 20 CECD CC(C)(NCc1cc(F)ccc1O)c1nocc1C(=O)O 1609680878 ULRHQMVNKVYGFN-UHFFFAOYSA-N 294.282 2.242 10 20 CECD C[C@@H](NC[C@@H](C)N(C)C1CC1)c1cc(C(=O)O)ccc1O 1604331859 HENCATWWTLIBOW-GHMZBOCLSA-N 292.379 2.224 10 20 CECD N[C@@H]1C[C@@H]1C1CCN(Cc2cc(F)c(F)cc2O)CC1 1574268868 JKQWRYDZTMANOH-BXUZGUMPSA-N 282.334 2.230 10 20 CECD O=C(O)C1(CNCc2cc(F)c(F)cc2O)CCC1 1594879871 ASUWVDJAZONEHV-UHFFFAOYSA-N 271.263 2.015 10 20 CECD O=C(Cc1cc(F)ccc1F)NCc1ccc(O)c(O)c1 159006899 UPHVDTYOVMTCGM-UHFFFAOYSA-N 293.269 2.235 10 20 CECD CCOCCOCCN[C@H](C)c1ccccc1O 927086158 DFJJVERJDUHGOQ-GFCCVEGCSA-N 253.342 2.096 10 20 CECD COc1cccc(O)c1CNC[C@@H]1CC[C@@H](C)O1 835088548 SLMILJBYLGOENU-MNOVXSKESA-N 251.326 2.058 10 20 CECD CO[C@@H]1C[C@@H](NCc2cc3c(cc2O)OCO3)C1(C)C 227828883 UEZUFNSCRTZZPT-ZIAGYGMSSA-N 279.336 2.024 10 20 CECD COc1cc(Cl)cc(CN[C@@H](C)CCN(C)C)c1O 228672841 IIVWCVGAGWYJPM-JTQLQIEISA-N 286.803 2.484 10 20 CECD COc1cc(Cl)cc(CN2CC[C@H]3NCC[C@@H]3C2)c1O 313194473 MSPBLWQLPPKCCZ-ZWNOBZJWSA-N 296.798 2.238 10 20 CECD CCCN1CC[C@@H](NCc2cc(F)ccc2O)C1 389440438 NPULIUGJFKHBSJ-CYBMUJFWSA-N 252.333 2.105 10 20 CECD Nc1ccc(CC(=O)N2CCc3ccc(O)cc3C2)cc1 37823122 AYONXAJLBUZZEF-UHFFFAOYSA-N 282.343 2.102 10 20 CECD C[C@H](NCc1ccc(N(C)C)cc1)c1nnc2n1CCC2 35255354 BTINXPSOOJDRRR-LBPRGKRZSA-N 285.395 2.141 10 20 CECD Oc1ccc(F)cc1CN1CCC[C@@H](C2OCCO2)C1 180058131 FWDHJVPPBKKMON-LLVKDONJSA-N 281.327 2.116 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@@H](Nc2ccccc2)C1 187066580 CPNGPRRFNVJEPA-CYBMUJFWSA-N 298.342 2.424 10 20 CECD CC(=O)OC1CCN(Cc2cc(F)ccc2O)CC1 180163097 YMIVURLZBLLOMI-UHFFFAOYSA-N 267.300 2.059 10 20 CECD CC[C@@](C)(CNCc1ccc(N2CCOCC2)cc1)OC 322552187 VPNHIPXEHOOGOL-KRWDZBQOSA-N 292.423 2.428 10 20 CECD COc1c([N+](=O)[O-])ccc(CNC[C@@H]2CCSC2)c1O 279884471 SARGKKKIIZWZBU-VIFPVBQESA-N 298.364 2.152 10 20 CECD CC[C@@H](N[C@H](C)c1nncn1C)c1ccc(F)cc1O 286375890 ZUMJPFQEUZUFHG-BXKDBHETSA-N 278.331 2.462 10 20 CECD CCN(CC)c1ccc(CN[C@@]2(C)CCOC2=O)cc1F 289876587 RPOZKDBPFNWHTA-INIZCTEOSA-N 294.370 2.467 10 20 CECD CCn1cc([C@@H](C)NCc2cc3c(cc2O)OCO3)cn1 294862207 OKHPFIFHFVLRHN-SNVBAGLBSA-N 289.335 2.188 10 20 CECD CCOc1ccc(CN2CCOCC(F)(F)C2)c(O)c1 809787517 GTPCBFKDRRCZMP-UHFFFAOYSA-N 287.306 2.258 10 20 CECD CC[C@H](N[C@H]1CCCNC1)c1ccc(F)cc1O 817942391 YFRLBPLKIPSKOJ-AAEUAGOBSA-N 252.333 2.324 10 20 CECD Cc1cc(C(=O)N(C)CCN)c(C)n1-c1ccc(F)cc1 818010489 MYFBOXFLQMCHGO-UHFFFAOYSA-N 289.354 2.264 10 20 CECD COc1ccc(N2CC[C@H](CNC3CCOCC3)C2)cc1 818221084 LDTXYNRDBAANQM-CQSZACIVSA-N 290.407 2.290 10 20 CECD COc1ccc(O)c([C@@H](C)NCCCNC2CC2)c1 817984056 MIENOLUGSGLTKP-LLVKDONJSA-N 264.369 2.194 10 20 CECD O=C(CC1(O)CCC1)NCCCSc1nccs1 823297842 JCFLGKHSKOJJMD-UHFFFAOYSA-N 286.422 2.047 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1ccsn1 825873430 JJYDBPWPDZSUAX-UHFFFAOYSA-N 275.377 2.448 10 20 CECD Cc1cc(O)c(CN2CCCC[C@H]2C(N)=O)cc1Cl 824523268 XFLUNUHCDWZLKV-LBPRGKRZSA-N 282.771 2.194 10 20 CECD COc1ccc2c(c1)CCN2Cc1ccc(-c2nn[nH]n2)o1 821849935 TUPNQBREYZWIEI-UHFFFAOYSA-N 297.318 2.031 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)[C@@H](O)C1CC1 822898912 VDGBQYDHRQLJKZ-INIZCTEOSA-N 290.407 2.261 10 20 CECD COc1ccc(N2CCC(N[C@H]3COC[C@@H]3C)CC2)cc1 903394372 AYNUBICSGGMUIH-GUYCJALGSA-N 290.407 2.289 10 20 CECD COc1cc2c(c(OC)c1)N(Cc1nc(C)no1)CCC2 839653631 AGLUPCCKMOHYNE-UHFFFAOYSA-N 289.335 2.348 10 20 CECD Oc1cccc2c1[C@H](N[C@@H]1CCO[C@@]3(CCOC3)C1)CC2 834697449 LHVOACUKANUMHX-CPUCHLNUSA-N 289.375 2.307 10 20 CECD COc1cccc([C@H](C)NC[C@@H]2CCCO2)c1O 846138935 XZDBSUMIARXOAK-QWRGUYRKSA-N 251.326 2.230 10 20 CECD O=C(O)[C@H]1CCCN1Cc1cc(Cl)c(F)cc1O 840995803 YXBITUUYZVGZDN-SNVBAGLBSA-N 273.691 2.234 10 20 CECD CCc1cccc(CNCCc2cnc(C)cn2)c1O 848915212 SYMWXDWOEPBXAZ-UHFFFAOYSA-N 271.364 2.385 10 20 CECD O=C(COC(=O)C1CCCC1)c1ccc(O)c(O)c1 916589993 RXQYAVPIIGQMRF-UHFFFAOYSA-N 264.277 2.014 10 20 CECD Cc1cc(CC(=O)NCc2ccc(N(C)C)cc2C)on1 845536897 RRONUTLIEDJQPL-UHFFFAOYSA-N 287.363 2.216 10 20 CECD O=C(C[C@@H]1CCCO1)NCc1cc(Cl)ccc1O 846471862 BVJIJSMSVULCMS-NSHDSACASA-N 269.728 2.231 10 20 CECD CN(CCOCCO)c1ccc(-c2nccs2)cc1 846997659 XRSSZWMFUHVPGF-UHFFFAOYSA-N 278.377 2.255 10 20 CECD CCO/C=C/C(=O)N(C)CCN(C)c1ccc(OC)cc1 844856245 HGAFJEHKYZZOQZ-JLHYYAGUSA-N 292.379 2.140 10 20 CECD C[C@H]1CN(Cc2ccc(N(C)C)c(F)c2)CC[C@@H]1N 843052261 RGCUOZWOCKUNFT-FZMZJTMJSA-N 265.376 2.061 10 20 CECD CNC[C@H]1CCCN(Cc2cc(C)c(C)cc2O)C1 843045381 WANUIZNSJWVGAT-CQSZACIVSA-N 262.397 2.440 10 20 CECD CCc1cccc(CNC2COC(C)(C)OC2)c1O 848902104 KQFSHXGUQFVCSE-UHFFFAOYSA-N 265.353 2.196 10 20 CECD COCc1cc(CN[C@@H](C)c2cc(OC)ccc2O)no1 845973404 ZTRXUNPNYWCPGS-JTQLQIEISA-N 292.335 2.386 10 20 CECD COC/C(C)=C\C(=O)N[C@@H](C)c1cc(OC)ccc1O 845834629 VLFAUNXNIRUWED-BRNRAETOSA-N 279.336 2.171 10 20 CECD CC(=O)c1cc(Cl)cc(CN2C[C@@H](C)NC[C@@H]2C)c1O 842474803 XELFTLBFINUNGR-ZJUUUORDSA-N 296.798 2.430 10 20 CECD C[C@H](NC[C@H]1C[C@@H](O)C1)c1cc(F)cc(F)c1O 858545459 OUTWVBPHLORUOG-OYNCUSHFSA-N 257.280 2.092 10 20 CECD C[C@H](CO)[C@@H]1CCCCN1C(=O)c1cc(O)cs1 855468109 ZFNBMVVCEZKIRI-KOLCDFICSA-N 269.366 2.077 10 20 CECD CC1(C)CN(C(=O)Cc2ccc(N)cc2)[C@@H]1[C@@H]1CCCO1 852873508 XCEZCMIMFOAGNY-GOEBONIOSA-N 288.391 2.227 10 20 CECD C[Si](C)(C)Cn1cc(COc2ccc(N)cc2)nn1 864621627 SLUWKWULHQGBMB-UHFFFAOYSA-N 276.416 2.317 10 20 CECD Cc1ccc(O)c(CNC(=O)CN2CCC(C)CC2)c1 862758166 RBBBXXPSXPSRLU-UHFFFAOYSA-N 276.380 2.049 10 20 CECD C[C@H](NC[C@H]1C[C@H](O)C1)c1ccc(Cl)cc1O 872126126 IPTIWRKRCCLWPO-QXEWZRGKSA-N 255.745 2.467 10 20 CECD CCC(CC)(CN)C(=O)N[C@H](C)c1ccccc1O 877255909 JYWIGECEQCEPBN-LLVKDONJSA-N 264.369 2.335 10 20 CECD CC[C@H](NC[C@H]1C[C@H](O)C1)c1ccc(F)cc1O 872125910 HEWOPKBKFZHISW-GAFUQQFSSA-N 253.317 2.343 10 20 CECD Cc1noc(CCCN[C@H](C)c2ccccc2O)n1 775130015 KKWMRWNUIYWQEG-SNVBAGLBSA-N 261.325 2.367 10 20 CECD COc1ccc(CNCCNC(=O)/C=C\C2CC2)cc1C 1125242794 JHABPTTZJQVFOC-VURMDHGXSA-N 288.391 2.176 10 20 CECD CCOC(=O)[C@H]1CCN(Cc2cc(C)cc(OC)c2O)C1 896954732 AQAIIKMDLXPTON-LBPRGKRZSA-N 293.363 2.094 10 20 CECD COc1ccc(CNCc2ccc(C)nc2)c(O)c1OC 892605433 RVAXWGJGMNRDMF-UHFFFAOYSA-N 288.347 2.403 10 20 CECD COc1ccc(CNC(=O)C[C@@H]2C=CCC2)c(O)c1 794378867 XIPQIEGXZNMJFF-LLVKDONJSA-N 261.321 2.373 10 20 CECD COC(=O)c1cnoc1CSc1nccs1 795216187 YMEUPVKITOPHQB-UHFFFAOYSA-N 256.308 2.210 10 20 CECD COC(=O)N1CCCN(Cc2cccc(Cl)c2O)CC1 1231909444 DGSVMOUYSBXJQX-UHFFFAOYSA-N 298.770 2.320 10 20 CECD CCC(O)(CC)CNCc1c(O)cccc1OC 725850229 SCBBNIGBPOIZOP-UHFFFAOYSA-N 253.342 2.042 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@@H](C)c2ncnn2C)c1 276744869 ZODMBLMAHMAOOH-MNOVXSKESA-N 260.341 2.241 10 20 CECD COc1ccc(O)c([C@@H](C)N[C@H](CO)C(C)C)c1 92392628 KAHIZZJDQHESCO-ZWNOBZJWSA-N 253.342 2.068 10 20 CECD Cc1cc(Br)cc([C@@H](C)NCCO)c1O 186939274 GCFIKCKHFABFBD-MRVPVSSYSA-N 274.158 2.106 10 20 CECD CCOc1cc(NCCc2ccc(N)cc2)ncn1 90784341 SYIZNNWEMKCMBK-UHFFFAOYSA-N 258.325 2.112 10 20 CECD O=C(O)[C@@H](CC(F)(F)F)NCc1ccc2c(c1)CCO2 1333136652 HLXNFGSFCOSCMZ-SNVBAGLBSA-N 289.253 2.117 10 20 CECD Cc1csc(CCNC(=O)NCc2ccc(N)cc2)n1 1357645563 ANCJIVINFMDSCS-UHFFFAOYSA-N 290.392 2.076 10 20 CECD Oc1c(CN2CCO[C@@]3(CCNC3)C2)ccc2ccccc12 1580885860 PDOGZGWZIKURPZ-GOSISDBHSA-N 298.386 2.110 10 20 CECD CN1CCc2cc(/C=C\c3ncc(C(=O)O)c(O)n3)ccc21 1777093534 AFCWKQVSLUQAOU-HYXAFXHYSA-N 297.314 2.043 10 20 CECD CCOCCCN(C)Cc1ccc(N2CCOCC2)cc1 158639861 DSQMXYMQCANENH-UHFFFAOYSA-N 292.423 2.382 10 20 CECD COC[C@H](C)NCc1ccc(N2CCSCC2)cc1 163635747 CAGKHEMISRCSKT-ZDUSSCGKSA-N 280.437 2.364 10 20 CECD COc1cc(CN2C[C@H](C)O[C@H](C)C2)c(O)cc1C 159457087 LQMVCLNHHRRQCI-TXEJJXNPSA-N 265.353 2.318 10 20 CECD COc1ccc(CN[C@@H](C)CN2CCCC2=O)cc1C 37782649 PFPGUEZYMXSILR-ZDUSSCGKSA-N 276.380 2.104 10 20 CECD C[C@@H](NCc1cc(F)ccc1O)[C@H]1CCCOC1 388733967 CGYHEYBMXXXAJW-MNOVXSKESA-N 253.317 2.436 10 20 CECD C[C@@H](N[C@@H](CCO)C(F)(F)F)c1ccccc1O 886800862 CVGQEZBCYDYSGN-KCJUWKMLSA-N 263.259 2.356 10 20 CECD CCN(CC)CC(=O)N(CC)Cc1ccc(N(C)C)cc1 63683499 ZPFLBTHXTCOCJN-UHFFFAOYSA-N 291.439 2.443 10 20 CECD COc1ccc(N(C)CCCN2CCCC2=O)cc1OC 63618021 ZCUAEUKEAFIXQX-UHFFFAOYSA-N 292.379 2.153 10 20 CECD CCC(O)(CC)CNCc1cc(OC)ccc1O 87013937 BZUKMNYSMSQFPY-UHFFFAOYSA-N 253.342 2.042 10 20 CECD COC[C@@H](C)CN[C@@H](C)c1cc(OC)ccc1O 45656218 UIWNBNQOJSPKRQ-QWRGUYRKSA-N 253.342 2.334 10 20 CECD CCOc1cccc(CN[C@H](C)C(=O)NC(C)(C)C)c1O 134493464 BDDOORPNGVQSJL-LLVKDONJSA-N 294.395 2.184 10 20 CECD CCNC(=O)C1(CN[C@@H](C)c2ccccc2O)CCC1 277382264 XSMHOHADKGLQCN-LBPRGKRZSA-N 276.380 2.349 10 20 CECD C/C=C/C[C@H](CO)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 274598168 GYFXVDHRRRDGQZ-YIZUVKHSSA-N 280.324 2.278 10 20 CECD C1=CO[C@@H](CNCc2ccc(N3CCOCC3)cc2)CC1 275841025 PXWBCMNTLJADMG-QGZVFWFLSA-N 288.391 2.306 10 20 CECD COc1c([N+](=O)[O-])ccc(CN[C@@H]2CCCSC2)c1O 278542650 XPFMMFDETBCOTF-SNVBAGLBSA-N 298.364 2.294 10 20 CECD CC[C@H]1CN(Cc2cc(C)ccc2O)C[C@@H](C)S1(=O)=O 289966755 YUYJVHRIPCQRHV-OCCSQVGLSA-N 297.420 2.098 10 20 CECD COc1cccc(CN2C[C@@H]3C[C@H]4C[C@H]3[C@H]2[C@H]4OC)c1O 289623714 LRCUXTOILSZUGZ-KEDVTSPUSA-N 289.375 2.256 10 20 CECD Cc1noc(C)c1C(=O)NCc1ccc(N(C)C)c(F)c1 299335953 OKPUVXISGNIXMF-UHFFFAOYSA-N 291.326 2.427 10 20 CECD COCCn1cc(CNCc2cc(C)c(C)cc2O)cn1 800285684 OWXDVUQEBAERFN-UHFFFAOYSA-N 289.379 2.142 10 20 CECD CCCCNC(=O)NCc1ccc(N(C)C)c(F)c1 299324754 MYYGSSJHGYZTNB-UHFFFAOYSA-N 267.348 2.491 10 20 CECD COC(=O)C1(C)CN(Cc2ccc(N(C)C)cc2C)C1 822530181 SRVHZZYJFKPWQM-UHFFFAOYSA-N 276.380 2.056 10 20 CECD CCOc1ccc(CN(C)C2(CO)CCC2)c(O)c1 827903428 HOQQKIWIRHLSOS-UHFFFAOYSA-N 265.353 2.138 10 20 CECD Cc1c(C)n(C)c2ccc(OC[C@H]3CNC(=O)C3)cc12 902442766 DENVHKKINXZHIW-GFCCVEGCSA-N 272.348 2.310 10 20 CECD Oc1ccccc1CN(Cc1cnccn1)C[C@@H]1CCCO1 838782392 ANJAJDFZSFBWCU-INIZCTEOSA-N 299.374 2.363 10 20 CECD CC[C@@H](NC[C@]1(C)CCC(=O)N1)c1ccc(C)cc1O 834907812 CVBYVDLLCXIJSM-CJNGLKHVSA-N 276.380 2.410 10 20 CECD CCc1nc(SCC(=O)C(C)=O)c2ccccc2n1 848447390 QODRPTCIAAWYHG-UHFFFAOYSA-N 274.345 2.442 10 20 CECD CCS(=O)(=O)CCCN[C@@H](C)c1ccc(C)c(C)c1O 840889759 VPOACBPSOJHZHK-ZDUSSCGKSA-N 299.436 2.484 10 20 CECD CCN(C(=O)/C=C\c1cnn(C)c1)c1ccc(OC)cc1 914478490 UJVHQIXUWGYGNG-YHYXMXQVSA-N 285.347 2.495 10 20 CECD COC(=O)[C@@]1(C)CCCN(Cc2cccc(OC)c2O)C1 840974729 FSQUOGUSSCWFQW-INIZCTEOSA-N 293.363 2.176 10 20 CECD C[C@H](N[C@H]1CCN(C)C1)c1ccc(Cl)cc1O 841748067 VVWNKYXBQHQWIP-ONGXEEELSA-N 254.761 2.400 10 20 CECD C[C@@H]1C[C@@H](NCc2c(O)cccc2Cl)CCN1 841061608 LNLHBYBOGBKJGO-ZJUUUORDSA-N 254.761 2.276 10 20 CECD CN(Cc1ccccc1O)C(=O)C(=O)C1CCSCC1 840923912 XBDSGKHQGAKDAD-UHFFFAOYSA-N 293.388 2.063 10 20 CECD COCCN1CC[C@@H](N[C@@H](C)c2ccc(Cl)cc2O)C1 841764826 RUUDZDDBEJNAOF-WCQYABFASA-N 298.814 2.417 10 20 CECD COC(C)(C)CC(=O)N[C@H](C)c1ccccc1O 827946478 JKLICNWTCVTHSC-SNVBAGLBSA-N 251.326 2.385 10 20 CECD C[C@H]1CCN(CCN[C@H](C)c2cc([N+](=O)[O-])ccc2O)C1 756629768 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287.743 2.015 10 20 CECD Nc1ccc(NC(=O)Cc2cc(F)ccc2O)cc1 1580447473 AHJKXCWEEFQSAQ-UHFFFAOYSA-N 260.268 2.295 10 20 CECD O=C(NCc1ccccc1C(=O)O)c1cc(O)cs1 1594772105 RWXKYDLLTJOJNR-UHFFFAOYSA-N 277.301 2.082 10 20 CECD COc1ccc(O)c(CN(C2CCC2)[C@@H](C)C(=O)O)c1 1599598401 LRBMJHPZSXWMBR-JTQLQIEISA-N 279.336 2.228 10 20 CECD CC(=O)Nc1ccc(NC(=O)Cc2ccc(N)cc2)cc1 19802466 MISSEHWXUZIYQP-UHFFFAOYSA-N 283.331 2.408 10 20 CECD CCC(CC)N1C[C@H](C(=O)Nc2ccc(N)cc2)CC1=O 160363766 AOZCLZBPOGIKKD-LLVKDONJSA-N 289.379 2.244 10 20 CECD CC(=O)N(C)C1CCN(Cc2cc(C)cc(C)c2O)CC1 164235646 HLRHYPZGTPGFEL-UHFFFAOYSA-N 290.407 2.452 10 20 CECD Nc1ccc(NC(=O)CNC(=O)OCc2ccccc2)cc1 1857523871 GSXZSPSOOIYELV-UHFFFAOYSA-N 299.330 2.134 10 20 CECD COC(=O)C1CCN(Cc2cc(Cl)ccc2O)CC1 159201203 ZCRWZVFTCKOYAH-UHFFFAOYSA-N 283.755 2.431 10 20 CECD COc1ccc(CNC[C@H](CO)C(C)C)cc1C 258956639 JYQXXJBECFUFKA-CQSZACIVSA-N 251.370 2.358 10 20 CECD O[C@H]1C[C@H](NCc2ccc(N3CCCCC3)cc2)C1 850418035 VXTPEQWMTJEOHI-KOMQPUFPSA-N 260.381 2.290 10 20 CECD COc1cccc(O)c1CN[C@@H]1CS[C@@H](C)C1 840957845 GKJPUTWIOZGMQQ-UWVGGRQHSA-N 253.367 2.384 10 20 CECD CCOc1cccc(CN2CC[C@H](N)[C@H](CC)C2)c1O 122251241 SUISXPROUVYUGS-OCCSQVGLSA-N 278.396 2.350 10 20 CECD Cc1ccc([C@@H](C)N[C@H](C)c2nncn2C)c(O)c1 37016330 XQLGGOPIOYJTTG-GHMZBOCLSA-N 260.341 2.241 10 20 CECD C[C@@](O)(CNCc1cccc(Cl)c1O)C(F)(F)F 271765129 AHMUDIYINMFBCC-SNVBAGLBSA-N 283.677 2.449 10 20 CECD COCCOCCN[C@@H](C)c1ccc(N(C)C)cc1 44694214 AFRSKFIYZANDOE-ZDUSSCGKSA-N 266.385 2.066 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)CCCO1 281221159 KKULIEDRAOIBHL-CYBMUJFWSA-N 265.353 2.402 10 20 CECD C[C@@H](N[C@H](C)c1ccc(F)cc1O)C(=O)NC(C)(C)C 181235119 MJBNQZWGYJUUEX-NXEZZACHSA-N 282.359 2.485 10 20 CECD COC1CCN(Cc2cc(F)cc(F)c2O)CC1 708421291 DDYMBUXYDWLNHT-UHFFFAOYSA-N 257.280 2.281 10 20 CECD C[C@@](O)(CNCc1c(O)cccc1Cl)C1CC1 310433811 QVPZOVFSYCOAKM-CYBMUJFWSA-N 255.745 2.296 10 20 CECD Cc1ccc(C(=O)N2C[C@@H](C)OC(C)(C)C2)c(O)c1O 177676498 VCHNVTMBVBOLNG-SNVBAGLBSA-N 279.336 2.046 10 20 CECD C[C@@H](NCCN1CCCC1)c1ccc(F)cc1O 62745035 VAVAMJAOZUXGEU-LLVKDONJSA-N 252.333 2.278 10 20 CECD O=C(NCc1ccc(O)c(O)c1)c1cc(F)c(O)c(F)c1 186880436 QJKAFZHNKGSVAV-UHFFFAOYSA-N 295.241 2.012 10 20 CECD CCC(=O)N1CC[C@H](N[C@H](C)c2cc(OC)ccc2O)C1 185787897 YTIBJUGELYAXCX-NEPJUHHUSA-N 292.379 2.062 10 20 CECD CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)CCC(=O)O 32153413 XDGCECVKZFYQLX-UHFFFAOYSA-N 292.379 2.354 10 20 CECD C[C@@H](CC(=O)N(C)Cc1ccccc1O)[C@@H]1CCCNC1 127231943 WTDCWRIYZYWCHL-UONOGXRCSA-N 290.407 2.376 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)Nc1ccon1 183594906 OWAXHOIQYJKMAR-UHFFFAOYSA-N 288.307 2.172 10 20 CECD CN(Cc1ccc(N(C)C)cc1)C(=O)[C@@H]1C[C@H]2CC[C@@H]1O2 71100745 AANGISWAUKIYHS-OAGGEKHMSA-N 288.391 2.279 10 20 CECD Cn1nccc1CCNCc1ccc(N2CCCC2)cc1 231033118 VEKRFZXIBHKPCM-UHFFFAOYSA-N 284.407 2.353 10 20 CECD C[C@H](CO)CCCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273359611 DLHUSNJLNZHSQD-QWRGUYRKSA-N 282.340 2.360 10 20 CECD Oc1ccc(Cl)c(F)c1CN1CCn2cncc2C1 368215514 MSBDBPYGNLFBKU-UHFFFAOYSA-N 281.718 2.397 10 20 CECD CC[C@H](C)[C@H](O)CN[C@H](C)c1cc(C(=O)OC)ccc1O 273599566 RPDPJSXIZMSEPF-FIXISWKDSA-N 295.379 2.236 10 20 CECD C[C@@H]1C[C@@H](NC[C@@H]2CNCCCO2)c2c(O)ccc(F)c21 817982506 UFNNYIZWZVEVQT-NTZNESFSSA-N 294.370 2.048 10 20 CECD O=C(COC(=O)C1(F)CCCCC1)c1ccc(O)c(O)c1 811249511 QGVUQRVSZVIXHM-UHFFFAOYSA-N 296.294 2.496 10 20 CECD Cc1cc(CN2CC[C@H](O)[C@H](C)C2)ccc1N(C)C 815096661 UIZKBPIGNZDNQQ-CJNGLKHVSA-N 262.397 2.264 10 20 CECD CN(C)c1ccc(CN(C)[C@@H]2CC(C)(C)OC2=O)cc1F 814180999 UZTCDERPXDGZLL-CQSZACIVSA-N 294.370 2.418 10 20 CECD CCNC(=O)CNCc1cc(-c2ccccc2)ccc1O 725842006 VXWXIOMSSPFSQU-UHFFFAOYSA-N 284.359 2.285 10 20 CECD CN(C)c1ccc(CNCCCCC(=O)O)cc1F 820548031 UJEIZZBKGNJUQT-UHFFFAOYSA-N 268.332 2.236 10 20 CECD C[C@@H](CN(C)Cc1ccc(N(C)C)c(F)c1)C(=O)O 901597333 NMFSZVMCSDTCIR-JTQLQIEISA-N 268.332 2.044 10 20 CECD O=C(NCCCSc1nccs1)N1CC[C@H](F)C1 838513387 IJXNXHQQSQOSFK-VIFPVBQESA-N 289.401 2.379 10 20 CECD CN(C)[C@@H](CNC(=O)c1cc(O)cs1)c1ccco1 731864484 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20 CECD Cc1cccc(O)c1CN(C)Cc1cccc(O)n1 897392336 XSVIKFGHNDFRPX-UHFFFAOYSA-N 258.321 2.433 10 20 CECD CCS(=O)(=O)C[C@H](C)N[C@H](C)c1ccc(F)cc1O 186029907 OAINZQAJJNTLQL-VHSXEESVSA-N 289.372 2.005 10 20 CECD COc1cc(CNCc2cc(C)ccc2O)sn1 399308846 LJFWQDFDTVKFRS-UHFFFAOYSA-N 264.350 2.456 10 20 CECD Cc1ccc(CNCc2nc(C(F)F)no2)c(O)c1 1333851048 SBTGPUHKAZGZGX-UHFFFAOYSA-N 269.251 2.311 10 20 CECD O=C(NCc1cccc(O)c1O)c1coc(C2CCC2)n1 1349080044 XUNLFUKOQYHMHI-UHFFFAOYSA-N 288.303 2.283 10 20 CECD C[C@H](NCCN1CCC[C@@H]1C)c1cc(C(=O)O)ccc1O 1609780460 SAAKFPRZSMQSSB-RYUDHWBXSA-N 292.379 2.225 10 20 CECD C[C@@H](NCCCCN(C)C)c1cc(C(=O)O)ccc1O 1609780454 RZMOMDAYZUYDFW-LLVKDONJSA-N 280.368 2.083 10 20 CECD CCCNCCNCc1cc(F)c(N(C)C)cc1F 1577559834 VQSRLMVWPSZDAI-UHFFFAOYSA-N 271.355 2.120 10 20 CECD CCOc1cccc(CNC2(CC(=O)O)CCC2)c1O 1597155253 JQHRGPLPFSENEJ-UHFFFAOYSA-N 279.336 2.278 10 20 CECD CCC[C@@H](CC(=O)O)NCc1cc(F)cc(F)c1O 1776827370 PLQUKWSFUXXTSD-JTQLQIEISA-N 273.279 2.403 10 20 CECD CN(Cc1ccc(N(C)C)cc1)Cc1ccc(N)nc1 843059742 RHZSETFEACNXPH-UHFFFAOYSA-N 270.380 2.362 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)[C@@H]1CCCNC1 841032872 GPABYYXFIZNBHE-SWLSCSKDSA-N 260.381 2.099 10 20 CECD CN(Cc1ccccc1O)C(=O)c1cncc(F)c1 131447849 OLCLLUSELURDCH-UHFFFAOYSA-N 260.268 2.199 10 20 CECD COc1cc(Cl)cc(CN2CC[C@](C)(CN)C2)c1O 388370376 KPVWDMYWJKDANJ-CQSZACIVSA-N 284.787 2.225 10 20 CECD COc1cccc(CNc2cc(Cl)nc(N)n2)c1O 66812689 KHJGXZGYMHKKQG-UHFFFAOYSA-N 280.715 2.039 10 20 CECD CN(C)c1ccc(CNC(=O)c2ccc(CCN)cc2)cc1 315488495 WTPJWDGOGRYRCD-UHFFFAOYSA-N 297.402 2.184 10 20 CECD COC(=O)[C@@]1(F)CCN(Cc2cc(C)c(C)cc2O)C1 74723039 LMRMGPFVEDSYAB-OAHLLOKOSA-N 281.327 2.096 10 20 CECD Cc1cccc(CN(C)[C@@H](C)C(=O)OC(C)C)c1O 180557299 OZXSLWHGMXWIFZ-LBPRGKRZSA-N 265.353 2.473 10 20 CECD CCOc1cccc(CNCCCCCO)c1O 75436116 SRQMDZINHICPCE-UHFFFAOYSA-N 253.342 2.043 10 20 CECD OCCCCCNCc1cccc(Br)c1O 192906148 GHPFKKAKRBBCRM-UHFFFAOYSA-N 288.185 2.407 10 20 CECD CCCOc1ccc(CNCCCCCO)c(O)c1 192903395 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C[C@@H]1CN(Cc2cc(Cl)ccc2O)C[C@@]1(C)CO 827699050 DIPJBUOXBAQTFC-YGRLFVJLSA-N 269.772 2.496 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)NOC1CCC1 836569354 FBZLOEOPAWGSBG-UHFFFAOYSA-N 277.368 2.344 10 20 CECD CCOc1cccc(CNC(C)(C)CC(=O)O)c1O 737209647 ADZKXMQRZKMJNY-UHFFFAOYSA-N 267.325 2.134 10 20 CECD O=C(NCCCc1nccs1)c1cc(O)cs1 732284133 JXSBPIMSDYVOTG-UHFFFAOYSA-N 268.363 2.273 10 20 CECD O=C(NCc1ccc(O)cc1O)[C@@H]1[C@H]2Cc3ccccc3[C@H]21 910942605 FZCZUSFRBSZFDG-USXIJHARSA-N 295.338 2.300 10 20 CECD CCOC(=O)CCN(CC1CC1)C(=O)c1cc(O)cs1 748364024 VVMCNUIVBKLPMQ-UHFFFAOYSA-N 297.376 2.259 10 20 CECD C[C@@H](N[C@@H]1CCN(CC(F)F)C1)c1ccccc1O 841765335 PPCSOUJHDPBDCQ-GHMZBOCLSA-N 270.323 2.382 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H](C)CN1CCCC1=O 840929960 RNZNHSZUAVQBCO-AWEZNQCLSA-N 289.423 2.162 10 20 CECD CCOc1cccc(CN[C@@H](CN)C(C)(C)C)c1O 841088093 WUUZNOXCNJJEBV-ZDUSSCGKSA-N 266.385 2.254 10 20 CECD CCOc1cccc(CN[C@H]2CCN[C@@H](C)C2)c1O 841062937 ZNDKBKOEUSIGMF-AAEUAGOBSA-N 264.369 2.021 10 20 CECD CCO[C@@H]1COCC[C@@H]1NCc1ccc(N(C)C)cc1C 840938738 GHYABJSPYGZSGF-DLBZAZTESA-N 292.423 2.345 10 20 CECD CCOc1ccc(CN[C@@H](C)CCCCN)c(O)c1 841081094 UBSLJXAVZLAUIZ-LBPRGKRZSA-N 266.385 2.398 10 20 CECD COc1cccc(CN2CCC[C@@H]([C@@H]3CCNC3)C2)c1O 843124846 JCJJIAVCWCKWFX-ZIAGYGMSSA-N 290.407 2.222 10 20 CECD CC(C)Cn1nccc1C(=O)NCCc1ccc(N)cc1 843343096 SMVSEIXSUWDDRF-UHFFFAOYSA-N 286.379 2.094 10 20 CECD COc1cccc([C@@H](C)NC[C@](C)(O)C2CC2)c1O 846148259 YUUDXNJBGPZWAO-BMIGLBTASA-N 265.353 2.212 10 20 CECD COc1ccc2c(c1)CCCN2Cc1nncs1 929238858 YXOYXFYCRMEBQN-UHFFFAOYSA-N 261.350 2.500 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)C(C)(C)CO 848227043 YRBXNTPDYGFYIT-ZDUSSCGKSA-N 292.423 2.127 10 20 CECD O=C1C[C@H](NCc2ccc(N3CCCC3)cc2)CCCN1 924647419 GIVGARXXEDJWQH-OAHLLOKOSA-N 287.407 2.045 10 20 CECD COc1ccc(N2CCC(NC(=O)OCCF)CC2)cc1 858933118 AOTLSBXPOIFSJF-UHFFFAOYSA-N 296.342 2.360 10 20 CECD CCOCc1cc(CNC[C@H]2CCCN2C)ccc1OC 858235739 PFQPYLPUCCHEJB-MRXNPFEDSA-N 292.423 2.416 10 20 CECD N[C@]12CCC[C@H]1CN(Cc1cc(Cl)cc(F)c1O)C2 857225948 BOTLBDKHQQBFFF-HZMBPMFUSA-N 284.762 2.498 10 20 CECD CCOCc1cc(CN[C@H]2CCC[C@@H]2O)ccc1OC 865736914 UORQEQZWNDUNCK-GJZGRUSLSA-N 279.380 2.235 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@@](C)(O)Cc2ccccc2)c1 862760482 RTMMMEYINPCAIV-SFHVURJKSA-N 299.370 2.311 10 20 CECD CC(C)[C@H](CNC(=O)N[C@H](C)c1ccccc1O)C(=O)O 874406426 CHYDADHKKNRCDU-PWSUYJOCSA-N 294.351 2.109 10 20 CECD CCCOc1ccc(CN[C@@H]2CCOC[C@H]2O)cc1C 873149410 UESQMQUDBLUBOM-HUUCEWRRSA-N 279.380 2.023 10 20 CECD C[C@@H](NC(=S)NC1CC1)c1ccc(N(C)C)cc1 774248710 GUUDCGWPFRIYHG-SNVBAGLBSA-N 263.410 2.440 10 20 CECD CO[C@@H](C)CN(C)Cc1ccc(N2CCC(O)CC2)cc1 877522108 APIXZHNYUATRME-AWEZNQCLSA-N 292.423 2.114 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)[C@@H]1CCO[C@@H](C)C1 776326166 YZAXVVNTVAHNIN-UONOGXRCSA-N 290.407 2.492 10 20 CECD CCNC(=S)N[C@@H](C)c1ccc(N(C)C)cc1 774256719 NVJLFBYOSLWGRJ-JTQLQIEISA-N 251.399 2.298 10 20 CECD C[C@H](C[C@H]1CCCC(=O)N1)N[C@H](C)c1ccccc1O 877755642 JNEJWZZLYUNATF-JHJVBQTASA-N 276.380 2.490 10 20 CECD C[C@@H](NC[C@@H]1CC(=O)N(C2CC2)C1)c1c(O)cccc1F 886633282 QUNUFSIJCHQJHT-MNOVXSKESA-N 292.354 2.193 10 20 CECD Oc1c(F)cc(F)cc1CN1C[C@H]2[C@H](C1)C2(F)F 895149603 MCRBGJPGZZZVRF-IUCAKERBSA-N 261.218 2.367 10 20 CECD COc1cc(C)cc(CN2C[C@H](C)S(=O)[C@@H](C)C2)c1O 894553142 YDVIFUFTPPUAHT-RYUDHWBXSA-N 297.420 2.051 10 20 CECD CN(CC(=O)N1CCCC1)Cc1cc(Cl)ccc1O 132700008 IGCBDUMWKSREFT-UHFFFAOYSA-N 282.771 2.100 10 20 CECD COc1ccc(CN[C@H](CO)CC2CCC2)c(O)c1OC 894168099 SDBQSHBGPCXOJJ-ZDUSSCGKSA-N 295.379 2.050 10 20 CECD COc1ccc(CNC(=O)C(C)(C)C(F)F)c(O)c1 794378669 VPEVJADVGHWJRO-UHFFFAOYSA-N 273.279 2.308 10 20 CECD OCC[C@H]1CCC[C@H]1NCc1ccc2c(c1)CCO2 189985559 VYIHFUHXRYLIHP-UKRRQHHQSA-N 261.365 2.262 10 20 CECD C[C@H]1CN(Cc2c(O)cccc2Br)CCO1 707134669 JMWZIVIRXKIQSD-VIFPVBQESA-N 286.169 2.375 10 20 CECD CCc1cccc(CN[C@@H](CCO)C(C)C)c1O 691483480 PJWMSQAYUAWGBX-AWEZNQCLSA-N 251.370 2.451 10 20 CECD CC1(C)C[C@H](C(=O)NCc2ccccc2O)CCO1 1182026276 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C[C@@H]1C[C@H](NCc2ccc(N(C)C)cc2)CN1C1CC1 122328349 DVCJRSVYSXVPTC-HIFRSBDPSA-N 273.424 2.467 10 20 CECD CN1CCN(Cc2cc(F)cc(F)c2O)CC1(C)C 708402157 VCHAPXBPZOPPAW-UHFFFAOYSA-N 270.323 2.196 10 20 CECD CO[C@@H]1CCCN(Cc2cc3c(cc2O)OCO3)CC1 378628094 CFNBYYPGXZNZAI-GFCCVEGCSA-N 279.336 2.122 10 20 CECD CCC[C@@](C)(NCc1ccc2c(c1)CCO2)C(=O)OC 111246846 MASJVOZRLPYVNB-MRXNPFEDSA-N 277.364 2.443 10 20 CECD O=C(O)[C@@H]1[C@H]2CCC[C@H]2CN1Cc1ccccc1O 300006434 WMYDXHOLOBUQMB-JKOKRWQUSA-N 261.321 2.077 10 20 CECD COCCN1CCC(N[C@@H](C)c2ccccc2O)CC1 183448858 VBKKIGXBIHAZTI-ZDUSSCGKSA-N 278.396 2.154 10 20 CECD CCNC(=O)CN(c1ccc(OC)cc1)[C@@H](C)C1CC1 121200142 WJUWWNNCXPGBFR-LBPRGKRZSA-N 276.380 2.436 10 20 CECD COc1ccc(O)c([C@H](C)N[C@H]2CCN(C(C)C)C2=O)c1 182435963 ZYDGHQRSWPXDDU-FZMZJTMJSA-N 292.379 2.061 10 20 CECD O=C(O)c1ccc2c(c1)CCN2C(=O)/C=C/c1cccnc1 314218383 ALPZZFHHEYDZQY-ZZXKWVIFSA-N 294.310 2.382 10 20 CECD CC[C@@H]1COCCN1Cc1ccc(N2CCOCC2)cc1 91980816 OMZJMFIEOJLNEJ-MRXNPFEDSA-N 290.407 2.134 10 20 CECD COCCN(C)C(=O)NCc1c(C)c2ccccc2n1C 350089533 BJEVAMFZNCVZAE-UHFFFAOYSA-N 289.379 2.275 10 20 CECD Cc1nc(C)c(CNC(=O)NCc2ccccc2O)s1 266551701 LPVCQGKPZUOXGX-UHFFFAOYSA-N 291.376 2.465 10 20 CECD O=C(c1cccc(O)c1O)N1CCC([C@@H]2CCCO2)CC1 276364412 ZLPOIEALNZJSPL-AWEZNQCLSA-N 291.347 2.129 10 20 CECD Cc1nccn1CCN[C@@H](C)c1cc([N+](=O)[O-])ccc1O 273594187 QBRWFHWDBOQOFJ-JTQLQIEISA-N 290.323 2.156 10 20 CECD COc1c([N+](=O)[O-])ccc(CN(C)C2CCC2)c1O 278141908 BAFWFNFVPHVNMB-UHFFFAOYSA-N 266.297 2.293 10 20 CECD Cc1ccc([C@H](C)NCC2(CO)CCOCC2)c(O)c1C 273447786 FLNIGMDDPVCETR-AWEZNQCLSA-N 293.407 2.449 10 20 CECD Cc1ccc(C(=O)N[C@H]2CCO[C@H](C(C)C)C2)c(O)c1O 272909350 CVNDAMNVSGZSPF-AAEUAGOBSA-N 293.363 2.340 10 20 CECD COc1ccc(CN[C@@H]2CCC(=O)NC23CCC3)cc1C 282937525 XAXGPECWJOMATM-OAHLLOKOSA-N 288.391 2.295 10 20 CECD C[C@H](NCCCCCO)c1cc([N+](=O)[O-])ccc1O 280144167 REQPOZNIZOOKKE-JTQLQIEISA-N 268.313 2.114 10 20 CECD CC(=O)NCCCN[C@H](C)c1c(C)cc(C)cc1O 284160607 PVIDIRKHYSSQQX-GFCCVEGCSA-N 264.369 2.186 10 20 CECD CC(C)(CN[C@@H]1CCc2cccc(O)c21)N1CCOCC1 295829031 DVMMAGBXRQTERY-CQSZACIVSA-N 290.407 2.080 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@H](OC)C2CC2)c1 293647294 HOKXJVVQKBVGHV-BMIGLBTASA-N 293.363 2.254 10 20 CECD C[C@@H](N[C@@H]1CCCNCC1)c1ccc(F)cc1O 817969763 ZLZQUPNUVPISOF-ZYHUDNBSSA-N 252.333 2.324 10 20 CECD COC[C@@H](O)CNc1ccccc1OC[C@@H]1CCCCO1 819423269 AKTQVGJVLZMCOB-KBPBESRZSA-N 295.379 2.054 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)S(=O)(=O)C1(C)CC1 820782663 SPZRUKRMAQVWQN-UHFFFAOYSA-N 296.436 2.457 10 20 CECD CC[C@@H](CO)N(C)Cc1cccc(Br)c1O 824533161 BLPVZQYJMDYGPS-JTQLQIEISA-N 288.185 2.357 10 20 CECD CC(=O)c1cc(Cl)cc(CN(C)C[C@H](C)C(=O)O)c1O 825946858 TWFGTYBZIYJGIC-QMMMGPOBSA-N 299.754 2.401 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)c1nccnc1C 827955488 JAJOHOQXDSSQBF-UHFFFAOYSA-N 284.363 2.089 10 20 CECD CC[C@@H](NCc1c(O)ccc(Cl)c1F)[C@@H](C)O 824921445 LYIQJHCCTGADPP-GMSGAONNSA-N 261.724 2.434 10 20 CECD COc1ccc(O)c(CNC(=O)[C@@H](C)OCC(C)C)c1 734016338 JTADDIZFJLLTMI-LLVKDONJSA-N 281.352 2.078 10 20 CECD O=C(O)/C=C\c1ccc(N2CC(C(F)F)C2)c([N+](=O)[O-])c1 833195961 KQWBMPNZYSUMIO-RQOWECAXSA-N 298.245 2.394 10 20 CECD Oc1c(Cl)cccc1CN[C@H]1CC12CCNCC2 841079326 MDBHVIXMOZKUOL-LBPRGKRZSA-N 266.772 2.277 10 20 CECD C[C@@H]1C[C@@H](CN2CCCc3cc(CN)ccc32)CCN1 843058192 OFRIANREGZQVIK-HIFRSBDPSA-N 273.424 2.286 10 20 CECD O=C(NCc1cc(Cl)ccc1O)[C@H]1CCCOC1 846472143 HNRRJSBUMODGBJ-VIFPVBQESA-N 269.728 2.088 10 20 CECD CCc1cccc(CN(C)CCc2cnccn2)c1O 848901652 YXJKKNMTPVDJQN-UHFFFAOYSA-N 271.364 2.419 10 20 CECD Oc1c(Cl)cccc1CN1CC[C@@]2(CCCN2)C1 841105645 VFLGDPBHFOPAES-AWEZNQCLSA-N 266.772 2.374 10 20 CECD COc1cccc([C@H](C)N[C@H](C)C[C@@H](C)O)c1O 846163035 KGXWMBKHWIZUAI-MXWKQRLJSA-N 253.342 2.211 10 20 CECD CC(=O)c1cc(Cl)cc(CN2CCNC[C@H]2C)c1O 843347781 MAPIIWXVTWOKLE-SECBINFHSA-N 282.771 2.042 10 20 CECD CCC[C@H](O)CN[C@@H](C)c1cccc(OC)c1O 846142551 ARFPAZMPILBKDD-QWRGUYRKSA-N 253.342 2.212 10 20 CECD Nc1ccc(CCNC(=O)CC[C@@H](N)c2ccccc2)cc1 841847929 NDJVEIXWXPALQQ-QGZVFWFLSA-N 297.402 2.408 10 20 CECD Cc1cc(N(C)C)ccc1CN1CC[C@H](C)[C@@H](CN)C1 841099570 MEQGGSQAESGADI-BBRMVZONSA-N 275.440 2.478 10 20 CECD C[C@@H]1CN(C(=O)c2cccc(O)c2O)CC2(CCCC2)O1 844115326 MJOXLWIUXWEKCM-LLVKDONJSA-N 291.347 2.272 10 20 CECD CCc1nncn1CCN[C@@H](C)c1cc(C)ccc1O 756621884 UGXAGCMLBJWTMR-LBPRGKRZSA-N 274.368 2.205 10 20 CECD CC(C)(C)n1nccc1NC(=O)c1cccc(O)c1O 856280341 OTZXYRPHLUAWMX-UHFFFAOYSA-N 275.308 2.302 10 20 CECD CN(C)c1cc(F)c(CNCC2(N(C)C)CC2)cc1F 858178827 APKMGMAHRQYSQQ-UHFFFAOYSA-N 283.366 2.215 10 20 CECD COC(=O)c1ccc(O)c([C@@H](C)NC[C@@H](O)CC(C)C)c1 756496341 GOKCJXPXMMQYRB-YPMHNXCESA-N 295.379 2.236 10 20 CECD C[C@@H](CSc1ncc(Cl)s1)S(C)(=O)=O 850001564 JQZKMPQJRWWDNW-YFKPBYRVSA-N 271.816 2.322 10 20 CECD Cc1cc(C(=O)N2CC(F)C2)c(C)n1-c1ccccn1 753072402 ITCPUMROSGACRP-UHFFFAOYSA-N 273.311 2.283 10 20 CECD COCC[C@](C)(O)CN[C@H]1C[C@@H](C)c2c(F)ccc(O)c21 756583612 CIMWWDOKVZLHDL-XAGWURHQSA-N 297.370 2.457 10 20 CECD CC[C@@H](C)[C@H](OC)C(=O)NCc1cc(C)ccc1O 862755430 GXIJHMYVVDACBW-RISCZKNCSA-N 265.353 2.378 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C[C@@]1(OC)CCOC1 876522510 SWFPLRFZIKUGIE-KRWDZBQOSA-N 292.423 2.380 10 20 CECD CCc1cccc(CN[C@@H](C)[C@@H](O)C(F)(F)F)c1O 877693778 QSEQFLOBQWCHAQ-QPUJVOFHSA-N 277.286 2.356 10 20 CECD Cc1ccc(CN2CCC[C@@H](C3OCCO3)C2)c(O)c1 876679060 BDBMAIKSDPIDGI-CQSZACIVSA-N 277.364 2.286 10 20 CECD Cc1cccc(O)c1CN(CCCO)CC(F)(F)F 876684149 BBGYORCUJKTKHO-UHFFFAOYSA-N 277.286 2.447 10 20 CECD Cc1cc(N(C)C)ccc1CNS(=O)(=O)C1CCC1 881903382 MYSXWTSBVRFTLS-UHFFFAOYSA-N 282.409 2.033 10 20 CECD CN(C)c1ccc(CN[C@H](CCO)C(F)(F)F)cc1F 886371249 HUXYADAGPGGXAX-GFCCVEGCSA-N 294.292 2.295 10 20 CECD COc1ccc(CN[C@@H]2CCC[C@H]2CCO)c(O)c1OC 893721545 SVWPEPUMAUCUKR-WCQYABFASA-N 295.379 2.050 10 20 CECD COc1ccc(CN2CCC[C@H]2C[C@H](C)O)c(O)c1OC 892064892 GADYYOKTUVVTOB-AAEUAGOBSA-N 295.379 2.145 10 20 CECD COc1cc(C)cc(CNC[C@@H](C)C[C@@H](C)O)c1O 894291818 FLPJJUQKRJTDMK-NWDGAFQWSA-N 267.369 2.206 10 20 CECD COc1ccc(O)c(C(=O)NCc2ccccc2O)c1 133764500 VZVUZLKUXXHUFP-UHFFFAOYSA-N 273.288 2.036 10 20 CECD COc1ccc(CNC(=O)[C@H]2CCC(=O)C[C@@H]2C)c(O)c1 794373840 NBNVFWYBEBYVAY-HZMBPMFUSA-N 291.347 2.022 10 20 CECD CCOc1nccnc1NCc1ccc(OC)cc1O 795290993 ZYYLGYXMCZMCKM-UHFFFAOYSA-N 275.308 2.202 10 20 CECD COCCN1CC[C@@H](N[C@H](C)c2cc(C)ccc2O)C1 273610457 VRMBGPUWSRLMCM-ZIAGYGMSSA-N 278.396 2.072 10 20 CECD COc1ccc(N(C)CCN(C)CC(=O)OC(C)C)cc1 1327224605 SHFJTMGLJUJMLU-UHFFFAOYSA-N 294.395 2.015 10 20 CECD COc1ccc(N(CCOCCO)C(C)C)cc1F 172622969 LRLCRKPWDKUFKP-UHFFFAOYSA-N 271.332 2.058 10 20 CECD CC[C@](C)(O)CNCc1c(O)cccc1Br 706883700 VXDNCTPCRCFPGE-LBPRGKRZSA-N 288.185 2.405 10 20 CECD CO[C@@H](C)CNCc1c(O)cccc1Br 706846431 ICIPTIRILCNQQB-QMMMGPOBSA-N 274.158 2.279 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)C[C@@H](N)C(C)(C)C)c1 1340967222 MFBPWKYBARVZRK-QMTHXVAHSA-N 294.395 2.342 10 20 CECD Cn1ccnc1[C@H]1N(C(=O)c2cc(O)cs2)CC1(C)C 1350424649 XKHALUKJYBKYLC-LLVKDONJSA-N 291.376 2.411 10 20 CECD CN(C)c1ccc(CNC(=O)NCCC(F)F)cc1F 1523726438 PKKHEYDEFKWKKE-UHFFFAOYSA-N 289.301 2.346 10 20 CECD C[C@@H](CN(C)Cc1c(O)ccc(Cl)c1F)C(=O)O 1604158635 HNPFAEKISHLDQO-ZETCQYMHSA-N 275.707 2.337 10 20 CECD Oc1cc(Cl)ccc1CN[C@]12CCC[C@H]1NCC2 1580888562 QDPBSEDNOCMJBY-KGLIPLIRSA-N 266.772 2.420 10 20 CECD CCOc1cccc(CNCCCn2ccnc2)c1O 20506275 QQHGLXLYTKLDNY-UHFFFAOYSA-N 275.352 2.167 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1cnsn1 846838031 VHEJGLQJGSQGKI-UHFFFAOYSA-N 276.365 2.003 10 20 CECD COc1cc(Cl)cc(CN[C@@H]2CCN(C3CC3)C2)c1O 228673565 PQFOIKVLPRPVEL-GFCCVEGCSA-N 296.798 2.381 10 20 CECD COc1cccc(CNCC2(OC)CCCC2)c1O 289461878 OLQLLKIFQQAKTA-UHFFFAOYSA-N 265.353 2.450 10 20 CECD C[C@H](N[C@H]1CC[C@@H](CO)C1)c1cc(F)ccc1O 296500253 PAULLJUNIYTUPK-UMNHJUIQSA-N 253.317 2.343 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](C)C[C@@H](C)O)c1 185521190 UREYOKZFOMPGCO-UTUOFQBUSA-N 267.369 2.458 10 20 CECD CCc1cccc(CN[C@H](C)[C@@H](CO)SC)c1O 709456727 SZWLMVMWPYXEKN-ZWNOBZJWSA-N 269.410 2.157 10 20 CECD Cn1cnnc1C1CCN(Cc2cc(F)ccc2O)CC1 179940274 UXBKIDFGUIINEV-UHFFFAOYSA-N 290.342 2.039 10 20 CECD COC(=O)[C@H](NCc1cc(F)cc(C(C)=O)c1O)C(C)C 119231621 KIFUNQFVZRBXCH-CYBMUJFWSA-N 297.326 2.021 10 20 CECD Cc1ccc(C(=O)NCCOCCC(C)C)c(O)c1O 179458714 SQRZKJWDPSFXGB-UHFFFAOYSA-N 281.352 2.199 10 20 CECD COc1cccc(CNC(=O)CCC(F)(F)F)c1O 175928585 AJRRPXREERQOKK-UHFFFAOYSA-N 277.242 2.360 10 20 CECD C[C@H](NCc1cc(Br)ccc1O)C(C)(C)O 381206243 GGPFNWPKRPKYDJ-QMMMGPOBSA-N 288.185 2.404 10 20 CECD Cc1cc(C(=O)NCCCO)c(C)n1-c1ccc(F)cc1 97176690 IHKNFPUUMKDGEX-UHFFFAOYSA-N 290.338 2.345 10 20 CECD Cc1cc(C)c(C(=O)NCCc2ccc(O)c(O)c2)o1 269219185 QJTLFBHDUIBQDT-UHFFFAOYSA-N 275.304 2.280 10 20 CECD CCC[C@H](O)CN[C@H](C)c1ccc(N2CCOCC2)cc1 268893807 OOGGHFAPMSDMHX-PBHICJAKSA-N 292.423 2.335 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)c(F)c2)[C@@H]1CO 276747754 LIUHBYCGGRJQAB-IAQYHMDHSA-N 266.360 2.094 10 20 CECD CCN(C)c1ccc([C@H](C)NC[C@@]2(O)CCO[C@@H]2C)cc1 278932314 XPWCQUZCXOAYEZ-VBQJREDUSA-N 292.423 2.333 10 20 CECD CCC(O)(CC)CCNCc1cc(OC)c(OC)cc1O 276413671 PVGZHZJIZSNQBT-UHFFFAOYSA-N 297.395 2.440 10 20 CECD C[C@H]1Oc2ccccc2[C@H]1NC(=O)c1cccc(O)c1O 365676777 OMSCJFPKLBGOAP-OTYXRUKQSA-N 285.299 2.350 10 20 CECD CC[C@@H](CNCc1ccc(N(C)C)c(F)c1)OC 289795110 LTLXLMMCJAXAAM-LBPRGKRZSA-N 254.349 2.406 10 20 CECD CCC[C@@H](C)C(=O)NCCNCc1ccc2c(c1)CCO2 292803992 VVEFWUNOAPUNQK-CYBMUJFWSA-N 290.407 2.264 10 20 CECD CCn1nncc1C(=O)NCc1c(C)c2ccccc2n1C 646121496 KKMQXNOVAWHTEH-UHFFFAOYSA-N 297.362 2.028 10 20 CECD CCN(CC)c1ccc(CN(C)C(=O)[C@H](O)C2CC2)cc1 819975234 ZTEWDSIEVDMBJJ-MRXNPFEDSA-N 290.407 2.262 10 20 CECD CCn1nc(C)c(CNCc2cc(C)c(C)cc2O)n1 818221004 MDOYPYWLNFOVNE-UHFFFAOYSA-N 274.368 2.219 10 20 CECD C[C@@H]1CCNCC[C@H]1NCc1ccc(N(C)C)c(F)c1 817900634 PCNBIEYBQFFDSV-IUODEOHRSA-N 279.403 2.369 10 20 CECD COC(=O)c1cnc(SC[C@@H]2COC(C)(C)O2)s1 829681109 NYRSEVVXRNWYNS-ZETCQYMHSA-N 289.378 2.173 10 20 CECD CCc1nnc(NC(=O)/C=C\c2ccc(O)c(O)c2)s1 588408092 KSZHPNQJSGZAJU-XQRVVYSFSA-N 291.332 2.164 10 20 CECD C[C@@H](NC(=O)C1CCC(O)CC1)c1ccccc1O 827946974 WQJHAXDYFXXVGT-VOMCLLRMSA-N 263.337 2.121 10 20 CECD CCCOc1ccc(CNC[C@H](F)C(=O)O)cc1C 904042403 DHDBIWNDERWIOQ-LBPRGKRZSA-N 269.316 2.296 10 20 CECD O=C(/C=C\c1ccc(O)c(O)c1)Nc1ccc(F)nc1 588408371 XLLRYOCYEMEKDL-KXFIGUGUSA-N 274.251 2.284 10 20 CECD CC(C)[C@@H]1OCCC[C@@H]1C(=O)NCc1ccc(O)cc1O 910944039 JTJXPXPFQOCVBI-ZFWWWQNUSA-N 293.363 2.165 10 20 CECD C[C@H](Cc1ccncc1)NCc1cc([N+](=O)[O-])ccc1O 749293717 DTZONCZUIFATAT-LLVKDONJSA-N 287.319 2.416 10 20 CECD CCc1cccc(CN2C[C@H](C)O[C@]3(CCOC3)C2)c1O 848908083 MRKSVAVDTTWLQI-SUMWQHHRSA-N 291.391 2.334 10 20 CECD CC(C)[C@H](C(=O)O)C(=O)NCc1cc(Cl)ccc1O 911332575 YLRYRZZIYVEISM-NSHDSACASA-N 285.727 2.019 10 20 CECD Cc1ccc(C(=O)NC2CC3(CCC3)C2)c(O)c1O 846607525 NGLRKPIDHRIFAE-UHFFFAOYSA-N 261.321 2.469 10 20 CECD CN(Cc1c(O)ccc2ccncc12)C[C@@H]1CCOC1 749966098 JBKWPPGEXYGCMI-LBPRGKRZSA-N 272.348 2.409 10 20 CECD CCc1cccc(CN(C)C2CCN(OC)CC2)c1O 848914114 DTOVWRDTQWFCPH-UHFFFAOYSA-N 278.396 2.412 10 20 CECD CCN(C)c1ccc(CN(C)[C@H]2CCC(=O)N(C)C2)cc1 846921292 RRLJIWISUIVMQL-INIZCTEOSA-N 289.423 2.195 10 20 CECD C[C@@H](NCC[C@]1(O)CCCOC1)c1cc(F)ccc1O 846214133 SKEUTHVDMOFDAV-IAQYHMDHSA-N 283.343 2.114 10 20 CECD C[C@H](NC(=O)[C@@H]1CCC(=O)C1)c1ccc(N(C)C)cc1 843859090 UVBRXGDFGLBUOM-WCQYABFASA-N 274.364 2.299 10 20 CECD CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(Cl)cc1O 841745313 XHHWYAKLABWUSS-RKDXNWHRSA-N 270.760 2.221 10 20 CECD COc1cc(C)cc(CN2CCOC[C@H](C)C2)c1O 754749255 ZPSJSQUPPDFLEE-GFCCVEGCSA-N 265.353 2.178 10 20 CECD CCOC(=O)[C@]1(C)CCC[C@@H]1NC(=O)c1cc(O)cs1 856303603 LOHXEOQKXVVNSE-SMDDNHRTSA-N 297.376 2.305 10 20 CECD C[C@@H](NC/C=C\CO)c1cc2c(cc1O)CCCC2 850510214 VWMHHDAPCRPLIT-QMAVJUDZSA-N 261.365 2.470 10 20 CECD COCC[C@@H](C)NCc1ccc(N2CCC(O)CC2)cc1 850566147 KBFAAHCFJIINBE-CQSZACIVSA-N 292.423 2.162 10 20 CECD O=C(NCc1ccc(N2CCC(O)CC2)cc1)C1CCC1 856208328 MSTORESEGUULCY-UHFFFAOYSA-N 288.391 2.064 10 20 CECD CCn1cc(C(=O)NCCc2ccc(N)cc2)c(C2CC2)n1 867964469 ZIVTWIAIISGFPF-UHFFFAOYSA-N 298.390 2.335 10 20 CECD CCN(CC)C(=O)CN(C)Cc1c(C)cccc1O 876511372 GSWDHSFAYWLICM-UHFFFAOYSA-N 264.369 2.001 10 20 CECD CC1(NC(=O)NCCCSc2nccs2)CC1 1116264663 OZJCOHHEZLXNCL-UHFFFAOYSA-N 271.411 2.477 10 20 CECD CCOC(=O)N[C@H](C(=O)N(C)c1ccc(N)cc1)C(C)C 877080438 IVZSSASFGHXAED-ZDUSSCGKSA-N 293.367 2.002 10 20 CECD Cc1cccc(O)c1CN1C[C@H](C)O[C@]2(CCCOC2)C1 877494286 JIMNXBDMZQKYKV-WMLDXEAASA-N 291.391 2.471 10 20 CECD Cc1cc(NC(=O)[C@@H](C)N[C@H](C)c2ccccc2O)on1 879649312 QILPLDACNGOXCK-GHMZBOCLSA-N 289.335 2.366 10 20 CECD Cc1cocc1C(=O)NC[C@H](N)c1ccc(N(C)C)cc1 876507145 WORKRFOHRYTHDY-HNNXBMFYSA-N 287.363 2.084 10 20 CECD C[C@@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)C1CC1 779498754 JRXJKDXPBJEFAQ-NXSJDDFASA-N 261.321 2.273 10 20 CECD C/C=C/C[C@H](CO)NCc1cc(F)cc(F)c1O 883090223 FIIXJAWEGHPJLJ-KXMPLOMGSA-N 257.280 2.087 10 20 CECD C[C@@H](NCCC(=O)Nc1cccnc1)c1ccccc1O 879648853 CMJGFSKFGAXFFM-GFCCVEGCSA-N 285.347 2.467 10 20 CECD Cc1ccc(CN2CCc3ccccc3[C@@H]2C(N)=O)c(O)c1 876651240 SJCJCBDQXBUKGL-QGZVFWFLSA-N 296.370 2.285 10 20 CECD COc1ccc(CNCCNC(=O)C2CCCC2)cc1C 1122486662 MUZIPNSPRCNLAP-UHFFFAOYSA-N 290.407 2.400 10 20 CECD COc1cccc(NC(=O)c2c(F)ccc(O)c2O)c1 789939794 TVLCGBACLYKHGD-UHFFFAOYSA-N 277.251 2.498 10 20 CECD CCOc1nccnc1NCc1cccc(OC)c1O 781388131 ZCUWJKUWJUUSGX-UHFFFAOYSA-N 275.308 2.202 10 20 CECD O=[N+]([O-])c1cnc(Sc2nnc3ccccn23)s1 799924049 HJRWXXLKCIYFJP-UHFFFAOYSA-N 279.306 2.245 10 20 CECD COc1ccc(O)c(CNC[C@@H]2C[C@H](C)O[C@@H]2C)c1 686511662 HBJLKSIBUQRNDP-TUAOUCFPSA-N 265.353 2.304 10 20 CECD Oc1c(F)cc(F)cc1CNCCOC(F)(F)F 708494398 IFTQHJGJVIVRNY-UHFFFAOYSA-N 271.185 2.296 10 20 CECD CC[C@@H](NC(=O)/C=C\c1ccc(O)c(O)c1)C(F)F 1330676650 JRTWTBGDHPJIDA-XTULLQBASA-N 271.263 2.271 10 20 CECD CO[C@H]1CCC[C@H]1C(=O)NCc1cc(Cl)ccc1O 1337284889 XULUWBIUETUKBW-YPMHNXCESA-N 283.755 2.477 10 20 CECD c1csc(SCc2cncc(-c3nn[nH]n3)c2)n1 1607136548 JSUUQWOFBQPRDO-UHFFFAOYSA-N 276.350 2.011 10 20 CECD C[C@@H](NC(=O)[C@H](CN)c1ccccc1)c1ccccc1O 1579405893 HTPIEUMOTOZSIM-IUODEOHRSA-N 284.359 2.312 10 20 CECD CCn1nccc1CN1CCCc2cc(CN)ccc21 843058650 ZFJACDXEXMCZRN-UHFFFAOYSA-N 270.380 2.315 10 20 CECD CCC[C@H]1CN(Cc2cc(OC)c(OC)cc2O)CCO1 160508266 SUAZNUMZNKQCIS-ZDUSSCGKSA-N 295.379 2.410 10 20 CECD CCCC[C@H](NCc1cc(F)ccc1O)C(=O)OC 154566451 WHHNFODDGNJQLS-LBPRGKRZSA-N 269.316 2.353 10 20 CECD Cc1ccc([C@@H](C)NCCO[C@@H]2CCOC2)c(O)c1 927079113 DMCMBUJNOGEORA-CHWSQXEVSA-N 265.353 2.157 10 20 CECD COc1cccc(O)c1CN[C@@H]1CS[C@H](C)C1 840957853 GKJPUTWIOZGMQQ-ZJUUUORDSA-N 253.367 2.384 10 20 CECD COc1ccc(O)c(CNC[C@@H](O)c2ccsc2)c1 224858706 MFMNRSGEMFCTTK-CQSZACIVSA-N 279.361 2.286 10 20 CECD COc1ccc(CNCCCC(=O)NC2CC2)cc1C 112346385 IPSDRYSPHCGGNW-UHFFFAOYSA-N 276.380 2.152 10 20 CECD C[C@H](NCC(=O)N1CCCC1)c1ccc(N(C)C)cc1 228796292 BJHGUZBANGYKPC-ZDUSSCGKSA-N 275.396 2.026 10 20 CECD COC(=O)CCCN[C@H](C)c1ccc(N(C)C)cc1 37416448 UGNNVILOQRIYGS-GFCCVEGCSA-N 264.369 2.356 10 20 CECD CC1CCN(CCNCc2ccc3c(c2)CCO3)CC1 40445342 RHJHLPKLPYVCQN-UHFFFAOYSA-N 274.408 2.443 10 20 CECD CCN(Cc1ccc(N(C)C)cc1)C(=O)CCCCN 70202492 SVTGLWGFRKTTGG-UHFFFAOYSA-N 277.412 2.230 10 20 CECD C[C@H]1CC[C@H](C(=O)O)CN1Cc1ccc(N(C)C)cc1 397048453 QDCANELPCFDMRJ-JSGCOSHPSA-N 276.380 2.438 10 20 CECD C[C@H]1C[C@H](C(=O)O)CN(Cc2cc(F)ccc2O)C1 398830134 HEZBHUGZPMUYKJ-ONGXEEELSA-N 267.300 2.074 10 20 CECD C[C@@H](C(=O)O)N(Cc1ccc(Cl)cc1O)C1CC1 1588596185 CUPWSTKXVMNSHE-QMMMGPOBSA-N 269.728 2.483 10 20 CECD C[C@@H](NCCCN1CCOCC1)c1cc(Cl)ccc1O 184837865 DJNCOMLANWYTQF-GFCCVEGCSA-N 298.814 2.419 10 20 CECD Cc1n[nH]cc1CNCc1cc(Cl)ccc1O 38011177 GGNAFPXQSJWIER-UHFFFAOYSA-N 251.717 2.367 10 20 CECD CC(=O)c1cc(F)cc(CN(C)c2cnn(C)c2)c1O 175715201 CVZDCMBRGGFOGS-UHFFFAOYSA-N 277.299 2.104 10 20 CECD COc1cccc(CN2C[C@@H](N)[C@H](c3ccccc3)C2)c1O 328461473 HJVAWEQBRWPUDX-JKSUJKDBSA-N 298.386 2.328 10 20 CECD Nc1ccc(CC(=O)Nc2cccc(CC(=O)O)c2)cc1 87845514 ANTHKWIXENHJNM-UHFFFAOYSA-N 284.315 2.077 10 20 CECD COc1cccc(CN(C)[C@@H]2CCSC2)c1O 130587773 FKULEOPDTJDUIW-LLVKDONJSA-N 253.367 2.338 10 20 CECD COc1cccc(CNC[C@@H]2CCCCO2)c1O 42812117 BRRZWYXEGNDLFC-LBPRGKRZSA-N 251.326 2.060 10 20 CECD CCOC[C@H](O)COc1ccc(N2CCCC2)cc1 193829636 NKXSOFGJAQJAMH-AWEZNQCLSA-N 265.353 2.063 10 20 CECD COc1ccncc1CNCc1cccc(C)c1O 293796881 CYLHHWVSNWWLHP-UHFFFAOYSA-N 258.321 2.394 10 20 CECD CCOc1ccc(O)c(CN2CC([C@H]3CCOC3)C2)c1 368443161 SFENKAXIXBOBJV-LBPRGKRZSA-N 277.364 2.259 10 20 CECD CN1CC[C@H]2CCN(Cc3cccc(F)c3O)[C@@H]2C1 272259473 AMCHDPVRHSUXIO-SMDDNHRTSA-N 264.344 2.057 10 20 CECD CO[C@@H](C)CN(C)Cc1cc(F)cc(C(C)=O)c1O 285626995 KQBWNNXHICDQHB-VIFPVBQESA-N 269.316 2.201 10 20 CECD COc1ccc(O)c(CNC[C@@H]2CCOC[C@H]2C)c1 289195506 AZXKMAQSBZEMEN-NEPJUHHUSA-N 265.353 2.163 10 20 CECD CCN(CC)c1ccc(CN[C@]2(C)CCOC2=O)cc1 289945963 XCLPUAFJROGDOF-MRXNPFEDSA-N 276.380 2.328 10 20 CECD CCN(Cc1cc(Cl)cc([N+](=O)[O-])c1O)[C@H](C)CO 292831777 RGYIAOOCXKLTPQ-MRVPVSSYSA-N 288.731 2.157 10 20 CECD CNC(=O)OC[C@H]1CCCCN1Cc1ccccc1O 809779104 DJDPQLIZZYWPSN-CYBMUJFWSA-N 278.352 2.103 10 20 CECD COC(=O)c1cnc(S[C@H](C(=O)OC)C(C)C)s1 295142567 DHELDWIAXOHYOI-QMMMGPOBSA-N 289.378 2.219 10 20 CECD C[C@H]1CCCCN(C(=O)c2c(F)ccc(O)c2O)C1 295093976 ZSPBUEWSMHRMPN-VIFPVBQESA-N 267.300 2.499 10 20 CECD CC[C@H](NC[C@@]1(COC)CCCN1)c1ccc(F)cc1O 817973985 HXUAYHGURKGTMC-GOEBONIOSA-N 296.386 2.341 10 20 CECD C[C@@H](NC[C@H](N)c1ccc(N(C)C)cc1)C1CCOCC1 817941456 JVCWJZCDDNWFIC-DYVFJYSZSA-N 291.439 2.157 10 20 CECD Cc1ncc2n1C[C@@H](C(=O)N[C@H](C)c1ccccc1O)CC2 827946224 AUXFTZUGNQXXFG-YPMHNXCESA-N 299.374 2.337 10 20 CECD Cc1cc(N(C)C)ccc1CNC(=O)CCCF 827956025 NHROSCQIYSMSJI-UHFFFAOYSA-N 252.333 2.427 10 20 CECD CCN(CC(=O)N[C@H](C)c1ccccc1O)C1CC1 827941648 URVUTPCALKDKST-LLVKDONJSA-N 262.353 2.054 10 20 CECD COc1cc(CN2CCC[C@H](CC(=O)O)C2)c(O)cc1C 820763910 LPYIKEOAZULKBN-GFCCVEGCSA-N 293.363 2.396 10 20 CECD CCN(CC)c1ccc(CN[C@@H](C)C(=O)O)cc1F 739415438 VKPQKFMEJKLLFK-JTQLQIEISA-N 268.332 2.235 10 20 CECD COc1cccc(O)c1CN[C@@H]1Cc2ccccc2[C@H]1N 904461635 KZRQRIUXCPCMBA-RHSMWYFYSA-N 284.359 2.115 10 20 CECD COc1cccc(O)c1CNCCCCN(C)C1CC1 835063525 ZRGPCTVLIDZIGE-UHFFFAOYSA-N 278.396 2.365 10 20 CECD CN1CCC[C@@]2(CCN(C(=O)c3cc(O)cs3)C2)C1 832870505 LZGCXRPZIPLMKF-CQSZACIVSA-N 280.393 2.012 10 20 CECD C[C@H](N[C@@H](C)C(C)(C)O)c1cc(F)cc(F)c1O 903390725 HHZQTKMQXLGUDM-YUMQZZPRSA-N 259.296 2.480 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H](C(C)(C)O)C2)c(O)c1O 832472235 IXNWIHHBOKOAEA-LLVKDONJSA-N 293.363 2.029 10 20 CECD CCN(C)c1ccc(CN2CCC(CO)CC2)cc1 741753882 DJZWKKYCFPVYHP-UHFFFAOYSA-N 262.397 2.347 10 20 CECD CO[C@@H](CNC(=O)/C=C\c1ccc(O)c(O)c1)CC(C)C 841446597 VBRHGHUCMMVPCG-SCXUMTSISA-N 293.363 2.288 10 20 CECD C[C@@H](N)[C@@H]1CCN(Cc2cccc(Br)c2O)C1 843057242 HLDLCABARLOYOP-NXEZZACHSA-N 299.212 2.324 10 20 CECD CO[C@@H](C)CC(=O)NCc1cc(Cl)ccc1O 846471993 DYEIXIVUFNTRHE-QMMMGPOBSA-N 257.717 2.087 10 20 CECD Cc1cc(N(C)C)ccc1CN[C@@H]1CCN(CC(F)F)C1 841897632 HDBXYNIJUOQUTJ-CQSZACIVSA-N 297.393 2.490 10 20 CECD O=C(NCc1ccc(O)cc1O)c1cccnc1C1CC1 910949641 MYNOSAYNTRBHJH-UHFFFAOYSA-N 284.315 2.300 10 20 CECD COC(=O)[C@]1(C)CCCN(Cc2cccc(C)c2O)C1 840975174 MDISRAXANGTZHT-MRXNPFEDSA-N 277.364 2.476 10 20 CECD Oc1ccc2ccncc2c1CN1CC[C@@H](N2CC=CC2)C1 742162979 LLCUTDDZPCOCQH-OAHLLOKOSA-N 295.386 2.387 10 20 CECD O=C1OCCN1CCSc1ncc(Cl)s1 849998345 DQEPINPHONTSNK-UHFFFAOYSA-N 264.759 2.341 10 20 CECD C[C@@H](NCc1nc([C@H]2CCCO2)n[nH]1)c1ccccc1O 848557411 JSOCVNZBEIDQRM-ZWNOBZJWSA-N 288.351 2.213 10 20 CECD CCOc1ccc(CNCC2(C)CCNCC2)c(O)c1 841057076 LRZVEEGWEMEHJL-UHFFFAOYSA-N 278.396 2.270 10 20 CECD COc1cc(C)cc(CN2CCC[C@H](N(C)C)C2)c1O 754732637 RNMRLJYHZFLJBX-AWEZNQCLSA-N 278.396 2.235 10 20 CECD CC1(C)OCC(NCc2cc(Cl)ccc2O)CO1 758012586 RZISCWGVZSLPAE-UHFFFAOYSA-N 271.744 2.287 10 20 CECD Cc1cn(C)nc1C(=O)NCc1cc(Cl)ccc1O 857548819 VSVQIANVJMEKJV-UHFFFAOYSA-N 279.727 2.018 10 20 CECD CO[C@H]1C[C@H](NCc2cc(Cl)c(F)cc2O)C1 862541636 YJOMHXQJVDJVKD-KYZUINATSA-N 259.708 2.452 10 20 CECD CCOC1CN(Cc2c(O)cccc2Br)C1 862388696 HPIVLLMMHAJYEN-UHFFFAOYSA-N 286.169 2.375 10 20 CECD Oc1ccc(Cl)c(F)c1CNC[C@H]1C[C@H](O)C1 873178508 VHPBCCPABMEBFR-ZKCHVHJHSA-N 259.708 2.045 10 20 CECD COc1ccc2c(c1)CCCN2C[C@]1(OC)CCOC1 877180499 NUSCHAYKIXWDBF-MRXNPFEDSA-N 277.364 2.253 10 20 CECD Cc1cc(NC(=O)/C=C/c2ccc(O)c(O)c2)cnc1O 779542191 NBQBTGSFYXNWGP-HWKANZROSA-N 286.287 2.159 10 20 CECD CC(C)c1ncc(S(=O)(=O)Nc2ccc(O)cc2)[nH]1 776744971 CQJCKBXUOWLEKN-UHFFFAOYSA-N 281.337 2.040 10 20 CECD CC[C@H](C)C(=O)NCCNCc1ccc(OC)c(C)c1 1123747013 JARWJIDNZNTHHI-LBPRGKRZSA-N 278.396 2.256 10 20 CECD CCCOc1ccc(CN[C@@H]2C(=O)NCC2(C)C)cc1C 895326749 ZXUGKKGKXYINKE-OAHLLOKOSA-N 290.407 2.398 10 20 CECD Cc1ccc(C(=O)OC[C@@H]2CC[C@H](C)O2)c(O)c1O 789042616 OBDGJWBTPGPZFW-UWVGGRQHSA-N 266.293 2.131 10 20 CECD COC(=O)[C@@H]1CC[C@H](NCc2c(O)cccc2Cl)C1 896125403 PJSKUCGHJHIFAU-ZJUUUORDSA-N 283.755 2.477 10 20 CECD Cc1cc(C)c(C(=O)NCc2ccc(O)c(O)c2)cc1C=O 793689463 MNSSMRXZUSHMFW-UHFFFAOYSA-N 299.326 2.457 10 20 CECD C[C@@H](NC(=O)[C@@H]1CCCCCN1)c1ccccc1O 1349621442 QNWYQRABTSUQOY-YPMHNXCESA-N 262.353 2.102 10 20 CECD Cc1cnc([C@H](C)NC(=O)Cc2ccc(N)cc2)s1 135290256 DRUUTNFLMKFGEB-JTQLQIEISA-N 275.377 2.454 10 20 CECD COc1ccc(CNc2cnccc2C#N)c(O)c1 83409059 DHBLDRVMIKDNRF-UHFFFAOYSA-N 255.277 2.280 10 20 CECD CC[C@@H](CCO)NCc1c(O)cccc1Br 706874971 FMBZTFWJFXTTDW-VIFPVBQESA-N 288.185 2.405 10 20 CECD CCN(CC)c1ccc(CNC[C@H]2C[C@H](O)C2)cc1 720908403 YDPAYENOIFRFGT-KOMQPUFPSA-N 262.397 2.393 10 20 CECD CC[C@@H]1CN(Cc2c(O)cccc2OC)CCO1 768238041 PAZJBZDBVHIYGG-LLVKDONJSA-N 251.326 2.012 10 20 CECD COc1cc(CCO)ccc1NCc1ccc(N)cc1 1336116623 HSZPLUKJEPWOJB-UHFFFAOYSA-N 272.348 2.424 10 20 CECD Cc1nc(C(C)C)ncc1C(=O)NCc1ccc(N)cc1 1346209493 KCUFPBBBKVFEQI-UHFFFAOYSA-N 284.363 2.421 10 20 CECD COC1(C(=O)NCc2cccc(O)c2O)CCCCC1 1528771322 NJMMYCQYNCNPIA-UHFFFAOYSA-N 279.336 2.063 10 20 CECD Cc1ccc(CN2CCSC[C@H]2CC(=O)O)c(O)c1 1600414286 KNZXLQXJXGIAMZ-GFCCVEGCSA-N 281.377 2.093 10 20 CECD COc1ccc(CN[C@H](C)[C@@H](C)NC(=O)C2CC2)cc1C 1755223523 KNWAGFQORGLXKJ-CHWSQXEVSA-N 290.407 2.396 10 20 CECD O=C(O)[C@]1(NCc2ccc3c(c2)CCCO3)CC[C@H]2C[C@H]21 1777600189 RDNXTEJQAAGUMR-QEORTHHSSA-N 287.359 2.355 10 20 CECD COCCN(C)CCCN[C@@H](C)c1ccc(N(C)C)cc1 153745472 BLVWCJJEVIJIKB-HNNXBMFYSA-N 293.455 2.372 10 20 CECD CCc1cccc(CNCCS(=O)(=O)C(C)(C)C)c1O 848898131 YNUDFBYTHDOAMP-UHFFFAOYSA-N 299.436 2.258 10 20 CECD Cc1ccc([C@H](C)NCCO[C@@H]2CCOC2)c(O)c1 927079115 DMCMBUJNOGEORA-QWHCGFSZSA-N 265.353 2.157 10 20 CECD Nc1ccc(NC(=O)N[C@@H]2CCCCC23OCCO3)cc1 841298445 POYCJOGTHPCQKC-CYBMUJFWSA-N 291.351 2.076 10 20 CECD CCOc1cccc(CN[C@@H]2C[C@@H](O)C2(C)C)c1O 128267673 YSWJFDPQFQHZAC-CHWSQXEVSA-N 265.353 2.040 10 20 CECD CC[C@@H]1CN(Cc2cc(OC)ccc2O)[C@H](C)CO1 403831373 QAYXRFAVTWUHGE-DGCLKSJQSA-N 265.353 2.400 10 20 CECD COc1ccc(CN[C@H](C)[C@H]2CCCOC2)c(O)c1 389071620 MINGBMOHPYURNX-YPMHNXCESA-N 265.353 2.306 10 20 CECD C[C@@H]1[C@@H](C(=O)N(C)Cc2ccccc2O)C1(F)F 1123665120 GHYMWMDJNFTOHH-KCJUWKMLSA-N 255.264 2.252 10 20 CECD Oc1cccc(Cl)c1CNCCOC[C@@H]1CCCO1 115624997 JCQVURFQQMKGRW-NSHDSACASA-N 285.771 2.331 10 20 CECD CCN(CC)c1ccc(CNC(=O)[C@@H](C)OC)cc1 55446563 UJEZHZHFVFYJBW-GFCCVEGCSA-N 264.369 2.184 10 20 CECD CN(C)c1ccc2c(c1)OCCN2C(=O)NC(C)(C)C 184205150 DOBKQMSLAPZFGL-UHFFFAOYSA-N 277.368 2.460 10 20 CECD COc1cc(O)c(CN2C[C@H]3[C@@H](C2)C3(C)C)cc1OC 179445111 UBDKTDMMIKBJKC-TXEJJXNPSA-N 277.364 2.497 10 20 CECD CC[C@H]1CN(Cc2cc3c(cc2O)CCC3)CCO1 78896251 LRAASCWFLCLFLP-HNNXBMFYSA-N 261.365 2.492 10 20 CECD C[C@H]1CCC[C@]1(O)CNCc1ccc2c(c1)CCO2 292995095 MOKVDKDILDYBOV-LRDDRELGSA-N 261.365 2.262 10 20 CECD CCOC(=O)C[C@@H]1CCCN1Cc1cccc(OC)c1O 130530460 RVOCVSGAUQISAZ-ZDUSSCGKSA-N 293.363 2.318 10 20 CECD Cc1nnc(NCc2ccc3c(c2)CCN3C)s1 225939653 VCORAQJDYPLREQ-UHFFFAOYSA-N 260.366 2.451 10 20 CECD CCCCn1nccc1NC(=O)Cc1ccc(N)cc1 236957913 RKZDILPBDWBNPY-UHFFFAOYSA-N 272.352 2.447 10 20 CECD CC1(C(=O)NCc2ccc(N3CCOCC3)cc2)CCC1 267340271 JQKWYIGICFZCEL-UHFFFAOYSA-N 288.391 2.330 10 20 CECD CCCN(Cc1ccccc1O)C(=O)c1cnc[nH]1 263997756 FSWLFGYZSBLECU-UHFFFAOYSA-N 259.309 2.168 10 20 CECD COc1ccc(O)c([C@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)c1 273516865 SSHFQHLKPVQLAD-NWDGAFQWSA-N 292.379 2.061 10 20 CECD Cc1ccc(C(=O)N2CCC[C@@H]2[C@H]2CCCO2)c(O)c1O 375975999 SPTALUMAVYUMSQ-CHWSQXEVSA-N 291.347 2.190 10 20 CECD C[C@@](O)(C(=O)NCc1c(O)ccc2c1CCCC2)C1CC1 287389556 RPOMPVDBYAMNNN-KRWDZBQOSA-N 289.375 2.048 10 20 CECD CC[C@H](NCCC1(O)CCOCC1)c1ccccc1O 287308371 DWIWNAICPGEOSX-AWEZNQCLSA-N 279.380 2.365 10 20 CECD CSCC(C)(C)C(=O)NCc1ccc(O)c(O)c1 282644681 ZRHNXAOCKAYXTL-UHFFFAOYSA-N 269.366 2.103 10 20 CECD CN(C)c1ccc(CNCCC2(O)CCC2)cc1F 283883594 HENPYISNMNBXHC-UHFFFAOYSA-N 266.360 2.286 10 20 CECD CC[C@H](C)N(CC(=O)OC)Cc1cc(C)ccc1O 281220890 KIGLHMWUTOCUKX-LBPRGKRZSA-N 265.353 2.474 10 20 CECD O=C(NCc1ccccc1O)c1coc2c1C(=O)CCC2 295276142 OWHFDSFZXZDMDP-UHFFFAOYSA-N 285.299 2.434 10 20 CECD Cn1nc(NC(=O)/C=C/c2ccc(O)c(O)c2)cc1C1CC1 292779272 SUMRDHIXWINCCQ-XVNBXDOJSA-N 299.330 2.361 10 20 CECD O=[N+]([O-])c1cc(Cl)cc(CNCC(F)F)c1O 298159837 SJPIOWMHIOPGCS-UHFFFAOYSA-N 266.631 2.309 10 20 CECD COCC1(NCc2ccc(N(C)C)cc2)CCOCC1 814302646 YAPUAQHQQSYJEN-UHFFFAOYSA-N 278.396 2.038 10 20 CECD CC[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc(N(C)C)cc1 817976891 WMWIPSBYASZLFU-QXSJWSMHSA-N 259.397 2.011 10 20 CECD Oc1cc2c(cc1CN1CCn3cncc3C1)CCCC2 811788027 WIKQHNFXPFPCBG-UHFFFAOYSA-N 283.375 2.483 10 20 CECD CCOc1ccc(O)c(CNCCC(C)(C)C(=O)O)c1 818628897 GAAXHGMCEGOPSI-UHFFFAOYSA-N 281.352 2.381 10 20 CECD C[C@@H](NC(=O)CCCF)c1ccc(N2CCOCC2)cc1 823835191 WBVJIQZFUSQUPT-CYBMUJFWSA-N 294.370 2.450 10 20 CECD Cc1cc(N(C)C)ccc1CN1CCC[C@H]1C(=O)O 901475192 KTAIMRVIAPGTCX-AWEZNQCLSA-N 262.353 2.110 10 20 CECD CCN(C)c1ccc([C@H](C)N[C@@H](C)CC(=O)NC)cc1 834898764 GNFAGTNTIRQGMT-STQMWFEESA-N 277.412 2.318 10 20 CECD C[C@@H](C1CC1)N(C)CC(=O)NCc1ccc(N(C)C)cc1 839460624 QGUSZMMEIOKXPU-ZDUSSCGKSA-N 289.423 2.099 10 20 CECD Cc1ccc(C(=O)N[C@H]2C[C@@H](OC(C)C)C2)c(O)c1O 837724410 GDGFDBANNZWJQZ-PHIMTYICSA-N 279.336 2.092 10 20 CECD CN(C)c1ccc(CN2[C@H]3CC[C@H]2COC3)cc1F 839179896 OVJXVKKDZMXHNG-STQMWFEESA-N 264.344 2.255 10 20 CECD C[C@@H](NC(=O)O[C@@H]1CCOC1)c1ccc(N(C)C)cc1 914390976 ALJKPXQQVPYXKI-BXUZGUMPSA-N 278.352 2.329 10 20 CECD CC[C@@H](C)C[C@@H](CO)NCc1cc(OC)c(OC)cc1O 843426823 BKEJVTOAEPWHCS-YPMHNXCESA-N 297.395 2.296 10 20 CECD Cc1cccc(CNC[C@H](C(=O)O)C(C)C)c1O 848640064 NCGSMIYJGMGXMB-LBPRGKRZSA-N 251.326 2.147 10 20 CECD N[C@H]1CCCN(Cc2c(O)ccc(Cl)c2F)C1 843047748 ZAGBIRGGWRBNND-QMMMGPOBSA-N 258.724 2.108 10 20 CECD NCCC[C@H](NC(=O)Cc1ccc(N)cc1)c1ccccc1 841855968 KJTVLCCMGUVDED-KRWDZBQOSA-N 297.402 2.408 10 20 CECD CNCc1cccc(NCc2cc3c(cc2O)OCO3)c1 841043479 QQYAIEKURNNOPQ-UHFFFAOYSA-N 286.331 2.452 10 20 CECD Cc1cc(N(C)C)ccc1CNC[C@H]1CCCN(C)C1 840933104 AIUWFIFCQZKUJU-OAHLLOKOSA-N 275.440 2.492 10 20 CECD CCOCc1cc(CNC[C@H]2CCCCN2)ccc1OC 841032520 FZSDGXQXNYBBBM-MRXNPFEDSA-N 292.423 2.463 10 20 CECD CCOCc1cc(CN[C@H]2CC[C@H](CN)C2)ccc1OC 841085184 WGHOAKCZUOCOKA-BBRMVZONSA-N 292.423 2.449 10 20 CECD COc1cccc(CNC(=O)/C=C/c2cnccc2C)c1O 752596412 MDZAFBUFDCUQEL-VOTSOKGWSA-N 298.342 2.434 10 20 CECD C[C@H](NCc1cnccn1)c1ccc(N2CCOCC2)cc1 856767372 LXYPAUAVUZLRMS-AWEZNQCLSA-N 298.390 2.164 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCO[C@@H](C)C2)c(O)c1C 756544473 ISDYYOKZPGSMFO-DZGCQCFKSA-N 292.423 2.380 10 20 CECD C[C@@H]1CCN(Cc2ccc(N(C)C)cc2)C[C@@H]1CO 856796011 MXALOZWQBPCNQL-UKRRQHHQSA-N 262.397 2.203 10 20 CECD COC(C)(C)CCNC(=O)NCc1ccc(N(C)C)cc1 866126720 DHYCNAJUCKTATE-UHFFFAOYSA-N 293.411 2.367 10 20 CECD CO[C@@H](CC(=O)NCc1cc(C)ccc1O)C(F)(F)F 862754741 ISUWWVQUUNTJIW-NSHDSACASA-N 291.269 2.284 10 20 CECD C[C@H]1C[C@H](O)CN1Cc1c(O)cccc1Br 862339380 RMUWHPROXCMYSU-IUCAKERBSA-N 286.169 2.110 10 20 CECD Cc1ccc(O)c(CNC(=O)[C@H]2CC23CCOCC3)c1 862758227 SZLPAUPZBKZNTQ-CYBMUJFWSA-N 275.348 2.134 10 20 CECD COC(=O)C(C)(C)N(C)Cc1cc(Cl)ccc1O 769306939 WNBNHSLWXBXMTP-UHFFFAOYSA-N 271.744 2.429 10 20 CECD CO[C@]1(CN[C@@H](C)c2cc(F)cc(F)c2O)CCOC1 763574320 YSCQSOIDIQKGHH-XPTSAGLGSA-N 287.306 2.127 10 20 CECD CCN(C)c1ccc(CN2CC[C@@H](n3cncn3)C2)cc1 773848976 QVVGHPZGQCACIN-MRXNPFEDSA-N 285.395 2.181 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)c2ccco2)c1 775369703 FTCZWILPZSCTBU-HZMBPMFUSA-N 277.320 2.378 10 20 CECD CCOc1ccc(CNCC2(OC)CCC2)c(O)c1 779984860 LAQQFSNTVHFURH-UHFFFAOYSA-N 265.353 2.450 10 20 CECD Cc1ccc(CN[C@H]2CCc3nc(C)ncc3C2)c(O)c1 876925850 FFMWOXKEJNCRLC-HNNXBMFYSA-N 283.375 2.446 10 20 CECD CCN(C)c1ccc(Cn2cc(-c3ccn(C)n3)nn2)cc1 881314757 CYVGFWDSOONEOH-UHFFFAOYSA-N 296.378 2.183 10 20 CECD O=C(c1cc(=NCc2ccccc2O)cc[nH]1)N1CCCC1 881873164 YXVQHQITQUTETL-UHFFFAOYSA-N 297.358 2.057 10 20 CECD COC(=O)N1CCC[C@@H](N[C@H](C)c2ccccc2O)C1 783505592 IEWZPAVOYQOPGF-VXGBXAGGSA-N 278.352 2.274 10 20 CECD COc1ccc(CN(C)Cc2ccon2)c(O)c1OC 892082580 CXBNLJIOYSBMFJ-UHFFFAOYSA-N 278.308 2.029 10 20 CECD CS[C@H]1CC[C@@H](NC(=O)c2ccc(C)c(O)c2O)C1 780955031 PZOLSOIYEHOQKF-ZJUUUORDSA-N 281.377 2.420 10 20 CECD COCCC(C)(C)C(=O)NCc1ccc(OC)cc1O 794388493 WOFVIJSYVJZBFA-UHFFFAOYSA-N 281.352 2.080 10 20 CECD CC[C@@H](NCCN1CCO[C@@H](C)C1)c1ccc(F)cc1O 796747610 TUHYWMSQFZITAS-SWLSCSKDSA-N 296.386 2.293 10 20 CECD CC[C@@H](NCCNc1cnccn1)c1ccc(F)cc1O 796798010 XRXKXTDOZLBHPE-CYBMUJFWSA-N 290.342 2.474 10 20 CECD CC[C@@H](NC[C@@]1(O)CCSC1)c1ccc(F)cc1O 796786448 CPZOCTUOJCKNRW-OCCSQVGLSA-N 285.384 2.440 10 20 CECD CC[C@H](SC)C(=O)NCc1ccc(OC)cc1O 794389720 CMROEBDVVIPLKQ-LBPRGKRZSA-N 269.366 2.159 10 20 CECD CC(=O)NCCC1=CCN(c2ncnc3ccccc23)CC1 1089802787 XNSAZZMLKGEUHE-UHFFFAOYSA-N 296.374 2.293 10 20 CECD CCS(=O)(=O)C[C@@H](C)N[C@@H](C)c1cc(F)ccc1O 186030493 IYGPEZYADKMXMO-ZJUUUORDSA-N 289.372 2.005 10 20 CECD Cc1ccc(O)c([C@@H](C)N[C@H]2CCN(C(C)C)C2=O)c1 186047805 UQZWSFFMYJVVNK-OCCSQVGLSA-N 276.380 2.361 10 20 CECD C[C@@H](NCC1(CO)CCC1)c1cc(F)ccc1O 186547668 ZBCCZGOZJKHBCX-SNVBAGLBSA-N 253.317 2.345 10 20 CECD C[C@H](NCc1ccc2c(c1)CCO2)c1cnccn1 765608073 HVLVTBITXBIAQS-NSHDSACASA-N 255.321 2.262 10 20 CECD Cc1cccc(CNCc2nc(C(F)F)no2)c1O 1333796227 QRYPLZPQWOLQQC-UHFFFAOYSA-N 269.251 2.311 10 20 CECD COc1ccc(CNC[C@@H](O)CC(C)(C)C)c(O)c1OC 1355262854 DHIWQJNMNQIZHZ-LBPRGKRZSA-N 297.395 2.296 10 20 CECD COc1ccc2c(c1)CCN2Cc1ccc(C(=O)O)[nH]1 1607294976 CJBXAKLGXFABHL-UHFFFAOYSA-N 272.304 2.284 10 20 CECD CCc1cccc(CN(C)C[C@H](C)C(=O)O)c1O 1573960722 NOMMHNVRYNICNI-JTQLQIEISA-N 251.326 2.107 10 20 CECD CO[C@H]1C[C@@H](CSc2ncc(C(=O)O)s2)C1 1599326345 HCPOIMRWXOMRKS-KNVOCYPGSA-N 259.352 2.358 10 20 CECD CCc1cccc(CN2CCC[C@]2(C)C(=O)O)c1O 1593642155 HCQYSBRVYBWUPK-OAHLLOKOSA-N 263.337 2.394 10 20 CECD COc1ccc(O)c([C@H](C)NC[C@H](O)C(C)C)c1 168776093 FEDJCSLPJXCRMA-HZMBPMFUSA-N 253.342 2.068 10 20 CECD CC1(C)CNCC[C@H]1NCc1ccc2c(c1)CCO2 841073302 RCOHOXAJTXBQEF-OAHLLOKOSA-N 260.381 2.099 10 20 CECD CC(C)OCCNCc1ccc(N2CCOCC2)cc1 168950365 ARMOOZCDYILHBY-UHFFFAOYSA-N 278.396 2.038 10 20 CECD Cc1cccc(CNC[C@](C)(O)C(F)(F)F)c1O 271766378 AJCZJWDQZMLJKM-NSHDSACASA-N 263.259 2.104 10 20 CECD Cc1ncccc1C(=O)N(C)Cc1ccccc1O 170994890 YIHRMWCHWFFAKS-UHFFFAOYSA-N 256.305 2.368 10 20 CECD Cc1cccc(CN2CC[C@@]3(CCN(C)C3)C2)c1O 292739418 HDKIHFZTGGKGNZ-MRXNPFEDSA-N 260.381 2.228 10 20 CECD Cc1cccc(CN2CC[C@]3(CCN(C)C3)C2)c1O 292739411 HDKIHFZTGGKGNZ-INIZCTEOSA-N 260.381 2.228 10 20 CECD CC(C)(O)C(C)(C)CNCc1cc2c(cc1O)OCO2 393583071 LIIQEFFXDDRMSX-UHFFFAOYSA-N 281.352 2.008 10 20 CECD C[C@@H](O)C1(NCc2cccc(Br)c2O)CC1 827579692 HJORIAOVBTUYSC-MRVPVSSYSA-N 286.169 2.158 10 20 CECD Cc1ccc(C(=O)N(C)Cc2cccnc2)c(O)c1O 179389681 ZDEZXFVYBPGALY-UHFFFAOYSA-N 272.304 2.073 10 20 CECD COc1ccc(N(C)CC(=O)NCC2CCC2)cc1F 121801935 ATNHWXAJOOMGME-UHFFFAOYSA-N 280.343 2.187 10 20 CECD O=C(/C=C/c1ccc(O)c(O)c1)Nn1cnc2ccccc21 180618991 NJWUHKHVELQJSE-SOFGYWHQSA-N 295.298 2.231 10 20 CECD Cc1cc(Br)cc(CN2CC[C@@H](O)C2)c1O 132487979 VQMBDDVXDIFWDC-LLVKDONJSA-N 286.169 2.030 10 20 CECD CN(C)c1ccc(CNC(=O)Nc2cccnc2)cc1 48388282 VINDSIPMPVJOEV-UHFFFAOYSA-N 270.336 2.469 10 20 CECD CN(C)c1ccc(CN(C(=O)c2cncnc2)C2CC2)cc1 273654069 VBHHKDQFMBSGHG-UHFFFAOYSA-N 296.374 2.347 10 20 CECD CN(Cc1ccccc1O)C(=O)C[C@@H]1CCCC[C@H]1N 294944711 CXENDGZVRFLVNN-GXTWGEPZSA-N 276.380 2.258 10 20 CECD Cc1cc(CN(C)CC(C)(C)O)ccc1N(C)C 292696593 AGRRXOMVOBKUDP-UHFFFAOYSA-N 250.386 2.264 10 20 CECD CC[S@](=O)c1ccccc1C(=O)N1CCSCC1 298566849 HHZCHNNHBGOMIF-SFHVURJKSA-N 283.418 2.003 10 20 CECD Cc1cc(O)c(CN(C)C[C@H](O)C(F)(F)F)cc1C 809750745 GDGQSPRAHCNPDX-LBPRGKRZSA-N 277.286 2.364 10 20 CECD CC[C@@H](N[C@@H](C)C(=O)NC)c1cccc(Cl)c1O 292006727 YHESKARELRDLTC-GZMMTYOYSA-N 270.760 2.221 10 20 CECD CC[C@H](N[C@H](C)CC(N)=O)c1cccc(Cl)c1O 806143752 OSPOTDMEKGAECI-KCJUWKMLSA-N 270.760 2.350 10 20 CECD COc1ccc(N(Cc2cnnn2C)CC(C)C)cc1 809957852 BBILXGFJBBSFPY-UHFFFAOYSA-N 274.368 2.486 10 20 CECD COc1ccc(O)c(CNC[C@@H](CC(C)C)C(=O)O)c1 818630464 JXESJEUHKPYBQW-GFCCVEGCSA-N 281.352 2.237 10 20 CECD C[C@@H](N[C@@H]1CCCC[C@H]1N)c1ccc(F)cc1O 818615476 PWRYGOVGPNBTNL-OASPWFOLSA-N 252.333 2.452 10 20 CECD Cc1cc(N(C)C)ccc1C[C@@H](C)NC(=O)[C@H]1CCOC1 822834277 WKAWIOKFCSEJGP-HIFRSBDPSA-N 290.407 2.145 10 20 CECD Cc1nc(/C=C2/SC(N3CCCCC3)=NC2=O)[nH]c1C 901436732 ZHIJWACZFLZVOF-DHZHZOJOSA-N 290.392 2.483 10 20 CECD Cc1cc(N(C)C)ccc1C[C@H](C)NC(=O)c1cn[nH]c1 839915721 JMTZBYTXQQCBTN-LBPRGKRZSA-N 286.379 2.145 10 20 CECD C[C@H]1CC[C@@H](CNC(=O)NCc2ccc(N(C)C)cc2)O1 836251926 RNUIOCDBGHBOIC-WFASDCNBSA-N 291.395 2.119 10 20 CECD CCCN1CC(=O)N[C@@H]1c1cc(Cl)c(C)cc1O 849182190 DATWGHNFZYWUQP-ZDUSSCGKSA-N 268.744 2.194 10 20 CECD CCc1cc(C(=O)NCc2c(O)ccc3c2CCCC3)n[nH]1 743717413 DGFOTGCZIIFFIR-UHFFFAOYSA-N 299.374 2.487 10 20 CECD COCC(C)(C)C(=O)NCc1cc(Cl)ccc1O 846475424 HESZGXANHFCUFK-UHFFFAOYSA-N 271.744 2.334 10 20 CECD Cc1ccc([C@H](C)NCCN2CCCC2=O)c(O)c1C 846205941 LCBHRTDLLNBIBP-ZDUSSCGKSA-N 276.380 2.282 10 20 CECD COCCOC[C@H](C)N[C@@H](C)c1cccc(OC)c1O 846155998 RKDQTBBVVCOCAY-RYUDHWBXSA-N 283.368 2.103 10 20 CECD Nc1ccc(Cc2noc(C[C@@H]3CCCCO3)n2)cc1 843158988 JXFROCAHSYJLLE-ZDUSSCGKSA-N 273.336 2.354 10 20 CECD CCN(C)c1ccc(CN(C)[C@@H](C)CCO)cc1 844452636 WZJWTBNKLHEMQL-ZDUSSCGKSA-N 250.386 2.345 10 20 CECD C[C@@H](N)[C@@H]1CCCN(Cc2cccc(F)c2O)C1 843052783 WEOIMXPFCYTYMB-GHMZBOCLSA-N 252.333 2.091 10 20 CECD C[C@H](CNC(=O)c1cc(O)cs1)c1nccs1 758735151 JTAVCLGDRSQMFS-SSDOTTSWSA-N 268.363 2.444 10 20 CECD CN(C)c1ccc(CN2C[C@@H]3CCC[C@@]3(N)C2)cc1F 857225908 AFIKYEQGVHFBQB-XJKSGUPXSA-N 277.387 2.205 10 20 CECD C[C@H](N[C@H](C)c1cc([N+](=O)[O-])ccc1O)C1(CO)CC1 850515995 JKRXNPVNYCGOFI-ZJUUUORDSA-N 280.324 2.112 10 20 CECD Cc1ccc(O)c(CNC(=O)NOC/C=C\Cl)c1 858478237 XHMYWJHTAXJJIO-DJWKRKHSSA-N 270.716 2.184 10 20 CECD CN1CCN(c2ccnc(NCc3ccccc3O)c2)CC1 865708239 LOQLMGRJKNRNBO-UHFFFAOYSA-N 298.390 2.151 10 20 CECD CCOc1ccc(O)c(CNC2(COC)CC2)c1 765270175 JXYZVJTXKRBLOA-UHFFFAOYSA-N 251.326 2.060 10 20 CECD CC[C@@H]1CN(Cc2cc(F)c(N(C)C)cc2F)C[C@@H]1O 862253781 SNIDHYFQROJIMU-BMIGLBTASA-N 284.350 2.234 10 20 CECD CC[C@@H](C)CN(C)Cc1cc2c(cc1O)OC[C@H]2O 768444402 AUOSGEKOHYULEF-QMTHXVAHSA-N 265.353 2.296 10 20 CECD COC[C@](C)(CO)NCc1ccc(N2CCCCC2)cc1 865671370 AAZHECUKPKTYHK-KRWDZBQOSA-N 292.423 2.164 10 20 CECD Oc1cc2c(cc1CN1CCCOCC1)CCCC2 768443105 AOSCCBBPLIEHRH-UHFFFAOYSA-N 261.365 2.493 10 20 CECD CN(C)c1cc(F)c(CN2C[C@H](O)C(C)(C)C2)cc1F 862352101 XTKAKDXEOMTNBD-AWEZNQCLSA-N 284.350 2.234 10 20 CECD CCOCc1cc(CNCCCCN)ccc1OC 1118018300 FRINCSXPIINVKC-UHFFFAOYSA-N 266.385 2.060 10 20 CECD Cc1nonc1CN[C@@H](C)c1ccc(F)cc1O 872137659 VAYYTFKAPVDBQC-ZETCQYMHSA-N 251.261 2.074 10 20 CECD CCc1cccc(CN2CCC3(CCNC3=O)CC2)c1O 877781982 IMQLRVBZSHJWBW-UHFFFAOYSA-N 288.391 2.057 10 20 CECD C[C@@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccccc1O 877755949 URGYJYUCXKWVKR-FRRDWIJNSA-N 297.420 2.399 10 20 CECD CN(C)c1ccc2c(c1)OCCN2Cc1ccc(O)nc1 877372889 JAQLXSNOWWTJLX-UHFFFAOYSA-N 285.347 2.252 10 20 CECD COC(C)(C)c1cn(Cc2ccc(N(C)C)cc2)nn1 881272470 WLNIGLFPXDWKNW-UHFFFAOYSA-N 274.368 2.274 10 20 CECD CN(C)CCOc1ccc(N(C)CC[C@H]2CCOC2)cc1 783667713 JJMZDTOVHDVHOI-HNNXBMFYSA-N 292.423 2.490 10 20 CECD C[C@@H](O)[C@@H]1CCN(Cc2c(O)cccc2Cl)C1 780786876 OOMABHGYTBRZJW-NXEZZACHSA-N 255.745 2.248 10 20 CECD COc1cc(C)cc(CN[C@@H]2CCN(C)[C@H](C)C2)c1O 894313003 QCUGOQAKEVVCED-TZMCWYRMSA-N 278.396 2.282 10 20 CECD CCOC(=O)[C@@H](CC1CC1)NCc1cc(F)cc(F)c1O 894442454 RWDUNUZFMWZJNC-CYBMUJFWSA-N 299.317 2.492 10 20 CECD CCCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C)c2)C1 966203702 KGXMPTLTJRPXSR-OAHLLOKOSA-N 290.407 2.494 10 20 CECD Cc1ccccc1CNC(=O)c1c(F)ccc(O)c1O 789944691 WMERNJWQDCYKDQ-UHFFFAOYSA-N 275.279 2.475 10 20 CECD C[C@@H](NC(=O)NCC1(C)CCNCC1)c1ccccc1O 892054233 SPTIMOGNBUNSTD-GFCCVEGCSA-N 291.395 2.142 10 20 CECD C[C@@H](NCC1(N(C)C)CC1)c1ccc(F)cc1O 397850269 GVBFWAUPWBCYNQ-SNVBAGLBSA-N 252.333 2.276 10 20 CECD CN(C)C(=O)[C@@H]1CCCN1Cc1cccc(Cl)c1O 179637618 BPBOKTMEHGSCOV-LBPRGKRZSA-N 282.771 2.098 10 20 CECD C[C@@H](NC(=O)c1cnc(C2CC2)[nH]1)c1ccccc1O 1261912291 HPXICGXXDVEKBQ-SECBINFHSA-N 271.320 2.484 10 20 CECD O=C(O)[C@]1(F)CCN(Cc2ccc(Cl)cc2O)C1 1601716830 JEDNLZGDAKOVND-LBPRGKRZSA-N 273.691 2.044 10 20 CECD COc1cc(O)c(CN2CCOC3(CCC3)C2)cc1OC 160524261 STJMRVMPAGBEAP-UHFFFAOYSA-N 293.363 2.164 10 20 CECD COC[C@@H](CNCc1ccc(N2CCCC2)cc1)OC 227704310 VZDWTOWUTXWYPF-MRXNPFEDSA-N 278.396 2.038 10 20 CECD CCOC(=O)N1CCN(Cc2cccc(Cl)c2O)CC1 183465963 GXDFTEMCGFNGIH-UHFFFAOYSA-N 298.770 2.320 10 20 CECD COc1ccnc(C(=O)NCc2ccc(N(C)C)cc2)c1 115979960 FRPXPTAGDQZCLN-UHFFFAOYSA-N 285.347 2.086 10 20 CECD CC(C)CN(C(=O)CN(C)Cc1ccccc1O)C1CC1 111236375 NUMYBNFSXOGFBG-UHFFFAOYSA-N 290.407 2.471 10 20 CECD Cc1ccc(O)c(CN2CCC(NC(=O)C3CC3)CC2)c1 179915955 KTVIXPMXFDBAOS-UHFFFAOYSA-N 288.391 2.191 10 20 CECD CCC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(N(C)C)cc2)C1 126447471 ZJTGLHMHZCSTSR-DZGCQCFKSA-N 289.423 2.414 10 20 CECD Cc1ccc(O)c([C@H](C)NCCCN2CCC(O)CC2)c1 185116025 SLFSAJNAACKOHH-AWEZNQCLSA-N 292.423 2.198 10 20 CECD CC[C@@H](SC)C(=O)N[C@@H](C)Cc1ccc(O)c(O)c1 185389150 IBCXPVHQONUCNF-TVQRCGJNSA-N 283.393 2.287 10 20 CECD CS[C@H](CO)[C@@H](C)N[C@@H](C)c1ccc(C)cc1O 185511817 PLIVAYKIDZMTGZ-MISXGVKJSA-N 269.410 2.464 10 20 CECD O=S(=O)(NCc1ccccc1O)c1ccc(F)cc1 158574448 BZXLESXUOFPJSY-UHFFFAOYSA-N 281.308 2.010 10 20 CECD COc1cccc(CNC(=O)NCc2cccs2)c1O 80541250 BFVWEQHOZSEYFP-UHFFFAOYSA-N 292.360 2.462 10 20 CECD C[C@H](NCCCO)c1cc(Br)cc(F)c1O 134903971 SELSMXPZGFJZKB-ZETCQYMHSA-N 292.148 2.327 10 20 CECD CN1CCCc2cc(CNC(=O)Nc3ccncn3)ccc21 194183550 GWUQLHIXLROTDZ-UHFFFAOYSA-N 297.362 2.181 10 20 CECD COc1cccc(CN2CCC[C@H](OC)C2)c1O 91772675 UBEHEUCQDALLHD-LBPRGKRZSA-N 251.326 2.012 10 20 CECD COc1cccc(CNC(=O)C2CCSCC2)c1O 264839013 UWLZKRAHLGNDLH-UHFFFAOYSA-N 281.377 2.160 10 20 CECD CN1CC[C@H]2CCN(Cc3ccc(N(C)C)cc3)[C@H]2C1 272267703 BHWSAPQRFQTZKG-RDJZCZTQSA-N 273.424 2.279 10 20 CECD CCc1cccnc1C(=O)NCc1cccc(OC)c1O 270902494 APLZLVVKMYBEIX-UHFFFAOYSA-N 286.331 2.288 10 20 CECD CCCN(Cc1cccc(OC)c1O)CC(C)(C)O 271160803 KHQACBCSDHJVGL-UHFFFAOYSA-N 267.369 2.384 10 20 CECD CC[C@H](C)[C@@H](O)CN[C@@H](C)c1cc(C(=O)OC)ccc1O 273599569 RPDPJSXIZMSEPF-PGUXBMHVSA-N 295.379 2.236 10 20 CECD O=S1(=O)CCC(CSc2nccs2)CC1 270433340 WUMJADFQQXEQIC-UHFFFAOYSA-N 263.409 2.060 10 20 CECD C[C@H](NC[C@@H](C)N(C)C1CC1)c1cc([N+](=O)[O-])ccc1O 273462243 CYKOTRRTRNETIM-MNOVXSKESA-N 293.367 2.434 10 20 CECD CC[C@@H](NCCS(C)(=O)=O)c1cccc(Cl)c1O 287314619 DBICOFDUCGZJCE-LLVKDONJSA-N 291.800 2.131 10 20 CECD C[C@H]1CC(CCNC(=O)c2cccc(O)c2O)C[C@H](C)O1 802196940 BOCCQQBIJSGUPN-QWRGUYRKSA-N 293.363 2.421 10 20 CECD COc1ccc(N(C)Cc2n[nH]cc2C)cc1OC 811490880 ZLFNNVMHHSKMGG-UHFFFAOYSA-N 261.325 2.372 10 20 CECD O=C(NC[C@@H]1CC1(Cl)Cl)c1c(F)ccc(O)c1O 825425181 GBOSVYYPVBIWBG-YFKPBYRVSA-N 294.109 2.161 10 20 CECD C[C@]1(O)CCN(Cc2ccc(Br)cc2O)C1 824905816 DZSQZPVMYTYPKM-LBPRGKRZSA-N 286.169 2.111 10 20 CECD COc1ccc2c(c1)CCCN2C[C@@H]1CCNC(=O)CC1 827377782 FLBJGBAGIHSXMD-ZDUSSCGKSA-N 288.391 2.364 10 20 CECD COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc2c(c1)CCO2 824703123 VWVIVOSOARPWME-KGLIPLIRSA-N 275.348 2.053 10 20 CECD CC[C@H](C)[C@@](C)(O)CNCc1c(O)cccc1OC 732820587 LVPQROYIDYPNMT-NHYWBVRUSA-N 267.369 2.288 10 20 CECD COc1ccc(O)c(CNCCCCN(C)C2CC2)c1 835063706 PIBGJJTVIMAVER-UHFFFAOYSA-N 278.396 2.365 10 20 CECD Cc1noc(C2CN(Cc3cc(Cl)c(F)cc3O)C2)n1 839130229 AIDRNLFSIBMEQJ-UHFFFAOYSA-N 297.717 2.476 10 20 CECD O=C(c1cccc(O)c1O)N1CC[C@H](C2CCC2)C1 839949971 VWYMMKXLNQAZLJ-NSHDSACASA-N 261.321 2.360 10 20 CECD C[C@@H](C[C@H](O)c1ccco1)NC(=O)c1cc(O)cs1 830118777 FPIITVMXIMAOPY-WPRPVWTQSA-N 281.333 2.289 10 20 CECD CN1CCCc2cc(CN[C@@H]3CCC[C@@H](N)C3)ccc21 848718423 MOVAWMRTBQAVCR-HZPDHXFCSA-N 273.424 2.429 10 20 CECD C[C@@H](NC(=O)c1ncccc1N(C)C)c1ccccc1O 913763994 XQFYQUSCYUIIFH-LLVKDONJSA-N 285.347 2.344 10 20 CECD C[C@H](C[C@@H]1CCOC1)NC(=O)Nc1ccc(N)cc1 841299739 JHTAAPHFTLVWDS-MNOVXSKESA-N 263.341 2.205 10 20 CECD CC[C@H](C(=O)O)N(C)Cc1cc(Cl)c(F)cc1O 844937570 OCWOHPSRTUDFIJ-SNVBAGLBSA-N 275.707 2.480 10 20 CECD COc1cccc([C@H](C)NC[C@H](C)CCCO)c1O 846170553 OTKZQMGRITVHJP-NEPJUHHUSA-N 267.369 2.460 10 20 CECD COC(=O)[C@]1(C)CCCN(Cc2c(O)cccc2OC)C1 840975163 MBXBGVJKWMCUTR-MRXNPFEDSA-N 293.363 2.176 10 20 CECD CCOc1ccc(CN[C@@H]2CCN[C@H](C)C2)c(O)c1 841061424 IVJGSIFVHFZJSH-DGCLKSJQSA-N 264.369 2.021 10 20 CECD CCc1cccc(CNC[C@H]2CC[C@H](C(N)=O)CC2)c1O 848918397 YGEVQJPUGFJYHE-MQMHXKEQSA-N 290.407 2.336 10 20 CECD Nc1ccc(CCNC(=O)N2CCCC3(CC3)C2)cc1 841959429 OAVOIRSWXYQLMQ-UHFFFAOYSA-N 273.380 2.397 10 20 CECD CCN1C[C@@H](CN[C@H](C)c2ccc(F)cc2O)CC1=O 846210275 WWTBNRJMXCQUTA-GHMZBOCLSA-N 280.343 2.050 10 20 CECD O=S(=O)(CCC1CC1)NCc1cc(Cl)ccc1O 845995822 HMGTYDCHCHSHEK-UHFFFAOYSA-N 289.784 2.265 10 20 CECD Oc1ccc(Br)cc1CN[C@H]1CCCNCC1 841057346 IZPXJSABJMYSBG-LBPRGKRZSA-N 299.212 2.386 10 20 CECD C[C@H]1C[C@H](N[C@H](C)C[S@](C)=O)c2c(O)ccc(F)c21 757659323 YGBHBSZZFXGGMU-FQBUZYRESA-N 285.384 2.436 10 20 CECD COCCOC[C@H](C)N[C@H](C)c1cc([N+](=O)[O-])ccc1O 756732043 GATRKNBTKQTKMJ-WDEREUQCSA-N 298.339 2.003 10 20 CECD CN(Cc1ccccc1O)[C@@H]1C[C@@H]2CCCC[C@H]2NC1=O 851841453 SHOPSRWBEUNGJU-NWANDNLSSA-N 288.391 2.271 10 20 CECD CCC(C)(C)N[C@@H](C)C(=O)NCc1cc(OC)ccc1O 753984555 BNDFIGPDWIBAFS-NSHDSACASA-N 294.395 2.184 10 20 CECD CCOC(=O)[C@@H](C)[C@H](C)NCc1ccc(C)cc1O 877323473 PHEITDSTJSQNEF-RYUDHWBXSA-N 265.353 2.378 10 20 CECD CCOCCC(=O)N[C@@H](C)c1ccc(N(C)C)cc1 773007334 GZYFHUZGISCAOU-LBPRGKRZSA-N 264.369 2.356 10 20 CECD COc1ccc(O)c(CNC(=O)N[C@@H]2CC23CCC3)c1 875290125 RKDHXRQTOQWYJY-CYBMUJFWSA-N 276.336 2.143 10 20 CECD Cc1ccc(CC(=O)NCc2ccccc2O)cc1O 772910532 PAEUSZKHAPAXLT-UHFFFAOYSA-N 271.316 2.265 10 20 CECD Cc1ccc(CN[C@@H]2CCC[C@H]([S@@](C)=O)C2)c(O)c1 877623012 GVLJGIJCHPXWLG-BIENJYKASA-N 281.421 2.480 10 20 CECD Cc1ccc(CNC2CCN(c3cccnn3)CC2)c(O)c1 877476329 AVQWVILYBGPIOS-UHFFFAOYSA-N 298.390 2.249 10 20 CECD CC[C@H](NC[C@@H](O)COCC1CC1)c1ccccc1O 775416250 XMMGVVCFTUFQFX-HIFRSBDPSA-N 279.380 2.220 10 20 CECD CC[C@](C)(CCO)NCc1cc(C)cc(OC)c1O 894334038 VWCDTCXGYVWKMM-OAHLLOKOSA-N 267.369 2.350 10 20 CECD CC(C)[C@@H](NCc1ccc2c(c1)CCCO2)C(=O)O 900029254 NJNATDOQNJRNAU-CQSZACIVSA-N 263.337 2.210 10 20 CECD COc1ccc(CN[C@@H](C)[C@H]2CCCO2)c(O)c1 40906051 KVIHTKYZBCPCHP-IINYFYTJSA-N 251.326 2.058 10 20 CECD C[C@H]1CCN(Cc2ccc(N3CCCC3)cc2)[C@@H]1CO 1321701264 JRPOTLAVJJSAKH-WMLDXEAASA-N 274.408 2.490 10 20 CECD COc1cccc(O)c1CN1CCCO[C@H](C)C1 769318097 INRCQAYWEVZYMC-LLVKDONJSA-N 251.326 2.012 10 20 CECD C[C@@H](NC(=O)c1cc(N)ccn1)c1ccc(N(C)C)cc1 1521335068 LKMCVSPIZINONV-LLVKDONJSA-N 284.363 2.221 10 20 CECD COC[C@H](N[C@H](C)c1cc(C(=O)O)ccc1O)C1CC1 1606814277 CGFBMQDZUHGRJS-RNCFNFMXSA-N 279.336 2.166 10 20 CECD Cc1nnsc1CN[C@H](C)c1cc(C(=O)O)ccc1O 1600802853 MEACRLFBAIVDQQ-SSDOTTSWSA-N 293.348 2.101 10 20 CECD COc1ccc(O)c([C@@H](C)Nc2ncc(C(=O)O)cn2)c1 1599598275 KJHOFMIRMPNBDT-MRVPVSSYSA-N 289.291 2.062 10 20 CECD COc1cccc(CNCc2ccc(CO)cc2)c1O 227463649 CKBXYYSGJBLKAI-UHFFFAOYSA-N 273.332 2.183 10 20 CECD Oc1cccc2c1[C@@H](NCCOCC(F)F)CC2 296425384 LSHDLWBRFOBDRV-JTQLQIEISA-N 257.280 2.251 10 20 CECD Cc1ccc(O)c(CN2C[C@@H]3CCC[C@H]3[C@H]2C(=O)O)c1 300001703 QMBSZTUGPQVNNS-LNSITVRQSA-N 275.348 2.386 10 20 CECD C[C@@H]1CN(Cc2cc(F)ccc2O)CC[C@@H]1C(=O)O 311402405 VOGLVGPFZYPHDD-SKDRFNHKSA-N 267.300 2.074 10 20 CECD CCN1CCCC[C@H]1C(=O)N(C)Cc1ccccc1O 104853222 IPBBBWZWOJVYLB-AWEZNQCLSA-N 276.380 2.225 10 20 CECD COCCN(C)CCCN[C@H](C)c1cc(OC)ccc1O 185008591 BQYNPKNTEAQQPM-CYBMUJFWSA-N 296.411 2.020 10 20 CECD Oc1ccc(Br)cc1CNC1CSC1 306635182 YPUQSVXEODDEID-UHFFFAOYSA-N 274.183 2.360 10 20 CECD CN(C)c1ccc(CNCc2cccc(C(N)=O)c2)cc1 35231645 CDPYIULVZVEKOT-UHFFFAOYSA-N 283.375 2.141 10 20 CECD C[C@@H](Sc1nccs1)c1nnnn1C1CC1 187910728 FVHPHVJGNKOGGS-ZCFIWIBFSA-N 253.356 2.318 10 20 CECD C[C@@H](NCCNC(=O)c1ccco1)c1ccc(F)cc1O 184917014 HMXYZOIICSQMJX-SNVBAGLBSA-N 292.310 2.205 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)CC[C@@H](C)OC)c1 184026351 FNZLPBXHUMKRCI-GHMZBOCLSA-N 281.352 2.393 10 20 CECD C[C@@H](C(=O)NCCc1ccc(N)cc1)c1cccnc1 237471333 HRCORVWKYYJKNU-GFCCVEGCSA-N 269.348 2.126 10 20 CECD CN(CCC(C)(C)O)Cc1ccc(N2CCOCC2)cc1 267414049 LBHNEPNVJGJCST-UHFFFAOYSA-N 292.423 2.116 10 20 CECD CCCN(Cc1ccccc1O)C(=O)CCn1cccn1 269206344 ZZPCXGJHVBHBOW-UHFFFAOYSA-N 287.363 2.418 10 20 CECD CC[S@](=O)c1ccccc1C(=O)N1CCS[C@H](C)C1 264093239 BURYVJMQISLMEG-WYRIXSBYSA-N 297.445 2.392 10 20 CECD OC[C@@H]1CN(Cc2c(O)cccc2Cl)CCC1(F)F 291272370 NWZDAGSNKHUFKO-VIFPVBQESA-N 291.725 2.495 10 20 CECD C[C@@H](N[C@H]1[C@@H]2CNC[C@@H]21)c1ccc2ccccc2c1O 817977646 MTBQIXYPIZABKG-XGVBPZLHSA-N 268.360 2.414 10 20 CECD CC[C@@H](NCC(F)(F)CN)c1ccc(F)cc1O 817967403 HIESICWAUUOOJP-SNVBAGLBSA-N 262.275 2.166 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=O)c2ncoc2C)c1 729535252 NYIZAEOCWYAHMC-MRVPVSSYSA-N 276.292 2.188 10 20 CECD Cc1ccncc1/C=C/C(=O)N1CCOc2ccncc21 492502623 PBRCKSRDIYSPAX-NSCUHMNNSA-N 281.315 2.224 10 20 CECD C[C@H](NC(=O)c1cnn2c1CCC2)c1ccc(N(C)C)cc1 828862251 UPMORSZWWUHGRR-LBPRGKRZSA-N 298.390 2.386 10 20 CECD CC[C@@H](CNCc1cc(Cl)cc(OC)c1O)C(=O)O 903709674 PTAVDCOOPYXCTG-QMMMGPOBSA-N 287.743 2.255 10 20 CECD CCOc1ccc(O)c(CN[C@@H]2CCC[C@@H]2C(=O)OC)c1 827845600 XOOBIILUXIDZOH-UONOGXRCSA-N 293.363 2.222 10 20 CECD COC(=O)N1CCC[C@@H](N[C@@H]2CCc3cccc(O)c32)C1 834559113 ZPJYWGFEJRMOBR-CHWSQXEVSA-N 290.363 2.200 10 20 CECD CN(CCO)c1ccc(N[C@@H]2CCc3cccc(O)c32)nc1 834729611 IJRBQCGZMCUPFT-CQSZACIVSA-N 299.374 2.315 10 20 CECD CCCN(Cc1ccccc1O)C(=O)NC[C@H](C)N(C)C 838685622 TUDJKUVUTFGGSX-ZDUSSCGKSA-N 293.411 2.264 10 20 CECD C[C@H](N[C@@H]1CCc2c(nnn2C)C1)c1ccc(N(C)C)cc1 848563993 GKWZWYMDUCOYIS-GXTWGEPZSA-N 299.422 2.089 10 20 CECD C[C@H]1C[C@H](CN)CN1Cc1ccc(N(C)C)c(F)c1 843058498 URQCBZFGUSWZJZ-WCQYABFASA-N 265.376 2.061 10 20 CECD Cc1ccc([C@@H](C)NCCN2CCOC[C@@H]2C)c(O)c1C 756534454 KVQLKUZPKTXBFG-DZGCQCFKSA-N 292.423 2.380 10 20 CECD C[S@](=O)[C@@H]1CCC[C@@H](NCc2ccccc2O)C1 850355442 IRNGHHUXORTRME-VFVRVIDISA-N 267.394 2.172 10 20 CECD CCn1cnc2c(Sc3nccs3)ncnc21 750531503 FICIYWVCUPMINL-UHFFFAOYSA-N 263.351 2.454 10 20 CECD Oc1cc2c(cc1CN1Cc3ccccc3C1)[C@H](O)CO2 768449253 FPGYCIPPSIZBCN-MRXNPFEDSA-N 283.327 2.334 10 20 CECD CSC1CCN(C(=O)/C=C\c2ccc(O)c(O)c2)CC1 869646121 NIRUBMSJJLKTNH-HYXAFXHYSA-N 293.388 2.465 10 20 CECD C[C@H]1[C@H](C)CCN1Cc1cc2c(cc1O)OC[C@@H]2O 768465196 YNNSFAYHGUBEGW-BFVZDQMLSA-N 263.337 2.048 10 20 CECD CCn1ncc(C(=O)NCc2ccccc2O)c1C1CC1 878560093 YYYYBQKEFXHULX-UHFFFAOYSA-N 285.347 2.416 10 20 CECD CCCn1cc(CN(C)Cc2ccccc2O)nn1 876616170 UETPRGRIDHMECS-UHFFFAOYSA-N 260.341 2.026 10 20 CECD CCCOc1ccc(CN[C@@H](C)C(=O)O)cc1C 871871932 IBYXSDSARVQAKN-NSHDSACASA-N 251.326 2.347 10 20 CECD CCN(C)c1ccc(CN(C)Cc2cn[nH]c2)cc1 773785619 MLMGITKDPWRJBQ-UHFFFAOYSA-N 258.369 2.498 10 20 CECD C[C@@H](NC[C@@H](O)CC1(O)CCCCC1)c1ccccc1O 879650409 ZYAHQMPHQMNQQS-KGLIPLIRSA-N 293.407 2.489 10 20 CECD C[C@@H](CC(=O)N(C)c1ccc(N)cc1)n1ccnc1 877075988 KSZHOMUESCYEGR-NSHDSACASA-N 258.325 2.079 10 20 CECD CCCN1C[C@H](CN[C@H](C)c2c(O)cccc2F)CC1=O 886628614 XIFZNOLIJZLSEX-NEPJUHHUSA-N 294.370 2.440 10 20 CECD OCC[C@H]1CCC[C@H]1NCc1cc(F)cc(F)c1O 883093622 ASKCYXDRWSJOSD-NOZJJQNGSA-N 271.307 2.311 10 20 CECD C[C@H](Cc1cnn(C)c1)NCc1cc(F)cc(F)c1O 883136330 ZWDLZLICNMLUCL-SECBINFHSA-N 281.306 2.125 10 20 CECD C[C@@]1(CO)CCCN1Cc1cc(Cl)ccc1O 789558329 WYXGIKQAQLBBFU-ZDUSSCGKSA-N 255.745 2.392 10 20 CECD Cc1cc(O)c(CN[C@H](CO)C[C@@H]2CCCO2)cc1C 886226127 HZUCFOJEMNMQTF-GJZGRUSLSA-N 279.380 2.029 10 20 CECD COc1ccc(O)c([C@@H](C)NC(=S)NC2(C)CC2)c1 789218266 ADDKTWVREANIRZ-SECBINFHSA-N 280.393 2.478 10 20 CECD C[C@@H](OC(=O)/C=C/c1ccc(O)c(O)c1)c1cnccn1 784287930 WGDNORPEQJRZSP-RXNUUUNCSA-N 286.287 2.205 10 20 CECD COC(=O)C[C@H](NCc1cccc(OC)c1O)C(C)(C)C 897889254 PKQJIVRBOIDDFF-ZDUSSCGKSA-N 295.379 2.468 10 20 CECD COc1cccc(CNC(=O)c2ncc(Cl)s2)c1O 1321481319 XMLFWUNLDWOSJP-UHFFFAOYSA-N 298.751 2.441 10 20 CECD C[C@@H](CNCc1cc(F)cc(F)c1O)CN1CCCC1 708557818 BOVDMHMLCFEITG-NSHDSACASA-N 284.350 2.492 10 20 CECD COC(=O)[C@@H]1CC[C@H](N[C@H]2CCc3cccc(O)c32)C1 1339191376 BNUZYGDGHGSDHP-AGIUHOORSA-N 275.348 2.311 10 20 CECD C[C@H](Cc1cccnc1)NC(=O)NCCc1ccc(N)cc1 1335665260 HOWWJXBYVLYPER-CYBMUJFWSA-N 298.390 2.137 10 20 CECD CN(Cc1ccccc1O)c1nnc(Cc2ccco2)n1C 1340211104 VMKIFOVRPVTNCK-UHFFFAOYSA-N 298.346 2.341 10 20 CECD Nc1ccc(CNC(=O)N[C@H]2CCC[C@@H]3C[C@H]23)cc1 1262584092 QJGPXVAYZNLKMJ-XBFCOCLRSA-N 259.353 2.257 10 20 CECD Cc1ccc(O)c(CNC(=O)NCCCCCC(=O)O)c1 1341366621 AEFRIEKXGOANET-UHFFFAOYSA-N 294.351 2.145 10 20 CECD Cc1ccc2c(c1)N[C@H](c1cc(C(=O)O)ccc1O)NC2=O 1600497639 XXELVZNVYKLADP-AWEZNQCLSA-N 298.298 2.253 10 20 CECD O=C(O)[C@@H]1CCC[C@@H]1NCc1cc(F)c(F)cc1O 1602173535 FGJKTCDWJWRGFR-KCJUWKMLSA-N 271.263 2.013 10 20 CECD CO[C@H]1CCN(Cc2cc(Cl)ccc2O)[C@H](C(=O)O)C1 1610238130 TZVRKBJJFBBDQZ-RYUDHWBXSA-N 299.754 2.110 10 20 CECD N[C@@H]1CCC[C@H](NC(=O)NCc2cccc(Cl)c2O)C1 1580176686 QBJFVDJJFZYHBE-MNOVXSKESA-N 297.786 2.115 10 20 CECD Cc1c(/C=C/C(=O)NCc2ccc(N(C)C)cc2)cnn1C 156045413 XMXJAKPZVQKOBP-JXMROGBWSA-N 298.390 2.124 10 20 CECD C[C@H]1CCCC[C@H]1OCC(=O)NCc1ccc(O)c(O)c1 159140835 NLJMGVVJAIRXDI-XHDPSFHLSA-N 293.363 2.309 10 20 CECD Cc1ccc([C@H](C)NCCc2cnn(C)c2)c(O)c1 128122966 LUUCRDLUJQAZLF-LBPRGKRZSA-N 259.353 2.327 10 20 CECD CC[C@H](N[C@@H](C)c1nncn1C)c1ccccc1O 37016934 QNAIQPLCZIJGER-JQWIXIFHSA-N 260.341 2.323 10 20 CECD C[C@H](N[C@H]1CCc2cccc(O)c21)C(=O)NC(C)(C)C 295787443 ABDOCUYZBCMXCF-JQWIXIFHSA-N 276.380 2.272 10 20 CECD N[C@H]1CCCCCN(Cc2cc(F)ccc2O)C1 708996696 ZTSDLASBRHPXCY-ZDUSSCGKSA-N 252.333 2.235 10 20 CECD COC[C@H](C)CC(=O)N(C)Cc1ccccc1O 383731922 MGGDVEOEECQOBL-LLVKDONJSA-N 251.326 2.023 10 20 CECD